#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kq7 h SER 2 N 0.00 0.86 -2.56 1.61 4.64 -2.14 -3.46 113.55 112.50 2kq7 h SER 2 Ca 0.00 -0.88 -0.40 0.00 -0.47 0.00 0.00 61.79 60.03 2kq7 h SER 2 Cb 0.00 -0.28 0.21 0.00 -0.31 0.00 0.00 62.40 62.03 2kq7 h SER 2 CO 0.00 1.69 -0.56 1.15 -0.87 0.00 0.00 176.83 178.23 2kq7 n MET 3 N -3.73 -2.47 -4.37 4.77 0.00 -1.26 -5.03 117.12 105.02 2kq7 n MET 3 Ca -0.16 -0.71 -0.27 0.00 0.00 0.00 0.00 57.70 56.56 2kq7 n MET 3 Cb 1.08 -1.82 -0.13 0.00 0.00 0.00 0.00 33.22 32.35 2kq7 n MET 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2kq7 s LYS 4 N -3.93 1.34 -0.31 3.17 3.01 -1.26 -5.11 119.74 116.66 2kq7 s LYS 4 Ca 0.58 -1.33 -0.23 0.00 -1.01 0.00 0.00 55.97 53.97 2kq7 s LYS 4 Cb -0.15 -1.73 0.00 0.00 -1.01 0.00 0.00 37.83 34.94 2kq7 s LYS 4 CO 0.60 0.40 0.79 -1.12 0.51 0.00 0.00 175.35 176.54 2kq7 s SER 5 N -2.15 6.66 0.01 2.83 0.01 -1.26 -5.03 113.70 114.77 2kq7 s SER 5 Ca 0.13 0.65 -0.30 0.00 1.31 0.00 0.00 55.95 57.74 2kq7 s SER 5 Cb -0.09 -2.41 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 2kq7 s SER 5 CO 0.06 -0.63 1.04 -0.89 0.41 0.00 0.00 173.24 173.24 2kq7 s THR 6 N 2.98 4.65 -0.04 1.44 2.01 -1.26 -5.03 115.64 120.39 2kq7 s THR 6 Ca 0.32 1.90 -0.17 0.00 0.31 0.00 0.00 61.69 64.05 2kq7 s THR 6 Cb -0.14 -4.22 0.03 0.00 0.01 0.00 0.00 72.50 68.18 2kq7 s THR 6 CO 0.13 0.14 0.38 -0.36 -0.69 0.00 0.00 174.62 174.22 2kq7 s PHE 7 N 1.08 -0.29 0.23 4.92 0.08 -1.26 -5.05 117.98 117.69 2kq7 s PHE 7 Ca 0.54 0.51 0.03 0.00 0.12 0.00 0.00 56.93 58.12 2kq7 s PHE 7 Cb -0.23 0.15 0.23 0.00 -0.57 0.00 0.00 43.02 42.60 2kq7 s PHE 7 CO 0.28 -0.40 1.55 -0.22 -0.10 0.00 0.00 175.22 176.33 2kq7 h LYS 8 N 3.93 0.30 -0.50 0.44 3.64 -2.00 -3.21 116.57 119.16 2kq7 h LYS 8 Ca -0.29 -0.20 0.10 0.00 -1.27 0.00 0.00 60.65 58.99 2kq7 h LYS 8 Cb 1.17 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.94 2kq7 h LYS 8 CO 0.38 0.80 -0.01 0.77 -2.27 0.00 0.00 179.45 179.13 2kq7 h SER 9 N 0.22 -0.23 -0.24 4.20 0.02 -2.01 0.49 113.55 116.01 2kq7 h SER 9 Ca -0.00 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 2kq7 h SER 9 Cb 1.10 0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.84 2kq7 h SER 9 CO 0.10 -0.08 0.10 -0.33 -1.14 0.00 0.00 176.83 175.48 2kq7 h GLU 10 N 0.11 0.42 -5.57 3.45 5.08 -1.98 -3.47 114.58 112.62 2kq7 h GLU 10 Ca 0.25 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.46 2kq7 h GLU 10 Cb 0.38 -0.08 0.02 0.00 0.50 0.00 0.00 28.75 29.57 2kq7 h GLU 10 CO -0.42 0.37 -0.25 0.66 -1.00 0.00 0.00 179.01 178.37 2kq7 n TYR 11 N -4.39 -2.78 0.97 4.33 4.01 0.16 -4.85 117.16 114.61 2kq7 n TYR 11 Ca 0.01 1.05 0.08 0.00 -0.16 0.00 0.00 57.90 58.88 2kq7 n TYR 11 Cb 0.15 -3.94 0.46 0.00 -0.31 0.00 0.00 39.34 35.70 2kq7 n TYR 11 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2kq7 n PRO 12 N -2.11 0.49 -0.20 -0.72 -0.04 -1.26 -3.92 135.00 127.23 2kq7 n PRO 12 Ca -0.05 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.29 2kq7 n PRO 12 Cb 0.54 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.41 2kq7 n PRO 12 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2kq7 h PHE 13 N 0.00 -1.65 0.00 0.54 3.57 -1.96 0.33 116.94 117.76 2kq7 h PHE 13 Ca 0.00 0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.52 2kq7 h PHE 13 Cb 0.00 0.79 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 2kq7 h PHE 13 CO 0.00 -0.43 -0.34 1.05 -2.23 0.00 0.00 178.31 176.35 2kq7 h GLU 14 N -0.28 0.00 0.00 1.11 9.09 -1.96 -2.35 114.58 120.19 2kq7 h GLU 14 Ca 0.09 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.46 2kq7 h GLU 14 Cb 0.51 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.61 2kq7 h GLU 14 CO -0.64 0.34 -0.16 0.87 0.05 0.00 0.00 179.01 179.47 2kq7 h LYS 15 N 0.00 0.00 -7.10 1.06 1.57 -0.91 -3.44 116.57 107.75 2kq7 h LYS 15 Ca -0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.23 2kq7 h LYS 15 Cb 0.61 0.00 0.13 0.00 0.08 0.00 0.00 32.23 33.05 2kq7 h LYS 15 CO 0.04 0.16 0.50 0.50 -0.57 0.00 0.00 179.45 180.09 2kq7 s ARG 16 N -4.15 2.80 -0.13 3.15 3.52 0.85 -4.95 118.95 120.04 2kq7 s ARG 16 Ca -0.02 1.96 0.19 0.00 -0.13 0.00 0.00 55.73 57.72 2kq7 s ARG 16 Cb 0.13 -1.92 -0.27 0.00 -1.56 0.00 0.00 34.95 31.33 2kq7 s ARG 16 CO 0.61 -1.38 0.22 0.36 -0.81 0.00 0.00 175.30 174.31 2kq7 n LYS 17 N -1.68 0.76 0.01 5.12 -0.00 -1.26 -4.32 118.16 116.77 2kq7 n LYS 17 Ca 0.14 -0.08 0.22 0.00 -0.00 0.00 0.00 58.31 58.59 2kq7 n LYS 17 Cb 0.49 -1.50 0.72 0.00 -0.00 0.00 0.00 35.03 34.74 2kq7 n LYS 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2kq7 h ALA 18 N 1.33 2.40 -0.53 0.58 0.00 -1.95 -1.37 119.26 119.72 2kq7 h ALA 18 Ca -0.32 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.67 2kq7 h ALA 18 Cb 1.70 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 19.45 2kq7 h ALA 18 CO 0.02 -0.73 0.07 1.49 0.00 0.00 0.00 179.25 180.09 2kq7 h GLU 19 N 0.00 0.19 -0.76 0.00 4.81 -1.92 0.55 114.58 117.45 2kq7 h GLU 19 Ca 0.26 -0.01 0.16 0.00 -0.13 0.00 0.00 59.36 59.64 2kq7 h GLU 19 Cb 1.16 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.45 2kq7 h GLU 19 CO -0.00 0.12 0.51 0.66 -0.73 0.00 0.00 179.01 179.57 2kq7 h SER 20 N 0.19 0.34 0.87 1.04 4.64 -1.54 -1.18 113.55 117.91 2kq7 h SER 20 Ca 0.27 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.57 2kq7 h SER 20 Cb 0.40 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2kq7 h SER 20 CO -0.39 0.17 -0.42 -0.08 -0.87 0.00 0.00 176.83 175.24 2kq7 h GLU 21 N 0.36 -1.12 -0.77 4.77 4.22 -0.99 0.24 114.58 121.28 2kq7 h GLU 21 Ca 0.37 0.08 0.08 0.00 0.08 0.00 0.00 59.36 59.97 2kq7 h GLU 21 Cb 0.94 0.26 -0.06 0.00 0.50 0.00 0.00 28.75 30.38 2kq7 h GLU 21 CO -0.11 -0.75 0.44 0.00 -2.18 0.00 0.00 179.01 176.41 2kq7 h ARG 22 N -1.19 0.76 -0.09 1.92 2.47 -1.31 -0.66 114.38 116.28 2kq7 h ARG 22 Ca -0.12 -0.05 -0.06 0.00 -1.26 0.00 0.00 59.98 58.50 2kq7 h ARG 22 Cb 0.89 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 29.03 2kq7 h ARG 22 CO 0.20 0.50 -0.22 0.82 0.56 0.00 0.00 179.97 181.83 2kq7 h ILE 23 N 0.78 1.20 0.00 2.04 1.08 -1.14 0.22 117.51 121.69 2kq7 h ILE 23 Ca 0.36 -0.93 -0.07 0.00 -0.39 0.00 0.00 64.86 63.83 2kq7 h ILE 23 Cb 0.27 1.38 -0.01 0.00 -3.07 0.00 0.00 36.82 35.38 2kq7 h ILE 23 CO -0.21 0.28 -0.34 0.00 -0.69 0.00 0.00 178.15 177.19 2kq7 h ALA 24 N 1.65 1.27 0.08 1.87 0.00 0.11 0.15 119.26 124.38 2kq7 h ALA 24 Ca 0.02 -0.31 -0.36 0.00 0.00 0.00 0.00 54.91 54.26 2kq7 h ALA 24 Cb 0.47 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2kq7 h ALA 24 CO 0.03 0.42 -2.10 -0.25 0.00 0.00 0.00 179.25 177.35 2kq7 n ASP 25 N -3.89 1.87 -0.07 0.00 9.92 -0.86 -4.27 116.55 119.25 2kq7 n ASP 25 Ca -0.01 0.14 -0.14 0.00 -0.53 0.00 0.00 54.79 54.24 2kq7 n ASP 25 Cb 0.41 -0.59 -0.02 0.00 -0.64 0.00 0.00 41.12 40.28 2kq7 n ASP 25 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2kq7 h ARG 26 N 0.04 0.84 -3.96 -1.24 3.08 -0.55 -3.39 114.38 109.21 2kq7 h ARG 26 Ca -0.45 -0.52 -0.67 0.00 0.07 0.00 0.00 59.98 58.41 2kq7 h ARG 26 Cb 2.01 0.05 -0.38 0.00 0.08 0.00 0.00 29.97 31.74 2kq7 h ARG 26 CO 0.04 1.15 -0.55 -0.06 -1.07 0.00 0.00 179.97 179.48 2kq7 s PHE 27 N -4.16 3.46 -0.14 3.04 0.08 0.53 -4.94 117.98 115.85 2kq7 s PHE 27 Ca -0.10 -2.84 -0.21 0.00 0.12 0.00 0.00 56.93 53.90 2kq7 s PHE 27 Cb 0.10 -3.04 -0.19 0.00 -0.57 0.00 0.00 43.02 39.32 2kq7 s PHE 27 CO 0.88 -0.86 0.52 0.87 -0.10 0.00 0.00 175.22 176.52 2kq7 h LYS 28 N 7.22 0.00 -6.19 0.44 1.57 -1.76 -3.41 116.57 114.43 2kq7 h LYS 28 Ca -0.06 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.12 2kq7 h LYS 28 Cb 0.97 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.18 2kq7 h LYS 28 CO 0.66 0.74 0.64 -0.80 -0.57 0.00 0.00 179.45 180.12 2kq7 s ASN 29 N -6.11 6.49 0.04 0.86 -0.87 -1.26 -5.00 114.94 109.08 2kq7 s ASN 29 Ca -0.15 0.08 -0.06 0.00 -1.57 0.00 0.00 52.86 51.15 2kq7 s ASN 29 Cb -0.01 -2.46 -0.01 0.00 -0.02 0.00 0.00 41.25 38.74 2kq7 s ASN 29 CO 0.51 -1.12 0.12 0.00 -2.57 0.00 0.00 177.10 174.03 2kq7 s ARG 30 N 3.93 0.61 0.02 -0.60 1.70 -1.26 -1.17 118.95 122.17 2kq7 s ARG 30 Ca 0.38 -0.72 0.06 0.00 -0.47 0.00 0.00 55.73 54.98 2kq7 s ARG 30 Cb -0.10 0.24 -0.02 0.00 -0.57 0.00 0.00 34.95 34.50 2kq7 s ARG 30 CO 0.26 -0.16 -0.18 0.96 -1.08 0.00 0.00 175.30 175.10 2kq7 s ILE 31 N -2.57 1.45 -1.04 4.99 -4.36 0.55 -4.73 121.20 115.49 2kq7 s ILE 31 Ca -0.05 -0.99 -0.24 0.00 -0.26 0.00 0.00 60.65 59.11 2kq7 s ILE 31 Cb -0.01 -1.25 -0.07 0.00 1.25 0.00 0.00 42.46 42.38 2kq7 s ILE 31 CO -0.04 0.23 1.94 -2.16 0.24 0.00 0.00 174.94 175.15 2kq7 s PRO 32 N -0.89 2.53 -0.28 0.37 0.04 -1.26 -3.98 135.00 131.53 2kq7 s PRO 32 Ca 0.06 -0.71 -0.12 0.00 0.04 0.00 0.00 61.00 60.28 2kq7 s PRO 32 Cb -0.08 -5.15 -0.05 0.00 0.04 0.00 0.00 34.50 29.26 2kq7 s PRO 32 CO 0.01 -3.65 0.22 0.08 0.04 0.00 0.00 177.00 173.69 2kq7 s VAL 33 N 10.49 5.29 -0.28 -0.36 1.01 -1.26 -2.04 120.40 133.25 2kq7 s VAL 33 Ca 0.69 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.89 2kq7 s VAL 33 Cb -0.04 -3.55 0.05 0.00 0.00 0.00 0.00 36.38 32.84 2kq7 s VAL 33 CO 0.06 0.23 -0.05 -0.63 0.00 0.00 0.00 175.10 174.71 2kq7 s ILE 34 N 1.80 2.65 -0.18 2.22 -1.09 -1.04 -3.50 121.20 122.07 2kq7 s ILE 34 Ca 0.08 -1.44 -0.24 0.00 -2.23 0.00 0.00 60.65 56.83 2kq7 s ILE 34 Cb -0.16 -2.51 -0.02 0.00 -1.58 0.00 0.00 42.46 38.19 2kq7 s ILE 34 CO 0.11 -0.04 0.75 0.00 -1.23 0.00 0.00 174.94 174.54 2kq7 s GLU 36 N 2.07 2.90 -0.19 0.00 2.02 0.76 -4.93 118.70 121.34 2kq7 s GLU 36 Ca 0.34 -0.97 -0.06 0.00 0.02 0.00 0.00 54.97 54.31 2kq7 s GLU 36 Cb -0.16 -2.59 -0.03 0.00 0.10 0.00 0.00 34.13 31.44 2kq7 s GLU 36 CO 0.11 0.44 0.02 0.21 0.02 0.00 0.00 175.26 176.07 2kq7 s LYS 37 N -3.46 3.77 0.76 1.61 2.20 -1.26 -1.87 119.74 121.49 2kq7 s LYS 37 Ca 0.32 -0.45 -0.12 0.00 -0.36 0.00 0.00 55.97 55.36 2kq7 s LYS 37 Cb -0.09 -3.12 0.06 0.00 -1.51 0.00 0.00 37.83 33.17 2kq7 s LYS 37 CO 0.24 0.15 1.12 0.00 -0.36 0.00 0.00 175.35 176.50 2kq7 s ALA 38 N 0.67 2.16 -0.05 3.13 0.00 -1.26 -4.96 121.76 121.44 2kq7 s ALA 38 Ca 0.01 0.46 0.13 0.00 0.00 0.00 0.00 51.96 52.56 2kq7 s ALA 38 Cb -0.14 -3.34 -0.12 0.00 0.00 0.00 0.00 23.12 19.52 2kq7 s ALA 38 CO 0.02 -1.83 1.07 0.93 0.00 0.00 0.00 175.76 175.95 2kq7 h GLU 39 N -0.88 0.00 -1.45 0.00 5.08 -1.99 -3.33 114.58 112.02 2kq7 h GLU 39 Ca -0.45 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.31 2kq7 h GLU 39 Cb 1.25 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.26 2kq7 h GLU 39 CO 0.50 0.57 0.76 1.17 -1.00 0.00 0.00 179.01 181.01 2kq7 n LYS 40 N -3.13 2.47 -4.22 2.33 4.81 -1.26 -4.91 118.16 114.26 2kq7 n LYS 40 Ca -0.06 -2.85 -0.17 0.00 -0.87 0.00 0.00 58.31 54.37 2kq7 n LYS 40 Cb 0.88 -2.12 -0.13 0.00 0.02 0.00 0.00 35.03 33.68 2kq7 n LYS 40 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2kq7 s SER 41 N -0.97 1.17 0.00 3.14 1.04 -1.25 -5.02 113.70 111.80 2kq7 s SER 41 Ca 0.54 -0.40 0.28 0.00 0.48 0.00 0.00 55.95 56.85 2kq7 s SER 41 Cb 0.42 -0.05 1.14 0.00 0.10 0.00 0.00 66.02 67.63 2kq7 s SER 41 CO -0.12 -0.03 1.79 -0.67 0.98 0.00 0.00 173.24 175.19 2kq7 n ASP 42 N 2.01 1.21 -4.73 7.02 2.03 -1.26 -4.89 116.55 117.94 2kq7 n ASP 42 Ca -0.18 -1.33 -0.41 0.00 0.52 0.00 0.00 54.79 53.39 2kq7 n ASP 42 Cb 0.55 0.01 -0.03 0.00 -0.72 0.00 0.00 41.12 40.93 2kq7 n ASP 42 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2kq7 s ILE 43 N -2.08 3.79 0.54 5.18 2.07 -1.26 -5.01 121.20 124.43 2kq7 s ILE 43 Ca 0.37 1.43 -0.20 0.00 -1.41 0.00 0.00 60.65 60.85 2kq7 s ILE 43 Cb 0.21 -3.92 -0.06 0.00 0.13 0.00 0.00 42.46 38.82 2kq7 s ILE 43 CO 0.37 0.19 1.13 -2.16 -1.91 0.00 0.00 174.94 172.56 2kq7 s PRO 44 N 0.17 3.38 -0.22 3.50 0.04 -1.26 -4.95 135.00 135.66 2kq7 s PRO 44 Ca 0.54 1.62 -0.29 0.00 0.04 0.00 0.00 61.00 62.91 2kq7 s PRO 44 Cb -0.31 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.18 2kq7 s PRO 44 CO 0.34 -0.83 1.56 -2.00 0.04 0.00 0.00 177.00 176.11 2kq7 s GLU 45 N -3.25 3.86 0.56 4.56 2.12 -1.26 -4.97 118.70 120.32 2kq7 s GLU 45 Ca 0.72 1.65 -0.21 0.00 0.36 0.00 0.00 54.97 57.49 2kq7 s GLU 45 Cb -0.24 -4.00 -0.04 0.00 0.26 0.00 0.00 34.13 30.11 2kq7 s GLU 45 CO 0.27 -1.21 1.34 -0.89 -0.54 0.00 0.00 175.26 174.23 2kq7 n ILE 46 N 6.27 4.01 0.03 -3.70 5.41 -1.26 -4.96 119.36 125.16 2kq7 n ILE 46 Ca 0.18 -0.50 -0.11 0.00 1.00 0.00 0.00 62.75 63.32 2kq7 n ILE 46 Cb 0.45 -1.63 -0.08 0.00 -0.71 0.00 0.00 39.64 37.67 2kq7 n ILE 46 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 2kq7 h ASP 47 N 1.28 -0.13 -1.46 4.38 1.82 -1.93 -3.43 116.42 116.94 2kq7 h ASP 47 Ca -0.51 -0.43 -0.67 0.00 -0.39 0.00 0.00 57.03 55.03 2kq7 h ASP 47 Cb 1.31 0.03 -0.00 0.00 0.68 0.00 0.00 39.33 41.36 2kq7 h ASP 47 CO 0.56 0.44 1.22 1.17 -1.61 0.00 0.00 179.24 181.02 2kq7 n LYS 48 N -4.89 1.40 0.00 0.28 4.81 -1.26 -4.89 118.16 113.62 2kq7 n LYS 48 Ca -0.08 0.46 -0.00 0.00 -0.87 0.00 0.00 58.31 57.82 2kq7 n LYS 48 Cb 0.28 -2.45 -0.00 0.00 0.02 0.00 0.00 35.03 32.88 2kq7 n LYS 48 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2kq7 h ARG 49 N 10.44 -0.00 -6.75 1.64 2.43 -1.98 -3.46 114.38 116.69 2kq7 h ARG 49 Ca -0.38 0.00 -0.49 0.00 -0.81 0.00 0.00 59.98 58.31 2kq7 h ARG 49 Cb 1.31 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.83 2kq7 h ARG 49 CO 0.99 -0.00 0.12 0.15 -1.51 0.00 0.00 179.97 179.72 2kq7 s LYS 50 N -1.40 4.04 -0.31 0.20 1.02 -1.26 -4.64 119.74 117.38 2kq7 s LYS 50 Ca -0.00 0.73 0.01 0.00 0.02 0.00 0.00 55.97 56.72 2kq7 s LYS 50 Cb 0.00 -2.43 0.10 0.00 -0.52 0.00 0.00 37.83 34.98 2kq7 s LYS 50 CO 0.00 0.15 0.07 0.71 -0.92 0.00 0.00 175.35 175.36 2kq7 s TYR 51 N -1.98 2.31 -0.78 3.18 2.02 -1.23 -5.06 117.35 115.81 2kq7 s TYR 51 Ca 0.54 -2.07 -0.26 0.00 -0.37 0.00 0.00 57.07 54.92 2kq7 s TYR 51 Cb -0.10 -2.03 -0.09 0.00 -0.40 0.00 0.00 41.96 39.34 2kq7 s TYR 51 CO 0.17 -0.89 2.19 -1.17 -1.57 0.00 0.00 175.55 174.28 2kq7 s LEU 52 N 1.41 3.07 -0.22 -1.29 1.98 -1.26 -4.21 118.68 118.16 2kq7 s LEU 52 Ca 0.09 -0.07 -0.09 0.00 -2.89 0.00 0.00 54.13 51.17 2kq7 s LEU 52 Cb -0.18 -2.55 -0.04 0.00 0.66 0.00 0.00 46.19 44.08 2kq7 s LEU 52 CO -0.19 -3.21 0.10 -0.69 -1.89 0.00 0.00 176.35 170.47 2kq7 s VAL 53 N 12.25 4.94 0.55 1.68 1.01 -1.26 -5.01 120.40 134.57 2kq7 s VAL 53 Ca 0.82 0.03 -0.19 0.00 0.00 0.00 0.00 61.98 62.65 2kq7 s VAL 53 Cb -0.11 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 2kq7 s VAL 53 CO 0.08 0.39 1.13 -2.16 0.00 0.00 0.00 175.10 174.54 2kq7 s PRO 54 N 0.88 3.30 0.31 2.72 0.04 -1.26 -0.33 135.00 140.66 2kq7 s PRO 54 Ca 0.05 1.59 0.22 0.00 0.04 0.00 0.00 61.00 62.91 2kq7 s PRO 54 Cb -0.13 -2.00 1.14 0.00 0.04 0.00 0.00 34.50 33.54 2kq7 s PRO 54 CO 0.03 -0.89 1.68 0.00 0.04 0.00 0.00 177.00 177.86 2kq7 n ALA 55 N -1.41 1.20 -0.95 8.56 0.00 -0.32 -0.89 120.51 126.69 2kq7 n ALA 55 Ca 0.11 0.17 0.07 0.00 0.00 0.00 0.00 53.44 53.80 2kq7 n ALA 55 Cb 0.51 -1.34 0.35 0.00 0.00 0.00 0.00 19.45 18.97 2kq7 n ALA 55 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2kq7 n ASP 56 N -2.27 4.98 -4.78 0.00 2.03 -1.26 -3.58 116.55 111.67 2kq7 n ASP 56 Ca -0.01 -2.99 -0.37 0.00 0.52 0.00 0.00 54.79 51.95 2kq7 n ASP 56 Cb 0.08 -0.63 -0.06 0.00 -0.72 0.00 0.00 41.12 39.79 2kq7 n ASP 56 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2kq7 s LEU 57 N -2.81 4.35 0.14 -2.67 1.98 -0.07 -4.93 118.68 114.67 2kq7 s LEU 57 Ca 0.50 1.81 0.09 0.00 -2.89 0.00 0.00 54.13 53.64 2kq7 s LEU 57 Cb 0.39 -3.97 -0.04 0.00 0.66 0.00 0.00 46.19 43.23 2kq7 s LEU 57 CO 0.13 -0.05 -0.13 0.42 -1.89 0.00 0.00 176.35 174.83 2kq7 s THR 58 N -1.59 3.09 0.21 3.68 -4.23 -1.26 -0.12 115.64 115.42 2kq7 s THR 58 Ca 0.49 -1.54 -0.11 0.00 -1.18 0.00 0.00 61.69 59.36 2kq7 s THR 58 Cb -0.19 -2.48 0.19 0.00 1.34 0.00 0.00 72.50 71.36 2kq7 s THR 58 CO 0.24 0.00 1.67 0.58 -0.54 0.00 0.00 174.62 176.57 2kq7 h VAL 59 N 3.12 0.53 -0.90 2.29 2.07 -1.00 -0.35 116.25 122.01 2kq7 h VAL 59 Ca -0.48 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.02 2kq7 h VAL 59 Cb 1.18 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 2kq7 h VAL 59 CO 0.51 0.03 0.58 1.23 0.02 0.00 0.00 177.57 179.94 2kq7 h GLY 60 N 0.15 1.31 1.04 2.17 0.00 -1.75 -0.91 103.07 105.08 2kq7 h GLY 60 Ca 0.32 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 2kq7 h GLY 60 CO -0.49 0.38 0.29 -1.61 0.00 0.00 0.00 176.54 175.11 2kq7 h GLN 61 N 1.13 1.14 -0.54 4.80 4.15 -1.39 -1.08 115.11 123.32 2kq7 h GLN 61 Ca 0.36 -0.21 -0.12 0.00 0.77 0.00 0.00 58.65 59.44 2kq7 h GLN 61 Cb 0.00 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.49 2kq7 h GLN 61 CO -0.12 0.94 -0.12 0.35 -1.93 0.00 0.00 178.83 177.95 2kq7 h PHE 62 N 1.10 1.17 -0.52 3.99 3.57 -0.69 -2.42 116.94 123.15 2kq7 h PHE 62 Ca 0.25 -0.25 -0.10 0.00 3.53 0.00 0.00 57.97 61.41 2kq7 h PHE 62 Cb 0.23 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2kq7 h PHE 62 CO 0.02 1.08 -0.06 0.28 -2.23 0.00 0.00 178.31 177.40 2kq7 h VAL 63 N 0.92 1.26 -0.22 1.41 2.07 -0.92 0.51 116.25 121.28 2kq7 h VAL 63 Ca 0.14 -1.17 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 2kq7 h VAL 63 Cb 0.70 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2kq7 h VAL 63 CO 0.05 0.41 0.08 1.88 0.02 0.00 0.00 177.57 180.01 2kq7 h TYR 64 N 0.84 0.35 -0.11 1.57 0.05 -1.07 -2.93 116.97 115.66 2kq7 h TYR 64 Ca 0.14 -0.03 -0.14 0.00 0.05 0.00 0.00 58.73 58.75 2kq7 h TYR 64 Cb 0.58 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.21 2kq7 h TYR 64 CO 0.04 0.41 -0.52 -0.39 -1.05 0.00 0.00 178.16 176.64 2kq7 h VAL 65 N 0.20 1.35 -0.43 -2.88 -1.51 -1.36 -3.22 116.25 108.40 2kq7 h VAL 65 Ca 0.07 -1.79 0.09 0.00 -1.23 0.00 0.00 66.70 63.84 2kq7 h VAL 65 Cb 0.21 1.84 -0.09 0.00 -2.13 0.00 0.00 31.29 31.12 2kq7 h VAL 65 CO -0.00 0.54 -0.14 0.40 -1.23 0.00 0.00 177.57 177.13 2kq7 h ILE 66 N 0.25 0.50 -0.91 7.19 1.08 -0.71 0.21 117.51 125.13 2kq7 h ILE 66 Ca 0.01 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.62 2kq7 h ILE 66 Cb 1.01 0.50 -0.07 0.00 -3.07 0.00 0.00 36.82 35.19 2kq7 h ILE 66 CO 0.09 0.00 0.58 -0.09 -0.69 0.00 0.00 178.15 178.04 2kq7 h ARG 67 N -0.04 0.69 0.00 2.37 2.43 -1.54 0.26 114.38 118.55 2kq7 h ARG 67 Ca 0.21 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.32 2kq7 h ARG 67 Cb 0.36 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2kq7 h ARG 67 CO -0.47 0.46 -0.07 -0.22 -1.51 0.00 0.00 179.97 178.15 2kq7 h LYS 68 N 0.71 0.00 -0.09 0.20 3.64 -1.04 -1.72 116.57 118.28 2kq7 h LYS 68 Ca 0.46 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.70 2kq7 h LYS 68 Cb 0.73 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.55 2kq7 h LYS 68 CO -0.22 0.07 -0.50 -0.09 -2.27 0.00 0.00 179.45 176.44 2kq7 h ARG 69 N 0.00 0.49 -0.32 1.90 9.65 0.24 -3.20 114.38 123.14 2kq7 h ARG 69 Ca -0.00 -0.41 0.00 0.00 -1.10 0.00 0.00 59.98 58.47 2kq7 h ARG 69 Cb 1.02 0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.69 2kq7 h ARG 69 CO 0.01 1.05 0.00 -0.89 2.80 0.00 0.00 179.97 182.94 2kq7 n ILE 70 N -4.25 0.41 -2.26 1.20 5.41 -0.63 -4.92 119.36 114.33 2kq7 n ILE 70 Ca -0.08 -0.58 -0.12 0.00 1.00 0.00 0.00 62.75 62.96 2kq7 n ILE 70 Cb 0.60 0.66 -0.01 0.00 -0.71 0.00 0.00 39.64 40.18 2kq7 n ILE 70 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 2kq7 n MET 71 N 0.98 -2.06 -1.93 0.38 2.81 -0.76 -4.88 117.12 111.66 2kq7 n MET 71 Ca 0.18 0.62 -0.41 0.00 -1.81 0.00 0.00 57.70 56.27 2kq7 n MET 71 Cb 0.48 -5.15 -0.02 0.00 -0.71 0.00 0.00 33.22 27.82 2kq7 n MET 71 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 2kq7 s LEU 72 N -5.27 4.37 0.91 4.03 2.96 -0.72 -4.99 118.68 119.96 2kq7 s LEU 72 Ca 0.00 2.83 -0.12 0.00 -0.22 0.00 0.00 54.13 56.62 2kq7 s LEU 72 Cb 0.00 -3.64 0.14 0.00 0.50 0.00 0.00 46.19 43.19 2kq7 s LEU 72 CO 0.00 -0.76 1.09 -2.16 -1.32 0.00 0.00 176.35 173.21 2kq7 s PRO 73 N -1.11 1.11 0.33 0.98 0.04 -1.26 -4.86 135.00 130.23 2kq7 s PRO 73 Ca 0.56 0.77 0.12 0.00 0.04 0.00 0.00 61.00 62.50 2kq7 s PRO 73 Cb -0.44 -1.80 0.57 0.00 0.04 0.00 0.00 34.50 32.88 2kq7 s PRO 73 CO 0.51 -2.33 1.73 -1.00 0.04 0.00 0.00 177.00 175.96 2kq7 h PRO 74 N -1.61 0.00 -0.87 0.56 0.13 -2.00 -3.04 132.00 125.18 2kq7 h PRO 74 Ca -0.50 0.00 0.24 0.00 -0.87 0.00 0.00 66.00 64.86 2kq7 h PRO 74 Cb 1.29 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.38 2kq7 h PRO 74 CO 0.55 0.47 0.61 0.93 -0.23 0.00 0.00 178.00 180.33 2kq7 h GLU 75 N 0.00 0.10 -5.08 0.86 5.08 -2.03 -3.42 114.58 110.09 2kq7 h GLU 75 Ca -0.00 -0.01 -0.52 0.00 -1.00 0.00 0.00 59.36 57.83 2kq7 h GLU 75 Cb 0.85 -0.02 -0.13 0.00 0.50 0.00 0.00 28.75 29.95 2kq7 h GLU 75 CO 0.06 0.07 -0.55 0.15 -1.00 0.00 0.00 179.01 177.74 2kq7 s LYS 76 N -5.10 1.81 0.23 2.33 1.02 -1.15 -5.18 119.74 113.71 2kq7 s LYS 76 Ca -0.06 -2.07 -0.15 0.00 0.02 0.00 0.00 55.97 53.71 2kq7 s LYS 76 Cb 0.22 -0.66 0.01 0.00 -0.52 0.00 0.00 37.83 36.88 2kq7 s LYS 76 CO 0.77 -0.38 0.50 0.00 -0.92 0.00 0.00 175.35 175.33 2kq7 s ALA 77 N -3.28 -0.53 0.14 5.17 0.00 -1.26 -4.68 121.76 117.32 2kq7 s ALA 77 Ca 0.28 -0.63 -0.02 0.00 0.00 0.00 0.00 51.96 51.58 2kq7 s ALA 77 Cb 0.05 0.96 -0.03 0.00 0.00 0.00 0.00 23.12 24.10 2kq7 s ALA 77 CO 0.15 -0.85 0.11 0.96 0.00 0.00 0.00 175.76 176.12 2kq7 s ILE 78 N -3.96 0.09 0.08 0.00 -4.36 -1.26 -4.58 121.20 107.21 2kq7 s ILE 78 Ca 0.17 -1.83 -0.07 0.00 -0.26 0.00 0.00 60.65 58.66 2kq7 s ILE 78 Cb -0.01 -2.06 -0.01 0.00 1.25 0.00 0.00 42.46 41.63 2kq7 s ILE 78 CO 0.05 -0.39 0.14 0.72 0.24 0.00 0.00 174.94 175.70 2kq7 s PHE 79 N -4.05 0.26 -0.12 1.37 -0.71 -0.53 -4.95 117.98 109.26 2kq7 s PHE 79 Ca 0.24 -0.72 -0.02 0.00 -1.04 0.00 0.00 56.93 55.40 2kq7 s PHE 79 Cb 0.07 -0.15 -0.03 0.00 -1.21 0.00 0.00 43.02 41.70 2kq7 s PHE 79 CO 0.03 -0.51 -0.05 0.42 -1.34 0.00 0.00 175.22 173.76 2kq7 s ILE 80 N -3.88 3.80 0.01 -4.49 -1.09 -1.26 -2.42 121.20 111.86 2kq7 s ILE 80 Ca 0.06 -0.41 0.02 0.00 -2.23 0.00 0.00 60.65 58.09 2kq7 s ILE 80 Cb 0.06 -2.62 -0.01 0.00 -1.58 0.00 0.00 42.46 38.31 2kq7 s ILE 80 CO -0.10 0.54 -0.07 0.72 -1.23 0.00 0.00 174.94 174.80 2kq7 s PHE 81 N -0.13 0.64 -0.19 3.97 -0.71 0.18 -4.78 117.98 116.97 2kq7 s PHE 81 Ca 0.02 -0.22 -0.03 0.00 -1.04 0.00 0.00 56.93 55.65 2kq7 s PHE 81 Cb -0.13 -0.40 -0.02 0.00 -1.21 0.00 0.00 43.02 41.27 2kq7 s PHE 81 CO 0.03 -0.02 -0.05 0.54 -1.34 0.00 0.00 175.22 174.37 2kq7 s VAL 82 N -0.52 3.52 -1.35 -2.49 0.11 0.94 -0.82 120.40 119.80 2kq7 s VAL 82 Ca -0.01 -0.47 -0.01 0.00 -2.93 0.00 0.00 61.98 58.57 2kq7 s VAL 82 Cb -0.05 -2.57 0.01 0.00 -1.53 0.00 0.00 36.38 32.24 2kq7 s VAL 82 CO 0.00 0.46 0.64 0.59 -3.33 0.00 0.00 175.10 173.46 2kq7 n ASN 83 N 4.18 -1.17 -1.63 3.54 4.13 -1.26 -0.08 115.26 122.96 2kq7 n ASN 83 Ca -0.18 -0.87 -0.20 0.00 1.68 0.00 0.00 54.58 55.01 2kq7 n ASN 83 Cb 0.52 -3.76 -0.07 0.00 -1.54 0.00 0.00 39.78 34.92 2kq7 n ASN 83 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2kq7 n ASP 84 N -3.02 -5.44 -4.31 6.41 2.03 -1.26 -4.96 116.55 106.00 2kq7 n ASP 84 Ca -0.28 0.42 -0.32 0.00 0.52 0.00 0.00 54.79 55.13 2kq7 n ASP 84 Cb 0.67 -4.66 -0.15 0.00 -0.72 0.00 0.00 41.12 36.26 2kq7 n ASP 84 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2kq7 s THR 85 N -2.78 2.54 -0.52 5.18 2.01 0.88 -5.08 115.64 117.87 2kq7 s THR 85 Ca 0.00 -0.86 0.04 0.00 0.31 0.00 0.00 61.69 61.18 2kq7 s THR 85 Cb 0.00 -2.01 0.13 0.00 0.01 0.00 0.00 72.50 70.63 2kq7 s THR 85 CO 0.00 0.55 0.26 -0.22 -0.69 0.00 0.00 174.62 174.52 2kq7 s LEU 86 N 0.15 4.31 0.96 4.42 2.96 -1.26 -0.04 118.68 130.19 2kq7 s LEU 86 Ca -0.10 -3.03 -0.12 0.00 -0.22 0.00 0.00 54.13 50.65 2kq7 s LEU 86 Cb -0.16 -1.64 0.17 0.00 0.50 0.00 0.00 46.19 45.06 2kq7 s LEU 86 CO 0.06 -0.23 1.09 -2.16 -1.32 0.00 0.00 176.35 173.80 2kq7 s PRO 87 N -0.32 0.71 1.07 0.98 0.04 -1.26 -5.04 135.00 131.18 2kq7 s PRO 87 Ca 0.17 0.62 -0.14 0.00 0.04 0.00 0.00 61.00 61.68 2kq7 s PRO 87 Cb -0.26 -1.76 0.22 0.00 0.04 0.00 0.00 34.50 32.75 2kq7 s PRO 87 CO -0.00 -2.57 1.10 -1.25 0.04 0.00 0.00 177.00 174.32 2kq7 s PRO 88 N -4.96 -0.16 0.19 0.56 0.04 -1.26 -4.94 135.00 124.48 2kq7 s PRO 88 Ca 0.65 0.32 -0.07 0.00 0.04 0.00 0.00 61.00 61.94 2kq7 s PRO 88 Cb -0.18 -1.69 0.10 0.00 0.04 0.00 0.00 34.50 32.77 2kq7 s PRO 88 CO 0.57 -3.08 1.57 1.79 0.04 0.00 0.00 177.00 177.89 2kq7 h THR 89 N -2.14 1.28 0.00 1.26 1.35 -1.96 -2.74 112.91 109.96 2kq7 h THR 89 Ca -0.52 -1.45 -0.02 0.00 -0.55 0.00 0.00 66.41 63.88 2kq7 h THR 89 Cb 1.32 1.29 -0.00 0.00 -1.73 0.00 0.00 68.15 69.04 2kq7 h THR 89 CO 0.51 0.48 -0.07 0.00 -0.25 0.00 0.00 175.52 176.19 2kq7 h ALA 90 N 0.96 1.22 -1.57 6.62 0.00 -1.96 -2.67 119.26 121.86 2kq7 h ALA 90 Ca 0.08 -0.07 -0.68 0.00 0.00 0.00 0.00 54.91 54.24 2kq7 h ALA 90 Cb 0.84 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.63 2kq7 h ALA 90 CO 0.07 0.09 1.12 0.00 0.00 0.00 0.00 179.25 180.53 2kq7 n ALA 91 N -2.22 0.53 -2.49 0.00 0.00 -1.03 -4.79 120.51 110.51 2kq7 n ALA 91 Ca -0.02 0.22 -0.42 0.00 0.00 0.00 0.00 53.44 53.23 2kq7 n ALA 91 Cb 0.20 -2.41 -0.04 0.00 0.00 0.00 0.00 19.45 17.21 2kq7 n ALA 91 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2kq7 s LEU 92 N 4.84 4.43 0.25 0.00 1.98 -1.26 -1.73 118.68 127.19 2kq7 s LEU 92 Ca 1.00 1.76 -0.03 0.00 -2.89 0.00 0.00 54.13 53.96 2kq7 s LEU 92 Cb -0.89 -3.58 0.41 0.00 0.66 0.00 0.00 46.19 42.79 2kq7 s LEU 92 CO 0.56 -0.19 1.84 0.24 -1.89 0.00 0.00 176.35 176.91 2kq7 h MET 93 N 6.24 0.94 -0.09 1.98 2.86 -0.79 0.51 114.93 126.58 2kq7 h MET 93 Ca -0.42 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.19 2kq7 h MET 93 Cb 1.22 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 32.66 2kq7 h MET 93 CO 0.74 0.62 0.08 1.03 1.06 0.00 0.00 176.91 180.44 2kq7 h SER 94 N 0.96 0.00 0.15 1.22 0.87 -1.76 0.37 113.55 115.35 2kq7 h SER 94 Ca 0.42 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 60.68 2kq7 h SER 94 Cb 0.29 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2kq7 h SER 94 CO -0.21 0.00 -1.46 0.00 -0.53 0.00 0.00 176.83 174.63 2kq7 h ALA 95 N 1.92 0.13 0.00 6.23 0.00 -1.27 -3.24 119.26 123.03 2kq7 h ALA 95 Ca 0.04 -1.06 -0.04 0.00 0.00 0.00 0.00 54.91 53.85 2kq7 h ALA 95 Cb 0.21 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2kq7 h ALA 95 CO -0.00 0.84 -0.21 0.82 0.00 0.00 0.00 179.25 180.69 2kq7 h ILE 96 N -0.17 0.50 -0.15 0.00 1.08 -0.60 -3.05 117.51 115.12 2kq7 h ILE 96 Ca -0.30 -1.11 -0.21 0.00 -0.39 0.00 0.00 64.86 62.84 2kq7 h ILE 96 Cb 1.87 1.78 0.01 0.00 -3.07 0.00 0.00 36.82 37.41 2kq7 h ILE 96 CO 0.11 0.21 -0.75 0.22 -0.69 0.00 0.00 178.15 177.25 2kq7 h TYR 97 N 0.00 0.99 -0.02 1.37 3.20 -0.41 -1.66 116.97 120.44 2kq7 h TYR 97 Ca -0.00 -0.43 -0.08 0.00 3.14 0.00 0.00 58.73 61.36 2kq7 h TYR 97 Cb 0.76 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 2kq7 h TYR 97 CO 0.00 1.25 -0.35 0.37 -1.64 0.00 0.00 178.16 177.79 2kq7 h GLN 98 N 0.51 0.03 0.00 1.82 5.75 -1.56 0.42 115.11 122.08 2kq7 h GLN 98 Ca -0.04 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2kq7 h GLN 98 Cb 1.37 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.92 2kq7 h GLN 98 CO 0.15 0.38 -0.00 1.49 -2.65 0.00 0.00 178.83 178.20 2kq7 h GLU 99 N 0.03 0.00 -0.73 1.69 4.81 -1.49 -3.30 114.58 115.60 2kq7 h GLU 99 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2kq7 h GLU 99 Cb 0.63 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.01 2kq7 h GLU 99 CO 0.05 0.94 0.00 0.72 -0.73 0.00 0.00 179.01 179.99 2kq7 n HIS 100 N -4.64 1.27 -1.59 0.92 8.25 -0.63 -4.94 115.22 113.86 2kq7 n HIS 100 Ca -0.10 -0.44 -0.47 0.00 -0.26 0.00 0.00 57.72 56.45 2kq7 n HIS 100 Cb 0.45 -0.34 -0.05 0.00 1.12 0.00 0.00 29.99 31.17 2kq7 n HIS 100 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2kq7 n LYS 101 N 0.41 1.90 -1.06 -0.41 4.81 0.15 -4.48 118.16 119.48 2kq7 n LYS 101 Ca 0.17 0.61 -0.35 0.00 -0.87 0.00 0.00 58.31 57.87 2kq7 n LYS 101 Cb 0.82 -2.83 0.08 0.00 0.02 0.00 0.00 35.03 33.12 2kq7 n LYS 101 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2kq7 n ASP 102 N 9.20 -2.32 0.08 3.14 2.03 0.02 -4.73 116.55 123.97 2kq7 n ASP 102 Ca 0.29 0.45 0.20 0.00 0.52 0.00 0.00 54.79 56.25 2kq7 n ASP 102 Cb 0.34 -1.13 0.75 0.00 -0.72 0.00 0.00 41.12 40.36 2kq7 n ASP 102 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2kq7 h LYS 103 N -0.85 0.00 -0.34 -0.67 1.57 -1.90 0.14 116.57 114.51 2kq7 h LYS 103 Ca -0.44 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.12 2kq7 h LYS 103 Cb 1.32 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.49 2kq7 h LYS 103 CO 0.37 0.00 -0.35 -0.25 -0.57 0.00 0.00 179.45 178.65 2kq7 n ASP 104 N -3.87 2.96 -2.47 0.86 8.00 -1.26 -5.02 116.55 115.74 2kq7 n ASP 104 Ca 0.08 -3.83 -0.03 0.00 0.71 0.00 0.00 54.79 51.71 2kq7 n ASP 104 Cb 0.60 -0.55 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 2kq7 n ASP 104 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kq7 n GLY 105 N -1.03 -4.68 3.54 0.44 0.00 0.47 -5.09 105.19 98.85 2kq7 n GLY 105 Ca 0.32 1.12 0.03 0.00 0.00 0.00 0.00 46.02 47.49 2kq7 n GLY 105 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kq7 s PHE 106 N -0.86 -0.00 -0.02 1.61 0.08 -1.26 -4.80 117.98 112.72 2kq7 s PHE 106 Ca -0.16 0.01 -0.27 0.00 0.12 0.00 0.00 56.93 56.62 2kq7 s PHE 106 Cb 0.01 0.00 -0.03 0.00 -0.57 0.00 0.00 43.02 42.43 2kq7 s PHE 106 CO 0.68 -0.00 0.84 -1.17 -0.10 0.00 0.00 175.22 175.47 2kq7 s LEU 107 N 1.22 4.35 -0.18 -0.37 1.98 -0.86 -0.80 118.68 124.02 2kq7 s LEU 107 Ca -0.06 1.44 -0.00 0.00 -2.89 0.00 0.00 54.13 52.62 2kq7 s LEU 107 Cb -0.02 -3.34 0.01 0.00 0.66 0.00 0.00 46.19 43.50 2kq7 s LEU 107 CO -0.11 -0.18 -0.15 -0.31 -1.89 0.00 0.00 176.35 173.72 2kq7 s TYR 108 N 0.84 2.82 0.05 5.38 2.02 -1.26 -2.50 117.35 124.69 2kq7 s TYR 108 Ca 0.45 -1.27 0.03 0.00 -0.37 0.00 0.00 57.07 55.90 2kq7 s TYR 108 Cb -0.20 -1.96 -0.02 0.00 -0.40 0.00 0.00 41.96 39.38 2kq7 s TYR 108 CO 0.23 -0.64 -0.09 0.14 -1.57 0.00 0.00 175.55 173.63 2kq7 s VAL 109 N 1.19 0.63 -0.07 0.71 -7.23 -1.09 -4.55 120.40 109.99 2kq7 s VAL 109 Ca 0.02 -1.11 0.06 0.00 -1.81 0.00 0.00 61.98 59.14 2kq7 s VAL 109 Cb -0.14 -0.68 -0.01 0.00 0.56 0.00 0.00 36.38 36.11 2kq7 s VAL 109 CO -0.06 -0.35 -0.25 -0.89 -0.31 0.00 0.00 175.10 173.24 2kq7 s THR 110 N -1.35 2.05 -0.09 5.32 2.01 0.00 -0.17 115.64 123.41 2kq7 s THR 110 Ca -0.09 -1.05 0.01 0.00 0.31 0.00 0.00 61.69 60.88 2kq7 s THR 110 Cb -0.10 -1.74 -0.02 0.00 0.01 0.00 0.00 72.50 70.65 2kq7 s THR 110 CO 0.01 0.57 -0.13 -0.72 -0.69 0.00 0.00 174.62 173.65 2kq7 s TYR 111 N -0.04 2.78 0.18 4.92 1.13 -0.78 -0.64 117.35 124.89 2kq7 s TYR 111 Ca -0.07 -0.39 -0.24 0.00 -1.41 0.00 0.00 57.07 54.96 2kq7 s TYR 111 Cb -0.15 -1.75 0.05 0.00 -1.10 0.00 0.00 41.96 39.02 2kq7 s TYR 111 CO 0.05 -0.01 0.91 0.45 -2.51 0.00 0.00 175.55 174.44 2kq7 s SER 112 N -0.17 -0.19 -0.13 -0.18 0.15 -1.02 -4.29 113.70 107.87 2kq7 s SER 112 Ca -0.00 -0.46 0.13 0.00 0.70 0.00 0.00 55.95 56.32 2kq7 s SER 112 Cb -0.13 0.55 0.60 0.00 -1.71 0.00 0.00 66.02 65.32 2kq7 s SER 112 CO 0.03 -1.01 1.46 0.61 1.20 0.00 0.00 173.24 175.53 2kq7 n GLY 113 N -0.47 2.36 3.28 9.45 0.00 -1.26 -1.46 105.19 117.09 2kq7 n GLY 113 Ca -0.06 -0.69 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 2kq7 n GLY 113 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kq7 s GLU 114 N -2.02 0.97 -0.00 1.61 -1.05 -1.26 -4.87 118.70 112.08 2kq7 s GLU 114 Ca 0.41 -0.74 0.03 0.00 -0.15 0.00 0.00 54.97 54.52 2kq7 s GLU 114 Cb 0.29 0.42 -0.03 0.00 -0.44 0.00 0.00 34.13 34.36 2kq7 s GLU 114 CO 0.17 -0.36 0.09 -1.71 0.95 0.00 0.00 175.26 174.40 2kq7 n ASN 115 N -0.07 1.36 -2.11 0.83 4.05 -1.26 -4.94 115.26 113.12 2kq7 n ASN 115 Ca -0.16 -0.40 -0.21 0.00 0.45 0.00 0.00 54.58 54.26 2kq7 n ASN 115 Cb 0.63 1.03 -0.04 0.00 1.23 0.00 0.00 39.78 42.63 2kq7 n ASN 115 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 177.26 174.62 2kq7 n THR 116 N -1.21 -0.63 -4.53 -0.44 -1.04 -1.26 -4.97 114.28 100.20 2kq7 n THR 116 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.77 2kq7 n THR 116 Cb 0.05 -2.62 -0.11 0.00 -1.82 0.00 0.00 70.33 65.83 2kq7 n THR 116 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2kq7 s PHE 117 N -2.94 2.24 0.00 -1.42 0.08 -1.26 -5.17 117.98 109.51 2kq7 s PHE 117 Ca 0.00 -0.80 0.00 0.00 0.12 0.00 0.00 56.93 56.25 2kq7 s PHE 117 Cb 0.00 -1.52 0.00 0.00 -0.57 0.00 0.00 43.02 40.93 2kq7 s PHE 117 CO 0.00 0.24 0.00 0.41 -0.10 0.00 0.00 175.22 175.77 2kq7 n GLY 118 N -0.82 4.04 0.00 4.36 0.00 -1.26 -5.23 105.19 106.28 2kq7 n GLY 118 Ca -0.04 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.30 2kq7 n GLY 118 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36