#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 0.00 -4.88 1.61 0.87 -2.03 -3.44 113.55 105.68 2kq7 h SER 2 Ca 0.00 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.35 2kq7 h SER 2 Cb 0.00 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 61.76 2kq7 h SER 2 CO 0.00 0.30 -0.71 -0.32 -0.53 0.00 0.00 176.83 175.57 2kq7 s MET 3 N -4.32 0.50 -0.25 2.24 0.00 -1.26 -5.14 119.30 111.07 2kq7 s MET 3 Ca -0.03 -0.83 -0.03 0.00 0.00 0.00 0.00 55.69 54.80 2kq7 s MET 3 Cb 0.15 -0.07 0.11 0.00 0.00 0.00 0.00 34.83 35.01 2kq7 s MET 3 CO 0.71 -0.02 0.22 0.21 0.00 0.00 0.00 175.02 176.14 2kq7 s LYS 4 N -2.11 0.23 0.30 4.11 2.20 -1.26 -5.13 119.74 118.08 2kq7 s LYS 4 Ca -0.07 -0.10 -0.29 0.00 -0.36 0.00 0.00 55.97 55.15 2kq7 s LYS 4 Cb -0.06 -1.04 -0.13 0.00 -1.51 0.00 0.00 37.83 35.09 2kq7 s LYS 4 CO -0.02 -0.87 1.22 -1.13 -0.36 0.00 0.00 175.35 174.19 2kq7 n SER 5 N 5.30 2.28 -0.07 1.43 3.41 -1.26 -4.92 113.62 119.79 2kq7 n SER 5 Ca -0.04 1.19 -0.08 0.00 -0.26 0.00 0.00 58.87 59.67 2kq7 n SER 5 Cb 0.47 -1.41 -0.08 0.00 -0.26 0.00 0.00 64.21 62.93 2kq7 n SER 5 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2kq7 n THR 6 N 0.62 0.84 -2.52 6.66 -2.24 -1.26 -4.93 114.28 111.46 2kq7 n THR 6 Ca 0.08 -0.43 -0.43 0.00 -2.27 0.00 0.00 64.05 61.00 2kq7 n THR 6 Cb 0.34 -0.85 -0.02 0.00 -2.10 0.00 0.00 70.33 67.70 2kq7 n THR 6 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2kq7 s PHE 7 N -2.30 2.75 0.27 4.78 0.08 -1.26 -4.88 117.98 117.42 2kq7 s PHE 7 Ca -0.13 0.81 0.18 0.00 0.12 0.00 0.00 56.93 57.91 2kq7 s PHE 7 Cb 0.04 -4.20 0.79 0.00 -0.57 0.00 0.00 43.02 39.08 2kq7 s PHE 7 CO 0.42 -1.43 1.80 1.57 -0.10 0.00 0.00 175.22 177.49 2kq7 h LYS 8 N 9.39 0.00 -0.78 0.44 2.10 -1.92 -3.10 116.57 122.71 2kq7 h LYS 8 Ca -0.24 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 58.56 2kq7 h LYS 8 Cb 1.08 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 32.31 2kq7 h LYS 8 CO 1.09 0.35 0.33 1.03 -2.00 0.00 0.00 179.45 180.25 2kq7 h SER 9 N 0.00 0.32 0.91 7.07 0.87 -2.01 -2.46 113.55 118.25 2kq7 h SER 9 Ca -0.00 0.11 -0.04 0.00 -1.23 0.00 0.00 61.79 60.62 2kq7 h SER 9 Cb 0.76 0.08 0.01 0.00 -0.44 0.00 0.00 62.40 62.80 2kq7 h SER 9 CO 0.05 0.12 -0.44 -0.08 -0.53 0.00 0.00 176.83 175.95 2kq7 h GLU 10 N 0.47 -1.17 -3.31 2.24 4.57 -1.96 -3.47 114.58 111.94 2kq7 h GLU 10 Ca 0.43 0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 58.65 2kq7 h GLU 10 Cb 0.65 0.27 -0.12 0.00 -0.16 0.00 0.00 28.75 29.39 2kq7 h GLU 10 CO -0.40 -0.78 -0.01 0.71 -1.18 0.00 0.00 179.01 177.34 2kq7 s TYR 11 N -5.95 -0.25 0.98 0.92 2.02 -0.93 -5.17 117.35 108.97 2kq7 s TYR 11 Ca -0.19 -0.05 -0.12 0.00 -0.37 0.00 0.00 57.07 56.34 2kq7 s TYR 11 Cb 0.02 0.33 0.18 0.00 -0.40 0.00 0.00 41.96 42.09 2kq7 s TYR 11 CO 0.60 -0.75 1.09 -1.25 -1.57 0.00 0.00 175.55 173.67 2kq7 s PRO 12 N -3.80 0.58 0.00 -1.71 0.04 -1.26 -4.41 135.00 124.44 2kq7 s PRO 12 Ca 0.03 0.58 0.10 0.00 0.04 0.00 0.00 61.00 61.75 2kq7 s PRO 12 Cb 0.01 -1.75 -0.23 0.00 0.04 0.00 0.00 34.50 32.57 2kq7 s PRO 12 CO -0.11 -2.65 0.84 0.27 0.04 0.00 0.00 177.00 175.39 2kq7 h PHE 13 N -1.83 0.02 -0.53 0.56 -5.15 -1.98 -3.34 116.94 104.70 2kq7 h PHE 13 Ca -0.54 -0.02 -0.09 0.00 -0.20 0.00 0.00 57.97 57.12 2kq7 h PHE 13 Cb 1.32 -0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.47 2kq7 h PHE 13 CO 0.32 1.03 -0.05 1.49 -2.00 0.00 0.00 178.31 179.10 2kq7 h GLU 14 N 0.00 0.93 -5.27 6.09 4.22 -2.04 -3.47 114.58 115.05 2kq7 h GLU 14 Ca -0.21 -0.30 -0.35 0.00 0.08 0.00 0.00 59.36 58.58 2kq7 h GLU 14 Cb 1.95 -0.08 0.12 0.00 0.50 0.00 0.00 28.75 31.24 2kq7 h GLU 14 CO 0.10 0.95 -0.60 1.63 -2.18 0.00 0.00 179.01 178.91 2kq7 n LYS 15 N -4.17 -7.03 -1.72 1.92 5.02 -1.26 -4.91 118.16 106.01 2kq7 n LYS 15 Ca 0.02 0.73 -0.42 0.00 -2.02 0.00 0.00 58.31 56.62 2kq7 n LYS 15 Cb 0.35 -5.48 -0.03 0.00 -0.02 0.00 0.00 35.03 29.85 2kq7 n LYS 15 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2kq7 s ARG 16 N -6.14 4.12 -0.12 1.97 3.00 -1.26 -4.99 118.95 115.53 2kq7 s ARG 16 Ca 0.51 2.61 0.02 0.00 -1.00 0.00 0.00 55.73 57.87 2kq7 s ARG 16 Cb -0.22 -3.19 0.01 0.00 0.00 0.00 0.00 34.95 31.55 2kq7 s ARG 16 CO 0.64 -0.78 -0.19 -1.59 0.00 0.00 0.00 175.30 173.38 2kq7 s LYS 17 N 1.53 2.66 0.40 5.12 0.00 -1.26 -5.01 119.74 123.19 2kq7 s LYS 17 Ca 0.76 -0.73 0.13 0.00 0.00 0.00 0.00 55.97 56.14 2kq7 s LYS 17 Cb -0.49 -2.17 0.97 0.00 0.00 0.00 0.00 37.83 36.14 2kq7 s LYS 17 CO 0.33 -0.01 1.91 0.00 0.00 0.00 0.00 175.35 177.58 2kq7 h ALA 18 N 7.29 2.01 -0.33 0.59 0.00 -2.01 -1.77 119.26 125.04 2kq7 h ALA 18 Ca -0.30 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.67 2kq7 h ALA 18 Cb 1.19 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 2kq7 h ALA 18 CO 0.52 -0.22 -0.05 1.49 0.00 0.00 0.00 179.25 180.99 2kq7 h GLU 19 N 0.51 0.03 -0.84 0.00 4.81 -2.00 -1.54 114.58 115.55 2kq7 h GLU 19 Ca 0.38 -0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.73 2kq7 h GLU 19 Cb 0.77 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.06 2kq7 h GLU 19 CO -0.14 0.02 0.46 1.03 -0.73 0.00 0.00 179.01 179.65 2kq7 h SER 20 N 0.03 0.62 0.46 1.04 0.87 -1.75 -0.76 113.55 114.07 2kq7 h SER 20 Ca 0.16 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 2kq7 h SER 20 Cb 0.23 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 2kq7 h SER 20 CO -0.31 0.32 -0.46 -0.08 -0.53 0.00 0.00 176.83 175.77 2kq7 h GLU 21 N 0.73 -0.88 -0.95 2.24 4.57 -1.26 0.25 114.58 119.27 2kq7 h GLU 21 Ca 0.42 0.06 0.12 0.00 -1.18 0.00 0.00 59.36 58.78 2kq7 h GLU 21 Cb 0.48 0.20 -0.08 0.00 -0.16 0.00 0.00 28.75 29.20 2kq7 h GLU 21 CO -0.29 -0.59 0.61 -0.09 -1.18 0.00 0.00 179.01 177.47 2kq7 h ARG 22 N -0.92 0.88 -0.17 1.92 9.65 -1.14 0.14 114.38 124.74 2kq7 h ARG 22 Ca -0.06 -0.05 -0.08 0.00 -1.10 0.00 0.00 59.98 58.69 2kq7 h ARG 22 Cb 0.79 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.16 2kq7 h ARG 22 CO -0.05 0.58 -0.25 0.82 2.80 0.00 0.00 179.97 183.87 2kq7 h ILE 23 N 0.90 1.25 0.00 1.20 2.04 -0.64 -1.53 117.51 120.73 2kq7 h ILE 23 Ca 0.47 -1.16 -0.08 0.00 1.00 0.00 0.00 64.86 65.09 2kq7 h ILE 23 Cb 0.52 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2kq7 h ILE 23 CO -0.23 0.36 -0.37 0.00 0.00 0.00 0.00 178.15 177.90 2kq7 h ALA 24 N 1.47 1.26 0.00 1.87 0.00 0.15 0.70 119.26 124.71 2kq7 h ALA 24 Ca 0.04 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.43 2kq7 h ALA 24 Cb 0.59 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2kq7 h ALA 24 CO 0.04 0.47 -1.16 0.22 0.00 0.00 0.00 179.25 178.82 2kq7 h ASP 25 N 0.00 0.00 1.03 0.00 1.82 -1.00 -3.33 116.42 114.95 2kq7 h ASP 25 Ca -0.00 0.00 -0.17 0.00 -0.39 0.00 0.00 57.03 56.47 2kq7 h ASP 25 Cb 0.71 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.70 2kq7 h ASP 25 CO 0.05 0.72 -1.03 0.03 -1.61 0.00 0.00 179.24 177.40 2kq7 h ARG 26 N 0.00 0.00 -4.89 0.28 3.08 -1.04 -3.43 114.38 108.38 2kq7 h ARG 26 Ca -0.12 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.26 2kq7 h ARG 26 Cb 1.65 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 31.37 2kq7 h ARG 26 CO 0.07 0.53 -0.75 -0.06 -1.07 0.00 0.00 179.97 178.69 2kq7 s PHE 27 N -2.86 3.10 -0.15 3.04 0.08 0.22 -4.99 117.98 116.42 2kq7 s PHE 27 Ca 0.00 -1.70 -0.21 0.00 0.12 0.00 0.00 56.93 55.14 2kq7 s PHE 27 Cb 0.08 -2.04 -0.19 0.00 -0.57 0.00 0.00 43.02 40.30 2kq7 s PHE 27 CO 0.79 -0.76 0.48 0.87 -0.10 0.00 0.00 175.22 176.50 2kq7 h LYS 28 N 7.98 0.00 -4.68 0.44 1.57 -1.85 -3.43 116.57 116.60 2kq7 h LYS 28 Ca -0.30 0.00 -0.71 0.00 -1.87 0.00 0.00 60.65 57.77 2kq7 h LYS 28 Cb 1.10 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.21 2kq7 h LYS 28 CO 0.56 0.77 -0.12 0.54 -0.57 0.00 0.00 179.45 180.63 2kq7 s ASN 29 N -6.19 6.19 0.06 0.86 2.20 -1.26 -5.04 114.94 111.76 2kq7 s ASN 29 Ca -0.17 -1.08 0.04 0.00 -0.94 0.00 0.00 52.86 50.71 2kq7 s ASN 29 Cb -0.01 -2.24 -0.03 0.00 -2.00 0.00 0.00 41.25 36.97 2kq7 s ASN 29 CO 0.52 -0.78 -0.11 0.00 -2.94 0.00 0.00 177.10 173.80 2kq7 s ARG 30 N 2.20 0.68 -0.19 3.55 1.04 -1.26 -2.23 118.95 122.74 2kq7 s ARG 30 Ca 0.10 -0.88 0.00 0.00 -1.04 0.00 0.00 55.73 53.91 2kq7 s ARG 30 Cb -0.21 -0.54 0.01 0.00 -2.04 0.00 0.00 34.95 32.17 2kq7 s ARG 30 CO 0.10 0.11 -0.17 0.96 -0.04 0.00 0.00 175.30 176.25 2kq7 s ILE 31 N -1.45 2.30 -1.02 4.99 -4.36 -0.49 -4.87 121.20 116.31 2kq7 s ILE 31 Ca -0.05 -0.86 -0.24 0.00 -0.26 0.00 0.00 60.65 59.24 2kq7 s ILE 31 Cb -0.09 -1.98 -0.06 0.00 1.25 0.00 0.00 42.46 41.57 2kq7 s ILE 31 CO 0.01 0.52 1.94 -2.16 0.24 0.00 0.00 174.94 175.49 2kq7 s PRO 32 N 1.32 2.53 0.09 0.37 0.04 -1.26 -3.96 135.00 134.12 2kq7 s PRO 32 Ca 0.05 -0.65 -0.12 0.00 0.04 0.00 0.00 61.00 60.32 2kq7 s PRO 32 Cb -0.13 -5.14 -0.06 0.00 0.04 0.00 0.00 34.50 29.21 2kq7 s PRO 32 CO -0.11 -3.63 0.46 0.14 0.04 0.00 0.00 177.00 173.89 2kq7 s VAL 33 N 10.49 5.00 -0.37 -0.36 -7.23 -1.26 -3.54 120.40 123.12 2kq7 s VAL 33 Ca 0.69 0.65 0.02 0.00 -1.81 0.00 0.00 61.98 61.53 2kq7 s VAL 33 Cb -0.04 -3.69 0.11 0.00 0.56 0.00 0.00 36.38 33.32 2kq7 s VAL 33 CO 0.05 0.32 0.14 -0.63 -0.31 0.00 0.00 175.10 174.67 2kq7 s ILE 34 N -1.37 1.58 -0.12 -0.62 1.01 -0.83 -3.56 121.20 117.29 2kq7 s ILE 34 Ca 0.33 -2.16 -0.29 0.00 0.00 0.00 0.00 60.65 58.53 2kq7 s ILE 34 Cb -0.15 -2.15 -0.01 0.00 0.01 0.00 0.00 42.46 40.16 2kq7 s ILE 34 CO 0.18 -0.72 1.01 0.00 0.00 0.00 0.00 174.94 175.40 2kq7 s GLU 36 N 2.14 2.48 -0.10 0.00 2.02 -0.55 -4.98 118.70 119.72 2kq7 s GLU 36 Ca 0.48 -1.61 0.01 0.00 0.02 0.00 0.00 54.97 53.87 2kq7 s GLU 36 Cb -0.18 -2.41 -0.02 0.00 0.10 0.00 0.00 34.13 31.62 2kq7 s GLU 36 CO 0.17 -0.38 -0.11 -1.59 0.02 0.00 0.00 175.26 173.37 2kq7 s LYS 37 N -4.26 3.02 0.34 1.61 0.00 -1.26 -3.07 119.74 116.12 2kq7 s LYS 37 Ca 0.48 -0.63 -0.14 0.00 0.00 0.00 0.00 55.97 55.68 2kq7 s LYS 37 Cb -0.04 -2.59 -0.09 0.00 0.00 0.00 0.00 37.83 35.12 2kq7 s LYS 37 CO 0.29 0.44 0.75 0.00 0.00 0.00 0.00 175.35 176.83 2kq7 s ALA 38 N -0.24 3.31 -0.10 0.59 0.00 -1.26 -5.01 121.76 119.05 2kq7 s ALA 38 Ca 0.02 0.01 -0.18 0.00 0.00 0.00 0.00 51.96 51.81 2kq7 s ALA 38 Cb -0.13 -2.77 -0.27 0.00 0.00 0.00 0.00 23.12 19.94 2kq7 s ALA 38 CO 0.03 0.26 0.61 1.49 0.00 0.00 0.00 175.76 178.14 2kq7 h GLU 39 N 2.04 0.22 -3.52 0.00 4.81 -1.98 -3.39 114.58 112.77 2kq7 h GLU 39 Ca -0.48 -0.38 -0.65 0.00 -0.13 0.00 0.00 59.36 57.72 2kq7 h GLU 39 Cb 1.18 0.14 0.01 0.00 0.63 0.00 0.00 28.75 30.70 2kq7 h GLU 39 CO 0.65 1.18 3.34 0.36 -0.73 0.00 0.00 179.01 183.81 2kq7 n LYS 40 N -4.04 3.04 -3.59 1.92 0.00 -1.26 -4.78 118.16 109.45 2kq7 n LYS 40 Ca -0.22 -2.22 -0.07 0.00 -0.00 0.00 0.00 58.31 55.80 2kq7 n LYS 40 Cb 0.85 -2.94 -0.04 0.00 -0.00 0.00 0.00 35.03 32.90 2kq7 n LYS 40 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2kq7 s SER 41 N 2.91 -0.24 -0.07 -5.58 1.04 -1.26 -4.16 113.70 106.33 2kq7 s SER 41 Ca 0.57 0.20 0.10 0.00 0.48 0.00 0.00 55.95 57.31 2kq7 s SER 41 Cb 0.15 0.21 0.42 0.00 0.10 0.00 0.00 66.02 66.91 2kq7 s SER 41 CO -0.05 -0.27 1.26 -0.90 0.98 0.00 0.00 173.24 174.26 2kq7 n ASP 42 N 0.44 3.02 -4.72 7.02 5.75 -1.26 -4.92 116.55 121.88 2kq7 n ASP 42 Ca -0.06 -2.28 -0.42 0.00 -0.01 0.00 0.00 54.79 52.03 2kq7 n ASP 42 Cb 0.59 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 40.19 2kq7 n ASP 42 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 2kq7 s ILE 43 N -1.73 3.88 0.73 2.12 1.10 -1.26 -5.02 121.20 121.02 2kq7 s ILE 43 Ca 0.30 1.42 -0.12 0.00 -0.51 0.00 0.00 60.65 61.74 2kq7 s ILE 43 Cb 0.19 -3.91 0.03 0.00 0.15 0.00 0.00 42.46 38.93 2kq7 s ILE 43 CO 0.14 0.15 1.10 -2.16 -2.11 0.00 0.00 174.94 172.06 2kq7 s PRO 44 N 0.64 2.46 -0.25 3.50 0.04 -1.26 -4.94 135.00 135.19 2kq7 s PRO 44 Ca 0.57 1.26 -0.23 0.00 0.04 0.00 0.00 61.00 62.64 2kq7 s PRO 44 Cb -0.30 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 2kq7 s PRO 44 CO 0.31 -1.50 0.76 -2.00 0.04 0.00 0.00 177.00 174.62 2kq7 s GLU 45 N -4.58 4.16 0.49 4.56 2.56 -1.26 -5.03 118.70 119.59 2kq7 s GLU 45 Ca 0.63 0.80 -0.22 0.00 0.00 0.00 0.00 54.97 56.19 2kq7 s GLU 45 Cb -0.19 -3.65 -0.06 0.00 2.00 0.00 0.00 34.13 32.23 2kq7 s GLU 45 CO 0.50 -0.49 1.22 0.42 -0.56 0.00 0.00 175.26 176.35 2kq7 s ILE 46 N 2.73 2.82 -0.08 -3.70 1.01 -1.26 -4.98 121.20 117.73 2kq7 s ILE 46 Ca 0.32 0.60 -0.15 0.00 0.00 0.00 0.00 60.65 61.42 2kq7 s ILE 46 Cb -0.15 -3.30 -0.12 0.00 0.01 0.00 0.00 42.46 38.90 2kq7 s ILE 46 CO 0.08 -0.02 0.55 -0.78 0.00 0.00 0.00 174.94 174.77 2kq7 h ASP 47 N 1.79 -0.12 -1.87 3.58 3.58 -1.96 -3.45 116.42 117.97 2kq7 h ASP 47 Ca -0.50 -0.34 -0.66 0.00 0.42 0.00 0.00 57.03 55.96 2kq7 h ASP 47 Cb 1.26 0.03 0.03 0.00 1.72 0.00 0.00 39.33 42.38 2kq7 h ASP 47 CO 0.59 0.50 0.88 0.29 -2.88 0.00 0.00 179.24 178.62 2kq7 n LYS 48 N -4.84 1.70 0.00 0.28 4.76 -1.26 -4.92 118.16 113.88 2kq7 n LYS 48 Ca -0.06 0.62 0.00 0.00 -2.87 0.00 0.00 58.31 56.00 2kq7 n LYS 48 Cb 0.22 -2.37 0.00 0.00 -1.84 0.00 0.00 35.03 31.04 2kq7 n LYS 48 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2kq7 n ARG 49 N 5.00 0.00 -2.69 1.97 0.63 -1.26 -4.89 116.66 115.41 2kq7 n ARG 49 Ca 0.22 0.27 -0.33 0.00 -0.92 0.00 0.00 57.85 57.09 2kq7 n ARG 49 Cb 0.23 -0.85 -0.06 0.00 0.45 0.00 0.00 32.46 32.22 2kq7 n ARG 49 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2kq7 s LYS 50 N -0.80 4.13 -0.29 -0.14 -2.85 -1.26 -4.61 119.74 113.92 2kq7 s LYS 50 Ca 0.00 1.09 0.02 0.00 -1.00 0.00 0.00 55.97 56.07 2kq7 s LYS 50 Cb 0.00 -2.16 0.08 0.00 -2.06 0.00 0.00 37.83 33.69 2kq7 s LYS 50 CO 0.00 -0.11 0.01 0.71 0.10 0.00 0.00 175.35 176.05 2kq7 s TYR 51 N -2.29 2.83 -0.83 1.78 2.02 -1.23 -5.06 117.35 114.56 2kq7 s TYR 51 Ca 0.61 -2.25 -0.25 0.00 -0.37 0.00 0.00 57.07 54.81 2kq7 s TYR 51 Cb -0.10 -2.12 -0.05 0.00 -0.40 0.00 0.00 41.96 39.29 2kq7 s TYR 51 CO 0.18 -0.87 2.00 -1.17 -1.57 0.00 0.00 175.55 174.12 2kq7 s LEU 52 N 1.24 3.16 -0.22 -1.29 1.98 -1.26 -4.13 118.68 118.16 2kq7 s LEU 52 Ca 0.03 -0.38 -0.09 0.00 -2.89 0.00 0.00 54.13 50.81 2kq7 s LEU 52 Cb -0.19 -2.55 -0.04 0.00 0.66 0.00 0.00 46.19 44.07 2kq7 s LEU 52 CO -0.11 -2.82 0.10 -0.69 -1.89 0.00 0.00 176.35 170.94 2kq7 s VAL 53 N 10.53 4.89 0.59 1.68 1.01 -1.25 -5.03 120.40 132.81 2kq7 s VAL 53 Ca 0.73 0.01 -0.18 0.00 0.00 0.00 0.00 61.98 62.55 2kq7 s VAL 53 Cb -0.09 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2kq7 s VAL 53 CO 0.05 0.38 1.12 -2.16 0.00 0.00 0.00 175.10 174.49 2kq7 s PRO 54 N 0.96 3.14 0.26 2.72 0.04 -1.26 -1.39 135.00 139.46 2kq7 s PRO 54 Ca 0.05 1.53 0.20 0.00 0.04 0.00 0.00 61.00 62.82 2kq7 s PRO 54 Cb -0.14 -1.98 0.98 0.00 0.04 0.00 0.00 34.50 33.40 2kq7 s PRO 54 CO 0.03 -1.00 1.61 0.00 0.04 0.00 0.00 177.00 177.68 2kq7 n ALA 55 N -1.74 1.26 -0.95 8.56 0.00 -0.95 -1.07 120.51 125.62 2kq7 n ALA 55 Ca 0.11 0.14 0.06 0.00 0.00 0.00 0.00 53.44 53.75 2kq7 n ALA 55 Cb 0.51 -1.31 0.36 0.00 0.00 0.00 0.00 19.45 19.02 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 -2.15 5.16 -4.77 0.00 2.03 -1.26 -3.94 116.55 111.62 2kq7 n ASP 56 Ca 0.00 -3.00 -0.39 0.00 0.52 0.00 0.00 54.79 51.92 2kq7 n ASP 56 Cb 0.10 -0.66 -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 -2.82 4.47 0.30 -2.67 1.98 -0.23 -4.98 118.68 114.72 2kq7 s LEU 57 Ca 0.52 1.35 0.08 0.00 -2.89 0.00 0.00 54.13 53.19 2kq7 s LEU 57 Cb 0.40 -3.08 -0.04 0.00 0.66 0.00 0.00 46.19 44.13 2kq7 s LEU 57 CO 0.14 0.11 0.12 0.42 -1.89 0.00 0.00 176.35 175.25 2kq7 s THR 58 N -0.43 3.49 0.18 3.68 -4.23 -1.26 -0.21 115.64 116.87 2kq7 s THR 58 Ca 0.34 -1.67 -0.15 0.00 -1.18 0.00 0.00 61.69 59.03 2kq7 s THR 58 Cb -0.20 -3.04 0.12 0.00 1.34 0.00 0.00 72.50 70.72 2kq7 s THR 58 CO 0.21 -0.28 1.68 0.58 -0.54 0.00 0.00 174.62 176.27 2kq7 h VAL 59 N 1.61 0.60 -0.12 2.29 2.07 -1.63 0.49 116.25 121.55 2kq7 h VAL 59 Ca -0.45 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 2kq7 h VAL 59 Cb 1.25 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 2kq7 h VAL 59 CO 0.61 0.01 0.07 1.23 0.02 0.00 0.00 177.57 179.51 2kq7 h GLY 60 N 0.07 0.18 1.96 2.17 0.00 -1.86 -0.89 103.07 104.69 2kq7 h GLY 60 Ca 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2kq7 h GLY 60 CO -0.42 0.08 0.02 -1.61 0.00 0.00 0.00 176.54 174.61 2kq7 h GLN 61 N 0.10 0.03 -0.04 4.80 4.15 -1.77 -0.72 115.11 121.67 2kq7 h GLN 61 Ca 0.04 -0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.32 2kq7 h GLN 61 Cb 0.07 -0.01 0.01 0.00 0.21 0.00 0.00 27.48 27.76 2kq7 h GLN 61 CO -0.01 0.02 -0.51 0.35 -1.93 0.00 0.00 178.83 176.76 2kq7 h PHE 62 N 0.03 0.59 -0.38 3.99 3.57 -0.44 -2.95 116.94 121.36 2kq7 h PHE 62 Ca 0.01 -0.29 -0.07 0.00 3.53 0.00 0.00 57.97 61.15 2kq7 h PHE 62 Cb 0.01 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2kq7 h PHE 62 CO -0.00 1.08 -0.04 0.28 -2.23 0.00 0.00 178.31 177.40 2kq7 h VAL 63 N -0.07 1.23 0.03 1.41 2.07 -0.63 -0.36 116.25 119.93 2kq7 h VAL 63 Ca -0.05 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 2kq7 h VAL 63 Cb 1.19 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2kq7 h VAL 63 CO 0.10 0.33 -0.01 0.22 0.02 0.00 0.00 177.57 178.22 2kq7 h TYR 64 N 0.58 -0.04 -0.20 1.57 3.20 -1.19 -2.80 116.97 118.10 2kq7 h TYR 64 Ca 0.11 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.88 2kq7 h TYR 64 Cb 0.44 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 2kq7 h TYR 64 CO 0.02 0.13 -0.34 -0.39 -1.64 0.00 0.00 178.16 175.94 2kq7 h VAL 65 N -0.20 1.29 -0.43 1.81 -1.51 -1.41 -3.12 116.25 112.67 2kq7 h VAL 65 Ca -0.00 -1.42 0.07 0.00 -1.23 0.00 0.00 66.70 64.12 2kq7 h VAL 65 Cb 0.19 1.51 -0.06 0.00 -2.13 0.00 0.00 31.29 30.80 2kq7 h VAL 65 CO 0.01 0.44 0.04 0.40 -1.23 0.00 0.00 177.57 177.23 2kq7 h ILE 66 N 0.35 0.72 -0.94 7.19 1.08 -0.90 0.23 117.51 125.24 2kq7 h ILE 66 Ca 0.04 -0.06 0.18 0.00 -0.39 0.00 0.00 64.86 64.64 2kq7 h ILE 66 Cb 0.77 0.54 -0.08 0.00 -3.07 0.00 0.00 36.82 34.98 2kq7 h ILE 66 CO 0.06 0.03 0.60 -0.09 -0.69 0.00 0.00 178.15 178.06 2kq7 h ARG 67 N 0.16 0.60 0.00 2.37 2.43 -1.43 0.33 114.38 118.83 2kq7 h ARG 67 Ca 0.21 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.25 2kq7 h ARG 67 Cb 0.29 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 2kq7 h ARG 67 CO -0.31 0.39 -0.48 -0.22 -1.51 0.00 0.00 179.97 177.84 2kq7 h LYS 68 N 0.61 0.00 -0.08 0.20 3.64 -1.23 -1.67 116.57 118.04 2kq7 h LYS 68 Ca 0.50 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.68 2kq7 h LYS 68 Cb 0.96 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.79 2kq7 h LYS 68 CO -0.25 0.48 -0.75 -0.09 -2.27 0.00 0.00 179.45 176.56 2kq7 h ARG 69 N 0.00 0.65 -0.19 1.90 2.43 0.15 -3.10 114.38 116.22 2kq7 h ARG 69 Ca -0.00 -0.59 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 2kq7 h ARG 69 Cb 1.34 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.04 2kq7 h ARG 69 CO 0.06 1.20 0.00 -0.89 -1.51 0.00 0.00 179.97 178.84 2kq7 n ILE 70 N -4.03 0.24 -3.40 1.20 5.41 0.07 -4.87 119.36 113.99 2kq7 n ILE 70 Ca -0.09 -0.31 -0.24 0.00 1.00 0.00 0.00 62.75 63.12 2kq7 n ILE 70 Cb 0.73 0.20 -0.00 0.00 -0.71 0.00 0.00 39.64 39.86 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 0.16 -3.42 -2.87 0.38 2.81 -1.09 -4.91 117.12 108.18 2kq7 n MET 71 Ca 0.13 0.48 -0.40 0.00 -1.81 0.00 0.00 57.70 56.10 2kq7 n MET 71 Cb 0.25 -5.19 -0.06 0.00 -0.71 0.00 0.00 33.22 27.51 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 -6.53 4.59 0.93 4.03 2.96 -0.65 -5.04 118.68 118.97 2kq7 s LEU 72 Ca 0.41 1.75 -0.12 0.00 -0.22 0.00 0.00 54.13 55.96 2kq7 s LEU 72 Cb -0.22 -3.43 0.15 0.00 0.50 0.00 0.00 46.19 43.19 2kq7 s LEU 72 CO 0.51 0.14 1.09 -2.16 -1.32 0.00 0.00 176.35 174.61 2kq7 s PRO 73 N -0.91 0.97 0.23 0.98 0.04 -1.26 -4.79 135.00 130.27 2kq7 s PRO 73 Ca 0.39 0.71 0.01 0.00 0.04 0.00 0.00 61.00 62.15 2kq7 s PRO 73 Cb -0.24 -1.78 0.26 0.00 0.04 0.00 0.00 34.50 32.77 2kq7 s PRO 73 CO 0.28 -2.41 1.60 -1.00 0.04 0.00 0.00 177.00 175.52 2kq7 h PRO 74 N -1.67 0.47 -0.85 0.56 0.13 -1.98 -3.04 132.00 125.62 2kq7 h PRO 74 Ca -0.51 -0.25 0.22 0.00 -0.87 0.00 0.00 66.00 64.59 2kq7 h PRO 74 Cb 1.30 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 2kq7 h PRO 74 CO 0.56 0.82 0.59 1.05 -0.23 0.00 0.00 178.00 180.78 2kq7 h GLU 75 N 0.38 0.17 0.00 0.86 4.11 -2.05 -3.42 114.58 114.64 2kq7 h GLU 75 Ca 0.03 -0.01 -0.31 0.00 0.07 0.00 0.00 59.36 59.13 2kq7 h GLU 75 Cb 0.92 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 2kq7 h GLU 75 CO 0.08 0.11 -0.12 1.63 0.07 0.00 0.00 179.01 180.78 2kq7 n LYS 76 N -4.39 0.96 -3.55 1.06 5.02 -1.15 -5.16 118.16 110.95 2kq7 n LYS 76 Ca 0.18 -1.91 -0.17 0.00 -2.02 0.00 0.00 58.31 54.38 2kq7 n LYS 76 Cb 0.80 0.12 -0.06 0.00 -0.02 0.00 0.00 35.03 35.87 2kq7 n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kq7 s ALA 77 N -2.44 -1.66 0.03 7.82 0.00 -1.26 -4.86 121.76 119.40 2kq7 s ALA 77 Ca 0.22 1.26 0.03 0.00 0.00 0.00 0.00 51.96 53.47 2kq7 s ALA 77 Cb -0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 2kq7 s ALA 77 CO 0.14 -0.35 -0.09 0.42 0.00 0.00 0.00 175.76 175.87 2kq7 s ILE 78 N -1.09 0.69 0.00 0.00 1.01 -1.26 -4.57 121.20 115.98 2kq7 s ILE 78 Ca -0.10 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 2kq7 s ILE 78 Cb -0.01 -0.69 -0.01 0.00 0.01 0.00 0.00 42.46 41.77 2kq7 s ILE 78 CO 0.09 -0.18 0.02 0.72 0.00 0.00 0.00 174.94 175.58 2kq7 s PHE 79 N -1.00 0.07 -0.15 3.97 -0.71 -0.60 -4.87 117.98 114.70 2kq7 s PHE 79 Ca -0.04 -0.14 -0.10 0.00 -1.04 0.00 0.00 56.93 55.61 2kq7 s PHE 79 Cb -0.08 -0.06 -0.05 0.00 -1.21 0.00 0.00 43.02 41.62 2kq7 s PHE 79 CO 0.01 -0.09 0.18 0.96 -1.34 0.00 0.00 175.22 174.94 2kq7 s ILE 80 N -0.57 5.40 0.33 -4.49 -5.25 -1.26 -2.27 121.20 113.09 2kq7 s ILE 80 Ca -0.06 0.31 0.04 0.00 -0.99 0.00 0.00 60.65 59.95 2kq7 s ILE 80 Cb -0.04 -3.49 -0.06 0.00 2.95 0.00 0.00 42.46 41.81 2kq7 s ILE 80 CO -0.00 0.51 0.04 0.72 -1.79 0.00 0.00 174.94 174.42 2kq7 s PHE 81 N -0.26 2.01 0.02 1.37 -0.12 -0.02 -4.78 117.98 116.20 2kq7 s PHE 81 Ca 0.13 -0.91 -0.08 0.00 -0.05 0.00 0.00 56.93 56.02 2kq7 s PHE 81 Cb -0.12 -1.31 0.00 0.00 -0.63 0.00 0.00 43.02 40.96 2kq7 s PHE 81 CO 0.03 0.07 0.15 0.54 -0.05 0.00 0.00 175.22 175.96 2kq7 s VAL 82 N -3.23 0.10 -1.13 -2.49 0.11 0.52 -1.27 120.40 113.01 2kq7 s VAL 82 Ca 0.36 -0.85 -0.04 0.00 -2.93 0.00 0.00 61.98 58.52 2kq7 s VAL 82 Cb 0.08 -0.71 0.03 0.00 -1.53 0.00 0.00 36.38 34.25 2kq7 s VAL 82 CO 0.15 -0.47 0.21 0.59 -3.33 0.00 0.00 175.10 172.26 2kq7 n ASN 83 N 1.02 -3.88 -2.23 3.54 3.02 -1.26 0.23 115.26 115.70 2kq7 n ASN 83 Ca -0.20 -0.04 -0.18 0.00 -0.03 0.00 0.00 54.58 54.13 2kq7 n ASN 83 Cb 0.57 -3.26 0.01 0.00 -0.61 0.00 0.00 39.78 36.50 2kq7 n ASN 83 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2kq7 n ASP 84 N -2.01 -5.16 -3.67 6.41 2.03 -1.26 -4.99 116.55 107.90 2kq7 n ASP 84 Ca -0.09 -0.13 -0.14 0.00 0.52 0.00 0.00 54.79 54.94 2kq7 n ASP 84 Cb 0.58 -4.12 -0.07 0.00 -0.72 0.00 0.00 41.12 36.79 2kq7 n ASP 84 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2kq7 s THR 85 N -2.96 0.04 -0.31 5.18 -1.32 0.14 -5.11 115.64 111.29 2kq7 s THR 85 Ca 0.13 -0.36 -0.09 0.00 -1.21 0.00 0.00 61.69 60.16 2kq7 s THR 85 Cb -0.06 -0.84 -0.00 0.00 -1.51 0.00 0.00 72.50 70.09 2kq7 s THR 85 CO 0.16 -0.20 0.14 -0.22 -2.21 0.00 0.00 174.62 172.30 2kq7 s LEU 86 N -1.58 4.10 0.92 9.08 2.96 -1.26 -0.36 118.68 132.53 2kq7 s LEU 86 Ca -0.10 -0.61 -0.12 0.00 -0.22 0.00 0.00 54.13 53.09 2kq7 s LEU 86 Cb -0.02 -1.97 0.14 0.00 0.50 0.00 0.00 46.19 44.83 2kq7 s LEU 86 CO 0.03 -0.21 1.09 -2.16 -1.32 0.00 0.00 176.35 173.78 2kq7 s PRO 87 N 1.58 1.10 0.55 0.98 0.04 -1.26 -5.01 135.00 132.97 2kq7 s PRO 87 Ca 0.04 0.76 -0.19 0.00 0.04 0.00 0.00 61.00 61.65 2kq7 s PRO 87 Cb -0.17 -1.79 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 2kq7 s PRO 87 CO 0.05 -2.34 1.13 -1.25 0.04 0.00 0.00 177.00 174.63 2kq7 s PRO 88 N -4.94 3.33 0.09 0.56 0.04 -1.26 -4.91 135.00 127.90 2kq7 s PRO 88 Ca 0.64 1.60 0.16 0.00 0.04 0.00 0.00 61.00 63.44 2kq7 s PRO 88 Cb -0.18 -2.00 0.69 0.00 0.04 0.00 0.00 34.50 33.04 2kq7 s PRO 88 CO 0.57 -0.86 1.50 0.25 0.04 0.00 0.00 177.00 178.49 2kq7 n THR 89 N -1.36 1.05 1.09 1.26 -2.24 -1.26 -1.60 114.28 111.22 2kq7 n THR 89 Ca 0.12 0.29 0.12 0.00 -2.27 0.00 0.00 64.05 62.31 2kq7 n THR 89 Cb 0.51 -1.13 0.25 0.00 -2.10 0.00 0.00 70.33 67.87 2kq7 n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2kq7 n ALA 90 N -1.59 3.49 -2.70 6.98 0.00 -1.26 -3.98 120.51 121.44 2kq7 n ALA 90 Ca 0.03 -0.40 -0.41 0.00 0.00 0.00 0.00 53.44 52.66 2kq7 n ALA 90 Cb 0.16 -1.08 -0.04 0.00 0.00 0.00 0.00 19.45 18.49 2kq7 n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kq7 s ALA 91 N -2.80 3.31 0.25 0.00 0.00 -0.62 -4.96 121.76 116.93 2kq7 s ALA 91 Ca 0.16 0.26 -0.13 0.00 0.00 0.00 0.00 51.96 52.25 2kq7 s ALA 91 Cb 0.18 -3.15 -0.08 0.00 0.00 0.00 0.00 23.12 20.07 2kq7 s ALA 91 CO 0.65 -0.26 0.62 -1.17 0.00 0.00 0.00 175.76 175.59 2kq7 s LEU 92 N 1.16 4.17 0.11 0.00 0.20 -1.26 -2.21 118.68 120.85 2kq7 s LEU 92 Ca 0.43 1.10 -0.22 0.00 0.69 0.00 0.00 54.13 56.13 2kq7 s LEU 92 Cb -0.19 -3.74 -0.08 0.00 -0.43 0.00 0.00 46.19 41.75 2kq7 s LEU 92 CO 0.20 -0.08 1.72 -0.03 -0.29 0.00 0.00 176.35 177.87 2kq7 h MET 93 N 2.67 -0.03 -0.49 1.98 4.05 -0.89 0.61 114.93 122.83 2kq7 h MET 93 Ca -0.47 0.00 0.14 0.00 -0.28 0.00 0.00 59.70 59.09 2kq7 h MET 93 Cb 1.18 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.96 2kq7 h MET 93 CO 0.67 -0.02 0.50 1.03 0.23 0.00 0.00 176.91 179.32 2kq7 h SER 94 N -0.03 0.00 0.12 1.39 0.87 -1.74 0.48 113.55 114.64 2kq7 h SER 94 Ca 0.05 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.30 2kq7 h SER 94 Cb 0.10 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 2kq7 h SER 94 CO -0.11 0.00 -1.63 0.00 -0.53 0.00 0.00 176.83 174.56 2kq7 h ALA 95 N 1.47 0.25 0.25 6.23 0.00 -1.54 -3.25 119.26 122.68 2kq7 h ALA 95 Ca 0.23 -1.20 -0.01 0.00 0.00 0.00 0.00 54.91 53.94 2kq7 h ALA 95 Cb 1.22 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.58 2kq7 h ALA 95 CO -0.00 0.99 -0.12 0.82 0.00 0.00 0.00 179.25 180.94 2kq7 h ILE 96 N -0.19 0.76 -0.71 0.00 1.08 0.73 -3.13 117.51 116.06 2kq7 h ILE 96 Ca -0.35 -0.77 0.16 0.00 -0.39 0.00 0.00 64.86 63.51 2kq7 h ILE 96 Cb 1.86 1.16 -0.04 0.00 -3.07 0.00 0.00 36.82 36.73 2kq7 h ILE 96 CO 0.06 0.15 0.49 0.22 -0.69 0.00 0.00 178.15 178.38 2kq7 h TYR 97 N -0.77 0.30 -0.62 1.37 3.20 -0.33 0.46 116.97 120.57 2kq7 h TYR 97 Ca -0.03 0.01 0.12 0.00 3.14 0.00 0.00 58.73 61.96 2kq7 h TYR 97 Cb 0.50 -0.09 -0.12 0.00 1.54 0.00 0.00 36.73 38.56 2kq7 h TYR 97 CO 0.04 0.11 -0.22 0.37 -1.64 0.00 0.00 178.16 176.82 2kq7 h GLN 98 N 0.25 -0.06 0.00 1.82 4.15 -1.57 0.11 115.11 119.81 2kq7 h GLN 98 Ca 0.35 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.77 2kq7 h GLN 98 Cb 1.00 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.71 2kq7 h GLN 98 CO -0.08 -0.04 -1.35 -1.91 -1.93 0.00 0.00 178.83 173.52 2kq7 n GLU 99 N -5.44 0.26 -0.51 1.69 4.07 -0.74 -4.17 120.64 115.80 2kq7 n GLU 99 Ca 0.07 -0.07 0.06 0.00 -0.06 0.00 0.00 57.16 57.15 2kq7 n GLU 99 Cb 0.34 -1.50 0.26 0.00 -0.06 0.00 0.00 31.44 30.48 2kq7 n GLU 99 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 2kq7 n HIS 100 N -1.77 1.21 -3.36 4.31 8.25 0.15 -4.91 115.22 119.11 2kq7 n HIS 100 Ca 0.01 -0.45 -0.38 0.00 -0.26 0.00 0.00 57.72 56.64 2kq7 n HIS 100 Cb 0.41 -0.28 -0.06 0.00 1.12 0.00 0.00 29.99 31.19 2kq7 n HIS 100 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2kq7 s LYS 101 N -1.96 4.15 1.02 -0.41 -2.85 0.32 -3.75 119.74 116.27 2kq7 s LYS 101 Ca 0.36 0.54 -0.12 0.00 -1.00 0.00 0.00 55.97 55.75 2kq7 s LYS 101 Cb 0.25 -3.30 0.17 0.00 -2.06 0.00 0.00 37.83 32.90 2kq7 s LYS 101 CO 0.14 0.49 0.90 -3.47 0.10 0.00 0.00 175.35 173.51 2kq7 n ASP 102 N 2.41 -0.89 0.16 0.03 2.03 0.11 -4.67 116.55 115.74 2kq7 n ASP 102 Ca -0.10 0.18 0.19 0.00 0.52 0.00 0.00 54.79 55.58 2kq7 n ASP 102 Cb 0.52 -1.33 0.78 0.00 -0.72 0.00 0.00 41.12 40.36 2kq7 n ASP 102 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 2kq7 h LYS 103 N -2.11 0.00 -0.52 -0.67 2.10 -1.97 0.24 116.57 113.64 2kq7 h LYS 103 Ca -0.50 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 57.83 2kq7 h LYS 103 Cb 1.30 0.00 -0.20 0.00 -0.90 0.00 0.00 32.23 32.43 2kq7 h LYS 103 CO 0.42 0.00 -0.11 -0.25 -2.00 0.00 0.00 179.45 177.51 2kq7 n ASP 104 N -3.56 3.60 -2.52 7.07 9.92 -1.26 -5.01 116.55 124.78 2kq7 n ASP 104 Ca 0.04 -3.79 -0.04 0.00 -0.53 0.00 0.00 54.79 50.48 2kq7 n ASP 104 Cb 0.52 -0.62 -0.03 0.00 -0.64 0.00 0.00 41.12 40.35 2kq7 n ASP 104 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kq7 n GLY 105 N -1.02 -4.85 3.28 0.44 0.00 0.86 -5.08 105.19 98.82 2kq7 n GLY 105 Ca 0.40 1.28 0.03 0.00 0.00 0.00 0.00 46.02 47.73 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 -0.57 -0.56 1.61 0.08 -1.26 -4.74 117.98 111.69 2kq7 s PHE 106 Ca -0.19 0.85 -0.27 0.00 0.12 0.00 0.00 56.93 57.44 2kq7 s PHE 106 Cb 0.01 0.29 0.03 0.00 -0.57 0.00 0.00 43.02 42.78 2kq7 s PHE 106 CO 0.72 -0.30 1.10 -1.17 -0.10 0.00 0.00 175.22 175.48 2kq7 s LEU 107 N 2.56 3.68 -0.30 -0.37 1.98 -1.23 0.08 118.68 125.09 2kq7 s LEU 107 Ca -0.01 0.01 -0.18 0.00 -2.89 0.00 0.00 54.13 51.07 2kq7 s LEU 107 Cb -0.07 -3.11 -0.02 0.00 0.66 0.00 0.00 46.19 43.66 2kq7 s LEU 107 CO -0.15 -1.36 0.51 -0.31 -1.89 0.00 0.00 176.35 173.15 2kq7 s TYR 108 N 4.56 3.23 0.07 5.38 2.02 -1.25 -1.97 117.35 129.39 2kq7 s TYR 108 Ca 0.40 0.44 0.02 0.00 -0.37 0.00 0.00 57.07 57.56 2kq7 s TYR 108 Cb -0.09 -2.81 -0.03 0.00 -0.40 0.00 0.00 41.96 38.62 2kq7 s TYR 108 CO 0.24 -0.39 -0.08 0.14 -1.57 0.00 0.00 175.55 173.89 2kq7 s VAL 109 N 2.36 0.67 0.16 0.71 -7.23 -1.18 -4.77 120.40 111.11 2kq7 s VAL 109 Ca 0.20 -1.53 0.07 0.00 -1.81 0.00 0.00 61.98 58.90 2kq7 s VAL 109 Cb -0.15 -1.19 -0.04 0.00 0.56 0.00 0.00 36.38 35.56 2kq7 s VAL 109 CO 0.11 -0.62 -0.14 0.42 -0.31 0.00 0.00 175.10 174.56 2kq7 s THR 110 N -2.51 1.49 -0.02 5.32 -4.23 -0.40 -1.48 115.64 113.82 2kq7 s THR 110 Ca 0.02 -1.94 0.01 0.00 -1.18 0.00 0.00 61.69 58.60 2kq7 s THR 110 Cb -0.02 -1.77 0.01 0.00 1.34 0.00 0.00 72.50 72.06 2kq7 s THR 110 CO -0.02 -0.50 -0.02 -0.72 -0.54 0.00 0.00 174.62 172.82 2kq7 s TYR 111 N -2.55 0.39 0.15 3.99 -0.85 -1.17 -0.84 117.35 116.47 2kq7 s TYR 111 Ca 0.15 -0.06 -0.25 0.00 -0.52 0.00 0.00 57.07 56.39 2kq7 s TYR 111 Cb -0.03 -0.37 0.07 0.00 0.38 0.00 0.00 41.96 42.01 2kq7 s TYR 111 CO 0.04 -0.09 0.97 0.45 -1.52 0.00 0.00 175.55 175.41 2kq7 s SER 112 N 0.55 -0.17 -0.08 -0.18 0.15 -0.96 -4.31 113.70 108.70 2kq7 s SER 112 Ca -0.06 -0.40 0.12 0.00 0.70 0.00 0.00 55.95 56.31 2kq7 s SER 112 Cb -0.09 0.48 0.50 0.00 -1.71 0.00 0.00 66.02 65.20 2kq7 s SER 112 CO -0.01 -0.88 1.35 0.61 1.20 0.00 0.00 173.24 175.51 2kq7 n GLY 113 N -0.48 1.94 3.07 9.45 0.00 -1.26 -1.55 105.19 116.37 2kq7 n GLY 113 Ca -0.06 -0.58 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.78 0.51 -0.01 1.61 -1.05 -1.26 -4.93 118.70 111.78 2kq7 s GLU 114 Ca 0.35 -0.74 0.10 0.00 -0.15 0.00 0.00 54.97 54.53 2kq7 s GLU 114 Cb 0.23 0.19 -0.13 0.00 -0.44 0.00 0.00 34.13 33.98 2kq7 s GLU 114 CO 0.16 -0.11 0.32 -1.71 0.95 0.00 0.00 175.26 174.87 2kq7 n ASN 115 N 0.97 1.49 -2.18 0.83 4.05 -1.26 -4.97 115.26 114.19 2kq7 n ASN 115 Ca -0.20 -0.40 -0.02 0.00 0.45 0.00 0.00 54.58 54.41 2kq7 n ASN 115 Cb 0.58 1.21 -0.00 0.00 1.23 0.00 0.00 39.78 42.79 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 -1.51 0.00 -0.75 -0.44 -1.04 -1.26 -4.95 114.28 104.33 2kq7 n THR 116 Ca 0.00 -0.16 -0.34 0.00 -2.04 0.00 0.00 64.05 61.51 2kq7 n THR 116 Cb 0.20 -0.03 0.14 0.00 -1.82 0.00 0.00 70.33 68.82 2kq7 n THR 116 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 2kq7 n PHE 117 N -0.15 -1.55 -3.97 -1.42 1.16 -1.26 -4.96 117.46 105.31 2kq7 n PHE 117 Ca -0.01 0.23 -0.32 0.00 -1.87 0.00 0.00 57.45 55.47 2kq7 n PHE 117 Cb 0.04 -1.56 -0.14 0.00 -1.61 0.00 0.00 39.48 36.21 2kq7 n PHE 117 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 2kq7 s GLY 118 N -1.70 1.99 0.00 4.97 0.00 -1.26 -5.05 107.32 106.26 2kq7 s GLY 118 Ca 0.52 -2.59 0.00 0.00 0.00 0.00 0.00 44.72 42.65 2kq7 s GLY 118 CO 0.67 0.96 0.00 0.54 0.00 0.00 0.00 173.10 175.27