#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 0.70 -2.91 1.61 4.64 -2.13 -3.46 113.55 111.99 2kq7 h SER 2 Ca 0.00 -0.64 -0.37 0.00 -0.47 0.00 0.00 61.79 60.31 2kq7 h SER 2 Cb 0.00 -0.22 0.21 0.00 -0.31 0.00 0.00 62.40 62.08 2kq7 h SER 2 CO 0.00 1.46 -0.16 0.23 -0.87 0.00 0.00 176.83 177.49 2kq7 n MET 3 N -3.73 -4.28 -4.10 4.77 2.81 -1.26 -5.00 117.12 106.33 2kq7 n MET 3 Ca -0.11 -1.26 -0.35 0.00 -1.81 0.00 0.00 57.70 54.17 2kq7 n MET 3 Cb 0.96 -1.94 -0.12 0.00 -0.71 0.00 0.00 33.22 31.41 2kq7 n MET 3 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2kq7 s LYS 4 N -4.83 3.74 -0.29 0.03 1.02 -1.26 -5.08 119.74 113.07 2kq7 s LYS 4 Ca 0.66 -0.47 0.01 0.00 0.02 0.00 0.00 55.97 56.19 2kq7 s LYS 4 Cb -0.15 -3.11 0.09 0.00 -0.52 0.00 0.00 37.83 34.14 2kq7 s LYS 4 CO 0.57 0.12 0.04 -1.12 -0.92 0.00 0.00 175.35 174.05 2kq7 s SER 5 N 0.74 4.10 -0.34 2.83 0.01 -1.26 -5.10 113.70 114.69 2kq7 s SER 5 Ca 0.01 -1.60 -0.27 0.00 1.31 0.00 0.00 55.95 55.40 2kq7 s SER 5 Cb -0.14 -1.12 0.01 0.00 0.21 0.00 0.00 66.02 64.98 2kq7 s SER 5 CO 0.02 -0.35 0.96 -0.89 0.41 0.00 0.00 173.24 173.39 2kq7 s THR 6 N 1.40 4.59 -0.14 1.44 2.01 -1.26 -4.89 115.64 118.79 2kq7 s THR 6 Ca 0.06 1.40 0.10 0.00 0.31 0.00 0.00 61.69 63.55 2kq7 s THR 6 Cb -0.18 -4.33 -0.23 0.00 0.01 0.00 0.00 72.50 67.76 2kq7 s THR 6 CO -0.15 -0.47 0.30 0.49 -0.69 0.00 0.00 174.62 174.10 2kq7 n PHE 7 N 6.72 0.57 -0.10 4.92 3.72 -1.26 -4.19 117.46 127.83 2kq7 n PHE 7 Ca 0.08 0.18 0.17 0.00 -0.05 0.00 0.00 57.45 57.83 2kq7 n PHE 7 Cb 0.48 -1.09 0.57 0.00 -0.94 0.00 0.00 39.48 38.49 2kq7 n PHE 7 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2kq7 h LYS 8 N 0.01 0.26 -0.88 -1.08 1.57 -2.04 -0.09 116.57 114.32 2kq7 h LYS 8 Ca -0.43 -0.02 0.23 0.00 -1.87 0.00 0.00 60.65 58.56 2kq7 h LYS 8 Cb 2.08 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 34.29 2kq7 h LYS 8 CO 0.04 0.17 0.61 0.77 -0.57 0.00 0.00 179.45 180.47 2kq7 h SER 9 N 0.26 0.18 0.36 0.86 0.02 -1.99 -1.82 113.55 111.43 2kq7 h SER 9 Ca 0.32 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2kq7 h SER 9 Cb 0.90 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.40 2kq7 h SER 9 CO -0.07 0.07 -0.42 -0.08 -1.14 0.00 0.00 176.83 175.19 2kq7 h GLU 10 N 0.18 -0.79 -5.75 3.45 4.57 -1.27 -3.47 114.58 111.51 2kq7 h GLU 10 Ca 0.44 0.05 -0.13 0.00 -1.18 0.00 0.00 59.36 58.54 2kq7 h GLU 10 Cb 1.44 0.18 0.00 0.00 -0.16 0.00 0.00 28.75 30.21 2kq7 h GLU 10 CO -0.09 -0.52 -0.33 0.66 -1.18 0.00 0.00 179.01 177.55 2kq7 n TYR 11 N -5.50 -2.76 0.27 0.92 4.01 -0.69 -4.88 117.16 108.53 2kq7 n TYR 11 Ca -0.10 1.07 0.15 0.00 -0.16 0.00 0.00 57.90 58.86 2kq7 n TYR 11 Cb 0.40 -3.73 0.65 0.00 -0.31 0.00 0.00 39.34 36.36 2kq7 n TYR 11 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2kq7 h PRO 12 N 0.35 0.00 0.02 -0.72 0.13 -1.89 -3.14 132.00 126.75 2kq7 h PRO 12 Ca -0.18 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.89 2kq7 h PRO 12 Cb 1.11 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.25 2kq7 h PRO 12 CO 0.31 0.06 -0.27 0.35 -0.23 0.00 0.00 178.00 178.23 2kq7 h PHE 13 N 0.00 0.22 -0.53 1.56 3.04 -1.99 -3.33 116.94 115.92 2kq7 h PHE 13 Ca -0.00 -0.14 0.09 0.00 3.98 0.00 0.00 57.97 61.90 2kq7 h PHE 13 Cb 0.54 -0.02 -0.07 0.00 2.56 0.00 0.00 35.95 38.96 2kq7 h PHE 13 CO 0.00 1.01 0.14 1.49 -2.02 0.00 0.00 178.31 178.93 2kq7 h GLU 14 N -0.63 0.28 -3.75 1.11 4.57 -1.92 -3.42 114.58 110.84 2kq7 h GLU 14 Ca -0.04 -0.02 -0.26 0.00 -1.18 0.00 0.00 59.36 57.86 2kq7 h GLU 14 Cb 1.10 -0.06 -0.30 0.00 -0.16 0.00 0.00 28.75 29.33 2kq7 h GLU 14 CO 0.05 0.19 -0.73 -1.59 -1.18 0.00 0.00 179.01 175.75 2kq7 s LYS 15 N -6.13 0.06 -0.02 1.92 0.00 -1.19 -5.07 119.74 109.31 2kq7 s LYS 15 Ca -0.13 0.02 -0.02 0.00 0.00 0.00 0.00 55.97 55.85 2kq7 s LYS 15 Cb 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 37.83 37.85 2kq7 s LYS 15 CO 0.73 -0.03 -0.04 0.54 0.00 0.00 0.00 175.35 176.55 2kq7 n ARG 16 N 3.37 0.07 -0.27 1.78 5.12 -1.26 -4.41 116.66 121.06 2kq7 n ARG 16 Ca -0.16 0.19 0.08 0.00 -1.93 0.00 0.00 57.85 56.03 2kq7 n ARG 16 Cb 0.57 -0.79 0.17 0.00 -1.16 0.00 0.00 32.46 31.25 2kq7 n ARG 16 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2kq7 n LYS 17 N -2.68 1.54 0.08 5.56 4.81 -1.26 -4.68 118.16 121.54 2kq7 n LYS 17 Ca -0.01 -2.82 -0.06 0.00 -0.87 0.00 0.00 58.31 54.55 2kq7 n LYS 17 Cb 0.05 -1.58 0.08 0.00 0.02 0.00 0.00 35.03 33.61 2kq7 n LYS 17 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kq7 h ALA 18 N 0.47 0.75 -0.29 3.14 0.00 -1.98 -3.24 119.26 118.12 2kq7 h ALA 18 Ca 0.01 -0.59 0.03 0.00 0.00 0.00 0.00 54.91 54.36 2kq7 h ALA 18 Cb 1.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 2kq7 h ALA 18 CO 0.04 0.78 0.09 1.49 0.00 0.00 0.00 179.25 181.65 2kq7 h GLU 19 N 0.17 0.21 -1.00 0.00 4.81 -1.91 -2.07 114.58 114.79 2kq7 h GLU 19 Ca -0.02 -0.01 0.13 0.00 -0.13 0.00 0.00 59.36 59.33 2kq7 h GLU 19 Cb 1.22 -0.05 -0.09 0.00 0.63 0.00 0.00 28.75 30.46 2kq7 h GLU 19 CO 0.10 0.14 0.63 1.03 -0.73 0.00 0.00 179.01 180.18 2kq7 h SER 20 N 0.22 0.90 0.63 1.04 0.87 -1.91 -0.70 113.55 114.60 2kq7 h SER 20 Ca 0.13 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.72 2kq7 h SER 20 Cb 0.10 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 2kq7 h SER 20 CO -0.14 0.45 -0.44 -0.08 -0.53 0.00 0.00 176.83 176.09 2kq7 h GLU 21 N 0.95 -0.98 -0.93 2.24 4.57 -1.45 0.24 114.58 119.22 2kq7 h GLU 21 Ca 0.51 0.07 0.11 0.00 -1.18 0.00 0.00 59.36 58.86 2kq7 h GLU 21 Cb 0.55 0.22 -0.08 0.00 -0.16 0.00 0.00 28.75 29.29 2kq7 h GLU 21 CO -0.29 -0.66 0.57 -0.09 -1.18 0.00 0.00 179.01 177.37 2kq7 h ARG 22 N -1.02 0.89 -0.60 1.92 2.43 -1.24 -0.84 114.38 115.93 2kq7 h ARG 22 Ca -0.08 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 58.97 2kq7 h ARG 22 Cb 0.84 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 2kq7 h ARG 22 CO 0.05 0.59 0.14 0.82 -1.51 0.00 0.00 179.97 180.06 2kq7 h ILE 23 N 0.92 1.24 -0.20 1.20 2.04 -0.85 -2.40 117.51 119.46 2kq7 h ILE 23 Ca 0.46 -0.88 -0.05 0.00 1.00 0.00 0.00 64.86 65.38 2kq7 h ILE 23 Cb 0.42 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2kq7 h ILE 23 CO -0.26 0.33 -0.09 0.00 0.00 0.00 0.00 178.15 178.13 2kq7 h ALA 24 N 1.26 1.47 -0.18 1.87 0.00 0.90 0.21 119.26 124.79 2kq7 h ALA 24 Ca 0.19 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2kq7 h ALA 24 Cb 0.33 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2kq7 h ALA 24 CO 0.00 0.37 -0.19 0.22 0.00 0.00 0.00 179.25 179.65 2kq7 h ASP 25 N 0.30 0.48 0.10 0.00 3.58 -0.93 -3.33 116.42 116.63 2kq7 h ASP 25 Ca 0.06 -0.49 -0.01 0.00 0.42 0.00 0.00 57.03 57.02 2kq7 h ASP 25 Cb 0.36 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2kq7 h ASP 25 CO 0.02 0.87 -0.05 0.03 -2.88 0.00 0.00 179.24 177.22 2kq7 h ARG 26 N 0.10 -0.13 -6.38 0.28 2.47 -1.24 -3.42 114.38 106.05 2kq7 h ARG 26 Ca 0.03 0.01 -0.57 0.00 -1.26 0.00 0.00 59.98 58.18 2kq7 h ARG 26 Cb 0.74 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 29.05 2kq7 h ARG 26 CO 0.05 0.37 1.17 -0.06 0.56 0.00 0.00 179.97 182.06 2kq7 s PHE 27 N -3.59 2.09 -0.21 3.04 0.40 0.73 -4.84 117.98 115.61 2kq7 s PHE 27 Ca -0.14 0.64 0.03 0.00 -0.60 0.00 0.00 56.93 56.86 2kq7 s PHE 27 Cb 0.00 -4.19 -0.21 0.00 0.51 0.00 0.00 43.02 39.14 2kq7 s PHE 27 CO 0.56 -2.54 0.01 0.36 0.70 0.00 0.00 175.22 174.30 2kq7 n LYS 28 N 8.20 0.68 -3.49 0.44 2.85 -1.26 -4.70 118.16 120.88 2kq7 n LYS 28 Ca 0.20 0.16 -0.42 0.00 -1.05 0.00 0.00 58.31 57.20 2kq7 n LYS 28 Cb 0.47 -1.58 -0.07 0.00 -0.65 0.00 0.00 35.03 33.20 2kq7 n LYS 28 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2kq7 s ASN 29 N -6.46 5.87 -0.02 -5.58 0.01 -1.26 -5.05 114.94 102.44 2kq7 s ASN 29 Ca -0.27 -2.01 0.05 0.00 -0.71 0.00 0.00 52.86 49.93 2kq7 s ASN 29 Cb 0.08 -2.06 -0.01 0.00 0.41 0.00 0.00 41.25 39.67 2kq7 s ASN 29 CO 0.69 -0.70 -0.17 -0.13 -1.51 0.00 0.00 177.10 175.28 2kq7 s ARG 30 N 1.23 1.49 -0.13 -0.60 0.52 -1.26 -0.15 118.95 120.06 2kq7 s ARG 30 Ca 0.07 -0.59 0.03 0.00 -0.52 0.00 0.00 55.73 54.72 2kq7 s ARG 30 Cb -0.25 -1.38 0.01 0.00 0.52 0.00 0.00 34.95 33.84 2kq7 s ARG 30 CO -0.01 0.31 -0.22 0.96 0.02 0.00 0.00 175.30 176.36 2kq7 s ILE 31 N -0.21 2.04 -0.93 1.52 -4.36 -0.50 -4.82 121.20 113.94 2kq7 s ILE 31 Ca 0.02 -0.98 -0.24 0.00 -0.26 0.00 0.00 60.65 59.19 2kq7 s ILE 31 Cb -0.08 -1.79 -0.05 0.00 1.25 0.00 0.00 42.46 41.78 2kq7 s ILE 31 CO 0.00 0.55 1.95 -2.16 0.24 0.00 0.00 174.94 175.52 2kq7 s PRO 32 N 0.66 2.54 -0.24 0.37 0.04 -1.26 -3.98 135.00 133.13 2kq7 s PRO 32 Ca -0.11 -0.37 -0.18 0.00 0.04 0.00 0.00 61.00 60.38 2kq7 s PRO 32 Cb -0.16 -5.08 -0.03 0.00 0.04 0.00 0.00 34.50 29.27 2kq7 s PRO 32 CO 0.02 -3.44 0.53 0.14 0.04 0.00 0.00 177.00 174.29 2kq7 s VAL 33 N 10.19 5.07 -0.49 -0.36 -7.23 -1.24 -3.47 120.40 122.87 2kq7 s VAL 33 Ca 0.70 0.94 -0.07 0.00 -1.81 0.00 0.00 61.98 61.74 2kq7 s VAL 33 Cb -0.06 -3.85 0.13 0.00 0.56 0.00 0.00 36.38 33.16 2kq7 s VAL 33 CO 0.01 0.10 0.34 -0.63 -0.31 0.00 0.00 175.10 174.61 2kq7 s ILE 34 N 2.16 4.00 -0.08 -0.62 1.09 -1.15 -2.91 121.20 123.69 2kq7 s ILE 34 Ca 0.23 -2.03 -0.30 0.00 -1.10 0.00 0.00 60.65 57.45 2kq7 s ILE 34 Cb -0.16 -3.65 -0.04 0.00 -1.06 0.00 0.00 42.46 37.55 2kq7 s ILE 34 CO 0.09 -0.78 1.56 0.00 -0.10 0.00 0.00 174.94 175.71 2kq7 s GLU 36 N 3.91 2.91 -0.15 0.00 2.02 0.16 -4.97 118.70 122.59 2kq7 s GLU 36 Ca 0.69 -0.92 -0.04 0.00 0.02 0.00 0.00 54.97 54.73 2kq7 s GLU 36 Cb -0.30 -2.63 -0.03 0.00 0.10 0.00 0.00 34.13 31.27 2kq7 s GLU 36 CO 0.26 0.46 -0.03 -1.59 0.02 0.00 0.00 175.26 174.38 2kq7 s LYS 37 N -3.30 3.61 1.26 1.61 -2.85 -1.26 -2.60 119.74 116.20 2kq7 s LYS 37 Ca 0.31 -0.50 -0.18 0.00 -1.00 0.00 0.00 55.97 54.60 2kq7 s LYS 37 Cb -0.09 -2.91 0.28 0.00 -2.06 0.00 0.00 37.83 33.04 2kq7 s LYS 37 CO 0.24 0.30 0.65 0.00 0.10 0.00 0.00 175.35 176.63 2kq7 n ALA 38 N 3.37 -3.55 -0.08 0.59 0.00 -1.26 -4.99 120.51 114.60 2kq7 n ALA 38 Ca -0.17 -1.49 -0.12 0.00 0.00 0.00 0.00 53.44 51.66 2kq7 n ALA 38 Cb 0.53 -1.50 -0.07 0.00 0.00 0.00 0.00 19.45 18.40 2kq7 n ALA 38 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2kq7 h GLU 39 N -3.00 0.00 -4.51 0.00 3.07 -1.99 -3.44 114.58 104.72 2kq7 h GLU 39 Ca -0.44 0.00 -0.70 0.00 -0.50 0.00 0.00 59.36 57.72 2kq7 h GLU 39 Cb 1.21 0.00 -0.34 0.00 -0.84 0.00 0.00 28.75 28.78 2kq7 h GLU 39 CO 0.30 0.58 -0.55 0.15 -1.40 0.00 0.00 179.01 178.09 2kq7 s LYS 40 N -2.13 2.12 -0.27 2.33 1.02 -1.26 -5.05 119.74 116.49 2kq7 s LYS 40 Ca -0.17 -1.73 -0.22 0.00 0.02 0.00 0.00 55.97 53.87 2kq7 s LYS 40 Cb 0.01 -3.57 0.07 0.00 -0.52 0.00 0.00 37.83 33.83 2kq7 s LYS 40 CO 0.42 -1.02 0.72 -1.54 -0.92 0.00 0.00 175.35 173.01 2kq7 s SER 41 N 1.82 -0.81 0.26 2.83 1.04 -1.26 -4.88 113.70 112.71 2kq7 s SER 41 Ca 0.06 1.46 0.22 0.00 0.48 0.00 0.00 55.95 58.17 2kq7 s SER 41 Cb -0.23 1.43 1.00 0.00 0.10 0.00 0.00 66.02 68.33 2kq7 s SER 41 CO -0.03 -0.24 1.66 -0.67 0.98 0.00 0.00 173.24 174.93 2kq7 n ASP 42 N 3.19 0.58 -4.72 7.02 2.03 -1.26 -4.69 116.55 118.70 2kq7 n ASP 42 Ca -0.16 0.69 -0.42 0.00 0.52 0.00 0.00 54.79 55.42 2kq7 n ASP 42 Cb 0.56 -0.80 -0.03 0.00 -0.72 0.00 0.00 41.12 40.14 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 -3.38 3.84 0.92 5.18 2.07 -1.26 -5.02 121.20 123.55 2kq7 s ILE 43 Ca 0.02 1.41 -0.12 0.00 -1.41 0.00 0.00 60.65 60.55 2kq7 s ILE 43 Cb 0.08 -3.90 0.14 0.00 0.13 0.00 0.00 42.46 38.91 2kq7 s ILE 43 CO 0.30 0.16 1.09 -2.16 -1.91 0.00 0.00 174.94 172.42 2kq7 s PRO 44 N 0.52 1.04 0.29 3.50 0.04 -1.26 -5.01 135.00 134.12 2kq7 s PRO 44 Ca 0.56 0.74 -0.25 0.00 0.04 0.00 0.00 61.00 62.09 2kq7 s PRO 44 Cb -0.31 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.35 2kq7 s PRO 44 CO 0.32 -2.37 0.89 -1.83 0.04 0.00 0.00 177.00 174.05 2kq7 s GLU 45 N -4.94 4.54 0.56 4.56 -1.05 -1.26 -5.04 118.70 116.07 2kq7 s GLU 45 Ca 0.64 1.24 -0.19 0.00 -0.15 0.00 0.00 54.97 56.51 2kq7 s GLU 45 Cb -0.18 -2.87 -0.05 0.00 -0.44 0.00 0.00 34.13 30.59 2kq7 s GLU 45 CO 0.57 0.33 1.12 0.42 0.95 0.00 0.00 175.26 178.66 2kq7 s ILE 46 N -1.55 3.21 -0.43 1.83 -1.09 -1.26 -4.93 121.20 116.97 2kq7 s ILE 46 Ca 0.47 0.71 0.00 0.00 -2.23 0.00 0.00 60.65 59.60 2kq7 s ILE 46 Cb -0.19 -3.26 0.39 0.00 -1.58 0.00 0.00 42.46 37.82 2kq7 s ILE 46 CO 0.24 -0.20 1.91 -0.90 -1.23 0.00 0.00 174.94 174.75 2kq7 n ASP 47 N -1.52 5.86 -3.70 3.58 5.75 -1.26 -4.89 116.55 120.37 2kq7 n ASP 47 Ca 0.11 -3.34 -0.13 0.00 -0.01 0.00 0.00 54.79 51.43 2kq7 n ASP 47 Cb 0.51 -0.93 -0.07 0.00 -1.03 0.00 0.00 41.12 39.60 2kq7 n ASP 47 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2kq7 s LYS 48 N -2.67 0.84 -0.12 0.11 -0.14 -1.26 -5.08 119.74 111.43 2kq7 s LYS 48 Ca 0.46 -0.32 -0.05 0.00 -1.36 0.00 0.00 55.97 54.69 2kq7 s LYS 48 Cb 0.37 0.37 -0.05 0.00 -1.68 0.00 0.00 37.83 36.83 2kq7 s LYS 48 CO 0.02 -0.27 -0.14 2.89 -0.76 0.00 0.00 175.35 177.09 2kq7 n ARG 49 N 0.73 0.25 -4.43 1.68 1.85 -1.26 -4.94 116.66 110.54 2kq7 n ARG 49 Ca -0.19 0.10 -0.34 0.00 -1.00 0.00 0.00 57.85 56.42 2kq7 n ARG 49 Cb 0.59 -0.97 -0.12 0.00 -1.05 0.00 0.00 32.46 30.90 2kq7 n ARG 49 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2kq7 s LYS 50 N -2.22 3.63 -0.12 2.89 2.20 -1.26 -4.38 119.74 120.49 2kq7 s LYS 50 Ca -0.16 -0.53 0.02 0.00 -0.36 0.00 0.00 55.97 54.94 2kq7 s LYS 50 Cb 0.06 -2.89 -0.00 0.00 -1.51 0.00 0.00 37.83 33.49 2kq7 s LYS 50 CO 0.22 0.25 -0.19 0.71 -0.36 0.00 0.00 175.35 175.98 2kq7 s TYR 51 N 0.32 2.68 -0.62 4.03 1.51 -1.15 -5.08 117.35 119.04 2kq7 s TYR 51 Ca -0.04 -0.96 -0.24 0.00 -1.01 0.00 0.00 57.07 54.82 2kq7 s TYR 51 Cb -0.14 -1.79 0.06 0.00 -0.11 0.00 0.00 41.96 39.97 2kq7 s TYR 51 CO 0.03 -0.39 0.98 -1.17 -1.11 0.00 0.00 175.55 173.89 2kq7 s LEU 52 N 0.48 4.17 -0.08 -1.29 1.98 -1.26 -3.68 118.68 118.99 2kq7 s LEU 52 Ca -0.13 -0.70 0.04 0.00 -2.89 0.00 0.00 54.13 50.46 2kq7 s LEU 52 Cb -0.17 -2.59 -0.00 0.00 0.66 0.00 0.00 46.19 44.10 2kq7 s LEU 52 CO 0.05 -1.39 -0.22 -0.69 -1.89 0.00 0.00 176.35 172.21 2kq7 s VAL 53 N 4.17 1.89 0.46 1.68 1.01 -1.26 -5.06 120.40 123.30 2kq7 s VAL 53 Ca 0.26 -0.94 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 2kq7 s VAL 53 Cb -0.14 -1.63 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 2kq7 s VAL 53 CO 0.14 0.52 1.16 -2.16 0.00 0.00 0.00 175.10 174.77 2kq7 s PRO 54 N 0.24 3.74 0.23 2.72 0.04 -1.26 -1.41 135.00 139.30 2kq7 s PRO 54 Ca -0.14 1.76 0.19 0.00 0.04 0.00 0.00 61.00 62.86 2kq7 s PRO 54 Cb -0.16 -2.39 0.91 0.00 0.04 0.00 0.00 34.50 32.90 2kq7 s PRO 54 CO 0.07 -0.56 1.58 0.00 0.04 0.00 0.00 177.00 178.13 2kq7 n ALA 55 N -0.52 1.33 0.61 8.56 0.00 0.78 -1.07 120.51 130.21 2kq7 n ALA 55 Ca 0.07 0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.71 2kq7 n ALA 55 Cb 0.48 -1.30 0.25 0.00 0.00 0.00 0.00 19.45 18.88 2kq7 n ALA 55 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2kq7 n ASP 56 N -2.09 2.48 -4.86 0.00 8.00 -1.26 -2.36 116.55 116.45 2kq7 n ASP 56 Ca 0.01 -1.94 -0.31 0.00 0.71 0.00 0.00 54.79 53.25 2kq7 n ASP 56 Cb 0.12 -0.27 -0.00 0.00 -0.02 0.00 0.00 41.12 40.95 2kq7 n ASP 56 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2kq7 s LEU 57 N -1.17 3.33 0.23 0.64 2.96 -0.23 -4.90 118.68 119.53 2kq7 s LEU 57 Ca 0.33 1.46 0.11 0.00 -0.22 0.00 0.00 54.13 55.81 2kq7 s LEU 57 Cb 0.17 -4.48 -0.05 0.00 0.50 0.00 0.00 46.19 42.34 2kq7 s LEU 57 CO 0.24 -0.81 -0.21 0.42 -1.32 0.00 0.00 176.35 174.67 2kq7 s THR 58 N -3.03 2.31 0.19 3.68 -4.23 -1.26 -0.73 115.64 112.57 2kq7 s THR 58 Ca 0.56 -2.22 -0.14 0.00 -1.18 0.00 0.00 61.69 58.72 2kq7 s THR 58 Cb -0.11 -2.17 0.15 0.00 1.34 0.00 0.00 72.50 71.71 2kq7 s THR 58 CO 0.48 -0.31 1.67 0.58 -0.54 0.00 0.00 174.62 176.50 2kq7 h VAL 59 N 2.71 0.54 -0.94 2.29 2.07 -1.72 -0.55 116.25 120.65 2kq7 h VAL 59 Ca -0.42 -0.02 0.03 0.00 0.82 0.00 0.00 66.70 67.10 2kq7 h VAL 59 Cb 1.23 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 2kq7 h VAL 59 CO 0.55 0.01 0.62 1.23 0.02 0.00 0.00 177.57 180.00 2kq7 h GLY 60 N 0.07 1.35 0.97 2.17 0.00 -1.79 -0.98 103.07 104.85 2kq7 h GLY 60 Ca 0.26 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 2kq7 h GLY 60 CO -0.48 0.43 0.20 -1.61 0.00 0.00 0.00 176.54 175.07 2kq7 h GLN 61 N 1.21 0.46 -0.63 4.80 4.15 -1.40 -0.45 115.11 123.25 2kq7 h GLN 61 Ca 0.36 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.65 2kq7 h GLN 61 Cb -0.04 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 2kq7 h GLN 61 CO -0.10 0.36 0.06 0.35 -1.93 0.00 0.00 178.83 177.57 2kq7 h PHE 62 N 0.43 1.15 -0.40 3.99 3.57 -0.94 -2.23 116.94 122.51 2kq7 h PHE 62 Ca 0.12 -0.17 -0.07 0.00 3.53 0.00 0.00 57.97 61.38 2kq7 h PHE 62 Cb 0.02 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 2kq7 h PHE 62 CO -0.04 0.99 -0.03 0.28 -2.23 0.00 0.00 178.31 177.27 2kq7 h VAL 63 N 0.99 1.23 0.07 1.41 2.07 -0.90 -0.87 116.25 120.25 2kq7 h VAL 63 Ca 0.19 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 2kq7 h VAL 63 Cb 0.49 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2kq7 h VAL 63 CO 0.02 0.33 -0.03 1.88 0.02 0.00 0.00 177.57 179.79 2kq7 h TYR 64 N 0.62 -0.09 -0.29 1.57 0.05 -0.82 -3.11 116.97 114.90 2kq7 h TYR 64 Ca 0.12 -0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.86 2kq7 h TYR 64 Cb 0.44 0.03 -0.02 0.00 1.01 0.00 0.00 36.73 38.19 2kq7 h TYR 64 CO 0.02 0.28 0.03 -0.39 -1.05 0.00 0.00 178.16 177.05 2kq7 h VAL 65 N -0.47 1.16 -0.70 -2.88 -1.51 -1.34 -2.79 116.25 107.72 2kq7 h VAL 65 Ca -0.01 -0.61 0.14 0.00 -1.23 0.00 0.00 66.70 64.99 2kq7 h VAL 65 Cb 0.41 0.91 -0.10 0.00 -2.13 0.00 0.00 31.29 30.38 2kq7 h VAL 65 CO 0.02 0.21 0.19 0.40 -1.23 0.00 0.00 177.57 177.16 2kq7 h ILE 66 N 0.43 0.58 -0.97 7.19 1.08 -1.09 0.14 117.51 124.87 2kq7 h ILE 66 Ca 0.10 -0.10 0.19 0.00 -0.39 0.00 0.00 64.86 64.65 2kq7 h ILE 66 Cb 0.23 0.25 -0.09 0.00 -3.07 0.00 0.00 36.82 34.14 2kq7 h ILE 66 CO 0.00 0.06 0.61 -0.09 -0.69 0.00 0.00 178.15 178.04 2kq7 h ARG 67 N 0.30 0.66 0.00 2.37 2.43 -1.51 0.15 114.38 118.78 2kq7 h ARG 67 Ca 0.39 -0.04 -0.18 0.00 -0.81 0.00 0.00 59.98 59.34 2kq7 h ARG 67 Cb 0.63 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 2kq7 h ARG 67 CO -0.46 0.44 -0.86 -0.22 -1.51 0.00 0.00 179.97 177.36 2kq7 h LYS 68 N 0.68 0.00 0.00 0.20 1.63 -0.92 -0.91 116.57 117.25 2kq7 h LYS 68 Ca 0.53 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 60.30 2kq7 h LYS 68 Cb 0.94 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2kq7 h LYS 68 CO -0.30 0.86 -0.14 -0.09 -3.45 0.00 0.00 179.45 176.33 2kq7 h ARG 69 N 0.00 0.00 -0.12 1.90 9.65 0.95 -2.44 114.38 124.33 2kq7 h ARG 69 Ca -0.01 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2kq7 h ARG 69 Cb 1.62 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.20 2kq7 h ARG 69 CO 0.11 0.14 0.00 -0.89 2.80 0.00 0.00 179.97 182.13 2kq7 n ILE 70 N -3.75 0.53 -2.21 1.20 5.41 -0.82 -4.82 119.36 114.90 2kq7 n ILE 70 Ca -0.02 -0.76 -0.13 0.00 1.00 0.00 0.00 62.75 62.84 2kq7 n ILE 70 Cb 0.25 0.81 -0.02 0.00 -0.71 0.00 0.00 39.64 39.97 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 0.26 -2.01 -2.03 0.38 2.81 -0.70 -4.88 117.12 110.95 2kq7 n MET 71 Ca 0.06 0.64 -0.41 0.00 -1.81 0.00 0.00 57.70 56.18 2kq7 n MET 71 Cb 0.27 -5.17 -0.02 0.00 -0.71 0.00 0.00 33.22 27.59 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 -5.22 4.39 0.89 4.03 2.96 -0.43 -5.00 118.68 120.30 2kq7 s LEU 72 Ca 0.00 2.71 -0.11 0.00 -0.22 0.00 0.00 54.13 56.50 2kq7 s LEU 72 Cb 0.00 -3.64 0.12 0.00 0.50 0.00 0.00 46.19 43.18 2kq7 s LEU 72 CO 0.00 -0.65 1.09 -2.16 -1.32 0.00 0.00 176.35 173.31 2kq7 s PRO 73 N -1.07 1.34 0.37 0.98 0.04 -1.26 -4.83 135.00 130.57 2kq7 s PRO 73 Ca 0.55 0.85 0.16 0.00 0.04 0.00 0.00 61.00 62.60 2kq7 s PRO 73 Cb -0.41 -1.82 0.73 0.00 0.04 0.00 0.00 34.50 33.04 2kq7 s PRO 73 CO 0.49 -2.19 1.78 -1.00 0.04 0.00 0.00 177.00 176.12 2kq7 h PRO 74 N -1.51 0.00 -0.89 0.56 0.13 -2.00 -3.05 132.00 125.24 2kq7 h PRO 74 Ca -0.49 0.00 0.23 0.00 -0.87 0.00 0.00 66.00 64.87 2kq7 h PRO 74 Cb 1.28 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.36 2kq7 h PRO 74 CO 0.54 0.39 0.61 1.05 -0.23 0.00 0.00 178.00 180.36 2kq7 h GLU 75 N 0.00 0.20 -5.08 0.86 4.11 -2.04 -3.42 114.58 109.22 2kq7 h GLU 75 Ca -0.00 -0.01 -0.63 0.00 0.07 0.00 0.00 59.36 58.79 2kq7 h GLU 75 Cb 0.78 -0.05 -0.13 0.00 0.50 0.00 0.00 28.75 29.86 2kq7 h GLU 75 CO 0.05 0.13 -0.50 0.15 0.07 0.00 0.00 179.01 178.91 2kq7 s LYS 76 N -5.21 2.09 0.25 1.06 -0.14 -1.15 -5.17 119.74 111.46 2kq7 s LYS 76 Ca -0.07 -2.32 -0.19 0.00 -1.36 0.00 0.00 55.97 52.04 2kq7 s LYS 76 Cb 0.22 -0.99 0.02 0.00 -1.68 0.00 0.00 37.83 35.41 2kq7 s LYS 76 CO 0.78 -0.47 0.62 0.00 -0.76 0.00 0.00 175.35 175.51 2kq7 s ALA 77 N -3.05 -0.97 0.20 5.17 0.00 -1.26 -4.76 121.76 117.09 2kq7 s ALA 77 Ca 0.13 -0.37 -0.06 0.00 0.00 0.00 0.00 51.96 51.67 2kq7 s ALA 77 Cb 0.01 0.90 -0.03 0.00 0.00 0.00 0.00 23.12 24.01 2kq7 s ALA 77 CO 0.09 -0.93 0.25 0.96 0.00 0.00 0.00 175.76 176.12 2kq7 s ILE 78 N -3.92 0.02 0.11 0.00 -4.36 -1.26 -4.71 121.20 107.08 2kq7 s ILE 78 Ca 0.13 -1.74 -0.14 0.00 -0.26 0.00 0.00 60.65 58.64 2kq7 s ILE 78 Cb -0.03 -2.28 0.03 0.00 1.25 0.00 0.00 42.46 41.42 2kq7 s ILE 78 CO 0.04 -0.08 0.35 0.72 0.24 0.00 0.00 174.94 176.21 2kq7 s PHE 79 N -4.08 -0.12 -0.07 1.37 -0.71 -0.68 -4.96 117.98 108.73 2kq7 s PHE 79 Ca 0.30 -0.22 0.04 0.00 -1.04 0.00 0.00 56.93 56.01 2kq7 s PHE 79 Cb 0.04 0.18 -0.02 0.00 -1.21 0.00 0.00 43.02 42.01 2kq7 s PHE 79 CO 0.09 -0.66 -0.19 0.96 -1.34 0.00 0.00 175.22 174.08 2kq7 s ILE 80 N -3.78 2.63 0.33 -4.49 -5.25 -1.26 -1.46 121.20 107.92 2kq7 s ILE 80 Ca 0.03 -0.86 0.07 0.00 -0.99 0.00 0.00 60.65 58.90 2kq7 s ILE 80 Cb 0.03 -2.02 -0.06 0.00 2.95 0.00 0.00 42.46 43.35 2kq7 s ILE 80 CO -0.12 0.57 -0.02 0.72 -1.79 0.00 0.00 174.94 174.30 2kq7 s PHE 81 N -0.26 2.15 0.02 1.37 -0.12 0.93 -4.86 117.98 117.21 2kq7 s PHE 81 Ca 0.00 -0.72 -0.08 0.00 -0.05 0.00 0.00 56.93 56.09 2kq7 s PHE 81 Cb -0.13 -1.34 0.00 0.00 -0.63 0.00 0.00 43.02 40.92 2kq7 s PHE 81 CO 0.03 0.31 0.15 0.54 -0.05 0.00 0.00 175.22 176.20 2kq7 s VAL 82 N -2.95 0.10 -1.05 -2.49 0.11 0.13 -1.42 120.40 112.83 2kq7 s VAL 82 Ca 0.33 -0.83 -0.03 0.00 -2.93 0.00 0.00 61.98 58.52 2kq7 s VAL 82 Cb 0.06 -0.68 0.03 0.00 -1.53 0.00 0.00 36.38 34.26 2kq7 s VAL 82 CO 0.15 -0.46 0.18 0.59 -3.33 0.00 0.00 175.10 172.23 2kq7 n ASN 83 N 1.07 -3.62 -2.71 3.54 4.13 -1.26 0.24 115.26 116.65 2kq7 n ASN 83 Ca -0.21 0.01 -0.19 0.00 1.68 0.00 0.00 54.58 55.87 2kq7 n ASN 83 Cb 0.57 -3.06 0.04 0.00 -1.54 0.00 0.00 39.78 35.79 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 -1.96 -5.53 -3.65 6.41 2.03 -1.26 -4.99 116.55 107.59 2kq7 n ASP 84 Ca -0.09 -0.29 -0.13 0.00 0.52 0.00 0.00 54.79 54.80 2kq7 n ASP 84 Cb 0.58 -4.32 -0.06 0.00 -0.72 0.00 0.00 41.12 36.60 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 -3.13 0.05 -0.34 5.18 -1.32 0.14 -5.14 115.64 111.09 2kq7 s THR 85 Ca 0.31 -0.40 0.01 0.00 -1.21 0.00 0.00 61.69 60.39 2kq7 s THR 85 Cb -0.14 -0.92 0.09 0.00 -1.51 0.00 0.00 72.50 70.02 2kq7 s THR 85 CO 0.38 -0.22 0.05 -0.22 -2.21 0.00 0.00 174.62 172.41 2kq7 s LEU 86 N -1.88 4.50 0.97 9.08 2.96 -1.26 -0.69 118.68 132.36 2kq7 s LEU 86 Ca -0.06 -1.82 -0.12 0.00 -0.22 0.00 0.00 54.13 51.90 2kq7 s LEU 86 Cb -0.01 -1.69 0.17 0.00 0.50 0.00 0.00 46.19 45.16 2kq7 s LEU 86 CO -0.01 -0.37 1.09 -2.16 -1.32 0.00 0.00 176.35 173.59 2kq7 s PRO 87 N 1.07 0.67 0.45 0.98 0.04 -1.26 -5.00 135.00 131.94 2kq7 s PRO 87 Ca 0.04 0.61 -0.23 0.00 0.04 0.00 0.00 61.00 61.45 2kq7 s PRO 87 Cb -0.20 -1.76 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 2kq7 s PRO 87 CO -0.05 -2.59 1.17 -1.25 0.04 0.00 0.00 177.00 174.32 2kq7 s PRO 88 N -4.96 3.82 0.13 0.56 0.04 -1.26 -4.91 135.00 128.42 2kq7 s PRO 88 Ca 0.65 1.80 0.17 0.00 0.04 0.00 0.00 61.00 63.66 2kq7 s PRO 88 Cb -0.18 -2.47 0.76 0.00 0.04 0.00 0.00 34.50 32.64 2kq7 s PRO 88 CO 0.57 -0.50 1.54 0.25 0.04 0.00 0.00 177.00 178.90 2kq7 n THR 89 N -0.36 1.02 0.77 1.26 -2.24 -1.26 -1.62 114.28 111.85 2kq7 n THR 89 Ca 0.07 0.30 0.12 0.00 -2.27 0.00 0.00 64.05 62.27 2kq7 n THR 89 Cb 0.48 -1.17 0.21 0.00 -2.10 0.00 0.00 70.33 67.75 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 -1.63 3.19 -0.60 6.98 0.00 -1.26 -2.85 120.51 124.33 2kq7 n ALA 90 Ca 0.02 -0.29 -0.11 0.00 0.00 0.00 0.00 53.44 53.05 2kq7 n ALA 90 Cb 0.17 -1.15 0.18 0.00 0.00 0.00 0.00 19.45 18.65 2kq7 n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kq7 n ALA 91 N -1.68 -3.16 -3.01 0.00 0.00 -0.64 -4.95 120.51 107.07 2kq7 n ALA 91 Ca 0.04 -0.99 -0.22 0.00 0.00 0.00 0.00 53.44 52.27 2kq7 n ALA 91 Cb 0.39 -0.09 -0.16 0.00 0.00 0.00 0.00 19.45 19.60 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 0.00 1.82 0.10 0.00 1.98 -1.26 -4.11 118.68 117.21 2kq7 s LEU 92 Ca 0.43 -0.25 -0.28 0.00 -2.89 0.00 0.00 54.13 51.14 2kq7 s LEU 92 Cb -0.07 -0.71 -0.13 0.00 0.66 0.00 0.00 46.19 45.95 2kq7 s LEU 92 CO 0.36 0.09 1.65 -0.03 -1.89 0.00 0.00 176.35 176.53 2kq7 h MET 93 N 6.37 -0.50 -0.46 1.98 4.05 -1.14 0.31 114.93 125.54 2kq7 h MET 93 Ca -0.33 0.03 0.13 0.00 -0.28 0.00 0.00 59.70 59.26 2kq7 h MET 93 Cb 1.17 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 32.07 2kq7 h MET 93 CO 0.48 -0.33 0.43 1.03 0.23 0.00 0.00 176.91 178.75 2kq7 h SER 94 N -0.52 0.00 0.66 1.39 0.87 -1.68 0.50 113.55 114.77 2kq7 h SER 94 Ca -0.01 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.30 2kq7 h SER 94 Cb 0.47 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.39 2kq7 h SER 94 CO -0.03 0.00 -1.48 0.00 -0.53 0.00 0.00 176.83 174.79 2kq7 h ALA 95 N 1.58 0.67 0.00 6.23 0.00 -1.57 -3.23 119.26 122.94 2kq7 h ALA 95 Ca 0.22 -1.23 -0.01 0.00 0.00 0.00 0.00 54.91 53.89 2kq7 h ALA 95 Cb 1.07 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 2kq7 h ALA 95 CO -0.00 1.39 -0.07 0.82 0.00 0.00 0.00 179.25 181.38 2kq7 h ILE 96 N 0.00 0.57 -0.74 0.00 1.08 0.28 -3.34 117.51 115.36 2kq7 h ILE 96 Ca -0.20 -1.44 0.16 0.00 -0.39 0.00 0.00 64.86 62.99 2kq7 h ILE 96 Cb 1.88 1.09 -0.05 0.00 -3.07 0.00 0.00 36.82 36.67 2kq7 h ILE 96 CO 0.08 0.19 0.50 0.22 -0.69 0.00 0.00 178.15 178.46 2kq7 h TYR 97 N -1.00 0.37 -0.70 1.37 3.20 -0.38 0.31 116.97 120.14 2kq7 h TYR 97 Ca -0.01 0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.01 2kq7 h TYR 97 Cb 0.37 -0.12 -0.13 0.00 1.54 0.00 0.00 36.73 38.40 2kq7 h TYR 97 CO 0.07 0.13 -0.20 0.37 -1.64 0.00 0.00 178.16 176.89 2kq7 h GLN 98 N 0.31 -0.02 0.00 1.82 4.15 -1.68 0.35 115.11 120.04 2kq7 h GLN 98 Ca 0.37 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.79 2kq7 h GLN 98 Cb 0.98 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.68 2kq7 h GLN 98 CO -0.10 -0.02 -1.24 -0.85 -1.93 0.00 0.00 178.83 174.70 2kq7 n GLU 99 N -5.47 0.19 -0.84 1.69 0.28 -0.74 -4.18 120.64 111.57 2kq7 n GLU 99 Ca 0.09 -0.05 0.07 0.00 -0.16 0.00 0.00 57.16 57.10 2kq7 n GLU 99 Cb 0.36 -1.50 0.38 0.00 1.43 0.00 0.00 31.44 32.12 2kq7 n GLU 99 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2kq7 n HIS 100 N -1.68 1.96 -3.25 -1.84 8.25 0.10 -4.94 115.22 113.82 2kq7 n HIS 100 Ca 0.02 -0.68 -0.39 0.00 -0.26 0.00 0.00 57.72 56.41 2kq7 n HIS 100 Cb 0.39 -0.49 -0.06 0.00 1.12 0.00 0.00 29.99 30.95 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 -2.64 4.26 1.07 -0.41 -2.85 0.11 -4.39 119.74 114.89 2kq7 s LYS 101 Ca 0.51 0.71 -0.19 0.00 -1.00 0.00 0.00 55.97 56.00 2kq7 s LYS 101 Cb 0.39 -3.31 0.04 0.00 -2.06 0.00 0.00 37.83 32.89 2kq7 s LYS 101 CO 0.15 0.46 -0.18 -3.47 0.10 0.00 0.00 175.35 172.42 2kq7 n ASP 102 N 2.41 -2.58 0.08 0.03 2.03 0.56 -4.64 116.55 114.44 2kq7 n ASP 102 Ca -0.08 -0.01 0.20 0.00 0.52 0.00 0.00 54.79 55.42 2kq7 n ASP 102 Cb 0.51 -0.93 0.75 0.00 -0.72 0.00 0.00 41.12 40.73 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 -1.79 0.00 -0.57 -0.67 1.57 -1.97 0.41 116.57 113.55 2kq7 h LYS 103 Ca -0.50 0.00 -0.42 0.00 -1.87 0.00 0.00 60.65 57.86 2kq7 h LYS 103 Cb 1.35 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 33.32 2kq7 h LYS 103 CO 0.35 0.00 -0.76 -3.47 -0.57 0.00 0.00 179.45 175.00 2kq7 n ASP 104 N -3.79 4.14 -2.13 0.86 2.03 -1.26 -5.04 116.55 111.36 2kq7 n ASP 104 Ca 0.08 -3.74 -0.01 0.00 0.52 0.00 0.00 54.79 51.63 2kq7 n ASP 104 Cb 0.61 -0.38 -0.01 0.00 -0.72 0.00 0.00 41.12 40.62 2kq7 n ASP 104 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kq7 n GLY 105 N -0.79 -5.14 3.65 0.27 0.00 0.13 -5.10 105.19 98.22 2kq7 n GLY 105 Ca 0.38 0.26 0.01 0.00 0.00 0.00 0.00 46.02 46.66 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 -0.49 -0.03 -0.22 1.61 0.08 -1.26 -4.67 117.98 113.00 2kq7 s PHE 106 Ca -0.05 0.07 -0.18 0.00 0.12 0.00 0.00 56.93 56.89 2kq7 s PHE 106 Cb 0.00 0.22 -0.03 0.00 -0.57 0.00 0.00 43.02 42.64 2kq7 s PHE 106 CO 0.14 -0.02 0.49 -1.17 -0.10 0.00 0.00 175.22 174.56 2kq7 s LEU 107 N 0.60 4.12 -0.30 -0.37 1.98 -1.23 -0.32 118.68 123.17 2kq7 s LEU 107 Ca -0.01 0.60 0.01 0.00 -2.89 0.00 0.00 54.13 51.83 2kq7 s LEU 107 Cb -0.03 -2.65 0.06 0.00 0.66 0.00 0.00 46.19 44.23 2kq7 s LEU 107 CO -0.12 -0.18 -0.02 -0.31 -1.89 0.00 0.00 176.35 173.82 2kq7 s TYR 108 N 1.74 3.35 -0.07 5.38 2.02 -1.26 -2.92 117.35 125.59 2kq7 s TYR 108 Ca 0.22 -2.22 0.05 0.00 -0.37 0.00 0.00 57.07 54.74 2kq7 s TYR 108 Cb -0.15 -2.21 -0.01 0.00 -0.40 0.00 0.00 41.96 39.18 2kq7 s TYR 108 CO 0.09 -0.86 -0.21 0.14 -1.57 0.00 0.00 175.55 173.14 2kq7 s VAL 109 N 1.14 2.39 -0.18 0.71 -7.23 -1.22 -4.71 120.40 111.30 2kq7 s VAL 109 Ca -0.04 -0.94 -0.01 0.00 -1.81 0.00 0.00 61.98 59.18 2kq7 s VAL 109 Cb -0.20 -1.91 -0.00 0.00 0.56 0.00 0.00 36.38 34.83 2kq7 s VAL 109 CO -0.04 0.57 -0.11 0.42 -0.31 0.00 0.00 175.10 175.63 2kq7 s THR 110 N -0.15 2.93 -0.08 5.32 -4.23 -0.51 -0.67 115.64 118.25 2kq7 s THR 110 Ca -0.03 -0.66 -0.02 0.00 -1.18 0.00 0.00 61.69 59.80 2kq7 s THR 110 Cb -0.14 -2.28 -0.03 0.00 1.34 0.00 0.00 72.50 71.39 2kq7 s THR 110 CO 0.04 0.48 0.02 -0.72 -0.54 0.00 0.00 174.62 173.90 2kq7 s TYR 111 N 1.11 3.21 0.13 3.99 -0.85 -1.07 -0.05 117.35 123.82 2kq7 s TYR 111 Ca 0.01 0.23 -0.25 0.00 -0.52 0.00 0.00 57.07 56.53 2kq7 s TYR 111 Cb -0.14 -1.79 0.07 0.00 0.38 0.00 0.00 41.96 40.47 2kq7 s TYR 111 CO -0.03 0.51 0.87 0.45 -1.52 0.00 0.00 175.55 175.82 2kq7 s SER 112 N -1.02 -0.28 -0.07 -0.18 0.15 -0.53 -4.04 113.70 107.73 2kq7 s SER 112 Ca 0.15 -0.29 0.10 0.00 0.70 0.00 0.00 55.95 56.61 2kq7 s SER 112 Cb -0.11 0.51 0.42 0.00 -1.71 0.00 0.00 66.02 65.12 2kq7 s SER 112 CO 0.04 -0.91 1.26 0.61 1.20 0.00 0.00 173.24 175.44 2kq7 n GLY 113 N -0.40 1.65 3.55 9.45 0.00 -1.26 -1.69 105.19 116.49 2kq7 n GLY 113 Ca -0.08 -0.49 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.72 1.42 -0.21 1.61 -1.05 -1.26 -4.91 118.70 112.58 2kq7 s GLU 114 Ca 0.29 -0.81 0.12 0.00 -0.15 0.00 0.00 54.97 54.43 2kq7 s GLU 114 Cb 0.19 0.55 0.42 0.00 -0.44 0.00 0.00 34.13 34.85 2kq7 s GLU 114 CO 0.14 -0.62 1.28 -1.71 0.95 0.00 0.00 175.26 175.30 2kq7 n ASN 115 N -0.37 2.14 -3.52 0.83 4.05 -1.26 -4.95 115.26 112.18 2kq7 n ASN 115 Ca -0.10 -3.67 -0.03 0.00 0.45 0.00 0.00 54.58 51.23 2kq7 n ASN 115 Cb 0.62 -0.54 0.01 0.00 1.23 0.00 0.00 39.78 41.10 2kq7 n ASN 115 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 2kq7 s THR 116 N -3.15 0.00 1.00 -0.44 -1.32 -1.26 -5.14 115.64 105.33 2kq7 s THR 116 Ca 0.39 -0.57 -0.14 0.00 -1.21 0.00 0.00 61.69 60.15 2kq7 s THR 116 Cb 0.36 -2.53 0.05 0.00 -1.51 0.00 0.00 72.50 68.87 2kq7 s THR 116 CO -0.03 0.00 0.27 2.22 -2.21 0.00 0.00 174.62 174.87 2kq7 n PHE 117 N -0.62 -1.53 0.00 9.09 -1.74 -1.26 -5.01 117.46 116.39 2kq7 n PHE 117 Ca -0.04 0.20 0.00 0.00 -0.56 0.00 0.00 57.45 57.05 2kq7 n PHE 117 Cb 0.60 -1.72 0.00 0.00 1.52 0.00 0.00 39.48 39.88 2kq7 n PHE 117 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2kq7 n GLY 118 N 1.68 4.93 0.24 4.97 0.00 -1.26 -5.11 105.19 110.65 2kq7 n GLY 118 Ca 0.05 -0.61 0.03 0.00 0.00 0.00 0.00 46.02 45.49 2kq7 n GLY 118 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36