#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kq7 s SER 2 N 0.00 5.50 0.23 1.61 0.01 -1.26 -4.96 113.70 114.84 2kq7 s SER 2 Ca 0.00 0.91 0.03 0.00 1.31 0.00 0.00 55.95 58.20 2kq7 s SER 2 Cb 0.00 -2.52 0.03 0.00 0.21 0.00 0.00 66.02 63.73 2kq7 s SER 2 CO 0.00 -2.09 0.21 0.80 0.41 0.00 0.00 173.24 172.57 2kq7 n MET 3 N 8.79 1.08 -3.82 12.44 0.00 -1.26 -5.10 117.12 129.25 2kq7 n MET 3 Ca 0.23 -1.42 -0.35 0.00 -0.00 0.00 0.00 57.70 56.17 2kq7 n MET 3 Cb 0.50 0.10 -0.12 0.00 0.00 0.00 0.00 33.22 33.69 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 -2.98 2.01 -0.30 2.12 1.02 -1.26 -5.03 119.74 115.32 2kq7 s LYS 4 Ca 0.16 -2.03 -0.17 0.00 0.02 0.00 0.00 55.97 53.95 2kq7 s LYS 4 Cb -0.01 -3.53 0.20 0.00 -0.52 0.00 0.00 37.83 33.97 2kq7 s LYS 4 CO 0.10 -1.07 1.26 0.45 -0.92 0.00 0.00 175.35 175.17 2kq7 s SER 5 N 1.29 -0.10 -0.08 2.83 0.15 -1.26 -5.05 113.70 111.49 2kq7 s SER 5 Ca 0.11 0.17 0.18 0.00 0.70 0.00 0.00 55.95 57.10 2kq7 s SER 5 Cb -0.22 0.90 -0.23 0.00 -1.71 0.00 0.00 66.02 64.76 2kq7 s SER 5 CO -0.04 -0.03 0.42 1.07 1.20 0.00 0.00 173.24 175.86 2kq7 n THR 6 N 2.90 1.12 -0.14 6.45 5.66 -1.26 -3.97 114.28 125.04 2kq7 n THR 6 Ca -0.16 -0.74 0.00 0.00 -3.05 0.00 0.00 64.05 60.10 2kq7 n THR 6 Cb 0.56 -0.53 0.26 0.00 -1.55 0.00 0.00 70.33 69.08 2kq7 n THR 6 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 2kq7 h PHE 7 N 0.00 0.82 -0.00 1.09 3.57 -2.02 -2.16 116.94 118.24 2kq7 h PHE 7 Ca -0.31 -0.01 -0.18 0.00 3.53 0.00 0.00 57.97 60.99 2kq7 h PHE 7 Cb 1.82 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 40.28 2kq7 h PHE 7 CO 0.00 0.58 -0.82 0.87 -2.23 0.00 0.00 178.31 176.72 2kq7 h LYS 8 N 0.84 0.10 -0.82 1.11 1.57 -2.00 -3.25 116.57 114.13 2kq7 h LYS 8 Ca 0.21 -0.11 0.15 0.00 -1.87 0.00 0.00 60.65 59.04 2kq7 h LYS 8 Cb 0.04 0.03 -0.10 0.00 0.08 0.00 0.00 32.23 32.28 2kq7 h LYS 8 CO -0.03 0.86 0.39 0.77 -0.57 0.00 0.00 179.45 180.86 2kq7 h SER 9 N 0.06 0.43 -0.17 0.86 0.02 -1.51 0.14 113.55 113.37 2kq7 h SER 9 Ca -0.02 0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 2kq7 h SER 9 Cb 1.42 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.99 2kq7 h SER 9 CO 0.12 0.16 -0.03 -0.33 -1.14 0.00 0.00 176.83 175.61 2kq7 h GLU 10 N 0.54 0.45 -5.67 3.45 5.08 -1.58 -3.48 114.58 113.37 2kq7 h GLU 10 Ca 0.46 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.60 2kq7 h GLU 10 Cb 0.68 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.87 2kq7 h GLU 10 CO -0.39 0.50 -0.27 0.66 -1.00 0.00 0.00 179.01 178.51 2kq7 n TYR 11 N -4.28 -2.76 -2.05 4.33 4.01 0.48 -4.82 117.16 112.07 2kq7 n TYR 11 Ca 0.01 1.06 -0.27 0.00 -0.16 0.00 0.00 57.90 58.54 2kq7 n TYR 11 Cb 0.25 -3.83 -0.05 0.00 -0.31 0.00 0.00 39.34 35.40 2kq7 n TYR 11 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2kq7 s PRO 12 N -3.50 2.56 -0.01 -0.72 0.04 -1.26 -4.75 135.00 127.35 2kq7 s PRO 12 Ca 0.02 -0.35 -0.13 0.00 0.04 0.00 0.00 61.00 60.59 2kq7 s PRO 12 Cb -0.01 -5.08 -0.33 0.00 0.04 0.00 0.00 34.50 29.13 2kq7 s PRO 12 CO 0.78 -3.41 0.82 0.35 0.04 0.00 0.00 177.00 175.58 2kq7 h PHE 13 N 11.18 0.82 -0.05 0.56 3.57 -2.01 -3.31 116.94 127.70 2kq7 h PHE 13 Ca 0.11 -0.60 -0.04 0.00 3.53 0.00 0.00 57.97 60.97 2kq7 h PHE 13 Cb 1.00 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 2kq7 h PHE 13 CO 1.22 1.61 -0.14 1.05 -2.23 0.00 0.00 178.31 179.83 2kq7 h GLU 14 N 0.12 0.07 -7.00 1.11 4.11 -2.00 -3.43 114.58 107.56 2kq7 h GLU 14 Ca -0.30 -0.01 -0.48 0.00 0.07 0.00 0.00 59.36 58.63 2kq7 h GLU 14 Cb 2.13 -0.01 0.03 0.00 0.50 0.00 0.00 28.75 31.40 2kq7 h GLU 14 CO 0.22 0.21 0.42 0.21 0.07 0.00 0.00 179.01 180.14 2kq7 s LYS 15 N -4.74 3.97 -0.20 1.06 2.20 -1.25 -4.99 119.74 115.79 2kq7 s LYS 15 Ca -0.05 1.51 -0.28 0.00 -0.36 0.00 0.00 55.97 56.79 2kq7 s LYS 15 Cb 0.16 -2.37 0.00 0.00 -1.51 0.00 0.00 37.83 34.11 2kq7 s LYS 15 CO 0.70 -0.31 1.00 0.50 -0.36 0.00 0.00 175.35 176.88 2kq7 s ARG 16 N -2.77 4.28 0.14 4.03 3.00 -1.26 -4.99 118.95 121.38 2kq7 s ARG 16 Ca 0.62 1.30 -0.02 0.00 -1.00 0.00 0.00 55.73 56.63 2kq7 s ARG 16 Cb -0.21 -3.62 -0.03 0.00 0.00 0.00 0.00 34.95 31.08 2kq7 s ARG 16 CO 0.26 -0.54 0.10 0.21 0.00 0.00 0.00 175.30 175.33 2kq7 s LYS 17 N 2.89 0.96 0.08 5.12 2.20 -1.26 -5.07 119.74 124.66 2kq7 s LYS 17 Ca 0.44 -1.39 -0.20 0.00 -0.36 0.00 0.00 55.97 54.46 2kq7 s LYS 17 Cb -0.16 0.27 -0.10 0.00 -1.51 0.00 0.00 37.83 36.33 2kq7 s LYS 17 CO 0.09 -0.29 1.52 0.00 -0.36 0.00 0.00 175.35 176.31 2kq7 h ALA 18 N 2.81 0.28 -0.38 3.13 0.00 -2.00 -2.71 119.26 120.39 2kq7 h ALA 18 Ca -0.34 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.45 2kq7 h ALA 18 Cb 1.20 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 2kq7 h ALA 18 CO 0.57 -0.02 -0.11 1.49 0.00 0.00 0.00 179.25 181.18 2kq7 h GLU 19 N 0.14 -0.03 -0.73 0.00 4.81 -2.00 -0.32 114.58 116.45 2kq7 h GLU 19 Ca 0.06 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 2kq7 h GLU 19 Cb 0.37 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 2kq7 h GLU 19 CO 0.01 -0.02 0.48 1.03 -0.73 0.00 0.00 179.01 179.78 2kq7 h SER 20 N -0.03 0.73 0.78 1.04 0.87 -1.93 -1.26 113.55 113.75 2kq7 h SER 20 Ca 0.19 -0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.70 2kq7 h SER 20 Cb 0.31 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 2kq7 h SER 20 CO -0.41 0.49 -0.44 -0.33 -0.53 0.00 0.00 176.83 175.61 2kq7 h GLU 21 N 0.84 -1.09 -0.32 2.24 4.39 -0.74 0.25 114.58 120.14 2kq7 h GLU 21 Ca 0.30 0.07 0.05 0.00 0.34 0.00 0.00 59.36 60.12 2kq7 h GLU 21 Cb 0.13 0.25 -0.05 0.00 -0.10 0.00 0.00 28.75 28.98 2kq7 h GLU 21 CO -0.09 -0.73 0.05 -0.09 -1.16 0.00 0.00 179.01 176.99 2kq7 h ARG 22 N -1.13 0.15 -0.12 2.33 2.43 -1.23 -1.06 114.38 115.74 2kq7 h ARG 22 Ca -0.11 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2kq7 h ARG 22 Cb 0.89 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.41 2kq7 h ARG 22 CO 0.13 0.10 0.08 0.82 -1.51 0.00 0.00 179.97 179.59 2kq7 h ILE 23 N 0.15 1.03 -0.65 1.20 1.08 -1.16 0.94 117.51 120.10 2kq7 h ILE 23 Ca 0.15 -0.07 0.11 0.00 -0.39 0.00 0.00 64.86 64.67 2kq7 h ILE 23 Cb 0.18 0.85 -0.08 0.00 -3.07 0.00 0.00 36.82 34.70 2kq7 h ILE 23 CO -0.22 0.03 0.24 0.00 -0.69 0.00 0.00 178.15 177.51 2kq7 h ALA 24 N 1.92 0.86 0.00 1.87 0.00 0.88 -2.29 119.26 122.50 2kq7 h ALA 24 Ca 0.05 0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.83 2kq7 h ALA 24 Cb -0.02 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2kq7 h ALA 24 CO -0.01 -0.20 -1.59 -3.47 0.00 0.00 0.00 179.25 173.97 2kq7 n ASP 25 N -5.01 0.81 0.03 0.00 -0.08 -0.91 -4.01 116.55 107.38 2kq7 n ASP 25 Ca 0.10 0.37 0.21 0.00 -1.51 0.00 0.00 54.79 53.96 2kq7 n ASP 25 Cb 0.32 0.14 0.72 0.00 2.34 0.00 0.00 41.12 44.64 2kq7 n ASP 25 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 2kq7 h ARG 26 N 0.00 0.00 -1.12 -0.67 2.43 -0.28 0.71 114.38 115.45 2kq7 h ARG 26 Ca -0.23 0.00 -0.52 0.00 -0.81 0.00 0.00 59.98 58.42 2kq7 h ARG 26 Cb 1.78 0.00 -0.24 0.00 -0.42 0.00 0.00 29.97 31.09 2kq7 h ARG 26 CO 0.06 0.00 0.67 1.19 -1.51 0.00 0.00 179.97 180.37 2kq7 n PHE 27 N -4.15 2.63 -3.79 2.20 3.01 -0.96 -4.73 117.46 111.68 2kq7 n PHE 27 Ca 0.09 -2.33 -0.13 0.00 1.01 0.00 0.00 57.45 56.10 2kq7 n PHE 27 Cb 0.61 -1.14 -0.13 0.00 -0.01 0.00 0.00 39.48 38.82 2kq7 n PHE 27 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2kq7 s LYS 28 N -3.01 0.17 -1.52 -1.08 1.02 0.24 -4.87 119.74 110.68 2kq7 s LYS 28 Ca 0.51 0.31 -0.13 0.00 0.02 0.00 0.00 55.97 56.68 2kq7 s LYS 28 Cb 0.41 -0.00 0.08 0.00 -0.52 0.00 0.00 37.83 37.80 2kq7 s LYS 28 CO 0.02 -0.08 0.99 0.09 -0.92 0.00 0.00 175.35 175.46 2kq7 n ASN 29 N 3.46 -4.80 -4.87 2.83 4.13 -1.26 -4.90 115.26 109.84 2kq7 n ASN 29 Ca -0.18 -0.77 -0.23 0.00 1.68 0.00 0.00 54.58 55.09 2kq7 n ASN 29 Cb 0.56 -3.95 -0.02 0.00 -1.54 0.00 0.00 39.78 34.83 2kq7 n ASN 29 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kq7 s ARG 30 N -6.59 2.40 -0.39 3.52 3.03 -1.26 -3.90 118.95 115.76 2kq7 s ARG 30 Ca 0.64 -1.72 -0.04 0.00 2.03 0.00 0.00 55.73 56.64 2kq7 s ARG 30 Cb -0.32 -2.26 0.09 0.00 -1.03 0.00 0.00 34.95 31.43 2kq7 s ARG 30 CO 0.83 -0.34 0.17 0.96 -1.13 0.00 0.00 175.30 175.78 2kq7 s ILE 31 N -2.59 3.40 -0.62 4.99 -4.36 -0.29 -4.90 121.20 116.83 2kq7 s ILE 31 Ca 0.44 -1.77 -0.26 0.00 -0.26 0.00 0.00 60.65 58.79 2kq7 s ILE 31 Cb -0.02 -3.20 -0.02 0.00 1.25 0.00 0.00 42.46 40.47 2kq7 s ILE 31 CO 0.26 -0.52 1.87 -2.16 0.24 0.00 0.00 174.94 174.62 2kq7 s PRO 32 N 1.22 2.62 0.14 0.37 0.04 -1.26 -3.79 135.00 134.34 2kq7 s PRO 32 Ca 0.04 0.57 0.06 0.00 0.04 0.00 0.00 61.00 61.71 2kq7 s PRO 32 Cb -0.22 -4.42 -0.04 0.00 0.04 0.00 0.00 34.50 29.86 2kq7 s PRO 32 CO -0.02 -2.76 0.02 0.14 0.04 0.00 0.00 177.00 174.42 2kq7 s VAL 33 N 9.13 3.98 -0.15 -0.36 -7.23 -1.22 -3.60 120.40 120.95 2kq7 s VAL 33 Ca 0.67 -1.18 0.02 0.00 -1.81 0.00 0.00 61.98 59.69 2kq7 s VAL 33 Cb -0.12 -2.96 0.01 0.00 0.56 0.00 0.00 36.38 33.87 2kq7 s VAL 33 CO 0.20 -0.01 -0.21 -0.51 -0.31 0.00 0.00 175.10 174.26 2kq7 s ILE 34 N -1.55 2.03 -0.14 -0.62 2.07 -1.08 -1.42 121.20 120.49 2kq7 s ILE 34 Ca 0.27 -0.95 -0.27 0.00 -1.41 0.00 0.00 60.65 58.30 2kq7 s ILE 34 Cb -0.10 -1.81 -0.01 0.00 0.13 0.00 0.00 42.46 40.66 2kq7 s ILE 34 CO 0.19 0.54 0.89 0.00 -1.91 0.00 0.00 174.94 174.65 2kq7 s GLU 36 N 2.06 2.45 -0.22 0.00 2.02 -0.16 -4.99 118.70 119.87 2kq7 s GLU 36 Ca 0.42 -1.65 0.02 0.00 0.02 0.00 0.00 54.97 53.78 2kq7 s GLU 36 Cb -0.17 -2.38 0.04 0.00 0.10 0.00 0.00 34.13 31.72 2kq7 s GLU 36 CO 0.14 -0.40 -0.14 0.21 0.02 0.00 0.00 175.26 175.10 2kq7 s LYS 37 N -4.26 2.44 1.12 1.61 2.20 -1.26 -3.89 119.74 117.69 2kq7 s LYS 37 Ca 0.47 -1.03 -0.19 0.00 -0.36 0.00 0.00 55.97 54.87 2kq7 s LYS 37 Cb -0.04 -2.65 0.12 0.00 -1.51 0.00 0.00 37.83 33.76 2kq7 s LYS 37 CO 0.28 -0.41 0.04 0.00 -0.36 0.00 0.00 175.35 174.91 2kq7 n ALA 38 N 4.57 -3.85 0.08 3.13 0.00 -1.26 -4.95 120.51 118.23 2kq7 n ALA 38 Ca -0.17 -1.30 -0.23 0.00 0.00 0.00 0.00 53.44 51.74 2kq7 n ALA 38 Cb 0.46 -1.43 -0.15 0.00 0.00 0.00 0.00 19.45 18.33 2kq7 n ALA 38 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2kq7 h GLU 39 N -2.19 0.41 -4.71 0.00 4.11 -1.99 -3.43 114.58 106.77 2kq7 h GLU 39 Ca -0.50 -0.69 -0.67 0.00 0.07 0.00 0.00 59.36 57.57 2kq7 h GLU 39 Cb 1.29 0.26 -0.38 0.00 0.50 0.00 0.00 28.75 30.42 2kq7 h GLU 39 CO 0.35 1.33 -0.71 0.21 0.07 0.00 0.00 179.01 180.26 2kq7 s LYS 40 N -2.57 1.76 -0.29 1.06 2.36 -1.26 -5.06 119.74 115.75 2kq7 s LYS 40 Ca -0.15 -1.72 -0.17 0.00 -2.55 0.00 0.00 55.97 51.38 2kq7 s LYS 40 Cb 0.05 -3.19 0.13 0.00 -1.05 0.00 0.00 37.83 33.77 2kq7 s LYS 40 CO 0.86 -0.86 0.90 -1.54 1.55 0.00 0.00 175.35 176.26 2kq7 s SER 41 N 1.08 -0.62 0.00 1.43 1.04 -1.26 -5.01 113.70 110.36 2kq7 s SER 41 Ca 0.05 1.00 0.22 0.00 0.48 0.00 0.00 55.95 57.71 2kq7 s SER 41 Cb -0.20 1.24 1.07 0.00 0.10 0.00 0.00 66.02 68.23 2kq7 s SER 41 CO -0.06 -0.16 1.71 0.47 0.98 0.00 0.00 173.24 176.18 2kq7 n ASP 42 N 3.76 0.00 -4.73 7.02 8.00 -1.26 -4.78 116.55 124.56 2kq7 n ASP 42 Ca -0.19 0.11 -0.41 0.00 0.71 0.00 0.00 54.79 55.01 2kq7 n ASP 42 Cb 0.58 -0.34 -0.03 0.00 -0.02 0.00 0.00 41.12 41.30 2kq7 n ASP 42 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2kq7 s ILE 43 N -2.69 3.79 0.58 0.53 2.07 -1.26 -5.01 121.20 119.21 2kq7 s ILE 43 Ca 0.18 1.42 -0.18 0.00 -1.41 0.00 0.00 60.65 60.66 2kq7 s ILE 43 Cb 0.15 -3.91 -0.04 0.00 0.13 0.00 0.00 42.46 38.79 2kq7 s ILE 43 CO 0.35 0.18 1.12 -2.16 -1.91 0.00 0.00 174.94 172.53 2kq7 s PRO 44 N 0.26 3.20 1.29 3.50 0.04 -1.26 -5.02 135.00 137.02 2kq7 s PRO 44 Ca 0.55 1.55 -0.20 0.00 0.04 0.00 0.00 61.00 62.94 2kq7 s PRO 44 Cb -0.31 -1.99 0.30 0.00 0.04 0.00 0.00 34.50 32.54 2kq7 s PRO 44 CO 0.33 -0.96 0.69 -0.85 0.04 0.00 0.00 177.00 176.25 2kq7 n GLU 45 N -1.61 -3.83 -4.27 4.56 0.28 -1.26 -5.02 120.64 109.49 2kq7 n GLU 45 Ca 0.11 -1.13 -0.31 0.00 -0.16 0.00 0.00 57.16 55.67 2kq7 n GLU 45 Cb 0.51 -1.77 -0.09 0.00 1.43 0.00 0.00 31.44 31.52 2kq7 n GLU 45 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2kq7 s ILE 46 N -2.11 3.69 -0.55 3.84 -1.09 -1.26 -5.01 121.20 118.70 2kq7 s ILE 46 Ca 0.56 -1.00 -0.02 0.00 -2.23 0.00 0.00 60.65 57.95 2kq7 s ILE 46 Cb -0.11 -2.70 0.26 0.00 -1.58 0.00 0.00 42.46 38.33 2kq7 s ILE 46 CO 0.48 0.21 2.24 -0.67 -1.23 0.00 0.00 174.94 175.97 2kq7 n ASP 47 N 0.95 7.00 -3.48 3.58 2.03 -1.26 -4.89 116.55 120.48 2kq7 n ASP 47 Ca -0.13 -3.44 -0.13 0.00 0.52 0.00 0.00 54.79 51.61 2kq7 n ASP 47 Cb 0.52 -1.09 -0.03 0.00 -0.72 0.00 0.00 41.12 39.80 2kq7 n ASP 47 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2kq7 s LYS 48 N -2.75 1.06 0.00 -0.67 2.20 -1.26 -5.12 119.74 113.21 2kq7 s LYS 48 Ca 0.52 -0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.94 2kq7 s LYS 48 Cb 0.39 0.49 0.00 0.00 -1.51 0.00 0.00 37.83 37.20 2kq7 s LYS 48 CO -0.15 -0.42 0.00 0.54 -0.36 0.00 0.00 175.35 174.95 2kq7 n ARG 49 N 0.08 0.00 -2.34 4.03 1.74 -1.26 -4.91 116.66 114.00 2kq7 n ARG 49 Ca -0.15 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.51 2kq7 n ARG 49 Cb 0.62 -0.11 -0.03 0.00 -1.02 0.00 0.00 32.46 31.92 2kq7 n ARG 49 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2kq7 s LYS 50 N -0.55 4.39 -0.56 5.56 1.02 -1.26 -3.94 119.74 124.40 2kq7 s LYS 50 Ca 0.00 1.87 -0.10 0.00 0.02 0.00 0.00 55.97 57.76 2kq7 s LYS 50 Cb 0.00 -3.33 0.14 0.00 -0.52 0.00 0.00 37.83 34.13 2kq7 s LYS 50 CO 0.00 -0.33 0.45 0.71 -0.92 0.00 0.00 175.35 175.26 2kq7 s TYR 51 N 1.13 3.45 -0.82 3.18 1.51 -0.51 -5.02 117.35 120.28 2kq7 s TYR 51 Ca 0.61 -1.91 -0.25 0.00 -1.01 0.00 0.00 57.07 54.51 2kq7 s TYR 51 Cb -0.32 -3.56 -0.05 0.00 -0.11 0.00 0.00 41.96 37.93 2kq7 s TYR 51 CO 0.29 -0.98 1.95 -1.17 -1.11 0.00 0.00 175.55 174.54 2kq7 s LEU 52 N 1.04 3.19 -0.18 -1.29 1.98 -1.26 -3.41 118.68 118.74 2kq7 s LEU 52 Ca 0.09 -0.38 -0.05 0.00 -2.89 0.00 0.00 54.13 50.91 2kq7 s LEU 52 Cb -0.24 -2.55 -0.03 0.00 0.66 0.00 0.00 46.19 44.04 2kq7 s LEU 52 CO -0.02 -2.71 -0.01 -0.69 -1.89 0.00 0.00 176.35 171.03 2kq7 s VAL 53 N 10.08 3.93 0.64 1.68 1.01 -1.25 -5.05 120.40 131.44 2kq7 s VAL 53 Ca 0.71 -0.33 -0.16 0.00 0.00 0.00 0.00 61.98 62.20 2kq7 s VAL 53 Cb -0.09 -2.75 -0.01 0.00 0.00 0.00 0.00 36.38 33.53 2kq7 s VAL 53 CO 0.05 0.45 1.11 -2.16 0.00 0.00 0.00 175.10 174.56 2kq7 s PRO 54 N 0.76 2.91 0.05 2.72 0.04 -1.26 -1.14 135.00 139.07 2kq7 s PRO 54 Ca -0.00 1.44 0.11 0.00 0.04 0.00 0.00 61.00 62.58 2kq7 s PRO 54 Cb -0.14 -1.96 0.48 0.00 0.04 0.00 0.00 34.50 32.91 2kq7 s PRO 54 CO 0.02 -1.17 1.34 0.00 0.04 0.00 0.00 177.00 177.23 2kq7 n ALA 55 N -2.20 1.39 -1.00 8.56 0.00 -1.25 -1.41 120.51 124.61 2kq7 n ALA 55 Ca 0.11 -0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.61 2kq7 n ALA 55 Cb 0.52 -1.17 0.30 0.00 0.00 0.00 0.00 19.45 19.10 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 -1.62 4.40 -4.76 0.00 2.03 -1.26 -4.17 116.55 111.17 2kq7 n ASP 56 Ca 0.02 -3.05 -0.39 0.00 0.52 0.00 0.00 54.79 51.89 2kq7 n ASP 56 Cb 0.11 -0.60 -0.05 0.00 -0.72 0.00 0.00 41.12 39.85 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 -2.85 4.44 0.15 -2.67 1.98 -0.50 -4.99 118.68 114.24 2kq7 s LEU 57 Ca 0.47 1.28 0.05 0.00 -2.89 0.00 0.00 54.13 53.03 2kq7 s LEU 57 Cb 0.37 -3.04 -0.04 0.00 0.66 0.00 0.00 46.19 44.14 2kq7 s LEU 57 CO 0.11 0.08 0.12 0.42 -1.89 0.00 0.00 176.35 175.19 2kq7 s THR 58 N -0.22 4.49 0.23 3.68 -4.23 -1.26 -0.32 115.64 118.01 2kq7 s THR 58 Ca 0.34 -1.02 -0.06 0.00 -1.18 0.00 0.00 61.69 59.76 2kq7 s THR 58 Cb -0.19 -3.26 0.20 0.00 1.34 0.00 0.00 72.50 70.59 2kq7 s THR 58 CO 0.20 -0.06 1.72 0.58 -0.54 0.00 0.00 174.62 176.51 2kq7 h VAL 59 N 2.15 0.64 -0.65 2.29 2.07 -1.53 0.84 116.25 122.08 2kq7 h VAL 59 Ca -0.47 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 2kq7 h VAL 59 Cb 1.19 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 2kq7 h VAL 59 CO 0.64 0.07 0.29 1.23 0.02 0.00 0.00 177.57 179.82 2kq7 h GLY 60 N 0.38 1.01 0.89 2.17 0.00 -1.84 -1.33 103.07 104.37 2kq7 h GLY 60 Ca 0.39 -0.52 -0.05 0.00 0.00 0.00 0.00 47.33 47.15 2kq7 h GLY 60 CO -0.41 0.49 0.02 -1.61 0.00 0.00 0.00 176.54 175.03 2kq7 h GLN 61 N 0.90 0.55 -0.35 4.80 4.15 -1.53 -0.16 115.11 123.47 2kq7 h GLN 61 Ca 0.22 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2kq7 h GLN 61 Cb 0.15 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.77 2kq7 h GLN 61 CO -0.02 0.67 0.23 0.35 -1.93 0.00 0.00 178.83 178.12 2kq7 h PHE 62 N 0.36 0.44 -0.31 3.99 3.57 -0.75 -1.64 116.94 122.60 2kq7 h PHE 62 Ca 0.09 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.50 2kq7 h PHE 62 Cb 0.41 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2kq7 h PHE 62 CO 0.03 0.28 -0.21 0.28 -2.23 0.00 0.00 178.31 176.46 2kq7 h VAL 63 N 0.47 1.26 0.05 1.41 2.07 -1.18 -1.30 116.25 119.03 2kq7 h VAL 63 Ca 0.13 -1.24 -0.00 0.00 0.82 0.00 0.00 66.70 66.40 2kq7 h VAL 63 Cb -0.05 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2kq7 h VAL 63 CO -0.03 0.40 -0.02 1.88 0.02 0.00 0.00 177.57 179.82 2kq7 h TYR 64 N 0.52 -0.06 -0.18 1.57 0.05 -0.59 -2.83 116.97 115.45 2kq7 h TYR 64 Ca 0.08 -0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.76 2kq7 h TYR 64 Cb 0.65 0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.40 2kq7 h TYR 64 CO 0.03 0.03 -0.33 -0.39 -1.05 0.00 0.00 178.16 176.45 2kq7 h VAL 65 N -0.14 1.28 -1.00 -2.88 -1.51 -1.26 -2.97 116.25 107.78 2kq7 h VAL 65 Ca -0.01 -1.38 0.22 0.00 -1.23 0.00 0.00 66.70 64.30 2kq7 h VAL 65 Cb 0.12 1.51 -0.10 0.00 -2.13 0.00 0.00 31.29 30.69 2kq7 h VAL 65 CO 0.01 0.43 0.62 0.40 -1.23 0.00 0.00 177.57 177.80 2kq7 h ILE 66 N 0.32 0.63 -0.81 7.19 1.08 -0.98 0.22 117.51 125.15 2kq7 h ILE 66 Ca 0.04 -0.20 0.06 0.00 -0.39 0.00 0.00 64.86 64.37 2kq7 h ILE 66 Cb 0.74 -0.01 -0.05 0.00 -3.07 0.00 0.00 36.82 34.43 2kq7 h ILE 66 CO 0.06 0.11 0.53 -0.09 -0.69 0.00 0.00 178.15 178.07 2kq7 h ARG 67 N 0.59 0.87 0.00 2.37 2.43 -1.44 0.40 114.38 119.61 2kq7 h ARG 67 Ca 0.58 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.69 2kq7 h ARG 67 Cb 1.15 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.50 2kq7 h ARG 67 CO -0.34 0.58 0.00 -0.22 -1.51 0.00 0.00 179.97 178.48 2kq7 h LYS 68 N 0.90 0.00 0.00 0.20 1.63 -0.73 -0.39 116.57 118.18 2kq7 h LYS 68 Ca 0.35 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.12 2kq7 h LYS 68 Cb 0.21 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.84 2kq7 h LYS 68 CO -0.12 0.00 -0.12 -0.09 -3.45 0.00 0.00 179.45 175.67 2kq7 h ARG 69 N 0.00 0.00 -0.01 1.90 1.12 -0.24 -3.21 114.38 113.94 2kq7 h ARG 69 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 2kq7 h ARG 69 Cb 0.82 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.78 2kq7 h ARG 69 CO 0.00 0.12 0.00 -0.89 -3.11 0.00 0.00 179.97 176.09 2kq7 n ILE 70 N -3.15 1.23 -2.10 1.20 5.41 -1.02 -4.77 119.36 116.17 2kq7 n ILE 70 Ca 0.03 -1.32 -0.13 0.00 1.00 0.00 0.00 62.75 62.33 2kq7 n ILE 70 Cb 0.52 0.31 -0.02 0.00 -0.71 0.00 0.00 39.64 39.75 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 -0.70 -1.90 -2.05 0.38 2.81 -0.90 -4.87 117.12 109.91 2kq7 n MET 71 Ca 0.04 0.67 -0.42 0.00 -1.81 0.00 0.00 57.70 56.18 2kq7 n MET 71 Cb 0.36 -5.16 -0.03 0.00 -0.71 0.00 0.00 33.22 27.68 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 -5.02 4.33 1.02 4.03 1.98 -0.21 -5.00 118.68 119.81 2kq7 s LEU 72 Ca 0.00 2.26 -0.13 0.00 -2.89 0.00 0.00 54.13 53.37 2kq7 s LEU 72 Cb 0.00 -3.55 0.20 0.00 0.66 0.00 0.00 46.19 43.50 2kq7 s LEU 72 CO 0.00 -0.86 1.09 -2.16 -1.89 0.00 0.00 176.35 172.53 2kq7 s PRO 73 N 3.26 0.29 0.00 0.98 0.04 -1.26 -4.77 135.00 133.53 2kq7 s PRO 73 Ca 0.71 0.49 0.15 0.00 0.04 0.00 0.00 61.00 62.38 2kq7 s PRO 73 Cb -0.34 -1.72 0.71 0.00 0.04 0.00 0.00 34.50 33.18 2kq7 s PRO 73 CO 0.29 -2.82 1.43 -0.35 0.04 0.00 0.00 177.00 175.59 2kq7 n PRO 74 N -4.23 0.14 0.08 0.56 -0.04 -1.26 -2.74 135.00 127.51 2kq7 n PRO 74 Ca 0.05 0.18 -0.03 0.00 -0.04 0.00 0.00 63.50 63.66 2kq7 n PRO 74 Cb 0.57 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.72 2kq7 n PRO 74 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2kq7 h GLU 75 N 0.00 0.29 -5.20 0.54 4.39 -2.02 -3.44 114.58 109.14 2kq7 h GLU 75 Ca 0.00 -0.15 -0.37 0.00 0.34 0.00 0.00 59.36 59.19 2kq7 h GLU 75 Cb 0.17 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 28.65 2kq7 h GLU 75 CO 0.00 0.68 -0.74 0.15 -1.16 0.00 0.00 179.01 177.94 2kq7 s LYS 76 N -4.09 0.97 0.15 2.33 1.02 -1.11 -5.16 119.74 113.84 2kq7 s LYS 76 Ca -0.05 -1.24 0.06 0.00 0.02 0.00 0.00 55.97 54.76 2kq7 s LYS 76 Cb 0.13 -0.73 -0.04 0.00 -0.52 0.00 0.00 37.83 36.67 2kq7 s LYS 76 CO 0.78 0.12 -0.13 0.00 -0.92 0.00 0.00 175.35 175.20 2kq7 s ALA 77 N -2.43 1.65 0.06 5.17 0.00 -1.26 -4.63 121.76 120.32 2kq7 s ALA 77 Ca 0.09 -1.45 -0.00 0.00 0.00 0.00 0.00 51.96 50.60 2kq7 s ALA 77 Cb -0.03 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 2kq7 s ALA 77 CO 0.02 0.05 -0.04 0.96 0.00 0.00 0.00 175.76 176.75 2kq7 s ILE 78 N -2.63 0.37 0.21 0.00 -4.36 -1.26 -4.54 121.20 108.99 2kq7 s ILE 78 Ca 0.15 -1.80 0.00 0.00 -0.26 0.00 0.00 60.65 58.74 2kq7 s ILE 78 Cb -0.02 -1.50 -0.05 0.00 1.25 0.00 0.00 42.46 42.14 2kq7 s ILE 78 CO 0.04 -0.93 0.09 0.72 0.24 0.00 0.00 174.94 175.10 2kq7 s PHE 79 N -3.68 1.28 -0.07 1.37 -0.71 -0.69 -4.92 117.98 110.56 2kq7 s PHE 79 Ca 0.07 -1.23 -0.02 0.00 -1.04 0.00 0.00 56.93 54.71 2kq7 s PHE 79 Cb 0.06 -0.71 -0.04 0.00 -1.21 0.00 0.00 43.02 41.13 2kq7 s PHE 79 CO -0.08 -0.44 0.04 0.42 -1.34 0.00 0.00 175.22 173.83 2kq7 s ILE 80 N -3.91 4.59 -0.15 -4.49 -1.09 -1.26 -2.18 121.20 112.72 2kq7 s ILE 80 Ca 0.34 -0.23 0.00 0.00 -2.23 0.00 0.00 60.65 58.53 2kq7 s ILE 80 Cb 0.07 -2.99 -0.01 0.00 -1.58 0.00 0.00 42.46 37.96 2kq7 s ILE 80 CO 0.10 0.54 -0.15 -0.36 -1.23 0.00 0.00 174.94 173.84 2kq7 s PHE 81 N -0.99 2.78 -0.00 3.97 0.08 0.99 -4.77 117.98 120.04 2kq7 s PHE 81 Ca 0.16 -0.91 0.07 0.00 0.12 0.00 0.00 56.93 56.36 2kq7 s PHE 81 Cb -0.12 -1.87 -0.02 0.00 -0.57 0.00 0.00 43.02 40.45 2kq7 s PHE 81 CO 0.06 -0.39 -0.21 0.08 -0.10 0.00 0.00 175.22 174.66 2kq7 s VAL 82 N 0.66 1.64 -1.02 -0.44 1.01 -0.75 -1.38 120.40 120.11 2kq7 s VAL 82 Ca -0.08 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.91 2kq7 s VAL 82 Cb -0.16 -1.37 0.04 0.00 0.00 0.00 0.00 36.38 34.89 2kq7 s VAL 82 CO 0.02 0.41 0.24 -3.20 0.00 0.00 0.00 175.10 172.58 2kq7 n ASN 83 N 2.44 -3.32 -2.98 3.32 5.15 -1.26 -0.11 115.26 118.50 2kq7 n ASN 83 Ca -0.16 -0.07 -0.17 0.00 -0.60 0.00 0.00 54.58 53.58 2kq7 n ASN 83 Cb 0.53 -2.80 0.07 0.00 -0.53 0.00 0.00 39.78 37.04 2kq7 n ASN 83 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2kq7 n ASP 84 N -2.00 -4.23 -2.96 1.20 8.00 -1.26 -5.00 116.55 110.29 2kq7 n ASP 84 Ca -0.06 -0.46 -0.13 0.00 0.71 0.00 0.00 54.79 54.86 2kq7 n ASP 84 Cb 0.56 -4.18 -0.01 0.00 -0.02 0.00 0.00 41.12 37.47 2kq7 n ASP 84 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2kq7 s THR 85 N -3.27 0.00 -0.39 -3.53 -1.32 0.84 -5.13 115.64 102.84 2kq7 s THR 85 Ca 0.30 -1.33 0.03 0.00 -1.21 0.00 0.00 61.69 59.48 2kq7 s THR 85 Cb -0.13 -2.83 0.16 0.00 -1.51 0.00 0.00 72.50 68.18 2kq7 s THR 85 CO 0.59 0.00 0.37 -0.22 -2.21 0.00 0.00 174.62 173.15 2kq7 s LEU 86 N -3.19 0.35 0.91 9.08 2.96 -1.26 -1.80 118.68 125.72 2kq7 s LEU 86 Ca 0.24 -2.07 -0.12 0.00 -0.22 0.00 0.00 54.13 51.97 2kq7 s LEU 86 Cb -0.03 0.27 0.14 0.00 0.50 0.00 0.00 46.19 47.07 2kq7 s LEU 86 CO 0.18 -0.23 1.09 -2.16 -1.32 0.00 0.00 176.35 173.91 2kq7 s PRO 87 N 0.98 1.16 0.85 0.98 0.04 -1.26 -5.03 135.00 132.71 2kq7 s PRO 87 Ca 0.22 0.78 -0.11 0.00 0.04 0.00 0.00 61.00 61.93 2kq7 s PRO 87 Cb -0.11 -1.80 0.10 0.00 0.04 0.00 0.00 34.50 32.73 2kq7 s PRO 87 CO -0.06 -2.30 1.09 -1.25 0.04 0.00 0.00 177.00 174.52 2kq7 s PRO 88 N -4.94 1.62 0.16 0.56 0.04 -1.26 -4.92 135.00 126.26 2kq7 s PRO 88 Ca 0.64 0.94 0.19 0.00 0.04 0.00 0.00 61.00 62.81 2kq7 s PRO 88 Cb -0.18 -1.84 0.81 0.00 0.04 0.00 0.00 34.50 33.33 2kq7 s PRO 88 CO 0.57 -2.03 1.58 0.25 0.04 0.00 0.00 177.00 177.41 2kq7 n THR 89 N -3.75 0.97 0.47 1.26 -2.24 -1.26 -1.88 114.28 107.84 2kq7 n THR 89 Ca 0.08 0.29 0.13 0.00 -2.27 0.00 0.00 64.05 62.27 2kq7 n THR 89 Cb 0.54 -1.16 0.34 0.00 -2.10 0.00 0.00 70.33 67.95 2kq7 n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2kq7 h ALA 90 N 2.32 1.00 -2.45 6.98 0.00 -1.98 -3.28 119.26 121.84 2kq7 h ALA 90 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 2kq7 h ALA 90 Cb 0.28 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 2kq7 h ALA 90 CO 0.00 0.00 0.33 0.00 0.00 0.00 0.00 179.25 179.58 2kq7 s ALA 91 N -3.17 3.40 0.34 0.00 0.00 -0.79 -4.96 121.76 116.59 2kq7 s ALA 91 Ca 0.09 0.18 -0.21 0.00 0.00 0.00 0.00 51.96 52.01 2kq7 s ALA 91 Cb 0.10 -3.20 -0.10 0.00 0.00 0.00 0.00 23.12 19.92 2kq7 s ALA 91 CO 0.61 -0.44 0.87 -1.17 0.00 0.00 0.00 175.76 175.63 2kq7 s LEU 92 N 1.61 4.14 0.07 0.00 0.20 -1.26 -1.91 118.68 121.53 2kq7 s LEU 92 Ca 0.41 1.61 -0.25 0.00 0.69 0.00 0.00 54.13 56.59 2kq7 s LEU 92 Cb -0.18 -4.15 -0.16 0.00 -0.43 0.00 0.00 46.19 41.27 2kq7 s LEU 92 CO 0.17 -0.18 1.62 0.24 -0.29 0.00 0.00 176.35 177.91 2kq7 h MET 93 N 2.58 -0.12 -0.39 1.98 2.86 -0.98 0.12 114.93 120.98 2kq7 h MET 93 Ca -0.48 0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.28 2kq7 h MET 93 Cb 1.18 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.86 2kq7 h MET 93 CO 0.64 0.01 0.42 1.03 1.06 0.00 0.00 176.91 180.06 2kq7 h SER 94 N -0.23 0.00 0.07 1.22 0.87 -1.73 0.49 113.55 114.24 2kq7 h SER 94 Ca -0.01 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.29 2kq7 h SER 94 Cb 0.19 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 2kq7 h SER 94 CO 0.02 0.00 -1.35 0.00 -0.53 0.00 0.00 176.83 174.97 2kq7 h ALA 95 N 1.53 0.24 0.30 6.23 0.00 -1.71 -3.25 119.26 122.59 2kq7 h ALA 95 Ca 0.18 -1.14 -0.01 0.00 0.00 0.00 0.00 54.91 53.94 2kq7 h ALA 95 Cb 1.01 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.38 2kq7 h ALA 95 CO -0.00 0.80 -0.14 0.82 0.00 0.00 0.00 179.25 180.72 2kq7 h ILE 96 N -0.54 0.70 -0.61 0.00 1.08 0.34 -3.03 117.51 115.45 2kq7 h ILE 96 Ca -0.32 -0.61 0.17 0.00 -0.39 0.00 0.00 64.86 63.71 2kq7 h ILE 96 Cb 1.59 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 36.32 2kq7 h ILE 96 CO -0.04 0.12 0.44 0.22 -0.69 0.00 0.00 178.15 178.20 2kq7 h TYR 97 N -0.75 0.07 -0.68 1.37 5.03 -0.28 0.35 116.97 122.09 2kq7 h TYR 97 Ca -0.04 0.00 0.14 0.00 2.58 0.00 0.00 58.73 61.41 2kq7 h TYR 97 Cb 0.50 -0.02 -0.13 0.00 1.55 0.00 0.00 36.73 38.63 2kq7 h TYR 97 CO 0.03 0.03 -0.13 0.37 -1.32 0.00 0.00 178.16 177.13 2kq7 h GLN 98 N 0.06 0.02 0.00 1.82 4.15 -1.56 0.39 115.11 120.00 2kq7 h GLN 98 Ca 0.29 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.71 2kq7 h GLN 98 Cb 1.08 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.77 2kq7 h GLN 98 CO -0.02 0.01 -0.88 -1.91 -1.93 0.00 0.00 178.83 174.11 2kq7 n GLU 99 N -5.42 1.47 -0.75 1.69 4.07 -0.72 -4.29 120.64 116.69 2kq7 n GLU 99 Ca 0.09 -0.02 0.08 0.00 -0.06 0.00 0.00 57.16 57.26 2kq7 n GLU 99 Cb 0.36 -1.29 0.38 0.00 -0.06 0.00 0.00 31.44 30.84 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 -1.46 1.77 -3.50 4.31 8.25 0.12 -4.95 115.22 119.76 2kq7 n HIS 100 Ca 0.02 -0.67 -0.36 0.00 -0.26 0.00 0.00 57.72 56.45 2kq7 n HIS 100 Cb 0.27 -0.37 -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 -2.30 3.88 1.03 -0.41 -2.85 0.13 -4.58 119.74 114.64 2kq7 s LYS 101 Ca 0.53 0.35 -0.16 0.00 -1.00 0.00 0.00 55.97 55.69 2kq7 s LYS 101 Cb 0.37 -3.10 0.07 0.00 -2.06 0.00 0.00 37.83 33.11 2kq7 s LYS 101 CO 0.20 0.61 0.21 -3.47 0.10 0.00 0.00 175.35 173.00 2kq7 n ASP 102 N 1.34 -2.26 0.04 0.03 2.03 0.11 -4.78 116.55 113.07 2kq7 n ASP 102 Ca -0.10 0.11 0.07 0.00 0.52 0.00 0.00 54.79 55.38 2kq7 n ASP 102 Cb 0.52 -1.08 0.30 0.00 -0.72 0.00 0.00 41.12 40.14 2kq7 n ASP 102 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2kq7 n LYS 103 N -1.86 0.05 -0.36 -0.67 4.76 -1.26 -1.37 118.16 117.45 2kq7 n LYS 103 Ca 0.04 0.37 0.08 0.00 -2.87 0.00 0.00 58.31 55.92 2kq7 n LYS 103 Cb 0.58 -1.61 0.24 0.00 -1.84 0.00 0.00 35.03 32.40 2kq7 n LYS 103 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2kq7 n ASP 104 N -1.71 3.68 0.00 4.39 9.92 -1.26 -4.97 116.55 126.60 2kq7 n ASP 104 Ca 0.02 -2.33 0.00 0.00 -0.53 0.00 0.00 54.79 51.95 2kq7 n ASP 104 Cb 0.14 -0.41 0.00 0.00 -0.64 0.00 0.00 41.12 40.21 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 0.54 2.12 3.54 0.44 0.00 -0.47 -5.00 105.19 106.35 2kq7 n GLY 105 Ca 0.18 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.33 2kq7 n GLY 105 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2kq7 n PHE 106 N 0.00 0.61 -4.27 1.61 3.72 -1.26 -4.25 117.46 113.62 2kq7 n PHE 106 Ca 0.00 0.68 -0.35 0.00 -0.05 0.00 0.00 57.45 57.74 2kq7 n PHE 106 Cb 0.00 -2.15 -0.10 0.00 -0.94 0.00 0.00 39.48 36.29 2kq7 n PHE 106 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2kq7 s LEU 107 N 0.89 3.61 -0.20 4.37 1.98 -1.24 0.08 118.68 128.17 2kq7 s LEU 107 Ca 0.61 0.09 -0.05 0.00 -2.89 0.00 0.00 54.13 51.89 2kq7 s LEU 107 Cb -0.68 -1.86 -0.02 0.00 0.66 0.00 0.00 46.19 44.29 2kq7 s LEU 107 CO 0.58 0.29 0.00 -0.31 -1.89 0.00 0.00 176.35 175.03 2kq7 s TYR 108 N -0.36 3.04 -0.03 5.38 2.02 -1.26 -2.62 117.35 123.52 2kq7 s TYR 108 Ca 0.07 -0.48 0.01 0.00 -0.37 0.00 0.00 57.07 56.30 2kq7 s TYR 108 Cb -0.12 -2.09 0.01 0.00 -0.40 0.00 0.00 41.96 39.36 2kq7 s TYR 108 CO 0.02 -0.26 -0.05 0.14 -1.57 0.00 0.00 175.55 173.83 2kq7 s VAL 109 N 1.06 0.48 0.27 0.71 -7.23 -0.90 -4.33 120.40 110.46 2kq7 s VAL 109 Ca 0.02 -0.16 0.12 0.00 -1.81 0.00 0.00 61.98 60.15 2kq7 s VAL 109 Cb -0.14 -0.47 -0.05 0.00 0.56 0.00 0.00 36.38 36.28 2kq7 s VAL 109 CO 0.02 0.18 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.89 2kq7 s THR 110 N 0.47 2.45 -0.02 5.32 2.01 -0.48 -0.99 115.64 124.40 2kq7 s THR 110 Ca -0.06 -2.37 0.01 0.00 0.31 0.00 0.00 61.69 59.59 2kq7 s THR 110 Cb -0.09 -2.28 0.01 0.00 0.01 0.00 0.00 72.50 70.15 2kq7 s THR 110 CO -0.00 -0.38 -0.04 -0.72 -0.69 0.00 0.00 174.62 172.79 2kq7 s TYR 111 N -2.44 0.52 0.11 4.92 1.13 -1.25 -0.01 117.35 120.33 2kq7 s TYR 111 Ca 0.29 -0.10 -0.20 0.00 -1.41 0.00 0.00 57.07 55.65 2kq7 s TYR 111 Cb -0.05 -0.41 0.05 0.00 -1.10 0.00 0.00 41.96 40.45 2kq7 s TYR 111 CO 0.14 -0.07 0.50 0.45 -2.51 0.00 0.00 175.55 174.06 2kq7 s SER 112 N 0.27 -0.40 -0.15 -0.18 0.15 -0.92 -4.50 113.70 107.98 2kq7 s SER 112 Ca -0.03 -0.07 0.09 0.00 0.70 0.00 0.00 55.95 56.64 2kq7 s SER 112 Cb -0.07 0.52 0.51 0.00 -1.71 0.00 0.00 66.02 65.27 2kq7 s SER 112 CO -0.00 -0.84 1.28 0.61 1.20 0.00 0.00 173.24 175.49 2kq7 n GLY 113 N -0.07 2.41 3.57 9.45 0.00 -1.26 -1.71 105.19 117.59 2kq7 n GLY 113 Ca -0.17 -0.58 -0.09 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.09 1.23 -0.01 1.61 -1.05 -1.26 -4.84 118.70 112.28 2kq7 s GLU 114 Ca 0.34 -0.55 0.06 0.00 -0.15 0.00 0.00 54.97 54.68 2kq7 s GLU 114 Cb 0.26 0.51 -0.09 0.00 -0.44 0.00 0.00 34.13 34.36 2kq7 s GLU 114 CO 0.10 -0.55 0.16 -1.71 0.95 0.00 0.00 175.26 174.21 2kq7 n ASN 115 N -0.37 3.10 -3.47 0.83 4.05 -1.26 -4.97 115.26 113.17 2kq7 n ASN 115 Ca -0.11 -0.09 -0.16 0.00 0.45 0.00 0.00 54.58 54.68 2kq7 n ASN 115 Cb 0.62 1.25 -0.07 0.00 1.23 0.00 0.00 39.78 42.82 2kq7 n ASN 115 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 2kq7 s THR 116 N -2.32 0.00 -0.23 -0.44 -4.23 -1.26 -5.07 115.64 102.08 2kq7 s THR 116 Ca -0.02 -1.82 0.12 0.00 -1.18 0.00 0.00 61.69 58.80 2kq7 s THR 116 Cb 0.04 -2.54 0.45 0.00 1.34 0.00 0.00 72.50 71.79 2kq7 s THR 116 CO 0.26 0.00 1.19 2.22 -0.54 0.00 0.00 174.62 177.75 2kq7 n PHE 117 N -0.54 1.40 -3.54 3.99 -1.74 -1.26 -5.06 117.46 110.71 2kq7 n PHE 117 Ca 0.04 -1.81 -0.03 0.00 -0.56 0.00 0.00 57.45 55.09 2kq7 n PHE 117 Cb 0.63 -0.28 -0.00 0.00 1.52 0.00 0.00 39.48 41.34 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 -0.71 2.68 0.00 4.97 0.00 -1.26 -5.31 105.19 105.56 2kq7 n GLY 118 Ca 0.27 -1.34 0.11 0.00 0.00 0.00 0.00 46.02 45.06 2kq7 n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86