#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w2q s PRO 2 N 0.00 3.78 -1.18 1.61 0.04 -1.26 -2.96 135.00 135.04 1w2q s PRO 2 Ca 0.00 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.82 1w2q s PRO 2 Cb 0.00 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 32.11 1w2q s PRO 2 CO 0.00 -0.53 0.00 -1.33 0.04 0.00 0.00 177.00 175.18 1w2q n MET 3 N -0.44 -2.12 -0.36 4.56 2.81 -1.26 -4.80 117.12 115.52 1w2q n MET 3 Ca 0.07 0.67 0.09 0.00 -1.81 0.00 0.00 57.70 56.72 1w2q n MET 3 Cb 0.48 -5.27 0.26 0.00 -0.71 0.00 0.00 33.22 27.98 1w2q n MET 3 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 1w2q h ARG 4 N 0.00 0.91 -4.62 0.03 2.43 -2.07 -3.41 114.38 107.65 1w2q h ARG 4 Ca -0.32 -0.05 -0.37 0.00 -0.81 0.00 0.00 59.98 58.42 1w2q h ARG 4 Cb 1.23 -0.20 -0.28 0.00 -0.42 0.00 0.00 29.97 30.29 1w2q h ARG 4 CO 0.38 0.60 -0.77 0.50 -1.51 0.00 0.00 179.97 179.17 1w2q s ARG 5 N -5.92 0.65 -0.09 0.20 3.52 -1.26 -5.01 118.95 111.03 1w2q s ARG 5 Ca -0.12 -0.31 -0.06 0.00 -0.13 0.00 0.00 55.73 55.12 1w2q s ARG 5 Cb 0.23 -0.62 -0.04 0.00 -1.56 0.00 0.00 34.95 32.96 1w2q s ARG 5 CO 0.81 0.17 0.15 -2.00 -0.81 0.00 0.00 175.30 173.61 1w2q s GLU 6 N -0.25 3.42 0.36 5.12 2.56 -1.26 -4.98 118.70 123.67 1w2q s GLU 6 Ca 0.03 -0.18 0.09 0.00 0.00 0.00 0.00 54.97 54.90 1w2q s GLU 6 Cb -0.03 -3.16 0.81 0.00 2.00 0.00 0.00 34.13 33.75 1w2q s GLU 6 CO -0.00 0.75 1.88 0.00 -0.56 0.00 0.00 175.26 177.33 1w2q h ARG 7 N 4.71 0.68 0.00 4.30 3.08 -2.00 -3.41 114.38 121.73 1w2q h ARG 7 Ca -0.53 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.30 1w2q h ARG 7 Cb 1.22 -0.15 0.08 0.00 0.08 0.00 0.00 29.97 31.20 1w2q h ARG 7 CO 0.60 0.45 0.08 0.41 -1.07 0.00 0.00 179.97 180.44 1w2q n GLY 8 N -1.44 -2.28 3.26 0.04 0.00 -1.26 -5.06 105.19 98.45 1w2q n GLY 8 Ca 0.16 -1.52 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 1w2q n GLY 8 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w2q s ARG 9 N -4.11 1.78 0.37 1.61 0.52 -1.26 -5.01 118.95 112.84 1w2q s ARG 9 Ca 0.31 -0.84 0.06 0.00 -0.52 0.00 0.00 55.73 54.73 1w2q s ARG 9 Cb -0.02 -1.75 0.70 0.00 0.52 0.00 0.00 34.95 34.40 1w2q s ARG 9 CO 0.23 0.48 1.94 1.96 0.02 0.00 0.00 175.30 179.93 1w2q h GLN 10 N 5.45 0.51 0.00 3.54 4.20 -1.97 -3.46 115.11 123.38 1w2q h GLN 10 Ca -0.41 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.22 1w2q h GLN 10 Cb 1.14 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.83 1w2q h GLN 10 CO 0.47 0.47 0.00 0.41 -0.67 0.00 0.00 178.83 179.51 1w2q n GLY 11 N -1.08 0.68 3.78 3.46 0.00 -1.26 -5.05 105.19 105.72 1w2q n GLY 11 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1w2q n GLY 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w2q s ASP 12 N -2.79 6.55 0.96 1.61 1.01 -1.26 -5.01 116.67 117.74 1w2q s ASP 12 Ca 0.00 2.18 -0.12 0.00 0.71 0.00 0.00 52.55 55.32 1w2q s ASP 12 Cb 0.00 -2.60 0.16 0.00 1.01 0.00 0.00 42.92 41.50 1w2q s ASP 12 CO 0.00 -0.64 1.09 -0.94 0.21 0.00 0.00 175.17 174.88 1w2q s SER 13 N -1.41 2.85 0.24 0.27 1.04 -1.26 -4.91 113.70 110.53 1w2q s SER 13 Ca 0.59 1.62 -0.07 0.00 0.48 0.00 0.00 55.95 58.57 1w2q s SER 13 Cb -0.26 -2.27 0.24 0.00 0.10 0.00 0.00 66.02 63.84 1w2q s SER 13 CO 0.32 -3.05 1.92 0.28 0.98 0.00 0.00 173.24 173.68 1w2q h SER 14 N -1.83 1.12 -3.20 7.02 0.02 -2.03 -3.39 113.55 111.25 1w2q h SER 14 Ca -0.51 -0.04 -0.67 0.00 -0.84 0.00 0.00 61.79 59.73 1w2q h SER 14 Cb 1.29 -0.28 -0.33 0.00 0.14 0.00 0.00 62.40 63.22 1w2q h SER 14 CO 0.51 0.82 -0.84 -0.55 -1.14 0.00 0.00 176.83 175.63 1w2q s SER 15 N -6.10 3.34 0.32 3.07 0.15 -1.26 -4.99 113.70 108.23 1w2q s SER 15 Ca -0.13 -0.56 0.04 0.00 0.70 0.00 0.00 55.95 56.00 1w2q s SER 15 Cb 0.17 -1.50 0.66 0.00 -1.71 0.00 0.00 66.02 63.64 1w2q s SER 15 CO 0.82 0.06 1.87 0.00 1.20 0.00 0.00 173.24 177.18 1w2q h GLU 17 N 0.88 0.05 -0.03 0.00 5.08 -1.96 1.28 114.58 119.87 1w2q h GLU 17 Ca 0.45 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.82 1w2q h GLU 17 Cb 0.51 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1w2q h GLU 17 CO -0.21 0.03 0.08 0.00 -1.00 0.00 0.00 179.01 177.91 1w2q h ARG 18 N 0.05 0.00 -0.01 2.33 3.08 -1.29 0.14 114.38 118.68 1w2q h ARG 18 Ca 0.61 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.50 1w2q h ARG 18 Cb 2.33 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 32.36 1w2q h ARG 18 CO -0.06 0.00 -0.75 1.96 -1.07 0.00 0.00 179.97 180.05 1w2q h GLN 19 N 0.00 0.06 -0.72 0.04 4.20 0.15 -3.15 115.11 115.69 1w2q h GLN 19 Ca 0.02 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.69 1w2q h GLN 19 Cb 0.18 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 1w2q h GLN 19 CO -0.00 0.78 0.47 0.28 -0.67 0.00 0.00 178.83 179.68 1w2q h VAL 20 N 0.03 1.14 -0.50 -0.54 2.07 -0.80 -0.16 116.25 117.49 1w2q h VAL 20 Ca -0.01 -0.32 0.15 0.00 0.82 0.00 0.00 66.70 67.33 1w2q h VAL 20 Cb 1.32 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1w2q h VAL 20 CO 0.10 0.17 0.71 0.44 0.02 0.00 0.00 177.57 179.01 1w2q h ASP 21 N 0.93 0.00 0.94 0.57 3.32 -1.56 2.11 116.42 122.73 1w2q h ASP 21 Ca 0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 1w2q h ASP 21 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1w2q h ASP 21 CO -0.08 0.00 -0.70 0.03 -1.72 0.00 0.00 179.24 176.77 1w2q h ARG 22 N 0.00 0.00 0.00 3.56 3.08 -1.18 -3.29 114.38 116.55 1w2q h ARG 22 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1w2q h ARG 22 Cb 1.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.71 1w2q h ARG 22 CO -0.00 0.00 0.00 0.28 -1.07 0.00 0.00 179.97 179.18 1w2q h VAL 23 N 0.00 0.00 -1.39 2.04 2.07 0.35 -3.44 116.25 115.89 1w2q h VAL 23 Ca 0.00 -0.11 -0.73 0.00 0.82 0.00 0.00 66.70 66.68 1w2q h VAL 23 Cb 0.82 0.80 0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1w2q h VAL 23 CO 0.00 0.00 0.31 -3.20 0.02 0.00 0.00 177.57 174.70 1w2q n ASN 24 N -2.46 1.00 -3.11 0.57 2.85 -1.24 -4.91 115.26 107.96 1w2q n ASN 24 Ca -0.01 1.14 0.03 0.00 -0.11 0.00 0.00 54.58 55.63 1w2q n ASN 24 Cb 0.12 -1.08 -0.00 0.00 1.24 0.00 0.00 39.78 40.06 1w2q n ASN 24 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1w2q s LEU 25 N 0.42 -1.14 0.26 1.20 1.02 -1.26 -5.02 118.68 114.16 1w2q s LEU 25 Ca 0.88 -0.16 -0.04 0.00 0.02 0.00 0.00 54.13 54.83 1w2q s LEU 25 Cb -1.09 1.60 0.33 0.00 0.02 0.00 0.00 46.19 47.05 1w2q s LEU 25 CO 0.52 -0.17 1.85 0.11 0.02 0.00 0.00 176.35 178.67 1w2q h LYS 26 N 7.17 1.01 -0.21 1.70 1.57 -2.00 -2.74 116.57 123.07 1w2q h LYS 26 Ca -0.02 -0.16 -0.07 0.00 -1.87 0.00 0.00 60.65 58.53 1w2q h LYS 26 Cb 1.19 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 1w2q h LYS 26 CO 0.05 0.81 -0.18 -1.00 -0.57 0.00 0.00 179.45 178.56 1w2q h PRO 27 N 1.00 0.37 0.39 3.15 0.13 -1.97 -1.69 132.00 133.38 1w2q h PRO 27 Ca 0.24 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 65.24 1w2q h PRO 27 Cb 0.17 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.26 1w2q h PRO 27 CO -0.02 0.54 -0.19 0.00 -0.23 0.00 0.00 178.00 178.10 1w2q h GLU 29 N -1.08 0.41 0.00 0.00 4.81 -1.52 1.71 114.58 118.90 1w2q h GLU 29 Ca -0.05 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1w2q h GLU 29 Cb 0.47 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1w2q h GLU 29 CO 0.09 0.27 -0.01 1.96 -0.73 0.00 0.00 179.01 180.59 1w2q h GLN 30 N 0.42 0.00 0.00 1.92 4.20 -1.20 0.10 115.11 120.55 1w2q h GLN 30 Ca 0.55 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.13 1w2q h GLN 30 Cb 1.36 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.12 1w2q h GLN 30 CO -0.25 0.01 -0.63 1.25 -0.67 0.00 0.00 178.83 178.54 1w2q h HIS 31 N 0.00 0.00 0.06 2.96 2.76 0.38 -1.13 115.15 120.17 1w2q h HIS 31 Ca -0.00 0.00 -0.33 0.00 -2.20 0.00 0.00 60.37 57.84 1w2q h HIS 31 Cb 0.63 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.56 1w2q h HIS 31 CO 0.00 0.63 -1.84 0.44 -1.30 0.00 0.00 177.93 175.86 1w2q n ILE 32 N -3.66 1.65 -0.07 6.26 -0.00 -0.95 -2.84 119.36 119.75 1w2q n ILE 32 Ca -0.01 -0.41 -0.10 0.00 -0.00 0.00 0.00 62.75 62.24 1w2q n ILE 32 Cb 0.65 -1.82 -0.03 0.00 -0.00 0.00 0.00 39.64 38.44 1w2q n ILE 32 CO 0.00 0.00 0.00 0.24 -0.00 0.00 0.00 176.55 176.79 1w2q h MET 33 N -0.40 0.35 -0.27 6.28 2.86 -0.88 0.18 114.93 123.06 1w2q h MET 33 Ca -0.44 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.12 1w2q h MET 33 Cb 1.73 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 1w2q h MET 33 CO -0.08 0.28 -0.01 0.37 1.06 0.00 0.00 176.91 178.53 1w2q h GLN 34 N 0.32 0.48 0.63 1.72 4.15 -1.39 -0.14 115.11 120.88 1w2q h GLN 34 Ca 0.09 -0.16 -0.03 0.00 0.77 0.00 0.00 58.65 59.32 1w2q h GLN 34 Cb 0.02 -0.04 0.01 0.00 0.21 0.00 0.00 27.48 27.67 1w2q h GLN 34 CO -0.02 0.65 -0.30 0.00 -1.93 0.00 0.00 178.83 177.23 1w2q h ARG 35 N 0.25 -0.82 -0.31 1.69 2.47 -1.35 -0.33 114.38 115.98 1w2q h ARG 35 Ca 0.07 0.06 0.09 0.00 -1.26 0.00 0.00 59.98 58.94 1w2q h ARG 35 Cb 0.45 0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.94 1w2q h ARG 35 CO 0.02 -0.54 0.33 -0.84 0.56 0.00 0.00 179.97 179.50 1w2q h ILE 36 N -0.91 0.42 -0.52 2.04 3.07 -0.72 0.68 117.51 121.58 1w2q h ILE 36 Ca -0.09 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.32 1w2q h ILE 36 Cb 0.65 0.73 0.00 0.00 -0.27 0.00 0.00 36.82 37.93 1w2q h ILE 36 CO 0.14 0.00 0.00 0.23 -1.05 0.00 0.00 178.15 177.47 1w2q n MET 37 N -3.77 3.24 0.25 0.16 2.81 -0.07 -4.31 117.12 115.45 1w2q n MET 37 Ca 0.05 -2.31 0.11 0.00 -1.81 0.00 0.00 57.70 53.74 1w2q n MET 37 Cb 0.49 -1.79 0.73 0.00 -0.71 0.00 0.00 33.22 31.94 1w2q n MET 37 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1w2q h GLY 38 N 4.48 0.00 2.00 3.03 0.00 0.22 0.29 103.07 113.08 1w2q h GLY 38 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1w2q h GLY 38 CO 0.20 0.00 -0.42 0.83 0.00 0.00 0.00 176.54 177.15 1w2q h GLU 39 N 0.00 0.00 -0.18 4.80 4.39 -1.79 -3.09 114.58 118.71 1w2q h GLU 39 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1w2q h GLU 39 Cb 0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1w2q h GLU 39 CO -0.00 0.42 0.00 1.04 -1.16 0.00 0.00 179.01 179.31 1w2q n GLN 40 N -3.31 2.06 -4.48 2.33 6.02 0.08 -4.92 117.38 115.16 1w2q n GLN 40 Ca 0.01 -1.91 -0.34 0.00 -0.01 0.00 0.00 57.00 54.75 1w2q n GLN 40 Cb 0.64 -1.42 -0.11 0.00 1.02 0.00 0.00 30.24 30.37 1w2q n GLN 40 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1w2q s GLU 41 N -1.53 3.04 0.06 -1.09 2.56 0.78 -5.10 118.70 117.43 1w2q s GLU 41 Ca 0.28 -0.49 0.05 0.00 0.00 0.00 0.00 54.97 54.82 1w2q s GLU 41 Cb 0.18 -2.74 -0.04 0.00 2.00 0.00 0.00 34.13 33.53 1w2q s GLU 41 CO 0.26 0.59 -0.05 -0.65 -0.56 0.00 0.00 175.26 174.85 1w2q s GLN 42 N -0.58 2.44 0.52 4.30 -0.21 -1.26 -4.87 119.66 119.99 1w2q s GLN 42 Ca 0.09 -0.85 0.29 0.00 0.02 0.00 0.00 55.36 54.92 1w2q s GLN 42 Cb -0.12 -2.47 1.38 0.00 1.00 0.00 0.00 33.01 32.81 1w2q s GLN 42 CO 0.02 0.55 2.02 0.10 -2.12 0.00 0.00 175.29 175.86 1w2q h TYR 43 N 3.86 0.00 -0.37 0.91 -0.00 -1.99 -2.50 116.97 116.88 1w2q h TYR 43 Ca -0.48 0.00 0.01 0.00 -0.00 0.00 0.00 58.73 58.25 1w2q h TYR 43 Cb 1.17 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.88 1w2q h TYR 43 CO 0.60 0.12 0.24 -0.44 -0.00 0.00 0.00 178.16 178.68 1w2q h ASP 44 N 0.00 0.41 -0.60 0.10 3.32 -2.01 -1.45 116.42 116.19 1w2q h ASP 44 Ca -0.00 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 1w2q h ASP 44 Cb 0.45 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 1w2q h ASP 44 CO 0.02 0.30 0.22 0.28 -1.72 0.00 0.00 179.24 178.34 1w2q h SER 45 N 0.49 0.87 -0.34 6.45 0.02 -1.86 -2.18 113.55 117.00 1w2q h SER 45 Ca 0.14 -0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 60.91 1w2q h SER 45 Cb -0.04 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.25 1w2q h SER 45 CO -0.03 0.80 0.07 1.88 -1.14 0.00 0.00 176.83 178.42 1w2q h TYR 46 N 0.93 0.66 -0.95 3.45 0.05 -1.39 -2.39 116.97 117.33 1w2q h TYR 46 Ca 0.21 -0.06 0.08 0.00 0.05 0.00 0.00 58.73 59.02 1w2q h TYR 46 Cb 0.23 -0.20 -0.07 0.00 1.01 0.00 0.00 36.73 37.70 1w2q h TYR 46 CO 0.02 0.59 0.59 -0.44 -1.05 0.00 0.00 178.16 177.87 1w2q h ASP 47 N 0.63 0.91 0.03 3.88 3.32 -1.23 -2.17 116.42 121.79 1w2q h ASP 47 Ca 0.14 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.23 1w2q h ASP 47 Cb 0.29 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1w2q h ASP 47 CO 0.00 0.55 -0.08 0.40 -1.72 0.00 0.00 179.24 178.39 1w2q h ILE 48 N 1.03 0.80 -3.96 0.35 1.08 -1.40 -3.43 117.51 111.98 1w2q h ILE 48 Ca 0.43 0.00 -0.31 0.00 -0.39 0.00 0.00 64.86 64.59 1w2q h ILE 48 Cb 0.28 0.80 -0.23 0.00 -3.07 0.00 0.00 36.82 34.60 1w2q h ILE 48 CO -0.21 0.00 -0.75 -0.13 -0.69 0.00 0.00 178.15 176.37 1w2q s ARG 49 N -6.16 0.56 0.72 2.37 0.52 -0.81 -5.14 118.95 111.00 1w2q s ARG 49 Ca -0.14 -0.63 -0.11 0.00 -0.52 0.00 0.00 55.73 54.33 1w2q s ARG 49 Cb 0.07 -0.42 0.03 0.00 0.52 0.00 0.00 34.95 35.14 1w2q s ARG 49 CO 0.66 0.09 1.07 -1.54 0.02 0.00 0.00 175.30 175.61 1w2q s SER 50 N -1.19 5.05 0.22 0.23 1.04 -1.25 -4.49 113.70 113.32 1w2q s SER 50 Ca -0.05 1.71 0.09 0.00 0.48 0.00 0.00 55.95 58.18 1w2q s SER 50 Cb -0.08 -2.51 -0.05 0.00 0.10 0.00 0.00 66.02 63.49 1w2q s SER 50 CO 0.00 -1.67 -0.17 0.42 0.98 0.00 0.00 173.24 172.80 1w2q s THR 51 N -2.96 2.03 0.43 2.02 -4.23 -1.26 -5.09 115.64 106.59 1w2q s THR 51 Ca 0.60 -2.23 -0.25 0.00 -1.18 0.00 0.00 61.69 58.62 1w2q s THR 51 Cb -0.15 -2.11 -0.08 0.00 1.34 0.00 0.00 72.50 71.50 1w2q s THR 51 CO 0.55 -0.47 1.35 -0.13 -0.54 0.00 0.00 174.62 175.38 1w2q s ARG 52 N -3.43 3.80 0.58 3.99 0.52 -1.26 -4.94 118.95 118.21 1w2q s ARG 52 Ca 0.24 2.25 -0.20 0.00 -0.52 0.00 0.00 55.73 57.49 1w2q s ARG 52 Cb -0.03 -2.67 -0.04 0.00 0.52 0.00 0.00 34.95 32.73 1w2q s ARG 52 CO 0.10 -0.67 1.30 -1.12 0.02 0.00 0.00 175.30 174.93 1w2q s SER 53 N -0.69 5.11 0.55 0.23 0.01 -1.26 -4.86 113.70 112.79 1w2q s SER 53 Ca 0.60 2.64 0.32 0.00 1.31 0.00 0.00 55.95 60.81 1w2q s SER 53 Cb -0.40 -2.62 1.59 0.00 0.21 0.00 0.00 66.02 64.80 1w2q s SER 53 CO 0.51 -1.67 2.10 0.28 0.41 0.00 0.00 173.24 174.87 1w2q h SER 54 N 1.13 0.00 0.14 2.44 0.02 -2.03 -1.90 113.55 113.35 1w2q h SER 54 Ca -0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 1w2q h SER 54 Cb 1.31 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.85 1w2q h SER 54 CO 0.56 0.08 -0.07 0.44 -1.14 0.00 0.00 176.83 176.70 1w2q h ASP 55 N 0.00 0.00 -0.75 3.07 3.32 -2.02 -2.05 116.42 117.98 1w2q h ASP 55 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1w2q h ASP 55 Cb 0.33 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 1w2q h ASP 55 CO 0.01 0.07 0.39 -0.61 -1.72 0.00 0.00 179.24 177.38 1w2q h GLN 56 N 0.00 1.06 -0.97 3.56 4.15 -1.70 -2.16 115.11 119.05 1w2q h GLN 56 Ca -0.00 -0.14 0.13 0.00 0.77 0.00 0.00 58.65 59.41 1w2q h GLN 56 Cb 0.15 -0.20 -0.08 0.00 0.21 0.00 0.00 27.48 27.56 1w2q h GLN 56 CO 0.01 0.80 0.62 1.96 -1.93 0.00 0.00 178.83 180.29 1w2q h GLN 57 N 1.05 0.87 -0.13 1.69 1.08 -1.53 0.34 115.11 118.47 1w2q h GLN 57 Ca 0.26 -0.05 0.04 0.00 -1.45 0.00 0.00 58.65 57.45 1w2q h GLN 57 Cb 0.07 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 1w2q h GLN 57 CO -0.04 0.58 0.45 1.96 -0.95 0.00 0.00 178.83 180.82 1w2q h GLN 58 N 0.90 0.00 -0.98 1.46 4.20 -1.46 0.16 115.11 119.39 1w2q h GLN 58 Ca 0.49 0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.23 1w2q h GLN 58 Cb 0.58 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.31 1w2q h GLN 58 CO -0.26 0.00 0.64 0.00 -0.67 0.00 0.00 178.83 178.55 1w2q h ARG 59 N 0.00 1.24 0.00 1.46 3.08 -0.42 -2.30 114.38 117.44 1w2q h ARG 59 Ca 0.06 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1w2q h ARG 59 Cb 0.95 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1w2q h ARG 59 CO -0.00 0.82 0.00 0.00 -1.07 0.00 0.00 179.97 179.72 1w2q h ASP 62 N 0.15 0.67 0.06 0.00 3.32 -0.36 0.99 116.42 121.25 1w2q h ASP 62 Ca 0.72 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.79 1w2q h ASP 62 Cb 1.68 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 41.13 1w2q h ASP 62 CO -0.72 0.36 -0.03 -0.33 -1.72 0.00 0.00 179.24 176.81 1w2q h GLU 63 N 0.72 -0.08 0.00 3.56 4.39 0.95 -2.55 114.58 121.57 1w2q h GLU 63 Ca 0.42 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.12 1w2q h GLU 63 Cb 0.61 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1w2q h GLU 63 CO -0.18 0.38 0.00 1.28 -1.16 0.00 0.00 179.01 179.33 1w2q n LEU 64 N -4.90 0.44 0.14 1.33 4.77 -0.70 -0.89 117.00 117.20 1w2q n LEU 64 Ca -0.08 0.69 0.01 0.00 -0.03 0.00 0.00 56.01 56.59 1w2q n LEU 64 Cb 0.25 -0.73 0.18 0.00 -2.33 0.00 0.00 43.42 40.79 1w2q n LEU 64 CO 0.32 -0.80 0.51 0.78 -1.33 0.00 0.00 177.39 176.87 1w2q h ASN 65 N 0.00 0.00 0.15 -1.43 -0.26 -0.40 -3.26 115.58 110.38 1w2q h ASN 65 Ca 0.00 0.00 -0.36 0.00 -0.56 0.00 0.00 56.30 55.38 1w2q h ASN 65 Cb 0.05 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.29 1w2q h ASN 65 CO 0.00 0.57 -1.95 -0.08 -1.06 0.00 0.00 177.43 174.91 1w2q h GLU 66 N 0.00 0.28 -2.57 0.81 4.81 -1.03 -3.37 114.58 113.51 1w2q h GLU 66 Ca -0.01 -0.47 -0.45 0.00 -0.13 0.00 0.00 59.36 58.31 1w2q h GLU 66 Cb 1.14 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 1w2q h GLU 66 CO 0.07 1.21 1.95 -1.33 -0.73 0.00 0.00 179.01 180.18 1w2q n MET 67 N -3.48 2.90 -0.12 1.92 2.81 -1.02 -4.63 117.12 115.50 1w2q n MET 67 Ca -0.30 -1.64 0.26 0.00 -1.81 0.00 0.00 57.70 54.21 1w2q n MET 67 Cb 1.05 -2.43 0.57 0.00 -0.71 0.00 0.00 33.22 31.70 1w2q n MET 67 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1w2q h GLU 68 N 4.15 0.00 0.00 0.03 4.81 -1.74 0.88 114.58 122.71 1w2q h GLU 68 Ca 0.56 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.79 1w2q h GLU 68 Cb 0.82 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1w2q h GLU 68 CO 1.09 0.00 0.15 -0.91 -0.73 0.00 0.00 179.01 178.61 1w2q h ASN 69 N 0.00 0.00 -3.93 1.04 2.35 -1.91 -3.42 115.58 109.71 1w2q h ASN 69 Ca 0.40 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.59 1w2q h ASN 69 Cb 2.28 0.00 0.15 0.00 0.05 0.00 0.00 38.32 40.80 1w2q h ASN 69 CO -0.00 0.00 0.52 0.35 -1.65 0.00 0.00 177.43 176.64 1w2q n THR 70 N -2.43 3.90 -0.21 2.81 -2.24 0.31 -4.97 114.28 111.45 1w2q n THR 70 Ca -0.02 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 1w2q n THR 70 Cb 0.19 -1.56 0.00 0.00 -2.10 0.00 0.00 70.33 66.86 1w2q n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1w2q n GLN 71 N -1.07 0.00 -0.35 -0.78 6.02 -1.26 -4.97 117.38 114.97 1w2q n GLN 71 Ca 0.11 0.00 0.27 0.00 -0.01 0.00 0.00 57.00 57.37 1w2q n GLN 71 Cb 0.45 0.00 0.52 0.00 1.02 0.00 0.00 30.24 32.23 1w2q n GLN 71 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1w2q h GLY 72 N 0.00 1.92 -1.00 1.08 0.00 -1.92 0.73 103.07 103.87 1w2q h GLY 72 Ca 0.00 -0.20 0.42 0.00 0.00 0.00 0.00 47.33 47.55 1w2q h GLY 72 CO 0.00 -0.50 0.93 0.00 0.00 0.00 0.00 176.54 176.97 1w2q h MET 74 N 0.10 -0.08 -0.67 0.00 2.86 0.10 0.43 114.93 117.67 1w2q h MET 74 Ca 0.77 0.01 0.14 0.00 -2.06 0.00 0.00 59.70 58.56 1w2q h MET 74 Cb 2.58 0.02 -0.12 0.00 0.06 0.00 0.00 31.60 34.14 1w2q h MET 74 CO -0.26 -0.05 -0.08 0.00 1.06 0.00 0.00 176.91 177.57 1w2q h GLU 76 N 0.05 0.00 0.01 0.00 4.81 -0.31 -1.66 114.58 117.48 1w2q h GLU 76 Ca 0.34 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.57 1w2q h GLU 76 Cb 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1w2q h GLU 76 CO -0.64 0.00 -0.01 0.00 -0.73 0.00 0.00 179.01 177.64 1w2q h ALA 77 N 2.09 -0.02 -0.61 2.92 0.00 0.46 -2.30 119.26 121.80 1w2q h ALA 77 Ca 0.00 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1w2q h ALA 77 Cb 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1w2q h ALA 77 CO 0.00 -0.06 0.07 -0.07 0.00 0.00 0.00 179.25 179.19 1w2q h LEU 78 N -0.92 0.97 -1.05 0.00 3.38 -0.99 -2.32 115.31 114.38 1w2q h LEU 78 Ca -0.00 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 1w2q h LEU 78 Cb 0.81 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1w2q h LEU 78 CO 0.00 0.99 0.26 1.56 0.09 0.00 0.00 178.44 181.34 1w2q h GLN 79 N 0.94 0.94 -0.36 1.13 4.20 -1.41 -2.34 115.11 118.21 1w2q h GLN 79 Ca 0.18 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.76 1w2q h GLN 79 Cb 0.45 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1w2q h GLN 79 CO 0.02 0.76 0.23 1.96 -0.67 0.00 0.00 178.83 181.12 1w2q h GLN 80 N 0.92 0.45 -0.16 1.46 1.08 -0.87 -2.50 115.11 115.49 1w2q h GLN 80 Ca 0.22 -0.03 0.05 0.00 -1.45 0.00 0.00 58.65 57.44 1w2q h GLN 80 Cb 0.17 -0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 27.44 1w2q h GLN 80 CO -0.02 0.30 -0.25 0.82 -0.95 0.00 0.00 178.83 178.73 1w2q h ILE 81 N 0.46 0.40 -0.76 2.54 2.04 -1.08 0.80 117.51 121.90 1w2q h ILE 81 Ca 0.14 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.15 1w2q h ILE 81 Cb -0.03 0.40 -0.14 0.00 -0.74 0.00 0.00 36.82 36.31 1w2q h ILE 81 CO -0.05 0.00 -0.22 0.24 0.00 0.00 0.00 178.15 178.13 1w2q h MET 82 N -0.30 -0.02 -0.37 2.37 2.86 -1.18 0.29 114.93 118.58 1w2q h MET 82 Ca 0.11 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.63 1w2q h MET 82 Cb 0.47 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 1w2q h MET 82 CO -0.33 -0.01 -0.24 0.93 1.06 0.00 0.00 176.91 178.31 1w2q h GLU 83 N -0.02 0.83 -0.96 1.72 5.08 -0.84 0.88 114.58 121.26 1w2q h GLU 83 Ca 0.36 -0.39 0.28 0.00 -1.00 0.00 0.00 59.36 58.61 1w2q h GLU 83 Cb 0.57 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 1w2q h GLU 83 CO -0.79 1.02 0.94 -0.91 -1.00 0.00 0.00 179.01 178.27 1w2q h ASN 84 N 0.63 0.00 0.00 1.42 -0.26 0.43 0.13 115.58 117.92 1w2q h ASN 84 Ca 0.08 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.72 1w2q h ASN 84 Cb 0.81 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.05 1w2q h ASN 84 CO 0.07 0.00 -1.46 0.00 -1.06 0.00 0.00 177.43 174.98 1w2q n GLN 85 N -3.60 2.08 0.00 0.81 1.13 -0.80 -4.78 117.38 112.21 1w2q n GLN 85 Ca 0.21 -0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.24 1w2q n GLN 85 Cb 1.25 -1.19 0.00 0.00 0.11 0.00 0.00 30.24 30.42 1w2q n GLN 85 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1w2q h ASP 87 N 0.00 1.06 -2.35 0.00 3.58 -1.50 -3.14 116.42 114.06 1w2q h ASP 87 Ca 0.00 -0.13 -0.69 0.00 0.42 0.00 0.00 57.03 56.62 1w2q h ASP 87 Cb 0.00 -0.27 -0.35 0.00 1.72 0.00 0.00 39.33 40.42 1w2q h ASP 87 CO 0.00 0.90 0.10 0.54 -2.88 0.00 0.00 179.24 177.90 1w2q n ARG 88 N -4.30 3.99 -0.02 0.28 1.74 0.22 -4.81 116.66 113.76 1w2q n ARG 88 Ca 0.08 -4.73 0.22 0.00 -0.77 0.00 0.00 57.85 52.65 1w2q n ARG 88 Cb 0.15 -2.35 0.56 0.00 -1.02 0.00 0.00 32.46 29.80 1w2q n ARG 88 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1w2q h LEU 89 N 3.94 0.00 -2.47 0.55 4.07 -1.81 -3.46 115.31 116.12 1w2q h LEU 89 Ca 0.28 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.24 1w2q h LEU 89 Cb 0.49 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 1w2q h LEU 89 CO 1.01 0.00 -0.25 0.00 -1.08 0.00 0.00 178.44 178.13 1w2q n GLN 90 N -3.34 -0.88 -1.50 1.13 6.02 -1.26 -4.65 117.38 112.90 1w2q n GLN 90 Ca 0.14 1.06 -0.34 0.00 -0.01 0.00 0.00 57.00 57.85 1w2q n GLN 90 Cb 1.06 -1.55 -0.18 0.00 1.02 0.00 0.00 30.24 30.60 1w2q n GLN 90 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1w2q n ASP 91 N 0.32 -0.28 0.00 1.08 2.03 -1.26 -4.50 116.55 113.93 1w2q n ASP 91 Ca -0.05 -0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.14 1w2q n ASP 91 Cb 0.07 -0.80 0.00 0.00 -0.72 0.00 0.00 41.12 39.67 1w2q n ASP 91 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1w2q n ARG 92 N 7.44 0.00 0.00 -0.67 0.63 -1.26 -5.08 116.66 117.72 1w2q n ARG 92 Ca 0.66 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.59 1w2q n ARG 92 Cb 0.09 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.00 1w2q n ARG 92 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1w2q n GLN 93 N -2.22 0.00 -0.02 -0.14 6.02 -1.26 -4.95 117.38 114.80 1w2q n GLN 93 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.83 1w2q n GLN 93 Cb 0.00 -0.01 -0.11 0.00 1.02 0.00 0.00 30.24 31.14 1w2q n GLN 93 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 1w2q h MET 94 N 0.00 0.23 -0.55 -1.09 1.85 -1.94 -3.13 114.93 110.30 1w2q h MET 94 Ca 0.00 -0.25 0.16 0.00 -0.61 0.00 0.00 59.70 59.00 1w2q h MET 94 Cb 0.00 0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.08 1w2q h MET 94 CO 0.00 0.97 0.71 -0.24 -0.40 0.00 0.00 176.91 177.95 1w2q h VAL 95 N -0.42 0.19 0.00 -5.77 3.04 -1.87 -0.71 116.25 110.72 1w2q h VAL 95 Ca -0.04 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1w2q h VAL 95 Cb 1.09 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.78 1w2q h VAL 95 CO 0.07 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.63 1w2q n GLN 96 N -3.41 0.00 -0.30 4.17 6.02 -1.18 -2.23 117.38 120.45 1w2q n GLN 96 Ca 0.11 0.00 0.29 0.00 -0.01 0.00 0.00 57.00 57.39 1w2q n GLN 96 Cb 0.91 -0.51 0.53 0.00 1.02 0.00 0.00 30.24 32.20 1w2q n GLN 96 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1w2q n GLN 97 N -0.36 -0.06 0.03 -1.09 6.02 -1.14 0.13 117.38 120.92 1w2q n GLN 97 Ca 0.00 1.31 -0.10 0.00 -0.01 0.00 0.00 57.00 58.19 1w2q n GLN 97 Cb 0.00 -2.32 -0.04 0.00 1.02 0.00 0.00 30.24 28.90 1w2q n GLN 97 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1w2q h PHE 98 N 0.00 -0.51 0.00 1.08 3.57 -1.23 0.53 116.94 120.38 1w2q h PHE 98 Ca 0.78 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 62.27 1w2q h PHE 98 Cb 2.04 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 41.01 1w2q h PHE 98 CO -0.05 -0.27 -0.15 -0.22 -2.23 0.00 0.00 178.31 175.40 1w2q h LYS 99 N -0.28 0.00 0.07 1.11 3.64 0.16 0.69 116.57 121.96 1w2q h LYS 99 Ca 0.08 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1w2q h LYS 99 Cb 0.39 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1w2q h LYS 99 CO -0.22 0.15 -0.03 -0.09 -2.27 0.00 0.00 179.45 176.98 1w2q h ARG 100 N 0.00 -0.09 -0.39 1.90 2.43 0.72 0.15 114.38 119.11 1w2q h ARG 100 Ca -0.00 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 1w2q h ARG 100 Cb 0.29 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1w2q h ARG 100 CO 0.02 0.41 -0.13 1.49 -1.51 0.00 0.00 179.97 180.25 1w2q h GLU 101 N -0.64 0.77 -0.82 0.20 4.81 0.25 -2.76 114.58 116.40 1w2q h GLU 101 Ca -0.01 -0.31 0.05 0.00 -0.13 0.00 0.00 59.36 58.96 1w2q h GLU 101 Cb 0.54 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.83 1w2q h GLU 101 CO 0.02 0.93 0.50 -0.07 -0.73 0.00 0.00 179.01 179.66 1w2q h LEU 102 N 0.58 0.80 -2.01 1.64 3.38 0.38 0.86 115.31 120.94 1w2q h LEU 102 Ca 0.09 0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.24 1w2q h LEU 102 Cb 0.66 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1w2q h LEU 102 CO 0.05 0.52 0.42 0.24 0.09 0.00 0.00 178.44 179.76 1w2q h MET 103 N 0.94 0.00 0.00 1.13 2.86 -0.39 0.29 114.93 119.76 1w2q h MET 103 Ca 0.35 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.79 1w2q h MET 103 Cb 0.13 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 1w2q h MET 103 CO -0.16 0.00 -0.99 0.66 1.06 0.00 0.00 176.91 177.48 1w2q h SER 104 N 0.00 0.00 -0.78 1.22 4.64 -0.79 -3.32 113.55 114.52 1w2q h SER 104 Ca 0.27 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 61.77 1w2q h SER 104 Cb 1.11 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.06 1w2q h SER 104 CO -0.00 0.88 -0.01 -0.07 -0.87 0.00 0.00 176.83 176.76 1w2q h LEU 105 N 0.00 -0.39 0.00 5.97 3.38 0.21 1.44 115.31 125.92 1w2q h LEU 105 Ca -0.05 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1w2q h LEU 105 Cb 1.71 0.37 0.00 0.00 0.09 0.00 0.00 40.66 42.83 1w2q h LEU 105 CO 0.11 -0.20 0.00 -0.81 0.09 0.00 0.00 178.44 177.63 1w2q n PRO 106 N -5.37 0.05 -0.05 1.13 -0.04 -1.23 -2.58 135.00 126.92 1w2q n PRO 106 Ca 0.14 0.27 -0.22 0.00 -0.04 0.00 0.00 63.50 63.66 1w2q n PRO 106 Cb 0.49 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.32 1w2q n PRO 106 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1w2q h GLN 107 N 0.00 0.14 -1.58 0.54 4.20 0.18 -3.06 115.11 115.53 1w2q h GLN 107 Ca 0.00 -0.24 0.46 0.00 0.06 0.00 0.00 58.65 58.93 1w2q h GLN 107 Cb 0.16 0.09 -0.07 0.00 0.30 0.00 0.00 27.48 27.96 1w2q h GLN 107 CO 0.00 1.11 1.13 0.94 -0.67 0.00 0.00 178.83 181.34 1w2q n GLN 108 N -3.99 -0.00 -0.01 1.46 7.27 -0.82 0.28 117.38 121.58 1w2q n GLN 108 Ca -0.31 0.88 0.08 0.00 0.07 0.00 0.00 57.00 57.72 1w2q n GLN 108 Cb 0.86 -2.02 -0.12 0.00 2.41 0.00 0.00 30.24 31.37 1w2q n GLN 108 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1w2q n ASN 110 N -2.04 -5.52 -2.97 0.00 5.03 0.80 -4.85 115.26 105.71 1w2q n ASN 110 Ca -0.03 -0.42 -0.32 0.00 0.87 0.00 0.00 54.58 54.68 1w2q n ASN 110 Cb 0.41 -4.14 -0.07 0.00 -1.02 0.00 0.00 39.78 34.96 1w2q n ASN 110 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1w2q n PHE 111 N -4.51 1.79 0.32 3.10 3.72 -1.23 -4.55 117.46 116.11 1w2q n PHE 111 Ca 0.00 -2.68 0.04 0.00 -0.05 0.00 0.00 57.45 54.76 1w2q n PHE 111 Cb 0.55 -2.26 0.18 0.00 -0.94 0.00 0.00 39.48 37.02 1w2q n PHE 111 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1w2q n ARG 112 N 3.28 0.05 0.00 -1.08 1.74 -1.26 -3.70 116.66 115.69 1w2q n ARG 112 Ca 0.69 0.29 0.00 0.00 -0.77 0.00 0.00 57.85 58.07 1w2q n ARG 112 Cb 0.41 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 1w2q n ARG 112 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1w2q n ALA 113 N -1.40 -0.07 -2.05 7.54 0.00 -1.26 -3.86 120.51 119.41 1w2q n ALA 113 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.07 1w2q n ALA 113 Cb 0.08 0.42 -0.03 0.00 0.00 0.00 0.00 19.45 19.92 1w2q n ALA 113 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1w2q s PRO 114 N -2.92 2.81 0.21 0.00 0.04 -1.24 -4.85 135.00 129.04 1w2q s PRO 114 Ca 0.00 0.78 -0.01 0.00 0.04 0.00 0.00 61.00 61.81 1w2q s PRO 114 Cb 0.00 -4.33 0.16 0.00 0.04 0.00 0.00 34.50 30.37 1w2q s PRO 114 CO 0.00 -2.51 1.53 1.96 0.04 0.00 0.00 177.00 178.02 1w2q h GLN 115 N 14.37 0.47 -5.26 4.56 4.20 -1.90 -3.45 115.11 128.10 1w2q h GLN 115 Ca -0.27 -0.30 -0.38 0.00 0.06 0.00 0.00 58.65 57.76 1w2q h GLN 115 Cb 1.16 0.03 -0.17 0.00 0.30 0.00 0.00 27.48 28.80 1w2q h GLN 115 CO 1.18 0.90 -0.74 1.03 -0.67 0.00 0.00 178.83 180.52 1w2q s ARG 116 N -3.96 1.00 0.12 1.46 0.52 -1.26 -5.16 118.95 111.67 1w2q s ARG 116 Ca -0.06 -1.28 -0.03 0.00 -0.52 0.00 0.00 55.73 53.84 1w2q s ARG 116 Cb 0.12 -0.78 -0.03 0.00 0.52 0.00 0.00 34.95 34.77 1w2q s ARG 116 CO 0.83 0.14 0.09 0.00 0.02 0.00 0.00 175.30 176.37 1w2q s ASP 118 N -3.00 0.34 -0.05 0.00 2.15 -1.26 -5.06 116.67 109.79 1w2q s ASP 118 Ca 0.19 -0.68 0.03 0.00 0.43 0.00 0.00 52.55 52.52 1w2q s ASP 118 Cb 0.07 0.14 -0.03 0.00 -0.30 0.00 0.00 42.92 42.80 1w2q s ASP 118 CO -0.01 -0.41 -0.13 -0.76 -0.17 0.00 0.00 175.17 173.69 1w2q s LEU 119 N -1.99 2.81 0.25 -1.34 1.43 -1.26 -4.79 118.68 113.79 1w2q s LEU 119 Ca -0.08 -0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 52.81 1w2q s LEU 119 Cb -0.03 -1.58 0.37 0.00 0.03 0.00 0.00 46.19 44.97 1w2q s LEU 119 CO -0.04 0.35 1.84 -0.78 0.23 0.00 0.00 176.35 177.95 1w2q h ASP 120 N 5.30 0.82 0.00 2.29 3.58 -2.01 -3.43 116.42 122.96 1w2q h ASP 120 Ca -0.47 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.01 1w2q h ASP 120 Cb 1.16 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 42.06 1w2q h ASP 120 CO 0.51 0.51 0.00 0.55 -2.88 0.00 0.00 179.24 177.92 1w2q n VAL 121 N -4.64 0.00 -1.35 2.25 3.14 -1.26 -5.15 118.33 111.31 1w2q n VAL 121 Ca 0.13 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.18 1w2q n VAL 121 Cb 0.21 0.00 0.09 0.00 -1.06 0.00 0.00 33.84 33.09 1w2q n VAL 121 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1w2q s SER 122 N 0.00 4.24 0.18 6.55 0.01 -1.26 -5.02 113.70 118.40 1w2q s SER 122 Ca 0.00 2.15 -0.10 0.00 1.31 0.00 0.00 55.95 59.31 1w2q s SER 122 Cb 0.00 -2.56 0.04 0.00 0.21 0.00 0.00 66.02 63.70 1w2q s SER 122 CO 0.00 -2.22 0.49 0.61 0.41 0.00 0.00 173.24 172.53 1w2q n GLY 123 N -0.13 1.24 0.16 3.44 0.00 -1.26 -5.14 105.19 103.50 1w2q n GLY 123 Ca 0.12 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1w2q n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w2q n GLY 124 N -0.34 -3.44 0.14 -0.02 0.00 -1.26 -4.80 105.19 95.47 1w2q n GLY 124 Ca -0.04 -0.91 -0.05 0.00 0.00 0.00 0.00 46.02 45.02 1w2q n GLY 124 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1w2q h ARG 125 N 0.08 -0.34 0.00 1.61 3.08 -1.97 -3.39 114.38 113.45 1w2q h ARG 125 Ca 0.00 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 1w2q h ARG 125 Cb 0.00 0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 1w2q h ARG 125 CO 0.00 -0.23 -0.45 0.00 -1.07 0.00 0.00 179.97 178.22