#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wb1 n TYR 12 N 0.00 0.00 -1.52 7.33 0.53 -1.26 -3.76 117.16 118.49 2wb1 n TYR 12 Ca 0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 57.90 56.77 2wb1 n TYR 12 Cb 0.00 0.00 0.16 0.00 -1.03 0.00 0.00 39.34 38.47 2wb1 n TYR 12 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 2wb1 n LEU 13 N 0.00 4.72 -0.20 7.72 4.32 -1.26 -4.50 117.00 127.80 2wb1 n LEU 13 Ca 0.00 -3.96 -0.06 0.00 -0.02 0.00 0.00 56.01 51.97 2wb1 n LEU 13 Cb 0.00 -0.64 0.04 0.00 -1.62 0.00 0.00 43.42 41.20 2wb1 n LEU 13 CO 0.00 1.40 1.11 -0.08 -1.22 0.00 0.00 177.39 178.60 2wb1 h GLU 14 N 1.25 0.74 -0.18 3.23 4.57 -2.02 -2.85 114.58 119.32 2wb1 h GLU 14 Ca 0.30 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.46 2wb1 h GLU 14 Cb 1.64 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 30.04 2wb1 h GLU 14 CO 0.59 0.49 -0.10 -1.91 -1.18 0.00 0.00 179.01 176.90 2wb1 n GLU 15 N -4.70 -0.08 -0.01 1.92 2.13 -1.26 -3.28 120.64 115.36 2wb1 n GLU 15 Ca 0.04 1.08 -0.06 0.00 0.66 0.00 0.00 57.16 58.89 2wb1 n GLU 15 Cb 0.04 -1.62 0.14 0.00 0.27 0.00 0.00 31.44 30.27 2wb1 n GLU 15 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2wb1 h LYS 16 N 0.00 0.57 -0.27 5.31 3.64 -1.86 -3.10 116.57 120.85 2wb1 h LYS 16 Ca 0.03 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 2wb1 h LYS 16 Cb 0.07 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2wb1 h LYS 16 CO -0.17 0.81 0.14 -0.24 -2.27 0.00 0.00 179.45 177.72 2wb1 h VAL 17 N 0.49 1.14 0.00 2.00 3.04 -1.49 0.69 116.25 122.12 2wb1 h VAL 17 Ca 0.06 -0.41 -0.05 0.00 -1.01 0.00 0.00 66.70 65.30 2wb1 h VAL 17 Cb 0.77 0.91 -0.01 0.00 -2.01 0.00 0.00 31.29 30.95 2wb1 h VAL 17 CO 0.06 0.15 -0.23 0.11 -1.01 0.00 0.00 177.57 176.64 2wb1 h LYS 18 N 0.31 0.00 0.11 4.17 1.57 -1.54 0.37 116.57 121.56 2wb1 h LYS 18 Ca 0.09 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.61 2wb1 h LYS 18 Cb 0.11 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 2wb1 h LYS 18 CO -0.01 0.23 -1.24 0.37 -0.57 0.00 0.00 179.45 178.23 2wb1 h GLN 19 N 0.00 0.23 0.00 3.15 4.15 -1.35 -3.27 115.11 118.02 2wb1 h GLN 19 Ca -0.00 -0.39 -0.08 0.00 0.77 0.00 0.00 58.65 58.95 2wb1 h GLN 19 Cb 0.42 0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 2wb1 h GLN 19 CO 0.03 1.18 -0.36 0.00 -1.93 0.00 0.00 178.83 177.74 2wb1 h ALA 20 N 0.64 0.78 -0.25 3.38 0.00 0.92 -2.62 119.26 122.10 2wb1 h ALA 20 Ca -0.13 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2wb1 h ALA 20 Cb 1.95 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.68 2wb1 h ALA 20 CO 0.19 0.45 0.00 -1.13 0.00 0.00 0.00 179.25 178.76 2wb1 n SER 21 N -3.21 2.14 -0.00 0.00 3.41 0.12 -3.58 113.62 112.49 2wb1 n SER 21 Ca 0.02 -2.18 0.01 0.00 -0.26 0.00 0.00 58.87 56.46 2wb1 n SER 21 Cb 0.66 -0.38 -0.01 0.00 -0.26 0.00 0.00 64.21 64.21 2wb1 n SER 21 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2wb1 n ASN 22 N 0.27 4.56 0.00 4.04 5.15 -1.00 -4.39 115.26 123.90 2wb1 n ASN 22 Ca 0.10 0.00 0.14 0.00 -0.60 0.00 0.00 54.58 54.21 2wb1 n ASN 22 Cb 0.42 0.96 0.76 0.00 -0.53 0.00 0.00 39.78 41.39 2wb1 n ASN 22 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2wb1 n ILE 23 N -1.68 0.06 -0.09 -1.44 2.08 -1.14 -3.79 119.36 113.35 2wb1 n ILE 23 Ca -0.01 0.02 -0.20 0.00 0.56 0.00 0.00 62.75 63.12 2wb1 n ILE 23 Cb 0.17 -0.58 -0.12 0.00 -0.75 0.00 0.00 39.64 38.37 2wb1 n ILE 23 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2wb1 h LEU 24 N 0.00 0.00 0.00 1.39 3.38 -1.77 -3.33 115.31 114.98 2wb1 h LEU 24 Ca 0.00 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.34 2wb1 h LEU 24 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2wb1 h LEU 24 CO 0.00 1.35 0.00 -0.81 0.09 0.00 0.00 178.44 179.07 2wb1 n PRO 25 N -4.48 0.30 0.11 1.13 -0.04 -1.25 -2.09 135.00 128.68 2wb1 n PRO 25 Ca -0.26 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.09 2wb1 n PRO 25 Cb 0.62 -1.35 -0.07 0.00 -0.04 0.00 0.00 33.50 32.67 2wb1 n PRO 25 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2wb1 h GLN 26 N 0.00 -0.33 -1.92 0.54 4.20 -1.67 -3.02 115.11 112.90 2wb1 h GLN 26 Ca 0.00 0.02 -0.21 0.00 0.06 0.00 0.00 58.65 58.52 2wb1 h GLN 26 Cb 0.00 0.08 -0.08 0.00 0.30 0.00 0.00 27.48 27.78 2wb1 h GLN 26 CO 0.00 0.02 -0.01 1.63 -0.67 0.00 0.00 178.83 179.79 2wb1 n LYS 27 N -5.02 1.75 0.00 1.46 4.76 -0.89 -4.96 118.16 115.26 2wb1 n LYS 27 Ca -0.08 -1.03 0.00 0.00 -2.87 0.00 0.00 58.31 54.33 2wb1 n LYS 27 Cb 0.26 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 2wb1 n LYS 27 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2wb1 n ILE 28 N 1.58 0.00 -0.09 -0.18 5.41 -1.08 -4.90 119.36 120.10 2wb1 n ILE 28 Ca 0.29 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.94 2wb1 n ILE 28 Cb 0.68 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 39.47 2wb1 n ILE 28 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2wb1 n VAL 29 N 0.00 1.27 0.00 1.39 0.24 -1.25 -4.99 118.33 114.99 2wb1 n VAL 29 Ca 0.00 -0.72 0.00 0.00 -2.04 0.00 0.00 64.34 61.58 2wb1 n VAL 29 Cb 0.00 -0.67 0.00 0.00 -1.47 0.00 0.00 33.84 31.70 2wb1 n VAL 29 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2wb1 n GLU 30 N -2.77 0.00 0.25 7.34 4.71 -1.26 -4.19 120.64 124.72 2wb1 n GLU 30 Ca -0.32 0.00 0.16 0.00 -0.01 0.00 0.00 57.16 57.00 2wb1 n GLU 30 Cb 1.06 0.00 0.88 0.00 -1.01 0.00 0.00 31.44 32.37 2wb1 n GLU 30 CO 0.00 0.00 0.00 0.22 0.09 0.00 0.00 177.13 177.44 2wb1 h ASP 31 N 0.00 0.00 0.16 1.62 1.82 -2.03 -3.08 116.42 114.92 2wb1 h ASP 31 Ca 0.00 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.48 2wb1 h ASP 31 Cb 0.00 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.00 2wb1 h ASP 31 CO 0.00 0.00 -0.60 -0.07 -1.61 0.00 0.00 179.24 176.96 2wb1 h LEU 32 N 0.00 0.50 -0.40 2.28 3.38 -2.01 -2.92 115.31 116.12 2wb1 h LEU 32 Ca 0.00 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 57.77 2wb1 h LEU 32 Cb 0.06 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.58 2wb1 h LEU 32 CO 0.00 0.98 -0.14 0.07 0.09 0.00 0.00 178.44 179.44 2wb1 h LYS 33 N 0.33 -0.05 0.05 1.13 2.10 -1.87 -2.88 116.57 115.37 2wb1 h LYS 33 Ca -0.00 0.00 0.03 0.00 -2.00 0.00 0.00 60.65 58.68 2wb1 h LYS 33 Cb 1.14 0.01 -0.05 0.00 -0.90 0.00 0.00 32.23 32.43 2wb1 h LYS 33 CO 0.11 -0.03 -0.38 -0.91 -2.00 0.00 0.00 179.45 176.23 2wb1 h ASN 34 N -0.05 -1.13 0.82 7.07 -0.26 -1.71 -2.67 115.58 117.65 2wb1 h ASN 34 Ca 0.20 0.14 0.00 0.00 -0.56 0.00 0.00 56.30 56.07 2wb1 h ASN 34 Cb 0.35 0.44 0.00 0.00 -1.06 0.00 0.00 38.32 38.05 2wb1 h ASN 34 CO -0.44 -0.44 0.00 -0.07 -1.06 0.00 0.00 177.43 175.42 2wb1 h LEU 35 N -0.56 0.00 0.01 1.61 3.38 -1.55 -1.70 115.31 116.50 2wb1 h LEU 35 Ca 0.04 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 2wb1 h LEU 35 Cb 0.63 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.38 2wb1 h LEU 35 CO -0.27 0.00 -0.26 0.40 0.09 0.00 0.00 178.44 178.40 2wb1 h ILE 36 N 0.00 1.58 -0.62 1.22 2.04 -1.27 -2.49 117.51 117.97 2wb1 h ILE 36 Ca 0.00 -2.05 0.03 0.00 1.00 0.00 0.00 64.86 63.84 2wb1 h ILE 36 Cb 0.41 2.89 -0.04 0.00 -0.74 0.00 0.00 36.82 39.34 2wb1 h ILE 36 CO 0.00 0.56 0.37 -1.28 0.00 0.00 0.00 178.15 177.80 2wb1 h SER 37 N -0.56 0.60 -0.68 1.72 0.87 -1.24 -0.03 113.55 114.22 2wb1 h SER 37 Ca -0.04 0.01 0.15 0.00 -1.23 0.00 0.00 61.79 60.68 2wb1 h SER 37 Cb 1.06 -0.12 -0.11 0.00 -0.44 0.00 0.00 62.40 62.79 2wb1 h SER 37 CO 0.05 0.42 0.09 0.78 -0.53 0.00 0.00 176.83 177.63 2wb1 h ASN 38 N 0.73 -0.13 1.44 6.23 2.35 -1.38 -0.22 115.58 124.59 2wb1 h ASN 38 Ca 0.25 0.15 -0.03 0.00 -0.55 0.00 0.00 56.30 56.12 2wb1 h ASN 38 Cb 0.04 0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.64 2wb1 h ASN 38 CO -0.11 -0.08 -0.15 0.11 -1.65 0.00 0.00 177.43 175.55 2wb1 h LYS 39 N 0.19 0.00 0.00 0.81 1.57 -0.90 -2.43 116.57 115.81 2wb1 h LYS 39 Ca 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2wb1 h LYS 39 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2wb1 h LYS 39 CO -0.52 0.15 0.00 0.39 -0.57 0.00 0.00 179.45 178.89 2wb1 n GLU 40 N -3.19 0.00 0.32 3.15 1.02 -0.09 -4.09 120.64 117.77 2wb1 n GLU 40 Ca 0.02 0.01 -0.14 0.00 -0.02 0.00 0.00 57.16 57.03 2wb1 n GLU 40 Cb 0.50 -0.64 -0.07 0.00 -0.02 0.00 0.00 31.44 31.21 2wb1 n GLU 40 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2wb1 h VAL 41 N 0.00 0.00 -0.37 2.62 2.07 -1.21 -3.26 116.25 116.11 2wb1 h VAL 41 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 2wb1 h VAL 41 Cb 0.00 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.73 2wb1 h VAL 41 CO 0.00 0.00 0.14 -0.07 0.02 0.00 0.00 177.57 177.66 2wb1 h LEU 42 N -0.88 0.15 -6.57 2.57 3.38 -1.61 -3.21 115.31 109.14 2wb1 h LEU 42 Ca -0.08 0.04 -0.78 0.00 0.09 0.00 0.00 57.88 57.15 2wb1 h LEU 42 Cb 0.70 0.02 -0.20 0.00 0.09 0.00 0.00 40.66 41.27 2wb1 h LEU 42 CO 0.09 0.12 1.59 0.52 0.09 0.00 0.00 178.44 180.86 2wb1 n VAL 43 N -5.01 4.78 -2.66 1.22 0.31 -1.19 -4.76 118.33 111.02 2wb1 n VAL 43 Ca 0.01 -4.97 -0.03 0.00 -0.01 0.00 0.00 64.34 59.34 2wb1 n VAL 43 Cb 0.13 -2.23 0.00 0.00 -0.91 0.00 0.00 33.84 30.83 2wb1 n VAL 43 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2wb1 n THR 44 N 2.47-10.77 -2.15 2.52 -1.04 -1.24 -4.83 114.28 99.24 2wb1 n THR 44 Ca 0.36 1.29 -0.43 0.00 -2.04 0.00 0.00 64.05 63.23 2wb1 n THR 44 Cb 0.34 -6.83 -0.02 0.00 -1.82 0.00 0.00 70.33 62.00 2wb1 n THR 44 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2wb1 s ARG 45 N -1.93 3.81 -0.41 -2.82 3.00 -1.21 -4.94 118.95 114.45 2wb1 s ARG 45 Ca 0.10 1.61 0.07 0.00 -1.00 0.00 0.00 55.73 56.51 2wb1 s ARG 45 Cb -0.03 -4.02 0.17 0.00 0.00 0.00 0.00 34.95 31.08 2wb1 s ARG 45 CO 0.71 -1.27 0.57 -0.51 0.00 0.00 0.00 175.30 174.80 2wb1 s ASP 46 N 4.05 -0.83 0.00 -2.12 1.01 -1.26 -5.07 116.67 112.45 2wb1 s ASP 46 Ca 0.70 -1.06 0.00 0.00 0.71 0.00 0.00 52.55 52.89 2wb1 s ASP 46 Cb -0.24 1.59 0.00 0.00 1.01 0.00 0.00 42.92 45.28 2wb1 s ASP 46 CO 0.28 -0.18 0.00 -1.84 0.21 0.00 0.00 175.17 173.64 2wb1 n GLU 47 N 4.27 0.00 0.00 8.23 0.00 -1.26 -4.97 120.64 126.91 2wb1 n GLU 47 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.28 2wb1 n GLU 47 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.98 2wb1 n GLU 47 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2wb1 n ILE 48 N -1.82 0.00 0.87 3.84 5.41 -1.26 -3.04 119.36 123.36 2wb1 n ILE 48 Ca 0.00 0.00 0.09 0.00 1.00 0.00 0.00 62.75 63.84 2wb1 n ILE 48 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 2wb1 n ILE 48 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2wb1 n ASP 49 N 0.65 1.29 0.07 4.38 9.92 -1.26 -4.05 116.55 127.55 2wb1 n ASP 49 Ca 0.00 -1.15 0.06 0.00 -0.53 0.00 0.00 54.79 53.17 2wb1 n ASP 49 Cb 0.00 0.77 -0.04 0.00 -0.64 0.00 0.00 41.12 41.22 2wb1 n ASP 49 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 2wb1 h LYS 50 N 0.92 0.00 0.05 -1.24 1.57 -1.91 -3.36 116.57 112.60 2wb1 h LYS 50 Ca 0.00 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2wb1 h LYS 50 Cb 0.53 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.79 2wb1 h LYS 50 CO 0.00 0.15 -0.42 0.82 -0.57 0.00 0.00 179.45 179.43 2wb1 h ILE 51 N 0.00 0.15 0.00 1.86 1.08 -1.81 0.86 117.51 119.65 2wb1 h ILE 51 Ca -0.08 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.39 2wb1 h ILE 51 Cb 1.29 0.15 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 2wb1 h ILE 51 CO 0.02 0.00 0.00 0.49 -0.69 0.00 0.00 178.15 177.97 2wb1 n PHE 52 N -5.46 0.00 0.00 1.37 0.99 -1.26 -1.86 117.46 111.25 2wb1 n PHE 52 Ca -0.06 -0.11 0.00 0.00 -0.00 0.00 0.00 57.45 57.28 2wb1 n PHE 52 Cb 0.37 -0.12 0.00 0.00 -1.00 0.00 0.00 39.48 38.74 2wb1 n PHE 52 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 2wb1 n ASP 53 N 0.26 1.90 0.29 4.37 2.03 -0.57 -4.48 116.55 120.35 2wb1 n ASP 53 Ca 0.00 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.14 2wb1 n ASP 53 Cb 0.25 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.56 2wb1 n ASP 53 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2wb1 h LEU 54 N 0.00 -0.83 -2.12 -2.67 3.38 -0.74 -2.44 115.31 109.89 2wb1 h LEU 54 Ca 0.00 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.10 2wb1 h LEU 54 Cb 0.61 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2wb1 h LEU 54 CO 0.00 -0.50 0.24 0.00 0.09 0.00 0.00 178.44 178.27 2wb1 h ALA 55 N -0.36 2.05 -0.52 1.53 0.00 -1.59 -1.43 119.26 118.93 2wb1 h ALA 55 Ca -0.05 -0.01 -0.51 0.00 0.00 0.00 0.00 54.91 54.34 2wb1 h ALA 55 Cb 0.66 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.30 2wb1 h ALA 55 CO 0.04 -0.38 0.52 0.44 0.00 0.00 0.00 179.25 179.87 2wb1 n ILE 56 N -4.06 3.46 -2.89 0.00 -5.35 -0.92 -4.47 119.36 105.13 2wb1 n ILE 56 Ca 0.04 -3.05 -0.24 0.00 -0.27 0.00 0.00 62.75 59.23 2wb1 n ILE 56 Cb 0.39 -1.65 -0.03 0.00 -1.74 0.00 0.00 39.64 36.62 2wb1 n ILE 56 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2wb1 n LYS 57 N 1.00 2.71 0.00 6.28 4.01 -0.54 -4.58 118.16 127.04 2wb1 n LYS 57 Ca 0.50 -4.42 0.13 0.00 -0.51 0.00 0.00 58.31 54.01 2wb1 n LYS 57 Cb 0.54 -2.08 0.43 0.00 -0.51 0.00 0.00 35.03 33.42 2wb1 n LYS 57 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2wb1 n GLU 58 N -0.18 0.43 -0.32 1.97 4.71 -1.26 -3.74 120.64 122.25 2wb1 n GLU 58 Ca 0.30 -0.20 0.32 0.00 -0.01 0.00 0.00 57.16 57.57 2wb1 n GLU 58 Cb 0.52 -1.50 0.69 0.00 -1.01 0.00 0.00 31.44 30.14 2wb1 n GLU 58 CO 0.00 0.00 0.00 1.88 0.09 0.00 0.00 177.13 179.10 2wb1 h TYR 59 N 0.49 0.17 0.00 -0.32 -1.99 -1.89 1.03 116.97 114.46 2wb1 h TYR 59 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 2wb1 h TYR 59 Cb 0.46 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.14 2wb1 h TYR 59 CO 0.00 0.01 -0.84 -1.13 -0.00 0.00 0.00 178.16 176.19 2wb1 n SER 60 N -4.30 0.69 0.07 3.88 3.41 -1.25 -3.92 113.62 112.21 2wb1 n SER 60 Ca 0.26 0.06 -0.21 0.00 -0.26 0.00 0.00 58.87 58.71 2wb1 n SER 60 Cb 1.15 0.44 -0.15 0.00 -0.26 0.00 0.00 64.21 65.39 2wb1 n SER 60 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2wb1 h GLU 61 N 0.00 0.35 -5.78 4.33 4.22 0.54 -3.41 114.58 114.84 2wb1 h GLU 61 Ca 0.00 -0.60 -0.35 0.00 0.08 0.00 0.00 59.36 58.49 2wb1 h GLU 61 Cb 0.79 0.22 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 2wb1 h GLU 61 CO 0.00 1.29 0.92 0.20 -2.18 0.00 0.00 179.01 179.23 2wb1 s GLY 62 N -4.46 0.11 -0.35 1.92 0.00 0.23 -4.78 107.32 100.00 2wb1 s GLY 62 Ca -0.13 -1.16 -0.04 0.00 0.00 0.00 0.00 44.72 43.40 2wb1 s GLY 62 CO 0.86 3.53 0.91 1.08 0.00 0.00 0.00 173.10 179.47 2wb1 s LEU 63 N 10.08 -0.73 0.00 0.66 1.43 -1.26 -4.86 118.68 124.00 2wb1 s LEU 63 Ca 0.71 -0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 53.46 2wb1 s LEU 63 Cb -0.09 0.95 0.00 0.00 0.03 0.00 0.00 46.19 47.08 2wb1 s LEU 63 CO 0.07 -0.08 0.07 -0.38 0.23 0.00 0.00 176.35 176.26 2wb1 n ILE 64 N 3.98 0.00 -3.57 -0.59 -0.00 -1.26 -5.18 119.36 112.74 2wb1 n ILE 64 Ca 0.07 -0.22 -0.01 0.00 -0.00 0.00 0.00 62.75 62.59 2wb1 n ILE 64 Cb 0.61 0.14 -0.05 0.00 -0.00 0.00 0.00 39.64 40.34 2wb1 n ILE 64 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2wb1 s ALA 65 N -1.64 -2.27 0.29 -1.39 0.00 -1.26 -5.16 121.76 110.33 2wb1 s ALA 65 Ca 0.04 2.24 -0.22 0.00 0.00 0.00 0.00 51.96 54.02 2wb1 s ALA 65 Cb -0.00 -1.80 -0.09 0.00 0.00 0.00 0.00 23.12 21.23 2wb1 s ALA 65 CO 0.03 -0.74 0.83 -1.25 0.00 0.00 0.00 175.76 174.63 2wb1 s PRO 66 N 2.27 4.37 0.00 0.00 0.04 -1.26 -3.99 135.00 136.44 2wb1 s PRO 66 Ca -0.06 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.05 2wb1 s PRO 66 Cb -0.07 -2.76 0.00 0.00 0.04 0.00 0.00 34.50 31.70 2wb1 s PRO 66 CO -0.18 0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.57 2wb1 n GLY 67 N 0.48 3.11 3.58 0.56 0.00 -1.26 -4.99 105.19 106.66 2wb1 n GLY 67 Ca 0.01 -1.11 -0.52 0.00 0.00 0.00 0.00 46.02 44.40 2wb1 n GLY 67 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wb1 n GLU 68 N 0.00 1.02 -1.87 1.61 -0.58 -1.26 0.49 120.64 120.05 2wb1 n GLU 68 Ca 0.00 0.37 -0.40 0.00 -0.42 0.00 0.00 57.16 56.70 2wb1 n GLU 68 Cb 0.00 -1.95 -0.01 0.00 -0.57 0.00 0.00 31.44 28.91 2wb1 n GLU 68 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wb1 n ALA 69 N 2.13 6.59 0.13 0.62 0.00 -1.26 -4.76 120.51 123.97 2wb1 n ALA 69 Ca 0.18 -3.98 0.15 0.00 0.00 0.00 0.00 53.44 49.79 2wb1 n ALA 69 Cb 0.19 -3.03 0.69 0.00 0.00 0.00 0.00 19.45 17.30 2wb1 n ALA 69 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2wb1 h ILE 70 N 3.06 0.80 -0.83 0.00 -2.65 -1.97 0.45 117.51 116.37 2wb1 h ILE 70 Ca 0.67 0.00 0.20 0.00 1.03 0.00 0.00 64.86 66.76 2wb1 h ILE 70 Cb 0.39 0.85 -0.13 0.00 -2.05 0.00 0.00 36.82 35.89 2wb1 h ILE 70 CO 1.62 0.00 0.21 1.23 0.03 0.00 0.00 178.15 181.24 2wb1 h GLY 71 N 0.00 1.22 1.04 0.16 0.00 -1.98 0.83 103.07 104.33 2wb1 h GLY 71 Ca 0.13 -0.03 -0.25 0.00 0.00 0.00 0.00 47.33 47.18 2wb1 h GLY 71 CO -0.00 -0.30 -1.02 -2.22 0.00 0.00 0.00 176.54 173.00 2wb1 h ILE 72 N 0.23 1.35 -0.43 2.60 1.08 -0.51 -1.37 117.51 120.46 2wb1 h ILE 72 Ca 0.50 -2.36 -0.08 0.00 -0.39 0.00 0.00 64.86 62.52 2wb1 h ILE 72 Cb 0.94 2.72 -0.01 0.00 -3.07 0.00 0.00 36.82 37.40 2wb1 h ILE 72 CO -0.60 0.71 -0.04 -0.37 -0.69 0.00 0.00 178.15 177.15 2wb1 h VAL 73 N 0.10 1.27 0.24 1.67 -1.51 -0.91 0.14 116.25 117.25 2wb1 h VAL 73 Ca -0.15 -1.10 0.00 0.00 -1.23 0.00 0.00 66.70 64.21 2wb1 h VAL 73 Cb 1.72 1.11 -0.01 0.00 -2.13 0.00 0.00 31.29 31.97 2wb1 h VAL 73 CO 0.20 0.38 -0.21 0.00 -1.23 0.00 0.00 177.57 176.70 2wb1 h ALA 74 N 0.89 -0.46 -0.51 5.19 0.00 0.57 0.27 119.26 125.20 2wb1 h ALA 74 Ca 0.12 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.05 2wb1 h ALA 74 Cb 0.55 0.30 -0.08 0.00 0.00 0.00 0.00 17.79 18.56 2wb1 h ALA 74 CO 0.03 -0.78 0.06 0.00 0.00 0.00 0.00 179.25 178.56 2wb1 h ALA 75 N 0.22 0.54 0.61 0.00 0.00 -1.15 -2.44 119.26 117.04 2wb1 h ALA 75 Ca -0.01 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2wb1 h ALA 75 Cb 0.43 0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.43 2wb1 h ALA 75 CO -0.03 -0.35 -0.29 1.96 0.00 0.00 0.00 179.25 180.54 2wb1 h GLN 76 N 0.18 -0.79 0.00 0.00 4.20 -0.79 -2.99 115.11 114.92 2wb1 h GLN 76 Ca 0.26 0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.02 2wb1 h GLN 76 Cb 0.38 0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2wb1 h GLN 76 CO -0.38 -0.53 0.00 -1.13 -0.67 0.00 0.00 178.83 176.12 2wb1 n SER 77 N -4.31 0.00 -0.00 1.46 3.41 0.92 0.03 113.62 115.13 2wb1 n SER 77 Ca -0.10 0.11 0.06 0.00 -0.26 0.00 0.00 58.87 58.68 2wb1 n SER 77 Cb 0.32 -0.20 -0.08 0.00 -0.26 0.00 0.00 64.21 63.99 2wb1 n SER 77 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 2wb1 n VAL 78 N -1.20 0.00 -0.07 -3.33 3.14 -0.93 -4.48 118.33 111.47 2wb1 n VAL 78 Ca 0.03 -0.24 -0.21 0.00 -2.96 0.00 0.00 64.34 60.95 2wb1 n VAL 78 Cb 0.03 0.65 -0.13 0.00 -1.06 0.00 0.00 33.84 33.33 2wb1 n VAL 78 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2wb1 n GLY 79 N 1.50 -0.51 0.26 7.55 0.00 0.10 -4.03 105.19 110.07 2wb1 n GLY 79 Ca 0.00 -0.19 0.03 0.00 0.00 0.00 0.00 46.02 45.87 2wb1 n GLY 79 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2wb1 h GLU 80 N -0.17 0.34 0.53 1.61 4.22 -1.12 -1.70 114.58 118.29 2wb1 h GLU 80 Ca -0.49 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 58.91 2wb1 h GLU 80 Cb 1.87 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 31.03 2wb1 h GLU 80 CO -0.05 0.23 -0.40 -1.35 -2.18 0.00 0.00 179.01 175.25 2wb1 h PRO 81 N 0.35 -0.88 -0.24 0.92 0.11 -1.78 -3.28 132.00 127.21 2wb1 h PRO 81 Ca 0.37 0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.57 2wb1 h PRO 81 Cb 0.57 0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.85 2wb1 h PRO 81 CO -0.41 -0.59 -0.14 0.41 -0.21 0.00 0.00 178.00 177.06 2wb1 n GLY 82 N -1.52 -0.61 0.43 -0.55 0.00 -0.65 -0.51 105.19 101.79 2wb1 n GLY 82 Ca -0.12 0.28 0.24 0.00 0.00 0.00 0.00 46.02 46.42 2wb1 n GLY 82 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2wb1 h THR 83 N 0.00 0.57 -0.57 2.61 1.35 -1.60 -3.48 112.91 111.80 2wb1 h THR 83 Ca 0.04 -0.09 -0.05 0.00 -0.55 0.00 0.00 66.41 65.76 2wb1 h THR 83 Cb 0.10 0.28 -0.02 0.00 -1.73 0.00 0.00 68.15 66.78 2wb1 h THR 83 CO -0.22 0.05 0.16 1.56 -0.25 0.00 0.00 175.52 176.82 2wb1 h GLN 84 N 0.27 0.89 0.00 4.72 4.20 -0.99 -3.54 115.11 120.66 2wb1 h GLN 84 Ca 0.51 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 59.02 2wb1 h GLN 84 Cb 1.51 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.17 2wb1 h GLN 84 CO -0.16 0.81 0.00 1.28 -0.67 0.00 0.00 178.83 180.10 2wb1 n LEU 102 N -4.42 0.00 0.00 1.46 4.77 -1.26 -5.08 117.00 112.47 2wb1 n LEU 102 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2wb1 n LEU 102 Cb 0.21 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2wb1 n LEU 102 CO 0.40 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2wb1 n GLY 103 N 0.00 0.73 0.22 -0.72 0.00 -1.26 -4.95 105.19 99.21 2wb1 n GLY 103 Ca 0.00 0.27 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 2wb1 n GLY 103 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2wb1 h LEU 104 N 0.00 0.68 -1.70 0.99 7.12 -1.96 -1.69 115.31 118.75 2wb1 h LEU 104 Ca 0.00 -0.19 -0.04 0.00 0.13 0.00 0.00 57.88 57.78 2wb1 h LEU 104 Cb 0.00 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 39.95 2wb1 h LEU 104 CO 0.00 0.69 -0.18 -0.65 -0.13 0.00 0.00 178.44 178.17 2wb1 h PRO 105 N 0.63 0.00 0.00 5.25 0.11 -1.98 0.11 132.00 136.11 2wb1 h PRO 105 Ca 0.15 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.23 2wb1 h PRO 105 Cb 0.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.35 2wb1 h PRO 105 CO -0.01 0.18 -0.16 -0.09 -0.21 0.00 0.00 178.00 177.71 2wb1 h ARG 106 N 0.00 0.00 0.07 1.05 9.65 -1.85 -1.54 114.38 121.76 2wb1 h ARG 106 Ca -0.00 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.68 2wb1 h ARG 106 Cb 0.35 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 28.94 2wb1 h ARG 106 CO 0.02 0.16 -0.81 1.25 2.80 0.00 0.00 179.97 183.40 2wb1 h LEU 107 N 0.00 0.58 -0.63 3.80 6.46 -0.28 -3.21 115.31 122.03 2wb1 h LEU 107 Ca -0.00 -0.84 -0.05 0.00 -0.12 0.00 0.00 57.88 56.87 2wb1 h LEU 107 Cb 0.76 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 40.48 2wb1 h LEU 107 CO 0.02 1.36 0.21 0.40 -0.62 0.00 0.00 178.44 179.81 2wb1 h ILE 108 N -0.12 1.24 0.03 4.05 2.04 -0.79 -2.70 117.51 121.26 2wb1 h ILE 108 Ca -0.12 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 64.93 2wb1 h ILE 108 Cb 1.55 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 2wb1 h ILE 108 CO 0.16 0.31 -0.05 -0.33 0.00 0.00 0.00 178.15 178.23 2wb1 h GLU 109 N 0.90 -0.09 -1.00 2.37 5.08 -1.38 -3.04 114.58 117.41 2wb1 h GLU 109 Ca 0.20 0.01 0.22 0.00 -1.00 0.00 0.00 59.36 58.79 2wb1 h GLU 109 Cb 0.27 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.42 2wb1 h GLU 109 CO -0.01 -0.06 0.61 0.97 -1.00 0.00 0.00 179.01 179.52 2wb1 h ILE 110 N -0.09 0.62 0.00 3.13 2.10 -1.60 0.37 117.51 122.05 2wb1 h ILE 110 Ca -0.00 -0.22 0.00 0.00 1.08 0.00 0.00 64.86 65.71 2wb1 h ILE 110 Cb 0.08 -0.09 0.00 0.00 -1.09 0.00 0.00 36.82 35.72 2wb1 h ILE 110 CO -0.02 0.12 0.00 0.55 -1.08 0.00 0.00 178.15 177.72 2wb1 n VAL 111 N -4.80 0.00 -2.09 2.19 3.14 -1.02 -3.03 118.33 112.72 2wb1 n VAL 111 Ca 0.25 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.63 2wb1 n VAL 111 Cb 0.67 -0.66 0.10 0.00 -1.06 0.00 0.00 33.84 32.90 2wb1 n VAL 111 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2wb1 n ASP 112 N -1.00 1.93 0.00 6.55 8.00 0.12 -2.50 116.55 129.66 2wb1 n ASP 112 Ca 0.16 -3.06 0.00 0.00 0.71 0.00 0.00 54.79 52.60 2wb1 n ASP 112 Cb 0.07 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 2wb1 n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wb1 n ALA 113 N -0.48 0.00 -2.41 2.24 0.00 -1.17 -4.70 120.51 113.99 2wb1 n ALA 113 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.60 2wb1 n ALA 113 Cb 0.89 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.33 2wb1 n ALA 113 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wb1 n LYS 114 N 0.00 -3.31 0.20 0.00 3.00 -1.26 -4.65 118.16 112.15 2wb1 n LYS 114 Ca 0.00 2.46 0.06 0.00 -0.00 0.00 0.00 58.31 60.82 2wb1 n LYS 114 Cb 0.00 -3.26 0.43 0.00 0.00 0.00 0.00 35.03 32.20 2wb1 n LYS 114 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 2wb1 h LYS 115 N 4.30 0.00 -4.86 1.64 3.64 -1.91 -3.42 116.57 115.97 2wb1 h LYS 115 Ca -0.12 0.00 -0.68 0.00 -1.27 0.00 0.00 60.65 58.58 2wb1 h LYS 115 Cb 0.27 0.00 -0.33 0.00 -0.41 0.00 0.00 32.23 31.76 2wb1 h LYS 115 CO 0.00 0.32 -0.74 0.14 -2.27 0.00 0.00 179.45 176.90 2wb1 s VAL 116 N -4.00 2.79 0.51 2.00 -7.23 -1.26 -4.91 120.40 108.29 2wb1 s VAL 116 Ca -0.02 -1.24 -0.06 0.00 -1.81 0.00 0.00 61.98 58.85 2wb1 s VAL 116 Cb 0.13 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 2wb1 s VAL 116 CO 0.68 0.06 0.82 -2.16 -0.31 0.00 0.00 175.10 174.20 2wb1 s PRO 117 N 1.26 3.47 0.21 4.82 0.04 -1.26 -5.07 135.00 138.47 2wb1 s PRO 117 Ca -0.03 0.23 -0.29 0.00 0.04 0.00 0.00 61.00 60.95 2wb1 s PRO 117 Cb -0.18 -2.33 -0.08 0.00 0.04 0.00 0.00 34.50 31.94 2wb1 s PRO 117 CO -0.04 -0.30 0.92 -1.12 0.04 0.00 0.00 177.00 176.50 2wb1 s SER 118 N -4.14 7.59 -1.05 6.66 0.01 -1.26 -4.13 113.70 117.38 2wb1 s SER 118 Ca 0.49 1.88 -0.13 0.00 1.31 0.00 0.00 55.95 59.51 2wb1 s SER 118 Cb -0.10 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 2wb1 s SER 118 CO 0.46 0.14 0.83 0.41 0.41 0.00 0.00 173.24 175.48 2wb1 n THR 119 N 1.66 -7.43 -2.44 1.44 -1.04 -1.26 -4.91 114.28 100.30 2wb1 n THR 119 Ca -0.02 -1.00 -0.43 0.00 -2.04 0.00 0.00 64.05 60.56 2wb1 n THR 119 Cb 0.48 -5.36 -0.02 0.00 -1.82 0.00 0.00 70.33 63.61 2wb1 n THR 119 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2wb1 s PRO 120 N -5.06 3.83 0.19 -2.82 0.02 -1.26 -5.01 135.00 124.89 2wb1 s PRO 120 Ca 0.41 1.09 0.10 0.00 0.02 0.00 0.00 61.00 62.61 2wb1 s PRO 120 Cb -0.11 -3.90 -0.04 0.00 0.02 0.00 0.00 34.50 30.47 2wb1 s PRO 120 CO 0.81 -1.23 -0.17 -1.64 -0.33 0.00 0.00 177.00 174.44 2wb1 s MET 121 N 4.34 1.79 0.01 5.54 -1.94 -1.26 -3.35 119.30 124.42 2wb1 s MET 121 Ca 0.56 -1.41 0.01 0.00 -1.71 0.00 0.00 55.69 53.14 2wb1 s MET 121 Cb -0.15 -2.00 -0.01 0.00 2.01 0.00 0.00 34.83 34.69 2wb1 s MET 121 CO 0.26 0.41 -0.03 -1.64 -0.01 0.00 0.00 175.02 174.01 2wb1 s MET 122 N -2.78 0.22 -0.12 2.03 -1.94 -1.08 -1.51 119.30 114.12 2wb1 s MET 122 Ca 0.23 -0.22 0.00 0.00 -1.71 0.00 0.00 55.69 53.99 2wb1 s MET 122 Cb -0.08 -0.14 -0.02 0.00 2.01 0.00 0.00 34.83 36.61 2wb1 s MET 122 CO 0.13 0.03 -0.13 0.95 -0.01 0.00 0.00 175.02 175.99 2wb1 s THR 123 N -0.38 3.05 -0.17 2.05 -4.23 0.69 -1.94 115.64 114.71 2wb1 s THR 123 Ca -0.03 -0.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.82 2wb1 s THR 123 Cb -0.03 -2.28 0.01 0.00 1.34 0.00 0.00 72.50 71.54 2wb1 s THR 123 CO -0.00 0.53 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.81 2wb1 s ILE 124 N 0.28 2.47 0.23 2.99 -1.09 0.44 -1.60 121.20 124.91 2wb1 s ILE 124 Ca -0.10 -0.82 -0.04 0.00 -2.23 0.00 0.00 60.65 57.47 2wb1 s ILE 124 Cb -0.16 -2.05 -0.05 0.00 -1.58 0.00 0.00 42.46 38.63 2wb1 s ILE 124 CO 0.05 0.51 0.46 -0.31 -1.23 0.00 0.00 174.94 174.43 2wb1 s TYR 125 N 1.09 3.47 -0.64 3.97 1.51 -1.26 -2.10 117.35 123.40 2wb1 s TYR 125 Ca -0.00 0.54 0.05 0.00 -1.01 0.00 0.00 57.07 56.64 2wb1 s TYR 125 Cb -0.14 -2.01 0.31 0.00 -0.11 0.00 0.00 41.96 40.01 2wb1 s TYR 125 CO -0.06 0.30 0.95 1.28 -1.11 0.00 0.00 175.55 176.91 2wb1 n LEU 126 N -0.61 4.49 0.00 -1.29 4.77 -1.26 -1.13 117.00 121.98 2wb1 n LEU 126 Ca -0.03 -5.59 0.03 0.00 -0.03 0.00 0.00 56.01 50.39 2wb1 n LEU 126 Cb 0.53 -0.65 -0.01 0.00 -2.33 0.00 0.00 43.42 40.97 2wb1 n LEU 126 CO 0.48 2.23 -0.04 0.35 -1.33 0.00 0.00 177.39 179.09 2wb1 n THR 127 N 0.14 0.00 0.20 -5.08 -2.24 -1.19 -3.36 114.28 102.74 2wb1 n THR 127 Ca 0.31 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.18 2wb1 n THR 127 Cb 0.39 -0.07 0.22 0.00 -2.10 0.00 0.00 70.33 68.77 2wb1 n THR 127 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2wb1 h ASP 128 N -0.19 0.00 -4.07 3.42 3.45 -1.99 -3.43 116.42 113.61 2wb1 h ASP 128 Ca 0.00 0.00 -0.36 0.00 0.43 0.00 0.00 57.03 57.10 2wb1 h ASP 128 Cb 0.19 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 38.89 2wb1 h ASP 128 CO 0.00 0.24 -0.28 1.21 -1.57 0.00 0.00 179.24 178.84 2wb1 n GLU 129 N -3.21 1.05 -0.64 3.56 4.07 -1.26 -4.84 120.64 119.38 2wb1 n GLU 129 Ca 0.02 -2.12 0.00 0.00 -0.06 0.00 0.00 57.16 55.00 2wb1 n GLU 129 Cb 0.57 0.80 0.00 0.00 -0.06 0.00 0.00 31.44 32.75 2wb1 n GLU 129 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2wb1 n TYR 130 N -0.66 0.00 -0.03 4.31 4.02 -1.26 -4.77 117.16 118.77 2wb1 n TYR 130 Ca -0.09 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.74 2wb1 n TYR 130 Cb 0.37 -1.32 -0.13 0.00 -0.02 0.00 0.00 39.34 38.24 2wb1 n TYR 130 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 2wb1 n LYS 131 N -1.67 0.65 0.03 -0.72 4.81 -1.21 -4.18 118.16 115.86 2wb1 n LYS 131 Ca 0.00 0.17 -0.03 0.00 -0.87 0.00 0.00 58.31 57.58 2wb1 n LYS 131 Cb 0.06 -1.71 -0.09 0.00 0.02 0.00 0.00 35.03 33.31 2wb1 n LYS 131 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2wb1 h HIS 132 N 0.00 0.00 -3.78 5.64 3.86 -1.86 0.87 115.15 119.88 2wb1 h HIS 132 Ca -0.31 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.40 2wb1 h HIS 132 Cb 1.93 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.40 2wb1 h HIS 132 CO 0.00 0.73 0.43 0.34 0.86 0.00 0.00 177.93 180.28 2wb1 s ASP 133 N -5.98 7.41 -0.03 2.45 2.15 -1.26 -4.86 116.67 116.55 2wb1 s ASP 133 Ca -0.03 2.15 -0.23 0.00 0.43 0.00 0.00 52.55 54.87 2wb1 s ASP 133 Cb 0.08 -2.62 -0.23 0.00 -0.30 0.00 0.00 42.92 39.85 2wb1 s ASP 133 CO 0.81 -0.03 1.06 0.11 -0.17 0.00 0.00 175.17 176.95 2wb1 h LYS 134 N 3.97 0.25 -0.46 4.34 1.57 -1.91 -3.29 116.57 121.04 2wb1 h LYS 134 Ca -0.46 -0.27 -0.13 0.00 -1.87 0.00 0.00 60.65 57.92 2wb1 h LYS 134 Cb 1.21 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.58 2wb1 h LYS 134 CO 0.67 0.98 -0.23 0.93 -0.57 0.00 0.00 179.45 181.23 2wb1 h GLU 135 N -0.36 0.97 -0.71 3.15 5.08 -1.95 -3.15 114.58 117.60 2wb1 h GLU 135 Ca -0.04 -0.42 0.05 0.00 -1.00 0.00 0.00 59.36 57.94 2wb1 h GLU 135 Cb 1.10 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 2wb1 h GLU 135 CO 0.07 1.09 0.47 0.87 -1.00 0.00 0.00 179.01 180.51 2wb1 h LYS 136 N 0.83 0.79 -0.05 2.33 1.79 -1.85 -1.75 116.57 118.66 2wb1 h LYS 136 Ca 0.10 -0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.46 2wb1 h LYS 136 Cb 0.81 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 31.27 2wb1 h LYS 136 CO 0.07 0.52 -0.29 0.00 -1.08 0.00 0.00 179.45 178.67 2wb1 h ALA 137 N 1.60 1.42 0.05 3.86 0.00 -1.61 -3.20 119.26 121.39 2wb1 h ALA 137 Ca 0.29 -0.29 -0.29 0.00 0.00 0.00 0.00 54.91 54.62 2wb1 h ALA 137 Cb 0.14 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2wb1 h ALA 137 CO -0.09 0.42 -1.55 -0.07 0.00 0.00 0.00 179.25 177.96 2wb1 h LEU 138 N 0.09 0.18 -1.17 0.00 3.38 -1.42 -3.26 115.31 113.11 2wb1 h LEU 138 Ca 0.01 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 2wb1 h LEU 138 Cb 0.56 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2wb1 h LEU 138 CO 0.04 1.24 -0.24 -0.33 0.09 0.00 0.00 178.44 179.24 2wb1 h GLU 139 N 0.03 0.00 0.10 1.13 5.08 -1.43 -1.45 114.58 118.04 2wb1 h GLU 139 Ca -0.24 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.84 2wb1 h GLU 139 Cb 1.97 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.24 2wb1 h GLU 139 CO 0.12 0.24 -1.19 0.28 -1.00 0.00 0.00 179.01 177.47 2wb1 h VAL 140 N 0.00 1.34 0.00 3.13 2.07 -1.72 -3.29 116.25 117.78 2wb1 h VAL 140 Ca -0.00 -2.55 0.00 0.00 0.82 0.00 0.00 66.70 64.96 2wb1 h VAL 140 Cb 0.73 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 33.18 2wb1 h VAL 140 CO 0.03 0.77 0.00 0.00 0.02 0.00 0.00 177.57 178.39 2wb1 n ALA 141 N -2.63 2.31 0.24 1.67 0.00 -0.60 -1.14 120.51 120.36 2wb1 n ALA 141 Ca -0.11 -0.08 0.02 0.00 0.00 0.00 0.00 53.44 53.27 2wb1 n ALA 141 Cb 0.96 -1.20 -0.03 0.00 0.00 0.00 0.00 19.45 19.18 2wb1 n ALA 141 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2wb1 n ARG 142 N -0.76 5.01 -0.25 0.00 1.85 -0.89 -4.44 116.66 117.18 2wb1 n ARG 142 Ca 0.09 -0.00 0.11 0.00 -1.00 0.00 0.00 57.85 57.05 2wb1 n ARG 142 Cb 0.04 -0.77 0.27 0.00 -1.05 0.00 0.00 32.46 30.95 2wb1 n ARG 142 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2wb1 n LYS 143 N -1.15 2.45 -0.04 2.89 4.76 -0.29 -4.47 118.16 122.30 2wb1 n LYS 143 Ca 0.01 -2.22 -0.05 0.00 -2.87 0.00 0.00 58.31 53.18 2wb1 n LYS 143 Cb 0.08 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.71 2wb1 n LYS 143 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2wb1 n LEU 144 N 1.35 0.95 -0.29 -0.35 4.77 -0.74 -4.82 117.00 117.88 2wb1 n LEU 144 Ca 0.20 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 2wb1 n LEU 144 Cb 0.56 0.02 0.13 0.00 -2.33 0.00 0.00 43.42 41.80 2wb1 n LEU 144 CO 0.15 0.35 1.16 -0.33 -1.33 0.00 0.00 177.39 177.39 2wb1 h GLU 145 N 0.00 0.84 -2.99 3.23 5.08 -1.78 -3.43 114.58 115.53 2wb1 h GLU 145 Ca -0.23 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2wb1 h GLU 145 Cb 1.46 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2wb1 h GLU 145 CO -0.00 0.56 0.00 0.98 -1.00 0.00 0.00 179.01 179.54 2wb1 n TYR 146 N -4.68 0.00 -3.43 4.33 9.36 -1.05 -3.81 117.16 117.88 2wb1 n TYR 146 Ca 0.11 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.90 2wb1 n TYR 146 Cb 0.19 -1.50 -0.09 0.00 -0.63 0.00 0.00 39.34 37.31 2wb1 n TYR 146 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2wb1 s THR 147 N 0.00 5.24 0.79 2.97 2.01 -1.25 -4.92 115.64 120.48 2wb1 s THR 147 Ca 0.00 -0.75 -0.12 0.00 0.31 0.00 0.00 61.69 61.13 2wb1 s THR 147 Cb 0.00 -4.00 0.07 0.00 0.01 0.00 0.00 72.50 68.58 2wb1 s THR 147 CO 0.00 -0.40 1.14 -0.54 -0.69 0.00 0.00 174.62 174.14 2wb1 s LYS 148 N 1.71 2.11 0.02 4.92 1.02 -1.26 -0.89 119.74 127.37 2wb1 s LYS 148 Ca 0.05 0.29 -0.21 0.00 0.02 0.00 0.00 55.97 56.12 2wb1 s LYS 148 Cb -0.20 -1.95 -0.18 0.00 -0.52 0.00 0.00 37.83 34.98 2wb1 s LYS 148 CO 0.09 -1.52 1.24 0.82 -0.92 0.00 0.00 175.35 175.05 2wb1 h ILE 149 N -1.01 1.40 -0.83 2.17 5.03 -1.69 -3.18 117.51 119.40 2wb1 h ILE 149 Ca -0.46 -1.60 0.28 0.00 -0.12 0.00 0.00 64.86 62.96 2wb1 h ILE 149 Cb 1.30 2.18 -0.15 0.00 -3.03 0.00 0.00 36.82 37.12 2wb1 h ILE 149 CO 0.64 0.46 0.19 -0.62 -0.68 0.00 0.00 178.15 178.15 2wb1 n GLU 150 N -4.46 -0.06 -0.17 2.37 1.02 -1.26 0.32 120.64 118.40 2wb1 n GLU 150 Ca -0.08 1.20 -0.07 0.00 -0.02 0.00 0.00 57.16 58.19 2wb1 n GLU 150 Cb 0.46 -2.01 0.02 0.00 -0.02 0.00 0.00 31.44 29.89 2wb1 n GLU 150 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2wb1 h ASN 151 N 0.00 0.57 -0.12 1.62 4.21 -1.92 -3.26 115.58 116.67 2wb1 h ASN 151 Ca 0.59 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 58.08 2wb1 h ASN 151 Cb 1.38 -0.14 0.00 0.00 -1.12 0.00 0.00 38.32 38.44 2wb1 h ASN 151 CO -0.72 0.41 0.00 0.55 -1.29 0.00 0.00 177.43 176.38 2wb1 n VAL 152 N -4.74 0.14 -4.96 2.81 3.14 0.15 -4.80 118.33 110.06 2wb1 n VAL 152 Ca 0.02 -0.45 -0.32 0.00 -2.96 0.00 0.00 64.34 60.63 2wb1 n VAL 152 Cb 0.02 0.90 -0.15 0.00 -1.06 0.00 0.00 33.84 33.56 2wb1 n VAL 152 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2wb1 s VAL 153 N -1.86 2.68 -0.07 1.55 0.11 -0.78 -1.57 120.40 120.46 2wb1 s VAL 153 Ca 0.34 -0.81 -0.04 0.00 -2.93 0.00 0.00 61.98 58.53 2wb1 s VAL 153 Cb 0.20 -2.08 -0.27 0.00 -1.53 0.00 0.00 36.38 32.70 2wb1 s VAL 153 CO 0.31 0.55 0.56 0.77 -3.33 0.00 0.00 175.10 173.95 2wb1 h SER 154 N 6.47 0.40 -4.78 3.54 4.64 -1.72 -3.46 113.55 118.65 2wb1 h SER 154 Ca -0.27 -0.76 -0.12 0.00 -0.47 0.00 0.00 61.79 60.17 2wb1 h SER 154 Cb 1.21 -0.13 -0.21 0.00 -0.31 0.00 0.00 62.40 62.96 2wb1 h SER 154 CO 0.52 1.66 -0.30 -0.94 -0.87 0.00 0.00 176.83 176.90 2wb1 s SER 155 N -6.96 -0.20 0.02 4.97 1.04 -1.23 -5.07 113.70 106.26 2wb1 s SER 155 Ca -0.16 0.16 0.02 0.00 0.48 0.00 0.00 55.95 56.44 2wb1 s SER 155 Cb 0.07 0.37 -0.01 0.00 0.10 0.00 0.00 66.02 66.54 2wb1 s SER 155 CO 0.81 -0.38 -0.06 -0.89 0.98 0.00 0.00 173.24 173.70 2wb1 s THR 156 N -1.07 0.39 0.24 2.02 2.01 -1.26 -1.95 115.64 116.03 2wb1 s THR 156 Ca -0.11 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.28 2wb1 s THR 156 Cb -0.05 -0.41 -0.03 0.00 0.01 0.00 0.00 72.50 72.02 2wb1 s THR 156 CO 0.03 -0.15 0.21 -0.94 -0.69 0.00 0.00 174.62 173.09 2wb1 s SER 157 N -0.82 0.55 -0.02 3.53 1.04 -1.03 -5.04 113.70 111.91 2wb1 s SER 157 Ca -0.05 -1.45 0.05 0.00 0.48 0.00 0.00 55.95 54.98 2wb1 s SER 157 Cb -0.06 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.51 2wb1 s SER 157 CO -0.00 -0.94 -0.18 -0.63 0.98 0.00 0.00 173.24 172.47 2wb1 s ILE 158 N -3.91 1.43 1.02 -1.02 1.01 -1.26 -1.92 121.20 116.55 2wb1 s ILE 158 Ca 0.38 -0.76 -0.17 0.00 0.00 0.00 0.00 60.65 60.09 2wb1 s ILE 158 Cb 0.05 -1.20 0.23 0.00 0.01 0.00 0.00 42.46 41.55 2wb1 s ILE 158 CO 0.16 0.41 1.33 -1.81 0.00 0.00 0.00 174.94 175.02 2wb1 s ASP 159 N -0.31 2.62 0.05 3.58 1.11 -0.40 -5.01 116.67 118.31 2wb1 s ASP 159 Ca 0.04 0.21 0.00 0.00 0.18 0.00 0.00 52.55 52.98 2wb1 s ASP 159 Cb -0.08 -0.19 0.00 0.00 1.07 0.00 0.00 42.92 43.72 2wb1 s ASP 159 CO -0.00 -3.04 0.00 -0.38 1.18 0.00 0.00 175.17 172.93 2wb1 n ILE 160 N -3.96 0.27 0.00 0.77 5.41 -1.26 -4.95 119.36 115.64 2wb1 n ILE 160 Ca 0.16 0.09 0.00 0.00 1.00 0.00 0.00 62.75 64.00 2wb1 n ILE 160 Cb 0.59 -1.23 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 2wb1 n ILE 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wb1 n ALA 161 N -3.05 -0.09 -3.01 -1.39 0.00 -1.26 -4.84 120.51 106.87 2wb1 n ALA 161 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2wb1 n ALA 161 Cb 0.25 0.07 -0.00 0.00 0.00 0.00 0.00 19.45 19.76 2wb1 n ALA 161 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2wb1 s SER 162 N -2.21 -1.10 0.00 0.00 1.04 -1.26 -5.10 113.70 105.06 2wb1 s SER 162 Ca 0.00 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.77 2wb1 s SER 162 Cb 0.00 1.42 0.00 0.00 0.10 0.00 0.00 66.02 67.54 2wb1 s SER 162 CO 0.00 -0.11 0.00 0.23 0.98 0.00 0.00 173.24 174.34 2wb1 n MET 163 N 3.97 0.00 -0.89 4.02 2.81 -1.26 -5.09 117.12 120.68 2wb1 n MET 163 Ca 0.10 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.98 2wb1 n MET 163 Cb 0.59 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 33.09 2wb1 n MET 163 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2wb1 n SER 164 N -0.31 -0.05 -4.07 7.83 3.41 -0.32 -3.00 113.62 117.11 2wb1 n SER 164 Ca 0.00 -1.74 -0.30 0.00 -0.26 0.00 0.00 58.87 56.57 2wb1 n SER 164 Cb 0.00 -0.03 -0.17 0.00 -0.26 0.00 0.00 64.21 63.76 2wb1 n SER 164 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2wb1 s ILE 165 N 0.00 1.62 -0.23 -1.33 1.01 -1.19 -1.27 121.20 119.79 2wb1 s ILE 165 Ca 0.08 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 60.02 2wb1 s ILE 165 Cb 0.09 -1.47 0.02 0.00 0.01 0.00 0.00 42.46 41.12 2wb1 s ILE 165 CO -0.04 0.46 -0.09 -0.63 0.00 0.00 0.00 174.94 174.64 2wb1 s ILE 166 N 1.05 2.71 -0.31 2.92 1.01 -0.81 -0.28 121.20 127.50 2wb1 s ILE 166 Ca -0.04 -1.01 -0.07 0.00 0.00 0.00 0.00 60.65 59.53 2wb1 s ILE 166 Cb -0.15 -2.34 0.02 0.00 0.01 0.00 0.00 42.46 40.00 2wb1 s ILE 166 CO -0.03 0.26 0.09 -0.76 0.00 0.00 0.00 174.94 174.50 2wb1 s LEU 167 N 1.31 3.98 -0.58 2.97 1.02 0.11 -2.48 118.68 125.03 2wb1 s LEU 167 Ca 0.01 -0.83 -0.17 0.00 0.02 0.00 0.00 54.13 53.16 2wb1 s LEU 167 Cb -0.16 -1.88 0.12 0.00 0.02 0.00 0.00 46.19 44.29 2wb1 s LEU 167 CO -0.06 -0.23 0.61 -1.10 0.02 0.00 0.00 176.35 175.59 2wb1 s GLN 168 N 1.47 3.04 0.37 1.70 -0.21 -0.82 -0.21 119.66 125.00 2wb1 s GLN 168 Ca 0.01 -1.57 -0.28 0.00 0.02 0.00 0.00 55.36 53.55 2wb1 s GLN 168 Cb -0.18 -4.30 -0.11 0.00 1.00 0.00 0.00 33.01 29.43 2wb1 s GLN 168 CO 0.03 -1.43 1.44 -0.51 -2.12 0.00 0.00 175.29 172.70 2wb1 s LEU 169 N 2.04 4.33 1.22 2.90 1.02 -1.14 -2.16 118.68 126.89 2wb1 s LEU 169 Ca 0.08 2.96 -0.19 0.00 0.02 0.00 0.00 54.13 57.00 2wb1 s LEU 169 Cb -0.27 -3.68 0.29 0.00 0.02 0.00 0.00 46.19 42.55 2wb1 s LEU 169 CO 0.04 -0.82 1.07 -0.62 0.02 0.00 0.00 176.35 176.04 2wb1 s ASP 170 N -0.25 0.75 -0.04 2.29 2.15 -0.61 -4.71 116.67 116.25 2wb1 s ASP 170 Ca 0.52 0.77 -0.04 0.00 0.43 0.00 0.00 52.55 54.24 2wb1 s ASP 170 Cb -0.45 -1.11 -0.01 0.00 -0.30 0.00 0.00 42.92 41.05 2wb1 s ASP 170 CO 0.60 -4.24 -0.07 0.59 -0.17 0.00 0.00 175.17 171.88 2wb1 n ASN 171 N -4.86 0.40 0.17 -0.34 3.02 -1.26 -4.68 115.26 107.71 2wb1 n ASN 171 Ca 0.12 0.07 0.04 0.00 -0.03 0.00 0.00 54.58 54.78 2wb1 n ASN 171 Cb 0.59 -0.55 0.45 0.00 -0.61 0.00 0.00 39.78 39.66 2wb1 n ASN 171 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2wb1 h GLU 172 N -0.20 0.12 0.00 3.52 5.08 -1.99 -3.21 114.58 117.90 2wb1 h GLU 172 Ca 0.00 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 2wb1 h GLU 172 Cb 0.20 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2wb1 h GLU 172 CO 0.00 0.27 -0.23 1.98 -1.00 0.00 0.00 179.01 180.03 2wb1 h MET 173 N 0.12 0.00 0.01 2.33 4.05 -1.93 -2.79 114.93 116.72 2wb1 h MET 173 Ca 0.02 0.00 -0.15 0.00 -0.28 0.00 0.00 59.70 59.29 2wb1 h MET 173 Cb 0.33 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 31.14 2wb1 h MET 173 CO 0.02 0.23 -0.60 -0.07 0.23 0.00 0.00 176.91 176.72 2wb1 h LEU 174 N 0.00 0.51 -0.34 3.39 -0.00 -1.83 -3.28 115.31 113.76 2wb1 h LEU 174 Ca -0.00 -0.78 -0.19 0.00 -0.00 0.00 0.00 57.88 56.91 2wb1 h LEU 174 Cb 1.08 -0.16 0.00 0.00 -0.00 0.00 0.00 40.66 41.58 2wb1 h LEU 174 CO 0.03 1.22 -0.66 0.50 -0.00 0.00 0.00 178.44 179.53 2wb1 h LYS 175 N -0.15 0.65 -0.04 1.13 3.64 -1.72 -2.05 116.57 118.03 2wb1 h LYS 175 Ca -0.08 -0.47 0.01 0.00 -1.27 0.00 0.00 60.65 58.84 2wb1 h LYS 175 Cb 1.32 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.22 2wb1 h LYS 175 CO 0.12 1.09 0.05 -0.44 -2.27 0.00 0.00 179.45 178.00 2wb1 h ASP 176 N 0.47 0.00 -0.02 4.20 5.19 -1.59 -2.43 116.42 122.23 2wb1 h ASP 176 Ca -0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2wb1 h ASP 176 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 2wb1 h ASP 176 CO 0.13 0.00 0.00 0.29 -3.12 0.00 0.00 179.24 176.54 2wb1 n LYS 177 N -3.80 0.11 -2.56 3.56 5.02 -1.23 -5.03 118.16 114.23 2wb1 n LYS 177 Ca -0.02 -0.95 -0.08 0.00 -2.02 0.00 0.00 58.31 55.25 2wb1 n LYS 177 Cb 0.14 -1.12 0.04 0.00 -0.02 0.00 0.00 35.03 34.06 2wb1 n LYS 177 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wb1 n GLY 178 N 0.33 0.03 3.09 0.72 0.00 -0.92 -4.80 105.19 103.65 2wb1 n GLY 178 Ca 0.04 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 2wb1 n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wb1 s VAL 179 N -3.17 2.27 -1.43 1.61 0.11 -0.79 -5.03 120.40 113.97 2wb1 s VAL 179 Ca 0.06 -1.52 -0.08 0.00 -2.93 0.00 0.00 61.98 57.51 2wb1 s VAL 179 Cb -0.01 -2.29 -0.03 0.00 -1.53 0.00 0.00 36.38 32.52 2wb1 s VAL 179 CO 0.34 0.03 2.81 0.41 -3.33 0.00 0.00 175.10 175.36 2wb1 n THR 180 N 4.48 4.53 -4.15 5.04 -1.04 -1.26 -4.54 114.28 117.35 2wb1 n THR 180 Ca -0.15 -3.09 -0.34 0.00 -2.04 0.00 0.00 64.05 58.44 2wb1 n THR 180 Cb 0.43 -2.40 -0.04 0.00 -1.82 0.00 0.00 70.33 66.50 2wb1 n THR 180 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2wb1 n VAL 181 N 2.89 -2.16 0.71 12.58 0.31 -1.26 -4.84 118.33 126.56 2wb1 n VAL 181 Ca 0.72 -0.56 0.13 0.00 -0.01 0.00 0.00 64.34 64.62 2wb1 n VAL 181 Cb 0.27 -1.87 0.39 0.00 -0.91 0.00 0.00 33.84 31.73 2wb1 n VAL 181 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2wb1 n ASP 182 N -2.71 0.62 -0.31 4.52 8.00 -1.26 -3.75 116.55 121.66 2wb1 n ASP 182 Ca -0.26 0.42 0.17 0.00 0.71 0.00 0.00 54.79 55.84 2wb1 n ASP 182 Cb 0.66 -0.48 0.36 0.00 -0.02 0.00 0.00 41.12 41.63 2wb1 n ASP 182 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2wb1 h ASP 183 N 0.00 0.16 0.00 -2.24 5.19 -1.94 0.55 116.42 118.14 2wb1 h ASP 183 Ca 0.00 0.20 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 2wb1 h ASP 183 Cb 0.68 0.23 0.00 0.00 0.18 0.00 0.00 39.33 40.42 2wb1 h ASP 183 CO 0.00 -0.17 0.03 1.62 -3.12 0.00 0.00 179.24 177.60 2wb1 h VAL 184 N 0.23 0.00 0.00 -1.35 3.04 -1.96 -0.61 116.25 115.60 2wb1 h VAL 184 Ca 0.63 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.32 2wb1 h VAL 184 Cb 1.34 0.81 0.00 0.00 -2.01 0.00 0.00 31.29 31.43 2wb1 h VAL 184 CO -0.66 0.00 -0.18 0.11 -1.01 0.00 0.00 177.57 175.83 2wb1 h LYS 185 N 0.00 0.00 -0.07 4.17 1.57 -0.15 -3.39 116.57 118.70 2wb1 h LYS 185 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wb1 h LYS 185 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2wb1 h LYS 185 CO 0.00 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.51 2wb1 n LYS 186 N -4.32 1.37 0.09 3.15 5.02 -1.18 -3.85 118.16 118.44 2wb1 n LYS 186 Ca -0.03 -0.56 -0.13 0.00 -2.02 0.00 0.00 58.31 55.58 2wb1 n LYS 186 Cb 0.09 -1.37 -0.08 0.00 -0.02 0.00 0.00 35.03 33.65 2wb1 n LYS 186 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wb1 h ALA 187 N 3.89 -0.25 0.31 7.82 0.00 -1.31 -3.26 119.26 126.46 2wb1 h ALA 187 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2wb1 h ALA 187 Cb 0.25 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2wb1 h ALA 187 CO 0.00 -0.46 -0.33 0.82 0.00 0.00 0.00 179.25 179.28 2wb1 h ILE 188 N -0.60 0.32 -5.13 0.00 5.03 -1.79 -3.48 117.51 111.85 2wb1 h ILE 188 Ca -0.03 0.00 -0.24 0.00 -0.12 0.00 0.00 64.86 64.47 2wb1 h ILE 188 Cb 0.45 0.32 0.16 0.00 -3.03 0.00 0.00 36.82 34.71 2wb1 h ILE 188 CO 0.04 0.00 -0.71 -3.20 -0.68 0.00 0.00 178.15 173.60 2wb1 n ASN 189 N -5.44 -4.39 -0.14 1.72 5.15 -1.23 -4.68 115.26 106.25 2wb1 n ASN 189 Ca -0.09 -0.58 0.00 0.00 -0.60 0.00 0.00 54.58 53.31 2wb1 n ASN 189 Cb 0.34 -4.54 -0.00 0.00 -0.53 0.00 0.00 39.78 35.05 2wb1 n ASN 189 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2wb1 n ARG 190 N -3.28 -0.36 0.00 1.20 5.12 -1.26 -4.91 116.66 113.17 2wb1 n ARG 190 Ca -0.14 0.28 0.00 0.00 -1.93 0.00 0.00 57.85 56.06 2wb1 n ARG 190 Cb 0.62 -0.35 0.00 0.00 -1.16 0.00 0.00 32.46 31.57 2wb1 n ARG 190 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2wb1 n LEU 191 N -1.65 0.00 -0.41 0.55 4.77 -1.26 -3.74 117.00 115.26 2wb1 n LEU 191 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2wb1 n LEU 191 Cb 0.04 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2wb1 n LEU 191 CO 0.00 0.00 0.24 2.29 -1.33 0.00 0.00 177.39 178.59 2wb1 n LYS 192 N 14.00 0.00 -4.01 3.23 2.85 -1.26 -5.04 118.16 127.93 2wb1 n LYS 192 Ca 0.00 -0.62 -0.32 0.00 -1.05 0.00 0.00 58.31 56.32 2wb1 n LYS 192 Cb 0.00 -0.34 -0.07 0.00 -0.65 0.00 0.00 35.03 33.97 2wb1 n LYS 192 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2wb1 n LEU 193 N 0.00 -0.72 0.00 -5.58 4.77 -1.24 -2.63 117.00 111.59 2wb1 n LEU 193 Ca 0.00 -1.04 0.00 0.00 -0.03 0.00 0.00 56.01 54.94 2wb1 n LEU 193 Cb 0.61 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.38 2wb1 n LEU 193 CO 0.00 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 2wb1 n GLY 194 N -1.45 2.05 0.00 -0.72 0.00 -1.26 -4.76 105.19 99.06 2wb1 n GLY 194 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2wb1 n GLY 194 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wb1 n GLU 195 N 0.00 0.00 -2.83 1.61 -0.58 -1.08 -5.09 120.64 112.67 2wb1 n GLU 195 Ca 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.73 2wb1 n GLU 195 Cb 0.00 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2wb1 n GLU 195 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2wb1 n PHE 196 N 0.00 -2.99 -4.01 -0.32 0.99 -1.16 -4.95 117.46 105.02 2wb1 n PHE 196 Ca 0.00 1.38 -0.26 0.00 -0.00 0.00 0.00 57.45 58.58 2wb1 n PHE 196 Cb 0.00 -3.21 -0.17 0.00 -1.00 0.00 0.00 39.48 35.11 2wb1 n PHE 196 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 2wb1 s VAL 197 N -1.34 0.93 -0.39 -4.37 1.01 -1.18 -4.97 120.40 110.09 2wb1 s VAL 197 Ca -0.03 -0.26 -0.20 0.00 0.00 0.00 0.00 61.98 61.49 2wb1 s VAL 197 Cb 0.00 -0.95 0.01 0.00 0.00 0.00 0.00 36.38 35.44 2wb1 s VAL 197 CO 0.58 0.34 0.62 -0.63 0.00 0.00 0.00 175.10 176.01 2wb1 s ILE 198 N 1.52 4.88 -0.47 2.22 -1.09 -1.26 -2.20 121.20 124.81 2wb1 s ILE 198 Ca 0.01 0.31 -0.18 0.00 -2.23 0.00 0.00 60.65 58.56 2wb1 s ILE 198 Cb -0.13 -4.12 0.05 0.00 -1.58 0.00 0.00 42.46 36.68 2wb1 s ILE 198 CO -0.05 -0.43 0.51 -1.81 -1.23 0.00 0.00 174.94 171.92 2wb1 s ASP 199 N 1.88 6.20 -0.32 3.58 -0.00 0.54 -4.95 116.67 123.60 2wb1 s ASP 199 Ca 0.22 -0.93 -0.18 0.00 -0.00 0.00 0.00 52.55 51.67 2wb1 s ASP 199 Cb -0.14 -2.24 -0.01 0.00 -0.00 0.00 0.00 42.92 40.52 2wb1 s ASP 199 CO 0.16 -0.73 0.50 -1.61 -0.00 0.00 0.00 175.17 173.50 2wb1 s GLU 200 N 2.22 3.76 0.00 8.23 2.02 -1.26 -0.22 118.70 133.45 2wb1 s GLU 200 Ca 0.11 -0.03 0.00 0.00 0.02 0.00 0.00 54.97 55.08 2wb1 s GLU 200 Cb -0.20 -3.76 0.00 0.00 0.10 0.00 0.00 34.13 30.28 2wb1 s GLU 200 CO 0.11 -0.54 0.00 0.43 0.02 0.00 0.00 175.26 175.28 2wb1 n SER 201 N 5.67 0.00 -3.48 -0.19 7.64 0.34 -5.04 113.62 118.56 2wb1 n SER 201 Ca -0.05 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.54 2wb1 n SER 201 Cb 0.49 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.57 2wb1 n SER 201 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2wb1 s GLU 202 N 1.77 0.55 -0.85 1.43 8.01 -1.26 -4.77 118.70 123.58 2wb1 s GLU 202 Ca 0.00 -1.28 0.00 0.00 0.01 0.00 0.00 54.97 53.70 2wb1 s GLU 202 Cb 0.00 -1.33 0.00 0.00 -4.31 0.00 0.00 34.13 28.49 2wb1 s GLU 202 CO 0.00 -1.19 0.00 0.41 0.01 0.00 0.00 175.26 174.49 2wb1 n GLY 203 N 4.14 0.04 3.36 -1.39 0.00 -1.26 -5.02 105.19 105.06 2wb1 n GLY 203 Ca 0.10 -0.48 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 2wb1 n GLY 203 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wb1 s THR 204 N -2.48 -0.01 -0.11 2.61 2.01 -1.26 -2.88 115.64 113.52 2wb1 s THR 204 Ca 0.00 0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.07 2wb1 s THR 204 Cb 0.00 -0.68 0.01 0.00 0.01 0.00 0.00 72.50 71.83 2wb1 s THR 204 CO 0.00 0.02 -0.20 -0.89 -0.69 0.00 0.00 174.62 172.85 2wb1 s THR 205 N 0.92 1.84 0.24 -0.82 2.01 0.70 -0.50 115.64 120.03 2wb1 s THR 205 Ca -0.05 -0.87 0.09 0.00 0.31 0.00 0.00 61.69 61.17 2wb1 s THR 205 Cb -0.06 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.79 2wb1 s THR 205 CO -0.08 0.51 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.59 2wb1 s LEU 206 N 0.63 3.18 -0.05 4.42 1.02 0.69 0.09 118.68 128.65 2wb1 s LEU 206 Ca -0.13 -0.60 0.02 0.00 0.02 0.00 0.00 54.13 53.45 2wb1 s LEU 206 Cb -0.16 -1.74 0.01 0.00 0.02 0.00 0.00 46.19 44.31 2wb1 s LEU 206 CO 0.03 0.03 -0.11 0.20 0.02 0.00 0.00 176.35 176.52 2wb1 s ASN 207 N -3.43 1.59 -0.22 2.29 0.01 0.62 -0.34 114.94 115.45 2wb1 s ASN 207 Ca 0.30 -0.26 -0.09 0.00 -0.71 0.00 0.00 52.86 52.10 2wb1 s ASN 207 Cb -0.07 -0.63 -0.05 0.00 0.41 0.00 0.00 41.25 40.92 2wb1 s ASN 207 CO 0.19 0.05 0.12 -0.63 -1.51 0.00 0.00 177.10 175.32 2wb1 s ILE 208 N 0.49 5.14 -0.34 0.60 -1.09 -0.93 -1.18 121.20 123.89 2wb1 s ILE 208 Ca -0.10 0.10 0.02 0.00 -2.23 0.00 0.00 60.65 58.44 2wb1 s ILE 208 Cb -0.13 -3.37 0.15 0.00 -1.58 0.00 0.00 42.46 37.53 2wb1 s ILE 208 CO 0.02 0.39 0.35 -0.94 -1.23 0.00 0.00 174.94 173.53 2wb1 s SER 209 N 0.82 1.28 0.00 3.58 1.04 -1.16 -2.98 113.70 116.28 2wb1 s SER 209 Ca 0.06 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.27 2wb1 s SER 209 Cb -0.13 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.57 2wb1 s SER 209 CO 0.02 -0.31 0.00 0.49 0.98 0.00 0.00 173.24 174.42 2wb1 n PHE 210 N 4.68 0.00 -1.41 5.02 3.01 -1.26 -4.80 117.46 122.69 2wb1 n PHE 210 Ca 0.06 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.62 2wb1 n PHE 210 Cb 0.46 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.87 2wb1 n PHE 210 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wb1 n ALA 211 N -3.00 -2.98 -2.71 4.37 0.00 -1.26 -4.61 120.51 110.33 2wb1 n ALA 211 Ca 0.00 0.74 -0.30 0.00 0.00 0.00 0.00 53.44 53.88 2wb1 n ALA 211 Cb 0.00 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 17.94 2wb1 n ALA 211 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2wb1 s ASN 212 N -6.43 6.44 -1.46 0.00 -0.87 -1.26 -4.30 114.94 107.06 2wb1 s ASN 212 Ca 0.00 0.51 -0.02 0.00 -1.57 0.00 0.00 52.86 51.78 2wb1 s ASN 212 Cb 0.00 -2.06 0.02 0.00 -0.02 0.00 0.00 41.25 39.19 2wb1 s ASN 212 CO 0.00 0.01 0.41 -0.38 -2.57 0.00 0.00 177.10 174.58 2wb1 n ILE 213 N -0.20 -2.54 0.00 0.60 -0.00 -1.26 -4.78 119.36 111.17 2wb1 n ILE 213 Ca -0.03 -0.43 0.00 0.00 -0.00 0.00 0.00 62.75 62.28 2wb1 n ILE 213 Cb 0.52 -2.32 0.00 0.00 -0.00 0.00 0.00 39.64 37.84 2wb1 n ILE 213 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 2wb1 n ASP 214 N -2.93 0.00 -3.35 4.38 5.68 -1.26 -5.05 116.55 114.02 2wb1 n ASP 214 Ca -0.26 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 53.88 2wb1 n ASP 214 Cb 0.66 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.57 2wb1 n ASP 214 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2wb1 s SER 215 N -0.97 0.96 -0.50 -1.12 1.04 -1.26 -5.08 113.70 106.77 2wb1 s SER 215 Ca 0.00 -1.16 0.02 0.00 0.48 0.00 0.00 55.95 55.29 2wb1 s SER 215 Cb 0.00 0.73 0.13 0.00 0.10 0.00 0.00 66.02 66.98 2wb1 s SER 215 CO 0.00 -0.30 0.26 -0.63 0.98 0.00 0.00 173.24 173.55 2wb1 s ILE 216 N 1.84 2.86 0.21 -1.02 1.09 -1.26 -4.95 121.20 119.97 2wb1 s ILE 216 Ca 0.14 -2.93 0.00 0.00 -1.10 0.00 0.00 60.65 56.76 2wb1 s ILE 216 Cb -0.14 -2.97 0.00 0.00 -1.06 0.00 0.00 42.46 38.29 2wb1 s ILE 216 CO -0.14 -0.77 0.00 0.00 -0.10 0.00 0.00 174.94 173.93 2wb1 n ALA 217 N 3.55 -2.32 -3.05 9.38 0.00 -1.26 -5.02 120.51 121.80 2wb1 n ALA 217 Ca 0.05 0.28 -0.10 0.00 0.00 0.00 0.00 53.44 53.67 2wb1 n ALA 217 Cb 0.36 -0.80 0.01 0.00 0.00 0.00 0.00 19.45 19.02 2wb1 n ALA 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wb1 n ALA 218 N -1.55 -2.76 -0.15 0.00 0.00 -1.26 -4.94 120.51 109.85 2wb1 n ALA 218 Ca 0.01 0.62 0.07 0.00 0.00 0.00 0.00 53.44 54.14 2wb1 n ALA 218 Cb 0.41 -2.71 0.18 0.00 0.00 0.00 0.00 19.45 17.32 2wb1 n ALA 218 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wb1 n LEU 219 N -0.91 3.04 0.13 0.00 4.32 -1.26 -4.49 117.00 117.84 2wb1 n LEU 219 Ca 0.03 -1.91 0.00 0.00 -0.02 0.00 0.00 56.01 54.11 2wb1 n LEU 219 Cb 0.51 -0.26 0.29 0.00 -1.62 0.00 0.00 43.42 42.34 2wb1 n LEU 219 CO 0.51 0.75 0.69 -0.26 -1.22 0.00 0.00 177.39 177.87 2wb1 h PHE 220 N 2.49 0.17 -0.01 -1.77 -1.00 -2.01 -1.33 116.94 113.48 2wb1 h PHE 220 Ca 0.00 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.74 2wb1 h PHE 220 Cb 0.76 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.28 2wb1 h PHE 220 CO 0.26 0.50 -0.01 1.63 -1.61 0.00 0.00 178.31 179.08 2wb1 n LYS 221 N -4.07 1.51 0.07 1.51 5.02 -1.26 -3.17 118.16 117.77 2wb1 n LYS 221 Ca -0.01 -0.76 -0.12 0.00 -2.02 0.00 0.00 58.31 55.40 2wb1 n LYS 221 Cb 0.43 -1.48 -0.13 0.00 -0.02 0.00 0.00 35.03 33.83 2wb1 n LYS 221 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2wb1 h LEU 222 N 1.86 0.22 -1.04 -0.35 4.07 -1.52 -3.30 115.31 115.24 2wb1 h LEU 222 Ca 0.00 -0.25 -0.02 0.00 0.08 0.00 0.00 57.88 57.70 2wb1 h LEU 222 Cb 0.40 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 42.04 2wb1 h LEU 222 CO 0.00 1.20 0.42 0.03 -1.08 0.00 0.00 178.44 179.01 2wb1 h ARG 223 N 0.04 1.09 0.00 1.13 3.08 -1.41 -2.76 114.38 115.55 2wb1 h ARG 223 Ca -0.10 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.82 2wb1 h ARG 223 Cb 1.89 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.73 2wb1 h ARG 223 CO 0.16 0.80 0.15 -3.47 -1.07 0.00 0.00 179.97 176.55 2wb1 n ASP 224 N -4.35 0.00 -0.05 7.04 2.03 -1.22 -1.91 116.55 118.09 2wb1 n ASP 224 Ca 0.08 0.31 -0.11 0.00 0.52 0.00 0.00 54.79 55.58 2wb1 n ASP 224 Cb 0.10 -0.31 -0.04 0.00 -0.72 0.00 0.00 41.12 40.16 2wb1 n ASP 224 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2wb1 n LYS 225 N -1.29 0.26 -0.28 -0.67 5.02 -1.06 -4.39 118.16 115.75 2wb1 n LYS 225 Ca 0.00 0.11 0.08 0.00 -2.02 0.00 0.00 58.31 56.48 2wb1 n LYS 225 Cb 0.15 -0.94 0.22 0.00 -0.02 0.00 0.00 35.03 34.44 2wb1 n LYS 225 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2wb1 h ILE 226 N -0.45 0.59 0.00 -0.18 2.04 -1.14 -3.06 117.51 115.31 2wb1 h ILE 226 Ca -0.24 -0.15 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 2wb1 h ILE 226 Cb 1.08 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2wb1 h ILE 226 CO -0.15 0.08 -0.80 0.18 0.00 0.00 0.00 178.15 177.46 2wb1 n LEU 227 N -5.02 1.26 -0.22 1.44 4.32 -1.02 -4.39 117.00 113.37 2wb1 n LEU 227 Ca 0.17 0.19 0.23 0.00 -0.02 0.00 0.00 56.01 56.59 2wb1 n LEU 227 Cb 0.49 -0.45 0.60 0.00 -1.62 0.00 0.00 43.42 42.44 2wb1 n LEU 227 CO 0.16 -0.30 1.24 0.78 -1.22 0.00 0.00 177.39 178.04 2wb1 h ASN 228 N -0.41 0.23 0.00 -1.43 4.21 -1.69 -3.20 115.58 113.29 2wb1 h ASN 228 Ca -0.09 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.44 2wb1 h ASN 228 Cb 0.68 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.87 2wb1 h ASN 228 CO -0.06 0.08 -0.74 0.41 -1.29 0.00 0.00 177.43 175.84 2wb1 n THR 229 N -4.42 0.00 -1.88 2.81 -1.04 -1.24 -5.06 114.28 103.45 2wb1 n THR 229 Ca 0.19 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.79 2wb1 n THR 229 Cb 0.82 -0.60 -0.02 0.00 -1.82 0.00 0.00 70.33 68.71 2wb1 n THR 229 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2wb1 s LYS 230 N -1.71 4.19 0.45 -2.82 1.02 -1.16 -5.00 119.74 114.72 2wb1 s LYS 230 Ca 0.00 2.45 0.03 0.00 0.02 0.00 0.00 55.97 58.47 2wb1 s LYS 230 Cb 0.00 -3.08 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 2wb1 s LYS 230 CO 0.00 -0.56 0.03 0.42 -0.92 0.00 0.00 175.35 174.32 2wb1 s ILE 231 N 0.26 1.28 0.00 2.17 1.09 -1.26 -3.17 121.20 121.56 2wb1 s ILE 231 Ca 0.64 -2.00 0.00 0.00 -1.10 0.00 0.00 60.65 58.19 2wb1 s ILE 231 Cb -0.45 -2.45 0.00 0.00 -1.06 0.00 0.00 42.46 38.50 2wb1 s ILE 231 CO 0.42 0.00 0.00 0.29 -0.10 0.00 0.00 174.94 175.55 2wb1 n LYS 232 N -1.09 0.00 -2.09 2.79 5.02 -0.07 -4.92 118.16 117.81 2wb1 n LYS 232 Ca -0.12 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.77 2wb1 n LYS 232 Cb 0.67 -0.18 0.03 0.00 -0.02 0.00 0.00 35.03 35.52 2wb1 n LYS 232 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wb1 n GLY 233 N 1.64 5.61 2.07 0.72 0.00 -1.25 -4.93 105.19 109.05 2wb1 n GLY 233 Ca 0.00 -2.46 -0.36 0.00 0.00 0.00 0.00 46.02 43.21 2wb1 n GLY 233 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2wb1 n ILE 234 N -0.26 0.00 0.00 -0.61 5.41 -1.26 -2.53 119.36 120.11 2wb1 n ILE 234 Ca 0.52 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.27 2wb1 n ILE 234 Cb 0.26 -0.08 0.00 0.00 -0.71 0.00 0.00 39.64 39.11 2wb1 n ILE 234 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2wb1 n LYS 235 N 1.26 0.00 0.00 0.38 4.76 -1.26 -4.74 118.16 118.56 2wb1 n LYS 235 Ca 0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2wb1 n LYS 235 Cb 0.02 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.21 2wb1 n LYS 235 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wb1 n GLY 236 N 0.00 0.57 1.43 0.72 0.00 -1.26 -4.99 105.19 101.67 2wb1 n GLY 236 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2wb1 n GLY 236 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2wb1 n ILE 237 N 0.00 0.00 -0.06 -0.61 -5.35 -1.26 -4.79 119.36 107.29 2wb1 n ILE 237 Ca 0.00 -0.51 -0.07 0.00 -0.27 0.00 0.00 62.75 61.90 2wb1 n ILE 237 Cb 0.00 -1.41 -0.02 0.00 -1.74 0.00 0.00 39.64 36.46 2wb1 n ILE 237 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2wb1 n LYS 238 N -1.81 0.41 -3.71 6.28 5.02 -1.25 -4.55 118.16 118.56 2wb1 n LYS 238 Ca 0.06 0.16 -0.14 0.00 -2.02 0.00 0.00 58.31 56.38 2wb1 n LYS 238 Cb 0.22 -1.22 -0.09 0.00 -0.02 0.00 0.00 35.03 33.91 2wb1 n LYS 238 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2wb1 s ARG 239 N -2.68 0.61 -0.29 1.97 3.52 -1.26 -4.74 118.95 116.08 2wb1 s ARG 239 Ca -0.23 0.36 0.03 0.00 -0.13 0.00 0.00 55.73 55.76 2wb1 s ARG 239 Cb 0.03 0.29 0.08 0.00 -1.56 0.00 0.00 34.95 33.79 2wb1 s ARG 239 CO 0.33 -0.12 -0.02 0.00 -0.81 0.00 0.00 175.30 174.68 2wb1 s ALA 240 N -0.34 2.49 -0.08 6.12 0.00 -1.26 -1.42 121.76 127.27 2wb1 s ALA 240 Ca -0.05 -1.98 -0.13 0.00 0.00 0.00 0.00 51.96 49.80 2wb1 s ALA 240 Cb -0.03 -1.71 -0.05 0.00 0.00 0.00 0.00 23.12 21.33 2wb1 s ALA 240 CO 0.03 -1.43 0.33 0.42 0.00 0.00 0.00 175.76 175.11 2wb1 s ILE 241 N 1.13 5.21 -0.47 0.00 -1.09 -0.92 -4.92 121.20 120.14 2wb1 s ILE 241 Ca 0.01 0.65 -0.16 0.00 -2.23 0.00 0.00 60.65 58.91 2wb1 s ILE 241 Cb -0.19 -3.64 0.06 0.00 -1.58 0.00 0.00 42.46 37.11 2wb1 s ILE 241 CO -0.08 0.51 0.45 -0.69 -1.23 0.00 0.00 174.94 173.89 2wb1 s VAL 242 N -0.47 5.14 -0.10 2.92 1.01 -1.26 -0.13 120.40 127.52 2wb1 s VAL 242 Ca 0.20 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.23 2wb1 s VAL 242 Cb -0.15 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 2wb1 s VAL 242 CO 0.09 -0.60 0.27 -1.10 0.00 0.00 0.00 175.10 173.75 2wb1 s GLN 243 N 1.92 3.86 -0.29 2.72 -0.21 0.17 -4.95 119.66 122.87 2wb1 s GLN 243 Ca 0.07 0.10 -0.17 0.00 0.02 0.00 0.00 55.36 55.38 2wb1 s GLN 243 Cb -0.22 -3.28 -0.02 0.00 1.00 0.00 0.00 33.01 30.49 2wb1 s GLN 243 CO 0.09 0.58 0.46 0.15 -2.12 0.00 0.00 175.29 174.45 2wb1 s LYS 244 N -0.56 3.91 0.00 2.91 3.01 -1.26 -3.14 119.74 124.61 2wb1 s LYS 244 Ca 0.18 0.07 0.00 0.00 -1.01 0.00 0.00 55.97 55.21 2wb1 s LYS 244 Cb -0.14 -3.70 0.00 0.00 -1.01 0.00 0.00 37.83 32.98 2wb1 s LYS 244 CO 0.07 -0.41 0.00 0.36 0.51 0.00 0.00 175.35 175.87 2wb1 n LYS 245 N 5.52 0.00 -2.40 1.68 2.85 -1.26 -5.06 118.16 119.49 2wb1 n LYS 245 Ca -0.06 0.00 -0.05 0.00 -1.05 0.00 0.00 58.31 57.15 2wb1 n LYS 245 Cb 0.50 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.90 2wb1 n LYS 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2wb1 n GLY 246 N 0.00 0.20 3.59 2.58 0.00 -1.26 -3.84 105.19 106.47 2wb1 n GLY 246 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2wb1 n GLY 246 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2wb1 n ASP 247 N -1.69 0.00 -4.01 1.61 2.03 -1.26 -4.95 116.55 108.28 2wb1 n ASP 247 Ca -0.08 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.02 2wb1 n ASP 247 Cb 0.55 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.79 2wb1 n ASP 247 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2wb1 s GLU 248 N -0.04 1.08 0.22 -0.67 2.02 -1.25 -4.79 118.70 115.27 2wb1 s GLU 248 Ca 0.00 -0.34 -0.30 0.00 0.02 0.00 0.00 54.97 54.36 2wb1 s GLU 248 Cb 0.00 -0.99 -0.09 0.00 0.10 0.00 0.00 34.13 33.15 2wb1 s GLU 248 CO 0.00 0.12 1.24 0.71 0.02 0.00 0.00 175.26 177.34 2wb1 s TYR 249 N 0.22 3.34 0.08 1.61 1.51 0.30 -4.59 117.35 119.82 2wb1 s TYR 249 Ca -0.04 1.38 0.05 0.00 -1.01 0.00 0.00 57.07 57.45 2wb1 s TYR 249 Cb -0.09 -3.50 -0.03 0.00 -0.11 0.00 0.00 41.96 38.23 2wb1 s TYR 249 CO 0.01 -1.43 -0.13 0.42 -1.11 0.00 0.00 175.55 173.30 2wb1 s ILE 250 N -0.24 1.05 -0.17 2.71 1.01 -1.19 -4.50 121.20 119.88 2wb1 s ILE 250 Ca 0.53 -1.35 0.01 0.00 0.00 0.00 0.00 60.65 59.83 2wb1 s ILE 250 Cb -0.35 -1.09 0.01 0.00 0.01 0.00 0.00 42.46 41.04 2wb1 s ILE 250 CO 0.39 -0.29 -0.17 -0.63 0.00 0.00 0.00 174.94 174.24 2wb1 s ILE 251 N -1.48 2.41 -0.24 2.92 1.01 -0.89 -0.66 121.20 124.27 2wb1 s ILE 251 Ca -0.01 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 59.78 2wb1 s ILE 251 Cb -0.09 -2.02 0.02 0.00 0.01 0.00 0.00 42.46 40.39 2wb1 s ILE 251 CO 0.02 0.52 -0.07 -0.76 0.00 0.00 0.00 174.94 174.65 2wb1 s LEU 252 N 1.03 3.10 0.09 2.97 1.43 0.82 -0.42 118.68 127.70 2wb1 s LEU 252 Ca -0.01 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.29 2wb1 s LEU 252 Cb -0.15 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 2wb1 s LEU 252 CO -0.05 -0.11 0.13 0.42 0.23 0.00 0.00 176.35 176.97 2wb1 s THR 253 N 1.33 4.80 -1.02 5.49 -4.23 -0.82 -2.16 115.64 119.04 2wb1 s THR 253 Ca 0.01 -0.69 0.26 0.00 -1.18 0.00 0.00 61.69 60.09 2wb1 s THR 253 Cb -0.16 -3.34 0.07 0.00 1.34 0.00 0.00 72.50 70.41 2wb1 s THR 253 CO -0.05 0.10 1.54 0.47 -0.54 0.00 0.00 174.62 176.14 2wb1 n ASP 254 N 0.28 0.39 -4.94 3.99 8.00 -0.51 -2.64 116.55 121.12 2wb1 n ASP 254 Ca -0.08 -0.08 -0.23 0.00 0.71 0.00 0.00 54.79 55.11 2wb1 n ASP 254 Cb 0.52 0.07 0.01 0.00 -0.02 0.00 0.00 41.12 41.70 2wb1 n ASP 254 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2wb1 s GLY 255 N -2.99 2.14 -0.01 0.44 0.00 -1.21 -4.29 107.32 101.40 2wb1 s GLY 255 Ca 0.12 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.23 2wb1 s GLY 255 CO 0.65 -1.83 -0.01 -1.35 0.00 0.00 0.00 173.10 170.57 2wb1 s SER 256 N -4.38 0.25 -0.43 1.64 1.04 -1.26 -4.16 113.70 106.41 2wb1 s SER 256 Ca 0.45 -0.02 0.01 0.00 0.48 0.00 0.00 55.95 56.86 2wb1 s SER 256 Cb -0.04 -0.08 0.20 0.00 0.10 0.00 0.00 66.02 66.20 2wb1 s SER 256 CO 0.28 -0.02 0.88 0.21 0.98 0.00 0.00 173.24 175.56 2wb1 s ASN 257 N 0.35 -0.94 0.10 7.02 3.04 -1.26 -4.74 114.94 118.51 2wb1 s ASN 257 Ca -0.03 -1.00 -0.19 0.00 0.04 0.00 0.00 52.86 51.69 2wb1 s ASN 257 Cb -0.05 1.22 -0.06 0.00 -1.54 0.00 0.00 41.25 40.82 2wb1 s ASN 257 CO -0.01 -0.05 1.63 0.25 -3.04 0.00 0.00 177.10 175.89 2wb1 h LEU 258 N 4.96 0.37 -0.09 3.21 5.85 -1.98 -0.65 115.31 126.97 2wb1 h LEU 258 Ca 0.03 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.60 2wb1 h LEU 258 Cb 1.15 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 2wb1 h LEU 258 CO -0.03 0.45 -0.15 0.28 -0.34 0.00 0.00 178.44 178.65 2wb1 h SER 259 N 0.26 -0.47 -0.32 1.25 0.02 -1.97 -2.96 113.55 109.36 2wb1 h SER 259 Ca 0.09 0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 2wb1 h SER 259 Cb 0.21 0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 2wb1 h SER 259 CO -0.00 -0.20 -0.19 1.23 -1.14 0.00 0.00 176.83 176.52 2wb1 h GLY 260 N -0.21 0.75 0.66 -3.77 0.00 -1.92 -3.25 103.07 95.33 2wb1 h GLY 260 Ca 0.08 -0.70 0.07 0.00 0.00 0.00 0.00 47.33 46.78 2wb1 h GLY 260 CO -0.22 0.64 0.46 -2.08 0.00 0.00 0.00 176.54 175.34 2wb1 h VAL 261 N 0.45 0.98 0.00 4.60 2.07 -1.06 -2.58 116.25 120.71 2wb1 h VAL 261 Ca 0.07 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2wb1 h VAL 261 Cb 0.74 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 2wb1 h VAL 261 CO 0.05 0.15 0.06 0.18 0.02 0.00 0.00 177.57 178.04 2wb1 n LEU 262 N -4.71 0.12 -1.78 2.57 4.77 -1.13 -2.24 117.00 114.61 2wb1 n LEU 262 Ca 0.11 0.51 -0.19 0.00 -0.03 0.00 0.00 56.01 56.41 2wb1 n LEU 262 Cb 0.20 -0.52 0.10 0.00 -2.33 0.00 0.00 43.42 40.87 2wb1 n LEU 262 CO 0.29 -0.55 0.67 -1.54 -1.33 0.00 0.00 177.39 174.93 2wb1 n SER 263 N -1.63 4.62 -4.56 -1.43 3.41 -0.97 -4.97 113.62 108.09 2wb1 n SER 263 Ca -0.00 -3.78 -0.32 0.00 -0.26 0.00 0.00 58.87 54.51 2wb1 n SER 263 Cb 0.07 -0.60 -0.11 0.00 -0.26 0.00 0.00 64.21 63.31 2wb1 n SER 263 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2wb1 s VAL 264 N -4.14 3.42 0.01 -3.33 1.01 -0.95 -5.09 120.40 111.32 2wb1 s VAL 264 Ca 0.52 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 2wb1 s VAL 264 Cb 0.43 -2.48 -0.06 0.00 0.00 0.00 0.00 36.38 34.27 2wb1 s VAL 264 CO 0.01 0.37 1.51 -0.54 0.00 0.00 0.00 175.10 176.46 2wb1 s LYS 265 N -1.44 4.24 0.00 2.72 3.01 -1.26 -3.09 119.74 123.92 2wb1 s LYS 265 Ca 0.17 2.11 0.00 0.00 -1.01 0.00 0.00 55.97 57.24 2wb1 s LYS 265 Cb -0.11 -3.64 0.00 0.00 -1.01 0.00 0.00 37.83 33.07 2wb1 s LYS 265 CO 0.07 -0.67 0.00 0.41 0.51 0.00 0.00 175.35 175.67 2wb1 n GLY 266 N 3.82 0.74 3.67 -3.33 0.00 -1.26 -4.98 105.19 103.86 2wb1 n GLY 266 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 2wb1 n GLY 266 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wb1 s VAL 267 N -2.69 4.74 -0.52 1.61 1.01 -1.18 -3.17 120.40 120.21 2wb1 s VAL 267 Ca 0.00 2.03 -0.27 0.00 0.00 0.00 0.00 61.98 63.73 2wb1 s VAL 267 Cb 0.00 -4.31 -0.01 0.00 0.00 0.00 0.00 36.38 32.06 2wb1 s VAL 267 CO 0.00 -0.08 1.72 -0.62 0.00 0.00 0.00 175.10 176.12 2wb1 s ASP 268 N 1.15 5.68 0.32 3.32 2.15 -0.28 -4.76 116.67 124.24 2wb1 s ASP 268 Ca 0.46 0.59 0.14 0.00 0.43 0.00 0.00 52.55 54.18 2wb1 s ASP 268 Cb -0.17 -2.53 0.52 0.00 -0.30 0.00 0.00 42.92 40.44 2wb1 s ASP 268 CO 0.12 -2.01 1.68 0.40 -0.17 0.00 0.00 175.17 175.20 2wb1 h ILE 269 N 6.73 1.18 0.00 4.11 1.08 -1.94 -3.16 117.51 125.51 2wb1 h ILE 269 Ca -0.28 -1.80 0.00 0.00 -0.39 0.00 0.00 64.86 62.39 2wb1 h ILE 269 Cb 1.14 2.02 0.00 0.00 -3.07 0.00 0.00 36.82 36.91 2wb1 h ILE 269 CO 1.15 0.48 0.00 0.00 -0.69 0.00 0.00 178.15 179.10 2wb1 h ALA 270 N 1.51 1.00 0.00 1.87 0.00 -1.98 -3.14 119.26 118.52 2wb1 h ALA 270 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2wb1 h ALA 270 Cb 0.98 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.71 2wb1 h ALA 270 CO 0.06 0.00 -0.50 1.63 0.00 0.00 0.00 179.25 180.44 2wb1 n LYS 271 N -2.31 0.27 -1.76 0.00 5.02 -1.21 -5.09 118.16 113.09 2wb1 n LYS 271 Ca 0.01 -1.51 -0.41 0.00 -2.02 0.00 0.00 58.31 54.38 2wb1 n LYS 271 Cb 0.20 -0.63 -0.01 0.00 -0.02 0.00 0.00 35.03 34.57 2wb1 n LYS 271 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wb1 s VAL 272 N -0.60 2.01 -0.08 -0.18 1.01 -1.19 -4.56 120.40 116.81 2wb1 s VAL 272 Ca 0.12 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.12 2wb1 s VAL 272 Cb 0.12 -3.00 0.02 0.00 0.00 0.00 0.00 36.38 33.52 2wb1 s VAL 272 CO -0.03 0.00 -0.11 -0.70 0.00 0.00 0.00 175.10 174.27 2wb1 s GLU 273 N -0.65 1.66 -0.00 2.72 2.12 -0.63 -5.02 118.70 118.91 2wb1 s GLU 273 Ca 0.63 -0.37 0.00 0.00 0.36 0.00 0.00 54.97 55.59 2wb1 s GLU 273 Cb -0.48 -1.48 0.00 0.00 0.26 0.00 0.00 34.13 32.43 2wb1 s GLU 273 CO 0.50 -0.07 -0.00 0.99 -0.54 0.00 0.00 175.26 176.14 2wb1 s THR 274 N 0.99 0.04 -2.09 -1.70 2.01 -1.26 -0.23 115.64 113.41 2wb1 s THR 274 Ca -0.08 -0.01 0.14 0.00 0.31 0.00 0.00 61.69 62.04 2wb1 s THR 274 Cb -0.15 -0.05 0.35 0.00 0.01 0.00 0.00 72.50 72.67 2wb1 s THR 274 CO -0.00 0.02 1.42 -0.46 -0.69 0.00 0.00 174.62 174.90 2wb1 n ASN 275 N 3.12 0.98 -4.36 3.53 6.94 -0.57 -4.72 115.26 120.19 2wb1 n ASN 275 Ca -0.13 -1.76 -0.46 0.00 -0.02 0.00 0.00 54.58 52.21 2wb1 n ASN 275 Cb 0.59 -0.09 -0.03 0.00 -2.36 0.00 0.00 39.78 37.90 2wb1 n ASN 275 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2wb1 s ASN 276 N -1.33 6.64 1.21 0.53 2.47 -1.26 -4.93 114.94 118.26 2wb1 s ASN 276 Ca 0.23 -2.37 -0.13 0.00 0.42 0.00 0.00 52.86 51.00 2wb1 s ASN 276 Cb 0.12 -2.26 0.31 0.00 -1.45 0.00 0.00 41.25 37.96 2wb1 s ASN 276 CO 0.18 -0.75 1.01 -0.63 -3.72 0.00 0.00 177.10 173.19 2wb1 s ILE 277 N 1.04 1.98 -1.43 -5.21 1.09 -1.26 -2.11 121.20 115.30 2wb1 s ILE 277 Ca 0.19 0.00 0.00 0.00 -1.10 0.00 0.00 60.65 59.74 2wb1 s ILE 277 Cb -0.12 -2.02 0.00 0.00 -1.06 0.00 0.00 42.46 39.26 2wb1 s ILE 277 CO -0.07 0.00 0.00 -1.14 -0.10 0.00 0.00 174.94 173.63 2wb1 n ARG 278 N -5.07 -1.62 0.00 2.79 0.00 -1.26 -4.46 116.66 107.04 2wb1 n ARG 278 Ca 0.02 0.97 0.00 0.00 -0.00 0.00 0.00 57.85 58.84 2wb1 n ARG 278 Cb 0.54 -5.38 0.00 0.00 0.00 0.00 0.00 32.46 27.62 2wb1 n ARG 278 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2wb1 n GLU 279 N -1.24 0.00 -0.35 -0.14 2.13 -1.18 -4.57 120.64 115.29 2wb1 n GLU 279 Ca -0.13 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.79 2wb1 n GLU 279 Cb 0.61 -0.35 0.29 0.00 0.27 0.00 0.00 31.44 32.27 2wb1 n GLU 279 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2wb1 h ILE 280 N 0.00 0.79 -0.10 6.31 1.08 -1.64 -1.34 117.51 122.60 2wb1 h ILE 280 Ca 0.00 -0.29 0.03 0.00 -0.39 0.00 0.00 64.86 64.20 2wb1 h ILE 280 Cb 0.03 -0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 33.62 2wb1 h ILE 280 CO 0.00 0.15 -0.06 -0.08 -0.69 0.00 0.00 178.15 177.48 2wb1 h GLU 281 N 0.85 -0.05 -0.81 2.37 4.81 -1.84 -1.26 114.58 118.64 2wb1 h GLU 281 Ca 0.55 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.81 2wb1 h GLU 281 Cb 0.75 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.09 2wb1 h GLU 281 CO -0.33 -0.03 0.52 0.93 -0.73 0.00 0.00 179.01 179.36 2wb1 h GLU 282 N -0.05 0.98 0.00 1.92 5.08 -1.51 -3.06 114.58 117.94 2wb1 h GLU 282 Ca 0.06 -0.06 -0.43 0.00 -1.00 0.00 0.00 59.36 57.93 2wb1 h GLU 282 Cb 0.14 -0.22 -0.07 0.00 0.50 0.00 0.00 28.75 29.10 2wb1 h GLU 282 CO -0.13 0.65 -2.50 0.28 -1.00 0.00 0.00 179.01 176.30 2wb1 n VAL 283 N -4.59 1.52 0.77 3.13 0.31 -0.93 -4.67 118.33 113.87 2wb1 n VAL 283 Ca 0.10 -0.46 0.11 0.00 -0.01 0.00 0.00 64.34 64.07 2wb1 n VAL 283 Cb 0.09 -1.69 -0.00 0.00 -0.91 0.00 0.00 33.84 31.33 2wb1 n VAL 283 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2wb1 n PHE 284 N -3.84 0.09 0.00 3.52 3.01 -0.48 -5.07 117.46 114.69 2wb1 n PHE 284 Ca -0.51 0.03 0.00 0.00 1.01 0.00 0.00 57.45 57.98 2wb1 n PHE 284 Cb 0.93 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 40.16 2wb1 n PHE 284 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2wb1 n GLY 285 N 1.44 2.20 0.29 1.37 0.00 -1.16 -4.51 105.19 104.81 2wb1 n GLY 285 Ca 0.03 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.76 2wb1 n GLY 285 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2wb1 h ILE 286 N 0.00 1.27 -0.36 -0.61 1.08 -1.88 -2.90 117.51 114.10 2wb1 h ILE 286 Ca 0.00 -1.31 -0.09 0.00 -0.39 0.00 0.00 64.86 63.07 2wb1 h ILE 286 Cb 0.00 1.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 2wb1 h ILE 286 CO 0.00 0.46 -0.14 -0.33 -0.69 0.00 0.00 178.15 177.45 2wb1 h GLU 287 N 0.88 0.73 -0.61 2.37 4.39 -1.94 -2.50 114.58 117.90 2wb1 h GLU 287 Ca 0.13 -0.30 -0.05 0.00 0.34 0.00 0.00 59.36 59.47 2wb1 h GLU 287 Cb 0.72 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.31 2wb1 h GLU 287 CO 0.06 0.91 0.17 0.00 -1.16 0.00 0.00 179.01 178.99 2wb1 h ALA 288 N 0.80 1.16 -0.30 3.43 0.00 -1.79 -2.43 119.26 120.14 2wb1 h ALA 288 Ca 0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2wb1 h ALA 288 Cb 0.67 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2wb1 h ALA 288 CO 0.05 0.58 0.09 0.00 0.00 0.00 0.00 179.25 179.97 2wb1 h ALA 289 N 1.29 1.61 -0.39 0.00 0.00 -1.32 0.79 119.26 121.25 2wb1 h ALA 289 Ca 0.20 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2wb1 h ALA 289 Cb 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2wb1 h ALA 289 CO -0.01 0.30 0.03 -0.09 0.00 0.00 0.00 179.25 179.48 2wb1 h ARG 290 N 0.42 0.67 -0.08 0.00 2.43 -1.00 -2.87 114.38 113.95 2wb1 h ARG 290 Ca 0.10 -0.20 -0.15 0.00 -0.81 0.00 0.00 59.98 58.92 2wb1 h ARG 290 Cb 0.13 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2wb1 h ARG 290 CO -0.01 0.75 -0.61 1.49 -1.51 0.00 0.00 179.97 180.08 2wb1 h GLU 291 N 0.50 0.28 -0.02 0.20 4.22 -0.73 -2.46 114.58 116.57 2wb1 h GLU 291 Ca 0.11 -0.19 -0.16 0.00 0.08 0.00 0.00 59.36 59.20 2wb1 h GLU 291 Cb 0.43 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2wb1 h GLU 291 CO 0.01 0.80 -0.72 0.97 -2.18 0.00 0.00 179.01 177.89 2wb1 h ILE 292 N 0.21 1.47 -0.30 2.32 -0.00 -0.99 -1.66 117.51 118.55 2wb1 h ILE 292 Ca -0.01 -2.35 -0.00 0.00 -0.00 0.00 0.00 64.86 62.50 2wb1 h ILE 292 Cb 1.12 2.26 -0.01 0.00 -0.00 0.00 0.00 36.82 40.19 2wb1 h ILE 292 CO 0.10 0.68 0.18 0.40 -0.00 0.00 0.00 178.15 179.51 2wb1 h ILE 293 N 0.08 1.11 0.20 2.19 1.08 -1.27 -0.18 117.51 120.72 2wb1 h ILE 293 Ca -0.02 -0.26 -0.00 0.00 -0.39 0.00 0.00 64.86 64.19 2wb1 h ILE 293 Cb 1.28 0.74 -0.01 0.00 -3.07 0.00 0.00 36.82 35.76 2wb1 h ILE 293 CO 0.10 0.11 -0.15 0.40 -0.69 0.00 0.00 178.15 177.92 2wb1 h ILE 294 N 0.39 0.68 -0.23 -0.67 2.04 -1.35 -1.51 117.51 116.85 2wb1 h ILE 294 Ca 0.11 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 2wb1 h ILE 294 Cb 0.02 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2wb1 h ILE 294 CO -0.02 0.00 0.06 -0.09 0.00 0.00 0.00 178.15 178.10 2wb1 h ARG 295 N -0.35 0.33 0.00 2.37 9.65 -1.16 -1.52 114.38 123.70 2wb1 h ARG 295 Ca -0.01 -0.04 -0.12 0.00 -1.10 0.00 0.00 59.98 58.71 2wb1 h ARG 295 Cb 0.31 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.81 2wb1 h ARG 295 CO -0.00 0.31 -1.04 1.49 2.80 0.00 0.00 179.97 183.53 2wb1 h GLU 296 N 0.33 0.00 0.01 0.20 4.57 -0.83 -2.20 114.58 116.66 2wb1 h GLU 296 Ca 0.08 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.19 2wb1 h GLU 296 Cb 0.13 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.73 2wb1 h GLU 296 CO -0.00 0.29 -0.27 0.82 -1.18 0.00 0.00 179.01 178.66 2wb1 h ILE 297 N 0.00 1.58 -0.47 2.32 1.08 -1.06 -3.09 117.51 117.87 2wb1 h ILE 297 Ca -0.09 -2.06 0.03 0.00 -0.39 0.00 0.00 64.86 62.35 2wb1 h ILE 297 Cb 1.41 2.90 -0.04 0.00 -3.07 0.00 0.00 36.82 38.03 2wb1 h ILE 297 CO 0.04 0.56 0.25 0.28 -0.69 0.00 0.00 178.15 178.60 2wb1 h SER 298 N -0.56 0.38 -0.73 1.72 0.02 -1.36 -1.70 113.55 111.32 2wb1 h SER 298 Ca -0.04 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2wb1 h SER 298 Cb 1.07 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 63.52 2wb1 h SER 298 CO 0.05 0.27 0.49 0.50 -1.14 0.00 0.00 176.83 177.00 2wb1 h LYS 299 N 0.50 0.96 0.40 3.45 3.64 -1.53 0.15 116.57 124.14 2wb1 h LYS 299 Ca 0.20 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2wb1 h LYS 299 Cb 0.08 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 2wb1 h LYS 299 CO -0.12 0.64 -0.19 0.28 -2.27 0.00 0.00 179.45 177.78 2wb1 h VAL 300 N 0.99 0.60 -0.39 2.00 2.07 -1.24 -2.15 116.25 118.13 2wb1 h VAL 300 Ca 0.27 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.56 2wb1 h VAL 300 Cb -0.11 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 2wb1 h VAL 300 CO -0.06 0.04 0.14 -0.07 0.02 0.00 0.00 177.57 177.64 2wb1 h LEU 301 N -0.66 0.56 -0.37 2.57 4.07 -1.22 -2.45 115.31 117.81 2wb1 h LEU 301 Ca -0.06 -0.19 0.06 0.00 0.08 0.00 0.00 57.88 57.78 2wb1 h LEU 301 Cb 0.48 -0.15 -0.09 0.00 1.08 0.00 0.00 40.66 41.99 2wb1 h LEU 301 CO 0.09 0.60 -0.45 0.00 -1.08 0.00 0.00 178.44 177.60 2wb1 h ALA 302 N 0.98 -0.50 0.00 1.53 0.00 -0.64 -0.88 119.26 119.75 2wb1 h ALA 302 Ca 0.13 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2wb1 h ALA 302 Cb 0.23 0.91 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2wb1 h ALA 302 CO -0.01 -0.90 -0.16 -1.91 0.00 0.00 0.00 179.25 176.27 2wb1 n GLU 303 N -5.41 0.06 -0.01 0.00 2.13 -0.81 -1.18 120.64 115.42 2wb1 n GLU 303 Ca -0.01 0.04 0.14 0.00 0.66 0.00 0.00 57.16 57.98 2wb1 n GLU 303 Cb 0.35 -1.56 0.70 0.00 0.27 0.00 0.00 31.44 31.20 2wb1 n GLU 303 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2wb1 n GLN 304 N -1.66 1.26 -1.02 5.31 1.13 -0.61 -5.04 117.38 116.75 2wb1 n GLN 304 Ca 0.06 -0.39 0.14 0.00 -1.94 0.00 0.00 57.00 54.87 2wb1 n GLN 304 Cb 0.36 -1.45 -0.03 0.00 0.11 0.00 0.00 30.24 29.23 2wb1 n GLN 304 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2wb1 n GLY 305 N 1.03 -1.84 2.72 1.08 0.00 -0.32 -5.02 105.19 102.83 2wb1 n GLY 305 Ca 0.20 -1.20 -0.03 0.00 0.00 0.00 0.00 46.02 44.99 2wb1 n GLY 305 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2wb1 n LEU 306 N 0.00 -6.64 -4.87 0.99 0.00 -1.26 -4.54 117.00 100.68 2wb1 n LEU 306 Ca 0.01 1.79 -0.37 0.00 0.00 0.00 0.00 56.01 57.44 2wb1 n LEU 306 Cb 0.46 -3.11 -0.06 0.00 0.00 0.00 0.00 43.42 40.72 2wb1 n LEU 306 CO 0.01 -3.53 -0.09 -1.81 0.00 0.00 0.00 177.39 171.96 2wb1 s ASP 307 N -1.01 6.51 -0.08 1.96 1.11 -1.26 -4.70 116.67 119.18 2wb1 s ASP 307 Ca -0.15 0.60 -0.06 0.00 0.18 0.00 0.00 52.55 53.13 2wb1 s ASP 307 Cb 0.01 -2.12 -0.04 0.00 1.07 0.00 0.00 42.92 41.84 2wb1 s ASP 307 CO 0.70 0.37 0.15 0.54 1.18 0.00 0.00 175.17 178.11 2wb1 s VAL 308 N -1.07 5.48 0.21 -1.27 0.11 -1.26 -5.08 120.40 117.53 2wb1 s VAL 308 Ca 0.18 0.09 -0.32 0.00 -2.93 0.00 0.00 61.98 59.00 2wb1 s VAL 308 Cb -0.13 -3.44 -0.12 0.00 -1.53 0.00 0.00 36.38 31.15 2wb1 s VAL 308 CO 0.08 0.52 1.71 -0.62 -3.33 0.00 0.00 175.10 173.46 2wb1 s ASP 309 N -1.32 6.39 0.37 3.54 3.68 -1.26 -4.86 116.67 123.20 2wb1 s ASP 309 Ca 0.19 2.86 0.27 0.00 2.13 0.00 0.00 52.55 58.00 2wb1 s ASP 309 Cb -0.12 -2.60 1.23 0.00 -1.45 0.00 0.00 42.92 39.98 2wb1 s ASP 309 CO 0.09 -0.96 1.28 0.23 0.13 0.00 0.00 175.17 175.93 2wb1 n MET 310 N 3.98 -0.03 -0.37 4.34 2.81 -1.26 -2.49 117.12 124.10 2wb1 n MET 310 Ca 0.16 1.02 0.02 0.00 -1.81 0.00 0.00 57.70 57.09 2wb1 n MET 310 Cb 0.35 -2.02 0.17 0.00 -0.71 0.00 0.00 33.22 31.02 2wb1 n MET 310 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2wb1 h ARG 311 N 0.00 1.16 -0.22 0.03 9.65 -2.01 -2.62 114.38 120.36 2wb1 h ARG 311 Ca 0.72 -0.07 -0.18 0.00 -1.10 0.00 0.00 59.98 59.36 2wb1 h ARG 311 Cb 2.37 -0.26 0.00 0.00 -1.39 0.00 0.00 29.97 30.69 2wb1 h ARG 311 CO -0.36 0.76 -0.55 0.45 2.80 0.00 0.00 179.97 183.08 2wb1 h HIS 312 N 1.19 0.98 0.00 2.20 3.86 -1.87 -2.88 115.15 118.63 2wb1 h HIS 312 Ca 0.42 -0.38 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2wb1 h HIS 312 Cb 0.14 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 2wb1 h HIS 312 CO -0.00 1.19 -0.08 0.82 0.86 0.00 0.00 177.93 180.72 2wb1 h ILE 313 N 0.50 0.39 0.10 2.45 2.04 -1.66 0.29 117.51 121.63 2wb1 h ILE 313 Ca -0.01 -0.41 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 2wb1 h ILE 313 Cb 1.17 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 2wb1 h ILE 313 CO 0.12 0.07 -0.05 -0.07 0.00 0.00 0.00 178.15 178.23 2wb1 h LEU 314 N 0.00 -0.11 -0.89 1.44 3.38 -1.35 -1.66 115.31 116.11 2wb1 h LEU 314 Ca -0.00 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 2wb1 h LEU 314 Cb 0.28 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 2wb1 h LEU 314 CO 0.01 0.20 0.46 0.25 0.09 0.00 0.00 178.44 179.45 2wb1 h LEU 315 N -0.44 1.13 0.20 1.67 6.46 -0.58 0.16 115.31 123.91 2wb1 h LEU 315 Ca -0.01 -0.12 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 2wb1 h LEU 315 Cb 0.36 -0.29 0.00 0.00 -0.73 0.00 0.00 40.66 40.01 2wb1 h LEU 315 CO 0.02 0.92 -0.09 0.58 -0.62 0.00 0.00 178.44 179.25 2wb1 h VAL 316 N 1.25 0.87 0.00 1.05 2.07 -0.63 -2.52 116.25 118.34 2wb1 h VAL 316 Ca 0.31 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2wb1 h VAL 316 Cb 0.06 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2wb1 h VAL 316 CO -0.05 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.62 2wb1 h ALA 317 N 0.35 1.00 0.07 1.67 0.00 -0.70 -2.44 119.26 119.21 2wb1 h ALA 317 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.56 2wb1 h ALA 317 Cb 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2wb1 h ALA 317 CO 0.04 0.00 -1.82 0.22 0.00 0.00 0.00 179.25 177.69 2wb1 h ASP 318 N 0.00 0.24 0.19 0.00 1.82 -0.59 -3.24 116.42 114.85 2wb1 h ASP 318 Ca 0.00 -0.51 -0.01 0.00 -0.39 0.00 0.00 57.03 56.12 2wb1 h ASP 318 Cb 0.29 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 40.22 2wb1 h ASP 318 CO 0.00 1.45 -0.09 0.58 -1.61 0.00 0.00 179.24 179.57 2wb1 h VAL 319 N 0.04 0.85 0.00 2.25 2.07 -0.99 -2.78 116.25 117.69 2wb1 h VAL 319 Ca -0.34 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2wb1 h VAL 319 Cb 2.02 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 32.75 2wb1 h VAL 319 CO 0.09 0.04 -0.11 0.24 0.02 0.00 0.00 177.57 177.86 2wb1 h MET 320 N -0.35 0.00 -0.03 1.57 2.86 -1.69 -3.14 114.93 114.15 2wb1 h MET 320 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2wb1 h MET 320 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2wb1 h MET 320 CO 0.04 0.11 -0.12 0.25 1.06 0.00 0.00 176.91 178.25 2wb1 n THR 321 N -3.75 0.00 -2.53 2.22 -2.24 -1.11 -2.16 114.28 104.71 2wb1 n THR 321 Ca -0.02 -0.44 -0.36 0.00 -2.27 0.00 0.00 64.05 60.96 2wb1 n THR 321 Cb 0.21 1.42 -0.04 0.00 -2.10 0.00 0.00 70.33 69.82 2wb1 n THR 321 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2wb1 s ARG 322 N -2.12 4.12 -0.07 -0.78 3.52 -1.07 -4.19 118.95 118.37 2wb1 s ARG 322 Ca 0.26 1.51 -0.00 0.00 -0.13 0.00 0.00 55.73 57.36 2wb1 s ARG 322 Cb 0.20 -2.50 -0.00 0.00 -1.56 0.00 0.00 34.95 31.09 2wb1 s ARG 322 CO 0.37 -0.18 0.06 2.41 -0.81 0.00 0.00 175.30 177.14 2wb1 n THR 323 N -0.17 -0.93 0.00 4.11 -1.04 -1.26 -4.79 114.28 110.20 2wb1 n THR 323 Ca 0.05 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2wb1 n THR 323 Cb 0.50 -2.93 0.00 0.00 -1.82 0.00 0.00 70.33 66.07 2wb1 n THR 323 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wb1 n GLY 324 N -1.25 0.23 3.57 3.41 0.00 -1.26 -4.61 105.19 105.28 2wb1 n GLY 324 Ca -0.01 0.05 -0.49 0.00 0.00 0.00 0.00 46.02 45.57 2wb1 n GLY 324 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wb1 n VAL 325 N 0.00 0.89 -2.26 1.61 0.31 -1.26 -4.84 118.33 112.78 2wb1 n VAL 325 Ca 0.00 -0.22 -0.41 0.00 -0.01 0.00 0.00 64.34 63.70 2wb1 n VAL 325 Cb 0.00 -0.80 -0.03 0.00 -0.91 0.00 0.00 33.84 32.11 2wb1 n VAL 325 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2wb1 s VAL 326 N -0.21 3.61 0.35 2.52 0.11 -1.26 -4.75 120.40 120.77 2wb1 s VAL 326 Ca 0.73 0.47 -0.04 0.00 -2.93 0.00 0.00 61.98 60.21 2wb1 s VAL 326 Cb -0.87 -4.27 -0.05 0.00 -1.53 0.00 0.00 36.38 29.66 2wb1 s VAL 326 CO 0.52 -1.12 0.62 0.00 -3.33 0.00 0.00 175.10 171.80 2wb1 s ARG 327 N 6.05 3.60 0.62 1.54 1.70 -0.92 -4.79 118.95 126.76 2wb1 s ARG 327 Ca 0.57 0.02 -0.16 0.00 -0.47 0.00 0.00 55.73 55.69 2wb1 s ARG 327 Cb -0.12 -2.57 -0.02 0.00 -0.57 0.00 0.00 34.95 31.67 2wb1 s ARG 327 CO 0.23 0.10 1.12 -1.14 -1.08 0.00 0.00 175.30 174.53 2wb1 s GLN 328 N -3.95 2.96 0.27 3.89 0.74 -1.26 -4.60 119.66 117.71 2wb1 s GLN 328 Ca 0.44 1.46 -0.00 0.00 0.05 0.00 0.00 55.36 57.31 2wb1 s GLN 328 Cb -0.10 -1.97 0.37 0.00 1.10 0.00 0.00 33.01 32.41 2wb1 s GLN 328 CO 0.34 -1.13 1.74 0.97 -0.55 0.00 0.00 175.29 176.66 2wb1 h ILE 329 N 0.37 1.25 -0.26 -2.34 6.09 -1.80 0.23 117.51 121.05 2wb1 h ILE 329 Ca -0.48 -1.11 0.00 0.00 -1.37 0.00 0.00 64.86 61.90 2wb1 h ILE 329 Cb 1.25 1.09 0.00 0.00 0.47 0.00 0.00 36.82 39.63 2wb1 h ILE 329 CO 0.55 0.37 0.00 0.61 -3.07 0.00 0.00 178.15 176.61 2wb1 n GLY 330 N -0.52 1.42 0.00 8.18 0.00 -1.26 -2.51 105.19 110.50 2wb1 n GLY 330 Ca 0.01 -1.63 0.09 0.00 0.00 0.00 0.00 46.02 44.50 2wb1 n GLY 330 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2wb1 n ARG 331 N 0.00 0.58 0.08 1.61 0.00 -1.26 -1.87 116.66 115.80 2wb1 n ARG 331 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.85 57.65 2wb1 n ARG 331 Cb 0.00 -1.50 -0.15 0.00 -0.00 0.00 0.00 32.46 30.81 2wb1 n ARG 331 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2wb1 h HIS 332 N 0.00 0.64 0.00 2.89 -0.00 -1.92 -3.42 115.15 113.34 2wb1 h HIS 332 Ca 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 60.37 59.91 2wb1 h HIS 332 Cb 0.01 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 27.39 2wb1 h HIS 332 CO 0.00 1.53 0.00 0.41 -0.00 0.00 0.00 177.93 179.87 2wb1 n GLY 333 N 1.76 1.83 0.26 5.26 0.00 -0.78 -4.85 105.19 108.67 2wb1 n GLY 333 Ca -0.20 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.49 2wb1 n GLY 333 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wb1 h VAL 334 N 0.00 0.50 -0.00 1.61 2.07 -0.55 0.32 116.25 120.20 2wb1 h VAL 334 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2wb1 h VAL 334 Cb 0.00 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2wb1 h VAL 334 CO 0.00 0.00 -0.00 1.07 0.02 0.00 0.00 177.57 178.66 2wb1 n THR 335 N -5.34 0.00 0.06 2.57 5.66 -1.04 -2.64 114.28 113.54 2wb1 n THR 335 Ca -0.06 -0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.06 2wb1 n THR 335 Cb 0.26 -0.50 0.26 0.00 -1.55 0.00 0.00 70.33 68.80 2wb1 n THR 335 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2wb1 n GLY 336 N 1.15 2.01 3.72 1.09 0.00 0.91 -4.86 105.19 109.21 2wb1 n GLY 336 Ca 0.19 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 2wb1 n GLY 336 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wb1 s GLU 337 N -1.31 0.19 -0.25 1.61 -1.05 0.02 -4.82 118.70 113.09 2wb1 s GLU 337 Ca 0.43 0.17 -0.29 0.00 -0.15 0.00 0.00 54.97 55.13 2wb1 s GLU 337 Cb 0.24 -1.74 -0.32 0.00 -0.44 0.00 0.00 34.13 31.87 2wb1 s GLU 337 CO 0.32 -2.82 1.70 0.36 0.95 0.00 0.00 175.26 175.78 2wb1 n LYS 338 N -4.17 0.37 -1.32 -4.83 0.00 -1.26 -4.86 118.16 102.08 2wb1 n LYS 338 Ca 0.09 -1.25 -0.07 0.00 -0.00 0.00 0.00 58.31 57.08 2wb1 n LYS 338 Cb 0.59 -2.69 0.03 0.00 -0.00 0.00 0.00 35.03 32.96 2wb1 n LYS 338 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2wb1 n ASN 339 N 9.32 0.48 -4.69 -5.58 3.02 -1.26 -5.06 115.26 111.49 2wb1 n ASN 339 Ca 0.47 -1.39 -0.41 0.00 -0.03 0.00 0.00 54.58 53.22 2wb1 n ASN 339 Cb 0.42 -0.19 -0.04 0.00 -0.61 0.00 0.00 39.78 39.37 2wb1 n ASN 339 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2wb1 s SER 340 N -2.24 7.07 0.51 6.41 0.15 -1.26 -4.95 113.70 119.39 2wb1 s SER 340 Ca 0.20 1.31 0.34 0.00 0.70 0.00 0.00 55.95 58.50 2wb1 s SER 340 Cb -0.01 -2.48 1.47 0.00 -1.71 0.00 0.00 66.02 63.29 2wb1 s SER 340 CO 0.13 -0.35 1.77 -0.37 1.20 0.00 0.00 173.24 175.62 2wb1 h VAL 341 N 5.06 0.38 -0.44 4.45 -1.51 -1.96 0.48 116.25 122.71 2wb1 h VAL 341 Ca -0.33 -0.03 -0.09 0.00 -1.23 0.00 0.00 66.70 65.02 2wb1 h VAL 341 Cb 1.15 0.29 -0.02 0.00 -2.13 0.00 0.00 31.29 30.58 2wb1 h VAL 341 CO 0.82 0.01 -0.10 -0.07 -1.23 0.00 0.00 177.57 177.00 2wb1 h LEU 342 N 0.08 0.78 -1.07 4.19 4.07 -1.94 -1.59 115.31 119.83 2wb1 h LEU 342 Ca 0.62 -0.23 -0.09 0.00 0.08 0.00 0.00 57.88 58.25 2wb1 h LEU 342 Cb 2.27 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 43.78 2wb1 h LEU 342 CO -0.09 0.90 -0.40 0.00 -1.08 0.00 0.00 178.44 177.78 2wb1 h ALA 343 N 1.17 1.23 0.00 1.53 0.00 -0.40 -2.50 119.26 120.29 2wb1 h ALA 343 Ca 0.12 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 2wb1 h ALA 343 Cb 0.58 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2wb1 h ALA 343 CO 0.04 0.54 -0.87 0.00 0.00 0.00 0.00 179.25 178.96 2wb1 h ARG 344 N 0.11 0.00 0.00 0.00 3.08 -1.41 -3.14 114.38 113.02 2wb1 h ARG 344 Ca 0.01 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 2wb1 h ARG 344 Cb 0.75 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.80 2wb1 h ARG 344 CO 0.06 0.27 -0.33 0.00 -1.07 0.00 0.00 179.97 178.89 2wb1 h ALA 345 N 1.63 0.83 0.00 0.04 0.00 -1.21 -3.25 119.26 117.30 2wb1 h ALA 345 Ca -0.06 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 2wb1 h ALA 345 Cb 1.34 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2wb1 h ALA 345 CO 0.04 0.19 -0.49 0.00 0.00 0.00 0.00 179.25 178.99 2wb1 h ALA 346 N 1.85 0.75 -2.76 0.00 0.00 -1.49 -0.79 119.26 116.82 2wb1 h ALA 346 Ca -0.01 -0.33 -0.61 0.00 0.00 0.00 0.00 54.91 53.96 2wb1 h ALA 346 Cb 1.12 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2wb1 h ALA 346 CO 0.02 0.43 -0.38 0.12 0.00 0.00 0.00 179.25 179.43 2wb1 s PHE 347 N -3.06 3.53 0.00 0.00 5.36 -1.19 -3.81 117.98 118.82 2wb1 s PHE 347 Ca 0.04 0.50 0.00 0.00 -0.96 0.00 0.00 56.93 56.51 2wb1 s PHE 347 Cb 0.07 -1.95 0.00 0.00 -0.34 0.00 0.00 43.02 40.80 2wb1 s PHE 347 CO 0.73 0.55 0.00 -1.91 -1.46 0.00 0.00 175.22 173.13 2wb1 n GLU 348 N 0.59 0.00 -2.77 10.12 2.13 -1.26 -4.04 120.64 125.41 2wb1 n GLU 348 Ca -0.07 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.74 2wb1 n GLU 348 Cb 0.52 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.75 2wb1 n GLU 348 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 2wb1 n VAL 349 N -0.76 -8.73 -4.58 6.31 3.14 -1.25 -5.06 118.33 107.40 2wb1 n VAL 349 Ca 0.00 -0.08 -0.25 0.00 -2.96 0.00 0.00 64.34 61.05 2wb1 n VAL 349 Cb 0.00 -6.40 -0.14 0.00 -1.06 0.00 0.00 33.84 26.24 2wb1 n VAL 349 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2wb1 s THR 350 N -2.91 1.70 -0.22 1.55 -1.32 -0.30 -5.03 115.64 109.11 2wb1 s THR 350 Ca 0.03 -1.28 -0.19 0.00 -1.21 0.00 0.00 61.69 59.04 2wb1 s THR 350 Cb -0.01 -1.49 -0.16 0.00 -1.51 0.00 0.00 72.50 69.33 2wb1 s THR 350 CO 0.62 0.16 0.04 0.52 -2.21 0.00 0.00 174.62 173.75 2wb1 n VAL 351 N 1.68 1.53 0.00 5.08 0.31 -1.26 -4.51 118.33 121.16 2wb1 n VAL 351 Ca -0.18 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2wb1 n VAL 351 Cb 0.53 -2.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.43 2wb1 n VAL 351 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wb1 n LYS 352 N -4.40 0.00 0.02 5.55 5.02 -1.26 0.56 118.16 123.65 2wb1 n LYS 352 Ca -0.36 0.31 -0.07 0.00 -2.02 0.00 0.00 58.31 56.17 2wb1 n LYS 352 Cb 0.71 -1.62 -0.05 0.00 -0.02 0.00 0.00 35.03 34.05 2wb1 n LYS 352 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2wb1 h HIS 353 N 0.00 -0.15 -1.08 2.13 3.86 -1.95 -3.29 115.15 114.67 2wb1 h HIS 353 Ca 0.00 -0.00 0.31 0.00 -1.16 0.00 0.00 60.37 59.52 2wb1 h HIS 353 Cb 0.23 0.05 -0.12 0.00 1.06 0.00 0.00 27.41 28.63 2wb1 h HIS 353 CO 0.00 0.17 0.67 -0.07 0.86 0.00 0.00 177.93 179.56 2wb1 h LEU 354 N -0.99 0.46 0.36 2.43 3.38 -0.14 0.21 115.31 121.02 2wb1 h LEU 354 Ca -0.02 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2wb1 h LEU 354 Cb 0.38 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2wb1 h LEU 354 CO 0.03 -0.02 -0.17 -0.07 0.09 0.00 0.00 178.44 178.29 2wb1 h LEU 355 N 0.34 -0.41 -2.29 1.67 3.38 -1.71 -1.78 115.31 114.51 2wb1 h LEU 355 Ca 0.68 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.53 2wb1 h LEU 355 Cb 1.73 0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.59 2wb1 h LEU 355 CO -0.43 -0.09 0.00 0.44 0.09 0.00 0.00 178.44 178.45 2wb1 h ASP 356 N -0.74 0.00 -0.04 -0.43 5.19 -1.14 0.14 116.42 119.40 2wb1 h ASP 356 Ca -0.05 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.21 2wb1 h ASP 356 Cb 0.51 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.03 2wb1 h ASP 356 CO 0.08 0.00 -0.56 0.00 -3.12 0.00 0.00 179.24 175.64 2wb1 h ALA 357 N 2.01 0.12 -0.09 3.45 0.00 -0.53 -1.93 119.26 122.28 2wb1 h ALA 357 Ca 0.00 -0.54 -0.10 0.00 0.00 0.00 0.00 54.91 54.27 2wb1 h ALA 357 Cb 0.16 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2wb1 h ALA 357 CO 0.00 0.35 -0.40 0.00 0.00 0.00 0.00 179.25 179.21 2wb1 h ALA 358 N 0.37 1.16 0.02 0.00 0.00 -0.17 0.30 119.26 120.95 2wb1 h ALA 358 Ca -0.06 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 2wb1 h ALA 358 Cb 1.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2wb1 h ALA 358 CO 0.11 0.57 -0.01 0.00 0.00 0.00 0.00 179.25 179.92 2wb1 h ALA 359 N 1.42 -0.03 0.00 0.00 0.00 -0.87 -3.26 119.26 116.52 2wb1 h ALA 359 Ca 0.02 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2wb1 h ALA 359 Cb 0.78 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2wb1 h ALA 359 CO 0.06 -0.09 0.00 0.54 0.00 0.00 0.00 179.25 179.76 2wb1 n ARG 360 N -4.71 0.26 -2.75 0.00 5.12 -0.73 -4.83 116.66 109.02 2wb1 n ARG 360 Ca -0.09 0.11 -0.17 0.00 -1.93 0.00 0.00 57.85 55.78 2wb1 n ARG 360 Cb 0.37 -1.50 0.02 0.00 -1.16 0.00 0.00 32.46 30.19 2wb1 n ARG 360 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2wb1 n GLY 361 N -0.21 -0.24 3.56 -0.13 0.00 -1.07 -4.88 105.19 102.22 2wb1 n GLY 361 Ca 0.07 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 2wb1 n GLY 361 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wb1 n ASP 362 N -1.41 1.68 -4.72 1.61 9.92 0.07 -4.93 116.55 118.78 2wb1 n ASP 362 Ca -0.10 -1.46 -0.42 0.00 -0.53 0.00 0.00 54.79 52.28 2wb1 n ASP 362 Cb 0.60 -1.62 -0.03 0.00 -0.64 0.00 0.00 41.12 39.43 2wb1 n ASP 362 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2wb1 s VAL 363 N 14.30 3.32 -0.08 2.53 1.01 -1.26 -4.88 120.40 135.34 2wb1 s VAL 363 Ca 0.95 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.89 2wb1 s VAL 363 Cb -0.16 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.63 2wb1 s VAL 363 CO 0.10 0.08 -0.06 -0.70 0.00 0.00 0.00 175.10 174.52 2wb1 s GLU 364 N 1.03 1.18 0.00 2.72 2.56 -1.26 -5.03 118.70 119.90 2wb1 s GLU 364 Ca 0.64 -0.16 0.00 0.00 0.00 0.00 0.00 54.97 55.44 2wb1 s GLU 364 Cb -0.37 -1.24 0.00 0.00 2.00 0.00 0.00 34.13 34.53 2wb1 s GLU 364 CO 0.31 -0.18 0.00 -1.91 -0.56 0.00 0.00 175.26 172.92 2wb1 n GLU 365 N 4.57 3.29 0.00 4.30 0.00 -1.26 -5.04 120.64 126.51 2wb1 n GLU 365 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.00 2wb1 n GLU 365 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.94 2wb1 n GLU 365 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2wb1 n PHE 366 N 0.00 0.00 0.00 4.31 0.99 -1.26 -4.91 117.46 116.59 2wb1 n PHE 366 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2wb1 n PHE 366 Cb 0.00 0.12 0.00 0.00 -1.00 0.00 0.00 39.48 38.60 2wb1 n PHE 366 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2wb1 n LYS 367 N -1.78 0.00 -0.92 -1.08 4.76 -1.26 -4.76 118.16 113.12 2wb1 n LYS 367 Ca 0.00 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.15 2wb1 n LYS 367 Cb 0.00 0.00 0.20 0.00 -1.84 0.00 0.00 35.03 33.39 2wb1 n LYS 367 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2wb1 s GLY 368 N 0.00 1.57 0.01 0.72 0.00 -1.26 -4.79 107.32 103.58 2wb1 s GLY 368 Ca 0.00 -0.16 -0.25 0.00 0.00 0.00 0.00 44.72 44.31 2wb1 s GLY 368 CO 0.00 0.46 1.21 -0.39 0.00 0.00 0.00 173.10 174.38 2wb1 h VAL 369 N -2.10 0.53 -0.08 1.40 -1.51 -1.99 -3.20 116.25 109.29 2wb1 h VAL 369 Ca -0.55 -0.51 0.03 0.00 -1.23 0.00 0.00 66.70 64.44 2wb1 h VAL 369 Cb 1.32 0.75 -0.04 0.00 -2.13 0.00 0.00 31.29 31.19 2wb1 h VAL 369 CO 0.53 0.08 -0.15 0.58 -1.23 0.00 0.00 177.57 177.39 2wb1 h VAL 370 N -0.86 0.62 -0.32 7.19 2.07 -1.96 -0.47 116.25 122.52 2wb1 h VAL 370 Ca -0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 2wb1 h VAL 370 Cb 0.55 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2wb1 h VAL 370 CO 0.09 0.00 0.01 -0.33 0.02 0.00 0.00 177.57 177.36 2wb1 h GLU 371 N -0.20 0.49 0.00 1.57 3.07 -1.89 -1.28 114.58 116.34 2wb1 h GLU 371 Ca 0.08 -0.10 -0.09 0.00 -0.50 0.00 0.00 59.36 58.75 2wb1 h GLU 371 Cb 0.31 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 2wb1 h GLU 371 CO -0.20 0.51 -0.44 -0.91 -1.40 0.00 0.00 179.01 176.56 2wb1 h ASN 372 N 0.47 0.00 0.81 1.42 2.35 -1.24 0.40 115.58 119.79 2wb1 h ASN 372 Ca 0.10 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.65 2wb1 h ASN 372 Cb 0.29 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 2wb1 h ASN 372 CO 0.01 0.44 -0.95 0.40 -1.65 0.00 0.00 177.43 175.68 2wb1 h ILE 373 N 0.00 1.60 -0.00 2.81 2.04 -0.71 0.09 117.51 123.34 2wb1 h ILE 373 Ca -0.00 -3.02 -0.00 0.00 1.00 0.00 0.00 64.86 62.84 2wb1 h ILE 373 Cb 1.01 2.68 -0.00 0.00 -0.74 0.00 0.00 36.82 39.76 2wb1 h ILE 373 CO 0.06 0.87 -0.00 0.40 0.00 0.00 0.00 178.15 179.48 2wb1 h ILE 374 N 0.03 1.41 -0.67 -0.67 2.04 -0.81 -3.25 117.51 115.60 2wb1 h ILE 374 Ca -0.03 -1.21 -0.03 0.00 1.00 0.00 0.00 64.86 64.58 2wb1 h ILE 374 Cb 1.64 2.24 -0.03 0.00 -0.74 0.00 0.00 36.82 39.93 2wb1 h ILE 374 CO 0.13 0.31 0.28 -0.29 0.00 0.00 0.00 178.15 178.59 2wb1 h ILE 375 N -0.51 1.24 0.00 -0.67 6.09 -0.32 -3.47 117.51 119.87 2wb1 h ILE 375 Ca 0.00 -0.72 0.00 0.00 -1.37 0.00 0.00 64.86 62.77 2wb1 h ILE 375 Cb 0.52 0.46 0.00 0.00 0.47 0.00 0.00 36.82 38.26 2wb1 h ILE 375 CO 0.00 0.29 0.00 0.61 -3.07 0.00 0.00 178.15 175.98 2wb1 n GLY 376 N -0.87 1.51 3.62 8.18 0.00 -0.96 -5.09 105.19 111.58 2wb1 n GLY 376 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 2wb1 n GLY 376 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wb1 s HIS 377 N -2.00 3.28 0.12 1.61 5.04 -0.02 -5.01 115.29 118.30 2wb1 s HIS 377 Ca 0.00 0.52 -0.24 0.00 -1.54 0.00 0.00 55.06 53.79 2wb1 s HIS 377 Cb 0.00 -2.60 -0.14 0.00 0.04 0.00 0.00 32.58 29.88 2wb1 s HIS 377 CO 0.00 -0.19 0.52 -2.30 -2.34 0.00 0.00 174.74 170.43 2wb1 n PRO 378 N 5.19 0.00 -2.41 2.88 -0.01 -1.26 -4.15 135.00 135.23 2wb1 n PRO 378 Ca -0.07 0.00 -0.39 0.00 -0.01 0.00 0.00 63.50 63.03 2wb1 n PRO 378 Cb 0.51 -0.89 -0.03 0.00 -0.01 0.00 0.00 33.50 33.07 2wb1 n PRO 378 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 175.50 176.45 2wb1 s ILE 379 N -0.58 3.39 -1.27 4.25 -4.36 -1.26 -4.95 121.20 116.42 2wb1 s ILE 379 Ca 0.56 1.26 0.02 0.00 -0.26 0.00 0.00 60.65 62.23 2wb1 s ILE 379 Cb -0.80 -3.75 0.11 0.00 1.25 0.00 0.00 42.46 39.27 2wb1 s ILE 379 CO 0.44 0.20 0.82 0.29 0.24 0.00 0.00 174.94 176.93 2wb1 n LYS 380 N 0.60 1.47 -4.26 0.37 4.01 -1.26 -4.12 118.16 114.97 2wb1 n LYS 380 Ca 0.02 -0.44 -0.14 0.00 -0.51 0.00 0.00 58.31 57.23 2wb1 n LYS 380 Cb 0.46 -1.43 -0.10 0.00 -0.51 0.00 0.00 35.03 33.45 2wb1 n LYS 380 CO 0.00 0.00 0.00 -0.48 -1.11 0.00 0.00 177.40 175.81 2wb1 s LEU 381 N -0.61 2.46 0.00 -0.35 0.05 -1.26 -4.27 118.68 114.70 2wb1 s LEU 381 Ca 0.08 -1.05 0.00 0.00 0.05 0.00 0.00 54.13 53.21 2wb1 s LEU 381 Cb 0.05 -0.32 0.00 0.00 -2.05 0.00 0.00 46.19 43.88 2wb1 s LEU 381 CO 0.03 -0.37 0.00 0.61 -0.55 0.00 0.00 176.35 176.07 2wb1 n GLY 382 N -0.23 1.46 0.22 -3.48 0.00 0.18 -3.40 105.19 99.94 2wb1 n GLY 382 Ca -0.09 -0.49 0.16 0.00 0.00 0.00 0.00 46.02 45.59 2wb1 n GLY 382 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2wb1 h THR 383 N 0.00 0.00 0.00 2.61 1.35 -1.90 -1.74 112.91 113.23 2wb1 h THR 383 Ca 0.00 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 2wb1 h THR 383 Cb 0.00 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.47 2wb1 h THR 383 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2wb1 n GLY 384 N -0.43 -0.82 0.12 5.82 0.00 -1.22 -3.59 105.19 105.07 2wb1 n GLY 384 Ca 0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 2wb1 n GLY 384 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2wb1 n MET 385 N -1.11 0.69 -2.51 1.61 1.56 -0.65 -4.62 117.12 112.08 2wb1 n MET 385 Ca 0.15 0.17 -0.42 0.00 -0.27 0.00 0.00 57.70 57.32 2wb1 n MET 385 Cb 0.11 -1.61 -0.03 0.00 2.15 0.00 0.00 33.22 33.85 2wb1 n MET 385 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 2wb1 s VAL 386 N -2.53 4.31 -0.02 1.12 0.11 -1.24 -5.04 120.40 117.12 2wb1 s VAL 386 Ca -0.23 1.66 0.01 0.00 -2.93 0.00 0.00 61.98 60.50 2wb1 s VAL 386 Cb 0.08 -4.06 -0.03 0.00 -1.53 0.00 0.00 36.38 30.83 2wb1 s VAL 386 CO 0.72 0.11 -0.02 -1.83 -3.33 0.00 0.00 175.10 170.75 2wb1 s GLU 387 N 1.20 2.75 0.22 1.54 -1.05 -1.26 -5.06 118.70 117.04 2wb1 s GLU 387 Ca 0.56 -0.61 0.11 0.00 -0.15 0.00 0.00 54.97 54.88 2wb1 s GLU 387 Cb -0.26 -2.64 -0.05 0.00 -0.44 0.00 0.00 34.13 30.74 2wb1 s GLU 387 CO 0.28 0.63 -0.20 -0.51 0.95 0.00 0.00 175.26 176.41 2wb1 s LEU 388 N -1.38 2.51 -0.03 1.83 1.43 -1.26 -5.14 118.68 116.64 2wb1 s LEU 388 Ca 0.18 -0.95 -0.01 0.00 -1.03 0.00 0.00 54.13 52.31 2wb1 s LEU 388 Cb -0.11 -1.02 0.03 0.00 0.03 0.00 0.00 46.19 45.12 2wb1 s LEU 388 CO 0.08 0.02 0.06 -0.89 0.23 0.00 0.00 176.35 175.85 2wb1 s THR 389 N -2.25 -0.09 0.06 5.49 2.01 -1.26 -5.16 115.64 114.45 2wb1 s THR 389 Ca 0.24 0.31 0.09 0.00 0.31 0.00 0.00 61.69 62.64 2wb1 s THR 389 Cb -0.05 -0.13 -0.03 0.00 0.01 0.00 0.00 72.50 72.30 2wb1 s THR 389 CO 0.11 0.13 -0.26 -0.32 -0.69 0.00 0.00 174.62 173.59 2wb1 s MET 390 N 1.58 1.64 -0.19 4.92 0.00 -1.26 -5.13 119.30 120.86 2wb1 s MET 390 Ca -0.03 -1.14 -0.04 0.00 0.00 0.00 0.00 55.69 54.48 2wb1 s MET 390 Cb -0.12 -1.88 -0.02 0.00 0.00 0.00 0.00 34.83 32.81 2wb1 s MET 390 CO -0.03 0.48 -0.03 1.03 0.00 0.00 0.00 175.02 176.46 2wb1 s ARG 391 N -1.42 3.55 0.23 4.11 0.52 -1.26 -4.97 118.95 119.71 2wb1 s ARG 391 Ca 0.11 -0.56 0.24 0.00 -0.52 0.00 0.00 55.73 55.00 2wb1 s ARG 391 Cb -0.10 -2.98 0.94 0.00 0.52 0.00 0.00 34.95 33.33 2wb1 s ARG 391 CO 0.03 0.03 1.71 -2.30 0.02 0.00 0.00 175.30 174.79 2wb1 n PRO 392 N 4.15 0.19 -0.46 3.54 -0.02 -1.26 -5.05 135.00 136.09 2wb1 n PRO 392 Ca -0.18 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2wb1 n PRO 392 Cb 0.52 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2wb1 n PRO 392 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2wb1 n ILE 393 N -2.19 -2.20 1.47 4.25 5.41 -1.26 -5.40 119.36 119.44 2wb1 n ILE 393 Ca 0.03 0.67 0.12 0.00 1.00 0.00 0.00 62.75 64.56 2wb1 n ILE 393 Cb 0.26 -1.49 0.70 0.00 -0.71 0.00 0.00 39.64 38.40 2wb1 n ILE 393 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73