#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 3.86 -1.28 1.61 0.04 -1.26 -4.95 135.00 133.02 1w2q s PRO 2 Ca 0.00 1.78 -0.11 0.00 0.04 0.00 0.00 61.00 62.71 1w2q s PRO 2 Cb 0.00 -2.48 0.16 0.00 0.04 0.00 0.00 34.50 32.21 1w2q s PRO 2 CO 0.00 -0.47 1.80 -1.33 0.04 0.00 0.00 177.00 177.04 1w2q n MET 3 N -0.32 3.50 -0.12 4.56 2.81 -1.26 -4.76 117.12 121.53 1w2q n MET 3 Ca 0.06 -3.52 0.10 0.00 -1.81 0.00 0.00 57.70 52.53 1w2q n MET 3 Cb 0.48 -3.00 0.44 0.00 -0.71 0.00 0.00 33.22 30.43 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 6.12 0.52 -6.57 0.03 2.43 -2.06 -3.41 114.38 111.45 1w2q h ARG 4 Ca 0.39 -0.03 -0.69 0.00 -0.81 0.00 0.00 59.98 58.85 1w2q h ARG 4 Cb 0.69 -0.12 -0.22 0.00 -0.42 0.00 0.00 29.97 29.90 1w2q h ARG 4 CO 1.56 0.35 -0.81 0.50 -1.51 0.00 0.00 179.97 180.06 1w2q s ARG 5 N -5.50 2.09 0.31 0.20 3.52 -1.26 -5.08 118.95 113.22 1w2q s ARG 5 Ca -0.08 -0.97 -0.29 0.00 -0.13 0.00 0.00 55.73 54.26 1w2q s ARG 5 Cb 0.20 -2.19 -0.13 0.00 -1.56 0.00 0.00 34.95 31.27 1w2q s ARG 5 CO 0.76 0.54 1.31 0.39 -0.81 0.00 0.00 175.30 177.50 1w2q n GLU 6 N 1.61 2.09 -4.20 5.12 1.02 -1.26 -4.99 120.64 120.03 1w2q n GLU 6 Ca -0.16 0.74 -0.20 0.00 -0.02 0.00 0.00 57.16 57.52 1w2q n GLU 6 Cb 0.52 -2.33 -0.12 0.00 -0.02 0.00 0.00 31.44 29.49 1w2q n GLU 6 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1w2q s ARG 7 N -1.48 0.90 0.00 3.49 0.52 -1.26 -5.01 118.95 116.11 1w2q s ARG 7 Ca 0.59 -1.01 0.06 0.00 -0.52 0.00 0.00 55.73 54.85 1w2q s ARG 7 Cb -0.59 -0.97 0.22 0.00 0.52 0.00 0.00 34.95 34.14 1w2q s ARG 7 CO 0.59 0.22 1.17 0.41 0.02 0.00 0.00 175.30 177.70 1w2q n GLY 8 N 1.21 -0.31 0.33 -3.53 0.00 -1.26 -3.94 105.19 97.69 1w2q n GLY 8 Ca -0.21 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.67 1w2q n GLY 8 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1w2q h ARG 9 N 0.88 0.74 -0.55 1.61 3.08 -2.00 -1.10 114.38 117.04 1w2q h ARG 9 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1w2q h ARG 9 Cb 0.20 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1w2q h ARG 9 CO 0.00 0.49 0.35 1.96 -1.07 0.00 0.00 179.97 181.70 1w2q h GLN 10 N 0.76 0.74 -1.73 0.04 4.20 -2.03 -3.45 115.11 113.63 1w2q h GLN 10 Ca 0.23 -0.05 -0.25 0.00 0.06 0.00 0.00 58.65 58.64 1w2q h GLN 10 Cb -0.02 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 1w2q h GLN 10 CO -0.06 0.50 -0.31 0.41 -0.67 0.00 0.00 178.83 178.70 1w2q n GLY 11 N -1.41 -0.11 3.74 3.46 0.00 -0.42 -4.96 105.19 105.49 1w2q n GLY 11 Ca 0.05 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.45 7.04 0.04 1.61 1.01 -1.26 -5.02 116.67 117.63 1w2q s ASP 12 Ca 0.00 2.26 -0.07 0.00 0.71 0.00 0.00 52.55 55.44 1w2q s ASP 12 Cb 0.00 -2.61 -0.00 0.00 1.01 0.00 0.00 42.92 41.32 1w2q s ASP 12 CO 0.00 -0.41 0.14 -0.94 0.21 0.00 0.00 175.17 174.17 1w2q s SER 13 N 0.23 0.10 -0.02 0.27 1.04 -1.26 -5.16 113.70 108.91 1w2q s SER 13 Ca 0.54 -0.44 0.05 0.00 0.48 0.00 0.00 55.95 56.58 1w2q s SER 13 Cb -0.33 0.25 -0.01 0.00 0.10 0.00 0.00 66.02 66.03 1w2q s SER 13 CO 0.36 -0.52 -0.16 -0.44 0.98 0.00 0.00 173.24 173.47 1w2q s SER 14 N -2.04 1.86 0.54 7.02 0.01 -1.26 -5.00 113.70 114.81 1w2q s SER 14 Ca -0.06 -0.29 0.25 0.00 1.31 0.00 0.00 55.95 57.16 1w2q s SER 14 Cb -0.02 -0.24 1.40 0.00 0.21 0.00 0.00 66.02 67.37 1w2q s SER 14 CO -0.04 0.19 2.01 0.77 0.41 0.00 0.00 173.24 176.58 1w2q h SER 15 N 5.81 0.00 -0.94 2.44 4.64 -2.02 0.12 113.55 123.60 1w2q h SER 15 Ca -0.35 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.08 1w2q h SER 15 Cb 1.16 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.17 1w2q h SER 15 CO 0.49 0.00 0.60 0.00 -0.87 0.00 0.00 176.83 177.04 1w2q h GLU 17 N 0.89 0.56 -0.39 0.00 5.08 -1.38 0.45 114.58 119.79 1w2q h GLU 17 Ca 0.46 -0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.89 1w2q h GLU 17 Cb 0.51 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 1w2q h GLU 17 CO -0.22 0.37 0.35 -0.09 -1.00 0.00 0.00 179.01 178.42 1w2q h ARG 18 N 0.57 0.00 0.00 2.33 2.43 -1.01 0.51 114.38 119.21 1w2q h ARG 18 Ca 0.48 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.60 1w2q h ARG 18 Cb 0.97 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 1w2q h ARG 18 CO -0.23 0.00 -0.28 1.96 -1.51 0.00 0.00 179.97 179.92 1w2q h GLN 19 N 0.00 0.00 -0.67 0.20 4.20 -0.18 -2.98 115.11 115.68 1w2q h GLN 19 Ca 0.18 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.83 1w2q h GLN 19 Cb 0.88 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 1w2q h GLN 19 CO -0.00 0.28 0.18 0.28 -0.67 0.00 0.00 178.83 178.90 1w2q h VAL 20 N 0.00 1.26 0.00 -0.54 2.07 -0.02 -1.62 116.25 117.39 1w2q h VAL 20 Ca -0.00 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.60 1w2q h VAL 20 Cb 0.75 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1w2q h VAL 20 CO 0.04 0.35 0.18 -2.24 0.02 0.00 0.00 177.57 175.92 1w2q h ASP 21 N 0.99 0.00 -0.53 0.57 3.04 -1.56 0.65 116.42 119.58 1w2q h ASP 21 Ca 0.21 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.00 1w2q h ASP 21 Cb 0.33 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.62 1w2q h ASP 21 CO -0.00 0.00 0.00 0.54 -2.04 0.00 0.00 179.24 177.74 1w2q n ARG 22 N -2.29 3.44 0.00 4.15 1.74 -0.61 -4.70 116.66 118.38 1w2q n ARG 22 Ca -0.01 -2.73 0.00 0.00 -0.77 0.00 0.00 57.85 54.34 1w2q n ARG 22 Cb 0.21 -1.77 0.00 0.00 -1.02 0.00 0.00 32.46 29.89 1w2q n ARG 22 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1w2q n VAL 23 N 0.74 0.00 -3.22 1.55 0.31 0.23 -4.97 118.33 112.96 1w2q n VAL 23 Ca 0.22 0.31 -0.25 0.00 -0.01 0.00 0.00 64.34 64.61 1w2q n VAL 23 Cb 0.80 -0.64 0.03 0.00 -0.91 0.00 0.00 33.84 33.12 1w2q n VAL 23 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1w2q n ASN 24 N -0.44 -6.59 -3.05 4.52 5.03 -1.26 -4.92 115.26 108.55 1w2q n ASN 24 Ca 0.00 0.14 -0.27 0.00 0.87 0.00 0.00 54.58 55.32 1w2q n ASN 24 Cb 0.00 -3.32 -0.05 0.00 -1.02 0.00 0.00 39.78 35.39 1w2q n ASN 24 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1w2q n LEU 25 N -0.26 4.32 -0.10 3.41 4.77 -1.26 -4.85 117.00 123.03 1w2q n LEU 25 Ca 0.00 -5.63 -0.08 0.00 -0.03 0.00 0.00 56.01 50.27 1w2q n LEU 25 Cb 0.59 -0.57 0.09 0.00 -2.33 0.00 0.00 43.42 41.19 1w2q n LEU 25 CO 0.52 2.29 0.71 0.50 -1.33 0.00 0.00 177.39 180.09 1w2q h LYS 26 N 3.24 0.80 -0.05 3.23 3.64 -2.00 -2.79 116.57 122.63 1w2q h LYS 26 Ca 0.14 -0.32 -0.08 0.00 -1.27 0.00 0.00 60.65 59.13 1w2q h LYS 26 Cb 0.54 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1w2q h LYS 26 CO 0.82 0.93 -0.32 -1.00 -2.27 0.00 0.00 179.45 177.62 1w2q h PRO 27 N 0.70 0.09 0.20 1.90 0.13 -1.99 -2.04 132.00 130.99 1w2q h PRO 27 Ca 0.10 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.19 1w2q h PRO 27 Cb 0.72 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1w2q h PRO 27 CO 0.06 0.40 -0.10 0.00 -0.23 0.00 0.00 178.00 178.13 1w2q h GLU 29 N -0.81 0.40 0.00 0.00 4.57 -1.45 0.49 114.58 117.77 1w2q h GLU 29 Ca -0.03 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.07 1w2q h GLU 29 Cb 0.52 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 1w2q h GLU 29 CO 0.04 0.26 -0.27 1.96 -1.18 0.00 0.00 179.01 179.82 1w2q h GLN 30 N 0.41 0.00 0.00 1.92 4.20 -1.24 0.13 115.11 120.53 1w2q h GLN 30 Ca 0.39 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 59.06 1w2q h GLN 30 Cb 0.92 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.69 1w2q h GLN 30 CO -0.13 0.27 -0.21 1.25 -0.67 0.00 0.00 178.83 179.35 1w2q h HIS 31 N 0.00 0.00 0.09 2.96 2.76 0.62 -2.04 115.15 119.54 1w2q h HIS 31 Ca -0.00 0.00 -0.36 0.00 -2.20 0.00 0.00 60.37 57.80 1w2q h HIS 31 Cb 0.76 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.69 1w2q h HIS 31 CO 0.00 0.21 -2.06 0.44 -1.30 0.00 0.00 177.93 175.22 1w2q n ILE 32 N -3.16 1.71 -0.03 6.26 -5.35 -0.83 -3.11 119.36 114.86 1w2q n ILE 32 Ca 0.03 -0.66 -0.07 0.00 -0.27 0.00 0.00 62.75 61.78 1w2q n ILE 32 Cb 0.60 -1.58 0.11 0.00 -1.74 0.00 0.00 39.64 37.04 1w2q n ILE 32 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 1w2q h MET 33 N 0.05 0.62 -0.13 6.28 2.86 -0.81 -2.73 114.93 121.07 1w2q h MET 33 Ca -0.44 -0.28 -0.06 0.00 -2.06 0.00 0.00 59.70 56.86 1w2q h MET 33 Cb 2.02 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 33.66 1w2q h MET 33 CO 0.06 0.86 -0.15 1.96 1.06 0.00 0.00 176.91 180.70 1w2q h GLN 34 N 0.53 0.34 0.02 1.72 1.08 -1.52 -3.16 115.11 114.11 1w2q h GLN 34 Ca 0.06 -0.19 0.03 0.00 -1.45 0.00 0.00 58.65 57.10 1w2q h GLN 34 Cb 0.81 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.21 1w2q h GLN 34 CO 0.07 0.75 -0.22 0.00 -0.95 0.00 0.00 178.83 178.47 1w2q h ARG 35 N -0.06 -0.35 0.00 1.46 2.47 -1.49 0.18 114.38 116.59 1w2q h ARG 35 Ca 0.02 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1w2q h ARG 35 Cb 0.70 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.10 1w2q h ARG 35 CO 0.04 -0.23 0.34 -0.84 0.56 0.00 0.00 179.97 179.83 1w2q h ILE 36 N -0.37 0.00 -0.50 2.04 3.07 -1.53 -1.08 117.51 119.14 1w2q h ILE 36 Ca 0.05 0.00 0.15 0.00 1.55 0.00 0.00 64.86 66.61 1w2q h ILE 36 Cb 0.43 0.51 -0.02 0.00 -0.27 0.00 0.00 36.82 37.48 1w2q h ILE 36 CO -0.19 0.00 0.73 0.24 -1.05 0.00 0.00 178.15 177.88 1w2q h MET 37 N 0.00 0.00 0.00 0.16 2.86 -0.60 -3.46 114.93 113.89 1w2q h MET 37 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1w2q h MET 37 Cb 0.68 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 1w2q h MET 37 CO 0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 1w2q n GLY 38 N -1.52 0.79 0.00 8.32 0.00 -0.41 -2.00 105.19 110.36 1w2q n GLY 38 Ca 0.10 -0.80 0.04 0.00 0.00 0.00 0.00 46.02 45.37 1w2q n GLY 38 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1w2q n GLU 39 N 0.00 0.00 0.00 1.61 1.02 -1.26 -4.83 120.64 117.18 1w2q n GLU 39 Ca 0.00 0.35 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1w2q n GLU 39 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1w2q n GLU 39 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1w2q n GLN 40 N -1.49 0.00 -4.40 3.49 6.02 -0.85 -4.60 117.38 115.55 1w2q n GLN 40 Ca 0.02 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.81 1w2q n GLN 40 Cb 0.10 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.26 1w2q n GLN 40 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1w2q s GLU 41 N 0.00 1.48 0.13 -1.09 2.02 -1.26 -5.05 118.70 114.93 1w2q s GLU 41 Ca 0.00 -1.70 -0.28 0.00 0.02 0.00 0.00 54.97 53.02 1w2q s GLU 41 Cb 0.00 -1.28 -0.04 0.00 0.10 0.00 0.00 34.13 32.91 1w2q s GLU 41 CO 0.00 0.17 1.60 1.96 0.02 0.00 0.00 175.26 179.00 1w2q h GLN 42 N 2.40 -0.45 -5.57 1.61 4.20 -2.03 -3.39 115.11 111.88 1w2q h GLN 42 Ca -0.39 0.03 -0.65 0.00 0.06 0.00 0.00 58.65 57.70 1w2q h GLN 42 Cb 1.23 0.10 -0.15 0.00 0.30 0.00 0.00 27.48 28.96 1w2q h GLN 42 CO 0.64 -0.30 -0.58 0.71 -0.67 0.00 0.00 178.83 178.62 1w2q s TYR 43 N -5.95 3.24 -0.43 2.96 2.02 -1.26 -5.04 117.35 112.89 1w2q s TYR 43 Ca -0.15 0.13 0.06 0.00 -0.37 0.00 0.00 57.07 56.74 1w2q s TYR 43 Cb 0.10 -1.95 0.22 0.00 -0.40 0.00 0.00 41.96 39.93 1w2q s TYR 43 CO 0.65 0.32 0.58 -3.47 -1.57 0.00 0.00 175.55 172.06 1w2q n ASP 44 N 2.84 -1.18 0.26 2.29 2.03 -1.26 -4.96 116.55 116.58 1w2q n ASP 44 Ca -0.18 -2.78 0.16 0.00 0.52 0.00 0.00 54.79 52.52 1w2q n ASP 44 Cb 0.53 0.26 0.88 0.00 -0.72 0.00 0.00 41.12 42.07 1w2q n ASP 44 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1w2q h SER 45 N 4.55 0.00 -5.08 1.67 0.02 -1.98 -3.43 113.55 109.30 1w2q h SER 45 Ca 0.07 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 1w2q h SER 45 Cb 0.95 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.35 1w2q h SER 45 CO 0.35 0.00 -0.14 -0.72 -1.14 0.00 0.00 176.83 175.17 1w2q s TYR 46 N -4.63 -0.15 -0.08 3.45 1.13 -1.26 -5.12 117.35 110.69 1w2q s TYR 46 Ca -0.05 -0.11 -0.30 0.00 -1.41 0.00 0.00 57.07 55.21 1w2q s TYR 46 Cb 0.15 0.18 -0.04 0.00 -1.10 0.00 0.00 41.96 41.15 1w2q s TYR 46 CO 0.55 -0.63 1.45 -0.51 -2.51 0.00 0.00 175.55 173.90 1w2q s ASP 47 N -2.57 6.81 0.20 -0.18 1.01 -1.26 -4.89 116.67 115.79 1w2q s ASP 47 Ca 0.01 2.01 -0.14 0.00 0.71 0.00 0.00 52.55 55.14 1w2q s ASP 47 Cb 0.01 -2.54 0.21 0.00 1.01 0.00 0.00 42.92 41.61 1w2q s ASP 47 CO -0.09 -0.81 1.65 0.40 0.21 0.00 0.00 175.17 176.53 1w2q h ILE 48 N 5.37 0.48 -3.40 0.77 2.04 -1.99 -3.39 117.51 117.39 1w2q h ILE 48 Ca -0.34 -0.01 -0.53 0.00 1.00 0.00 0.00 64.86 64.97 1w2q h ILE 48 Cb 1.15 0.44 -0.34 0.00 -0.74 0.00 0.00 36.82 37.33 1w2q h ILE 48 CO 0.95 0.01 -0.82 -0.13 0.00 0.00 0.00 178.15 178.15 1w2q s ARG 49 N -6.20 1.84 0.10 2.37 0.52 -1.26 -5.13 118.95 111.18 1w2q s ARG 49 Ca -0.14 -0.46 -0.05 0.00 -0.52 0.00 0.00 55.73 54.56 1w2q s ARG 49 Cb 0.18 -1.51 -0.02 0.00 0.52 0.00 0.00 34.95 34.12 1w2q s ARG 49 CO 0.73 0.03 0.12 -1.54 0.02 0.00 0.00 175.30 174.66 1w2q s SER 50 N 0.67 0.25 0.63 0.23 1.04 -1.26 -5.17 113.70 110.08 1w2q s SER 50 Ca -0.14 -0.89 -0.02 0.00 0.48 0.00 0.00 55.95 55.38 1w2q s SER 50 Cb -0.16 0.31 0.06 0.00 0.10 0.00 0.00 66.02 66.33 1w2q s SER 50 CO 0.04 -0.72 0.89 0.42 0.98 0.00 0.00 173.24 174.84 1w2q s THR 51 N -3.93 2.46 0.41 2.02 -4.23 -1.26 -4.95 115.64 106.15 1w2q s THR 51 Ca 0.11 -0.53 0.13 0.00 -1.18 0.00 0.00 61.69 60.23 1w2q s THR 51 Cb 0.06 -2.93 0.34 0.00 1.34 0.00 0.00 72.50 71.31 1w2q s THR 51 CO -0.06 0.00 1.91 0.03 -0.54 0.00 0.00 174.62 175.95 1w2q h ARG 52 N -0.24 0.49 -2.89 3.99 3.08 -2.07 -3.40 114.38 113.34 1w2q h ARG 52 Ca -0.42 -0.03 -0.19 0.00 0.07 0.00 0.00 59.98 59.42 1w2q h ARG 52 Cb 1.30 -0.11 -0.30 0.00 0.08 0.00 0.00 29.97 30.94 1w2q h ARG 52 CO 0.53 0.32 -0.47 0.45 -1.07 0.00 0.00 179.97 179.73 1w2q s SER 53 N -5.91 -0.11 0.43 7.04 0.15 -1.26 -5.01 113.70 109.03 1w2q s SER 53 Ca -0.09 0.62 0.30 0.00 0.70 0.00 0.00 55.95 57.48 1w2q s SER 53 Cb 0.21 0.60 1.26 0.00 -1.71 0.00 0.00 66.02 66.37 1w2q s SER 53 CO 0.77 -0.20 1.88 0.77 1.20 0.00 0.00 173.24 177.67 1w2q h SER 54 N 7.57 0.00 0.03 5.45 4.64 -2.00 -2.60 113.55 126.64 1w2q h SER 54 Ca -0.31 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1w2q h SER 54 Cb 1.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1w2q h SER 54 CO 0.28 0.00 -0.01 0.44 -0.87 0.00 0.00 176.83 176.67 1w2q h ASP 55 N 0.00 0.00 -0.34 4.97 3.32 -1.97 -2.57 116.42 119.83 1w2q h ASP 55 Ca 0.00 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.12 1w2q h ASP 55 Cb 0.41 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.88 1w2q h ASP 55 CO 0.00 0.01 -0.17 -0.61 -1.72 0.00 0.00 179.24 176.75 1w2q h GLN 56 N 0.00 -0.11 -0.27 3.56 4.15 -1.90 -1.06 115.11 119.48 1w2q h GLN 56 Ca -0.00 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.49 1w2q h GLN 56 Cb 0.03 0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.68 1w2q h GLN 56 CO 0.00 -0.07 -0.10 1.96 -1.93 0.00 0.00 178.83 178.69 1w2q h GLN 57 N -0.11 -0.05 -0.72 1.69 4.20 -1.70 0.59 115.11 119.02 1w2q h GLN 57 Ca 0.17 0.00 0.15 0.00 0.06 0.00 0.00 58.65 59.04 1w2q h GLN 57 Cb 0.37 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 1w2q h GLN 57 CO -0.41 -0.03 0.49 1.96 -0.67 0.00 0.00 178.83 180.16 1w2q h GLN 58 N -0.05 0.32 -0.69 1.46 1.08 -1.37 0.96 115.11 116.82 1w2q h GLN 58 Ca 0.14 -0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.37 1w2q h GLN 58 Cb 0.26 -0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.57 1w2q h GLN 58 CO -0.31 0.21 0.46 -0.09 -0.95 0.00 0.00 178.83 178.15 1w2q h ARG 59 N 0.33 0.73 0.00 1.46 2.43 0.33 -2.61 114.38 117.05 1w2q h ARG 59 Ca 0.35 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 1w2q h ARG 59 Cb 0.90 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1w2q h ARG 59 CO -0.09 0.48 0.00 0.00 -1.51 0.00 0.00 179.97 178.85 1w2q h ASP 62 N 0.13 0.33 -0.07 0.00 3.58 -0.72 0.14 116.42 119.81 1w2q h ASP 62 Ca 0.61 0.04 -0.04 0.00 0.42 0.00 0.00 57.03 58.06 1w2q h ASP 62 Cb 1.30 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 42.33 1w2q h ASP 62 CO -0.75 0.11 -0.10 -0.33 -2.88 0.00 0.00 179.24 175.29 1w2q h GLU 63 N 0.31 0.19 0.00 0.28 4.39 0.91 -2.53 114.58 118.13 1w2q h GLU 63 Ca 0.50 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 60.09 1w2q h GLU 63 Cb 1.41 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 1w2q h GLU 63 CO -0.17 0.67 0.00 1.28 -1.16 0.00 0.00 179.01 179.63 1w2q n LEU 64 N -4.67 0.39 0.12 1.33 4.77 0.31 -1.06 117.00 118.19 1w2q n LEU 64 Ca -0.08 0.66 -0.02 0.00 -0.03 0.00 0.00 56.01 56.54 1w2q n LEU 64 Cb 0.34 -0.69 0.15 0.00 -2.33 0.00 0.00 43.42 40.89 1w2q n LEU 64 CO 0.37 -0.73 0.48 -1.13 -1.33 0.00 0.00 177.39 175.04 1w2q h ASN 65 N 0.00 0.05 0.09 -1.43 -1.24 -0.61 -3.29 115.58 109.15 1w2q h ASN 65 Ca 0.00 -0.03 -0.37 0.00 0.71 0.00 0.00 56.30 56.61 1w2q h ASN 65 Cb 0.06 -0.01 -0.05 0.00 0.73 0.00 0.00 38.32 39.06 1w2q h ASN 65 CO 0.00 0.67 -2.21 1.21 -1.29 0.00 0.00 177.43 175.81 1w2q n GLU 66 N -3.80 0.70 -1.14 6.67 2.13 -0.23 -4.38 120.64 120.60 1w2q n GLU 66 Ca -0.01 0.20 -0.24 0.00 0.66 0.00 0.00 57.16 57.76 1w2q n GLU 66 Cb 0.63 -1.62 -0.11 0.00 0.27 0.00 0.00 31.44 30.61 1w2q n GLU 66 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1w2q n MET 67 N -3.31 2.76 -0.40 5.31 2.81 -0.77 -4.62 117.12 118.91 1w2q n MET 67 Ca -0.37 -1.54 0.39 0.00 -1.81 0.00 0.00 57.70 54.37 1w2q n MET 67 Cb 1.03 -2.36 0.75 0.00 -0.71 0.00 0.00 33.22 31.94 1w2q n MET 67 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1w2q h GLU 68 N 3.91 0.00 -1.03 0.03 5.08 -1.76 0.43 114.58 121.25 1w2q h GLU 68 Ca 0.50 0.00 0.30 0.00 -1.00 0.00 0.00 59.36 59.16 1w2q h GLU 68 Cb 0.96 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.17 1w2q h GLU 68 CO 0.93 0.00 0.91 -0.91 -1.00 0.00 0.00 179.01 178.94 1w2q h ASN 69 N 0.00 0.00 -0.01 1.42 -0.26 -1.91 1.07 115.58 115.90 1w2q h ASN 69 Ca 0.64 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.38 1w2q h ASN 69 Cb 2.64 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 39.90 1w2q h ASN 69 CO -0.01 0.00 0.12 0.71 -1.06 0.00 0.00 177.43 177.20 1w2q h THR 70 N 0.00 0.02 0.00 2.81 1.35 -0.47 0.21 112.91 116.82 1w2q h THR 70 Ca 0.49 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.35 1w2q h THR 70 Cb 2.31 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.60 1w2q h THR 70 CO -0.01 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.26 1w2q n GLN 71 N -3.04 0.15 0.04 4.72 6.02 0.37 -1.61 117.38 124.03 1w2q n GLN 71 Ca -0.03 0.18 -0.18 0.00 -0.01 0.00 0.00 57.00 56.97 1w2q n GLN 71 Cb 0.19 -1.50 -0.08 0.00 1.02 0.00 0.00 30.24 29.86 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 2.28 0.71 -5.17 1.08 0.00 -0.76 -3.38 103.07 97.82 1w2q h GLY 72 Ca 0.00 -1.20 -0.36 0.00 0.00 0.00 0.00 47.33 45.77 1w2q h GLY 72 CO 0.00 1.06 -1.08 0.00 0.00 0.00 0.00 176.54 176.53 1w2q h MET 74 N 2.88 0.20 -0.95 0.00 2.07 -1.49 0.23 114.93 117.87 1w2q h MET 74 Ca -0.09 -0.01 0.10 0.00 -2.07 0.00 0.00 59.70 57.64 1w2q h MET 74 Cb 1.16 -0.05 -0.08 0.00 -1.87 0.00 0.00 31.60 30.76 1w2q h MET 74 CO 0.42 0.14 0.58 0.00 1.07 0.00 0.00 176.91 179.12 1w2q h GLU 76 N 0.95 0.00 0.00 0.00 5.08 -0.97 0.19 114.58 119.84 1w2q h GLU 76 Ca 0.46 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1w2q h GLU 76 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1w2q h GLU 76 CO -0.25 0.15 -0.00 0.00 -1.00 0.00 0.00 179.01 177.91 1w2q h ALA 77 N 1.85 -0.01 -0.22 3.43 0.00 0.30 -2.26 119.26 122.36 1w2q h ALA 77 Ca -0.00 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1w2q h ALA 77 Cb 0.36 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1w2q h ALA 77 CO 0.02 -0.01 0.12 1.25 0.00 0.00 0.00 179.25 180.63 1w2q h LEU 78 N -1.00 0.20 -1.06 0.00 5.85 -0.90 -1.41 115.31 116.98 1w2q h LEU 78 Ca -0.00 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.78 1w2q h LEU 78 Cb 0.47 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 1w2q h LEU 78 CO 0.00 0.15 0.63 1.56 -0.34 0.00 0.00 178.44 180.43 1w2q h GLN 79 N 0.25 1.10 -0.12 1.25 4.20 -0.75 -1.93 115.11 119.12 1w2q h GLN 79 Ca 0.08 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1w2q h GLN 79 Cb -0.00 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.53 1w2q h GLN 79 CO -0.04 0.73 0.07 0.37 -0.67 0.00 0.00 178.83 179.29 1w2q h GLN 80 N 1.13 0.16 -0.15 1.46 4.15 -0.70 -2.17 115.11 118.99 1w2q h GLN 80 Ca 0.41 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.86 1w2q h GLN 80 Cb 0.15 -0.03 -0.07 0.00 0.21 0.00 0.00 27.48 27.74 1w2q h GLN 80 CO -0.16 0.14 -0.47 0.82 -1.93 0.00 0.00 178.83 177.24 1w2q h ILE 81 N 0.13 0.09 -0.56 2.39 2.04 -0.50 0.47 117.51 121.56 1w2q h ILE 81 Ca 0.04 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.01 1w2q h ILE 81 Cb 0.02 0.09 -0.11 0.00 -0.74 0.00 0.00 36.82 36.08 1w2q h ILE 81 CO -0.01 0.00 -0.21 0.24 0.00 0.00 0.00 178.15 178.17 1w2q h MET 82 N -0.52 -0.07 0.00 2.37 2.86 -1.30 1.73 114.93 120.01 1w2q h MET 82 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1w2q h MET 82 Cb 0.65 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.32 1w2q h MET 82 CO -0.43 -0.05 0.00 -1.91 1.06 0.00 0.00 176.91 175.59 1w2q n GLU 83 N -5.42 0.14 0.06 1.72 2.13 -0.36 0.14 120.64 119.06 1w2q n GLU 83 Ca 0.05 0.18 0.11 0.00 0.66 0.00 0.00 57.16 58.17 1w2q n GLU 83 Cb 0.33 -1.50 -0.01 0.00 0.27 0.00 0.00 31.44 30.53 1w2q n GLU 83 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1w2q n ASN 84 N -1.35 0.62 -1.49 4.31 5.15 0.58 -4.53 115.26 118.55 1w2q n ASN 84 Ca 0.06 0.10 -0.04 0.00 -0.60 0.00 0.00 54.58 54.09 1w2q n ASN 84 Cb 0.13 0.78 -0.01 0.00 -0.53 0.00 0.00 39.78 40.15 1w2q n ASN 84 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1w2q n GLN 85 N -2.35 0.35 -0.06 1.20 6.02 -0.48 -4.92 117.38 117.15 1w2q n GLN 85 Ca 0.00 -1.29 -0.03 0.00 -0.01 0.00 0.00 57.00 55.67 1w2q n GLN 85 Cb 0.51 0.33 -0.13 0.00 1.02 0.00 0.00 30.24 31.97 1w2q n GLN 85 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1w2q h ASP 87 N 0.00 0.51 -0.71 0.00 3.32 -1.86 1.35 116.42 119.02 1w2q h ASP 87 Ca -0.32 0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.84 1w2q h ASP 87 Cb 1.66 0.03 0.00 0.00 0.22 0.00 0.00 39.33 41.24 1w2q h ASP 87 CO 0.02 0.06 0.00 0.54 -1.72 0.00 0.00 179.24 178.14 1w2q n ARG 88 N -4.73 2.91 -0.23 3.56 1.74 -1.26 -4.42 116.66 114.23 1w2q n ARG 88 Ca 0.27 -2.67 0.21 0.00 -0.77 0.00 0.00 57.85 54.89 1w2q n ARG 88 Cb 0.88 -1.64 0.55 0.00 -1.02 0.00 0.00 32.46 31.24 1w2q n ARG 88 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1w2q h LEU 89 N 4.22 0.33 -2.09 0.55 5.85 0.16 -3.47 115.31 120.86 1w2q h LEU 89 Ca 0.00 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.76 1w2q h LEU 89 Cb 1.08 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.00 1w2q h LEU 89 CO 0.05 0.12 -1.34 0.00 -0.34 0.00 0.00 178.44 176.94 1w2q n GLN 90 N -4.47 -4.07 -1.51 1.25 6.02 -1.26 -4.48 117.38 108.85 1w2q n GLN 90 Ca 0.19 3.14 -0.29 0.00 -0.01 0.00 0.00 57.00 60.03 1w2q n GLN 90 Cb 0.76 -5.07 -0.17 0.00 1.02 0.00 0.00 30.24 26.78 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 1.28 -0.29 0.00 1.08 2.03 -1.26 -4.63 116.55 114.76 1w2q n ASP 91 Ca -0.26 -0.34 0.00 0.00 0.52 0.00 0.00 54.79 54.71 1w2q n ASP 91 Cb 0.40 -0.84 0.00 0.00 -0.72 0.00 0.00 41.12 39.96 1w2q n ASP 91 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1w2q n ARG 92 N 7.14 0.00 -0.03 -0.67 1.74 -1.26 -5.03 116.66 118.56 1w2q n ARG 92 Ca 0.64 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.56 1w2q n ARG 92 Cb 0.15 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.50 1w2q n ARG 92 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1w2q h GLN 93 N 0.00 0.44 -0.67 5.56 4.20 -1.93 -3.31 115.11 119.41 1w2q h GLN 93 Ca 0.00 -0.37 0.07 0.00 0.06 0.00 0.00 58.65 58.41 1w2q h GLN 93 Cb 0.00 0.08 -0.10 0.00 0.30 0.00 0.00 27.48 27.76 1w2q h GLN 93 CO 0.00 1.00 -0.56 1.98 -0.67 0.00 0.00 178.83 180.58 1w2q h MET 94 N -0.01 -0.22 -1.65 1.46 4.05 -1.87 0.99 114.93 117.69 1w2q h MET 94 Ca -0.03 0.01 0.51 0.00 -0.28 0.00 0.00 59.70 59.92 1w2q h MET 94 Cb 1.10 0.05 -0.11 0.00 -0.80 0.00 0.00 31.60 31.84 1w2q h MET 94 CO 0.09 -0.14 1.13 -0.24 0.23 0.00 0.00 176.91 177.98 1w2q h VAL 95 N -0.22 0.04 0.00 -5.77 3.04 -1.82 1.41 116.25 112.93 1w2q h VAL 95 Ca 0.12 -0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.80 1w2q h VAL 95 Cb 0.52 0.02 0.00 0.00 -2.01 0.00 0.00 31.29 29.82 1w2q h VAL 95 CO -0.75 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 175.82 1w2q n GLN 96 N -4.34 0.00 -0.33 4.17 6.02 0.33 -2.11 117.38 121.12 1w2q n GLN 96 Ca 0.41 0.19 0.21 0.00 -0.01 0.00 0.00 57.00 57.81 1w2q n GLN 96 Cb 1.75 -0.66 0.43 0.00 1.02 0.00 0.00 30.24 32.78 1w2q n GLN 96 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1w2q h GLN 97 N 0.00 0.28 -0.04 -1.09 1.08 -0.73 0.40 115.11 115.01 1w2q h GLN 97 Ca 0.00 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1w2q h GLN 97 Cb 0.00 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.36 1w2q h GLN 97 CO 0.00 0.19 0.01 0.35 -0.95 0.00 0.00 178.83 178.43 1w2q h PHE 98 N 0.29 0.06 -0.89 2.96 3.57 0.18 0.41 116.94 123.52 1w2q h PHE 98 Ca 0.69 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 62.22 1w2q h PHE 98 Cb 1.54 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 40.22 1w2q h PHE 98 CO -0.07 0.21 0.58 -0.22 -2.23 0.00 0.00 178.31 176.57 1w2q h LYS 99 N -0.11 1.10 0.02 1.11 3.64 0.21 2.25 116.57 124.79 1w2q h LYS 99 Ca 0.01 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1w2q h LYS 99 Cb 0.17 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1w2q h LYS 99 CO -0.00 0.73 -0.01 0.00 -2.27 0.00 0.00 179.45 177.89 1w2q h ARG 100 N 1.13 -0.03 -0.60 1.90 3.08 -0.46 -1.71 114.38 117.68 1w2q h ARG 100 Ca 0.35 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.30 1w2q h ARG 100 Cb -0.02 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 1w2q h ARG 100 CO -0.11 0.35 -0.00 0.93 -1.07 0.00 0.00 179.97 180.07 1w2q h GLU 101 N -0.41 1.06 -0.25 0.04 4.39 0.23 -1.96 114.58 117.69 1w2q h GLU 101 Ca -0.00 -0.34 0.07 0.00 0.34 0.00 0.00 59.36 59.43 1w2q h GLU 101 Cb 0.39 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1w2q h GLU 101 CO 0.00 1.04 0.18 1.25 -1.16 0.00 0.00 179.01 180.32 1w2q h LEU 102 N 0.97 0.00 -0.70 1.33 5.85 0.39 0.27 115.31 123.41 1w2q h LEU 102 Ca 0.17 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.76 1w2q h LEU 102 Cb 0.56 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 1w2q h LEU 102 CO 0.03 0.00 -0.60 0.24 -0.34 0.00 0.00 178.44 177.77 1w2q h MET 103 N 0.00 0.00 0.12 1.25 2.86 -0.52 -3.15 114.93 115.48 1w2q h MET 103 Ca 0.12 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.47 1w2q h MET 103 Cb 0.47 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.13 1w2q h MET 103 CO -0.00 0.60 -1.39 0.77 1.06 0.00 0.00 176.91 177.95 1w2q h SER 104 N 0.00 0.40 -0.83 1.22 0.02 -0.40 -3.34 113.55 110.62 1w2q h SER 104 Ca -0.01 -0.49 0.18 0.00 -0.84 0.00 0.00 61.79 60.63 1w2q h SER 104 Cb 1.13 -0.13 -0.16 0.00 0.14 0.00 0.00 62.40 63.38 1w2q h SER 104 CO 0.08 1.39 -0.16 -0.07 -1.14 0.00 0.00 176.83 176.94 1w2q h LEU 105 N 0.07 -0.68 0.00 5.07 3.38 -0.81 2.09 115.31 124.43 1w2q h LEU 105 Ca -0.19 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1w2q h LEU 105 Cb 1.99 0.49 0.00 0.00 0.09 0.00 0.00 40.66 43.23 1w2q h LEU 105 CO 0.18 -0.27 0.00 -0.81 0.09 0.00 0.00 178.44 177.63 1w2q n PRO 106 N -5.51 0.23 -0.12 1.13 -0.04 -1.25 -2.70 135.00 126.74 1w2q n PRO 106 Ca 0.13 0.12 -0.25 0.00 -0.04 0.00 0.00 63.50 63.46 1w2q n PRO 106 Cb 0.46 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.31 1w2q n PRO 106 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1w2q n GLN 107 N -1.19 0.61 0.23 0.54 6.02 0.70 -3.81 117.38 120.48 1w2q n GLN 107 Ca 0.06 0.27 0.13 0.00 -0.01 0.00 0.00 57.00 57.45 1w2q n GLN 107 Cb 0.07 -1.54 0.68 0.00 1.02 0.00 0.00 30.24 30.47 1w2q n GLN 107 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1w2q h GLN 108 N -0.67 0.00 -0.00 -1.09 4.20 -1.07 0.66 115.11 117.14 1w2q h GLN 108 Ca -0.61 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.10 1w2q h GLN 108 Cb 1.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.46 1w2q h GLN 108 CO -0.28 0.00 -0.24 0.00 -0.67 0.00 0.00 178.83 177.64 1w2q n ASN 110 N -1.10 -5.87 -2.52 0.00 3.02 0.23 -4.83 115.26 104.19 1w2q n ASN 110 Ca 0.10 -0.28 -0.21 0.00 -0.03 0.00 0.00 54.58 54.17 1w2q n ASN 110 Cb 0.32 -4.69 -0.11 0.00 -0.61 0.00 0.00 39.78 34.69 1w2q n ASN 110 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1w2q n PHE 111 N -4.46 0.89 0.88 3.10 3.72 -1.25 -4.41 117.46 115.94 1w2q n PHE 111 Ca -0.10 -2.02 0.12 0.00 -0.05 0.00 0.00 57.45 55.39 1w2q n PHE 111 Cb 0.61 -1.88 0.53 0.00 -0.94 0.00 0.00 39.48 37.81 1w2q n PHE 111 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1w2q n ARG 112 N 2.96 0.04 0.11 -1.08 0.63 -1.26 -3.82 116.66 114.24 1w2q n ARG 112 Ca 0.54 0.07 -0.15 0.00 -0.92 0.00 0.00 57.85 57.40 1w2q n ARG 112 Cb 0.62 -1.50 -0.09 0.00 0.45 0.00 0.00 32.46 31.94 1w2q n ARG 112 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1w2q h ALA 113 N 2.88 -0.96 -2.44 5.13 0.00 -2.00 -3.39 119.26 118.48 1w2q h ALA 113 Ca 0.00 -0.10 -0.54 0.00 0.00 0.00 0.00 54.91 54.27 1w2q h ALA 113 Cb 0.40 0.84 0.01 0.00 0.00 0.00 0.00 17.79 19.04 1w2q h ALA 113 CO 0.00 -1.07 0.78 -1.25 0.00 0.00 0.00 179.25 177.71 1w2q s PRO 114 N -5.44 4.31 0.08 0.00 0.04 -1.25 -4.94 135.00 127.80 1w2q s PRO 114 Ca -0.15 1.98 -0.20 0.00 0.04 0.00 0.00 61.00 62.68 1w2q s PRO 114 Cb 0.05 -3.46 -0.09 0.00 0.04 0.00 0.00 34.50 31.04 1w2q s PRO 114 CO 0.54 -0.51 1.58 1.96 0.04 0.00 0.00 177.00 180.61 1w2q h GLN 115 N 7.44 0.31 0.00 4.56 4.20 -1.90 -3.48 115.11 126.24 1w2q h GLN 115 Ca -0.40 -0.07 0.08 0.00 0.06 0.00 0.00 58.65 58.32 1w2q h GLN 115 Cb 1.19 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.92 1w2q h GLN 115 CO 0.88 0.42 0.44 2.89 -0.67 0.00 0.00 178.83 182.80 1w2q n ARG 116 N -4.79 0.82 -3.90 1.46 1.85 -1.26 -5.13 116.66 105.71 1w2q n ARG 116 Ca -0.04 -1.73 -0.22 0.00 -1.00 0.00 0.00 57.85 54.87 1w2q n ARG 116 Cb 0.16 2.25 -0.04 0.00 -1.05 0.00 0.00 32.46 33.77 1w2q n ARG 116 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1w2q s ASP 118 N -3.95 6.46 0.53 0.00 1.01 -1.26 -4.88 116.67 114.58 1w2q s ASP 118 Ca 0.39 2.65 0.20 0.00 0.71 0.00 0.00 52.55 56.51 1w2q s ASP 118 Cb -0.05 -2.64 1.38 0.00 1.01 0.00 0.00 42.92 42.61 1w2q s ASP 118 CO 0.25 -0.75 2.14 -0.07 0.21 0.00 0.00 175.17 176.96 1w2q h LEU 119 N 2.89 0.00 -1.29 1.23 3.38 -1.98 -1.70 115.31 117.85 1w2q h LEU 119 Ca -0.49 0.00 0.13 0.00 0.09 0.00 0.00 57.88 57.61 1w2q h LEU 119 Cb 1.24 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.92 1w2q h LEU 119 CO 0.63 0.04 0.57 -0.78 0.09 0.00 0.00 178.44 178.99 1w2q h ASP 120 N 0.00 0.67 0.69 -0.43 3.58 -2.04 0.35 116.42 119.24 1w2q h ASP 120 Ca -0.00 0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 1w2q h ASP 120 Cb 0.08 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.02 1w2q h ASP 120 CO 0.01 0.36 -0.20 -0.37 -2.88 0.00 0.00 179.24 176.15 1w2q h VAL 121 N 0.72 0.60 -4.25 2.25 -1.51 -1.68 -3.44 116.25 108.95 1w2q h VAL 121 Ca 0.43 -0.94 -0.50 0.00 -1.23 0.00 0.00 66.70 64.46 1w2q h VAL 121 Cb 0.64 1.62 0.13 0.00 -2.13 0.00 0.00 31.29 31.54 1w2q h VAL 121 CO -0.19 0.20 0.31 -0.94 -1.23 0.00 0.00 177.57 175.72 1w2q s SER 122 N -6.21 4.35 0.00 4.19 1.04 0.12 -4.12 113.70 113.08 1w2q s SER 122 Ca -0.01 1.65 0.00 0.00 0.48 0.00 0.00 55.95 58.08 1w2q s SER 122 Cb 0.11 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.86 1w2q s SER 122 CO 0.62 -2.11 0.00 0.61 0.98 0.00 0.00 173.24 173.34 1w2q n GLY 123 N -1.38 0.83 3.67 7.32 0.00 -1.26 -5.01 105.19 109.36 1w2q n GLY 123 Ca 0.08 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.63 0.12 0.31 -0.02 0.00 -1.26 -4.89 105.19 98.82 1w2q n GLY 124 Ca 0.00 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 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 0.60 1.10 0.00 1.61 3.08 -1.95 -1.89 114.38 116.93 1w2q h ARG 125 Ca -0.50 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.22 1w2q h ARG 125 Cb 1.35 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1w2q h ARG 125 CO 0.52 1.04 0.12 0.00 -1.07 0.00 0.00 179.97 180.59