#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 -0.34 -3.78 1.61 0.02 -2.11 -3.45 113.55 105.51 2kq7 h SER 2 Ca 0.00 -0.20 -0.44 0.00 -0.84 0.00 0.00 61.79 60.31 2kq7 h SER 2 Cb 0.00 0.09 0.17 0.00 0.14 0.00 0.00 62.40 62.80 2kq7 h SER 2 CO 0.00 0.08 0.19 -0.04 -1.14 0.00 0.00 176.83 175.92 2kq7 s MET 3 N -4.29 -0.14 0.09 3.45 1.00 -1.26 -4.98 119.30 113.17 2kq7 s MET 3 Ca -0.13 0.22 -0.30 0.00 0.00 0.00 0.00 55.69 55.48 2kq7 s MET 3 Cb 0.02 -1.70 -0.06 0.00 0.00 0.00 0.00 34.83 33.09 2kq7 s MET 3 CO 0.51 -3.05 1.07 0.21 0.00 0.00 0.00 175.02 173.75 2kq7 s LYS 4 N -5.20 4.57 -0.01 2.03 2.47 -1.26 -4.97 119.74 117.38 2kq7 s LYS 4 Ca 0.68 1.60 -0.25 0.00 -1.56 0.00 0.00 55.97 56.44 2kq7 s LYS 4 Cb -0.14 -3.36 -0.18 0.00 -1.46 0.00 0.00 37.83 32.68 2kq7 s LYS 4 CO 0.56 -0.01 1.26 0.77 0.16 0.00 0.00 175.35 178.10 2kq7 h SER 5 N 6.04 -0.13 -3.67 1.43 0.02 -1.94 -3.46 113.55 111.85 2kq7 h SER 5 Ca -0.43 -0.33 -0.16 0.00 -0.84 0.00 0.00 61.79 60.04 2kq7 h SER 5 Cb 1.21 0.03 -0.26 0.00 0.14 0.00 0.00 62.40 63.52 2kq7 h SER 5 CO 0.75 0.28 -0.39 0.42 -1.14 0.00 0.00 176.83 176.75 2kq7 s THR 6 N -4.48 -0.01 -0.32 -2.27 -4.23 -1.26 -5.04 115.64 98.03 2kq7 s THR 6 Ca -0.15 0.04 0.09 0.00 -1.18 0.00 0.00 61.69 60.49 2kq7 s THR 6 Cb 0.02 -0.43 0.59 0.00 1.34 0.00 0.00 72.50 74.03 2kq7 s THR 6 CO 0.61 0.02 1.64 2.22 -0.54 0.00 0.00 174.62 178.57 2kq7 n PHE 7 N 3.35 1.82 0.10 3.99 1.16 -1.26 -4.47 117.46 122.15 2kq7 n PHE 7 Ca -0.17 -1.51 0.01 0.00 -1.87 0.00 0.00 57.45 53.91 2kq7 n PHE 7 Cb 0.57 -0.62 -0.02 0.00 -1.61 0.00 0.00 39.48 37.79 2kq7 n PHE 7 CO 0.00 0.00 0.00 0.87 -1.87 0.00 0.00 176.76 175.76 2kq7 h LYS 8 N 1.38 0.00 -0.98 3.97 6.56 -2.02 -3.32 116.57 122.17 2kq7 h LYS 8 Ca 0.31 0.00 0.19 0.00 -1.06 0.00 0.00 60.65 60.09 2kq7 h LYS 8 Cb 2.07 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 33.63 2kq7 h LYS 8 CO 0.62 0.50 0.61 0.77 -2.06 0.00 0.00 179.45 179.89 2kq7 h SER 9 N 0.00 0.69 0.24 0.86 0.02 -2.04 -2.71 113.55 110.60 2kq7 h SER 9 Ca -0.05 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2kq7 h SER 9 Cb 1.49 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.99 2kq7 h SER 9 CO 0.07 0.26 -0.12 -0.33 -1.14 0.00 0.00 176.83 175.57 2kq7 h GLU 10 N 0.68 -0.31 -5.89 3.45 5.08 -1.92 -3.49 114.58 112.18 2kq7 h GLU 10 Ca 0.54 0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.74 2kq7 h GLU 10 Cb 0.96 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.28 2kq7 h GLU 10 CO -0.31 -0.15 -0.50 0.98 -1.00 0.00 0.00 179.01 178.03 2kq7 n TYR 11 N -4.99 -2.73 -2.19 4.33 9.36 -1.03 -4.88 117.16 115.04 2kq7 n TYR 11 Ca -0.05 1.07 -0.42 0.00 3.32 0.00 0.00 57.90 61.83 2kq7 n TYR 11 Cb 0.15 -3.51 -0.03 0.00 -0.63 0.00 0.00 39.34 35.32 2kq7 n TYR 11 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2kq7 s PRO 12 N -3.53 4.30 0.32 2.98 0.04 -1.26 -4.92 135.00 132.93 2kq7 s PRO 12 Ca 0.06 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.13 2kq7 s PRO 12 Cb -0.01 -3.45 0.57 0.00 0.04 0.00 0.00 34.50 31.65 2kq7 s PRO 12 CO 0.81 -0.52 1.96 0.27 0.04 0.00 0.00 177.00 179.56 2kq7 h PHE 13 N 7.46 0.93 -0.35 0.56 -0.00 -2.03 -2.36 116.94 121.15 2kq7 h PHE 13 Ca -0.40 0.02 -0.07 0.00 -0.00 0.00 0.00 57.97 57.53 2kq7 h PHE 13 Cb 1.19 -0.31 -0.01 0.00 -0.00 0.00 0.00 35.95 36.82 2kq7 h PHE 13 CO 0.72 0.54 -0.04 1.49 -0.00 0.00 0.00 178.31 181.02 2kq7 h GLU 14 N 0.97 0.64 -4.98 6.09 4.57 -2.03 -3.47 114.58 116.38 2kq7 h GLU 14 Ca 0.31 -0.22 -0.41 0.00 -1.18 0.00 0.00 59.36 57.86 2kq7 h GLU 14 Cb 0.03 -0.05 0.07 0.00 -0.16 0.00 0.00 28.75 28.65 2kq7 h GLU 14 CO -0.09 0.78 -0.63 1.17 -1.18 0.00 0.00 179.01 179.06 2kq7 n LYS 15 N -4.46 -5.65 -3.45 1.92 4.81 -0.89 -4.97 118.16 105.46 2kq7 n LYS 15 Ca -0.02 0.85 -0.19 0.00 -0.87 0.00 0.00 58.31 58.08 2kq7 n LYS 15 Cb 0.30 -5.76 -0.11 0.00 0.02 0.00 0.00 35.03 29.48 2kq7 n LYS 15 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2kq7 s ARG 16 N -5.93 0.26 -1.45 1.64 1.81 -1.26 -4.89 118.95 109.14 2kq7 s ARG 16 Ca 0.40 -0.05 -0.10 0.00 -1.72 0.00 0.00 55.73 54.26 2kq7 s ARG 16 Cb -0.18 -0.91 0.06 0.00 -0.45 0.00 0.00 34.95 33.47 2kq7 s ARG 16 CO 0.50 -0.89 0.73 1.17 -0.68 0.00 0.00 175.30 176.13 2kq7 n LYS 17 N 5.31 -4.75 -0.01 3.54 3.00 -1.26 -4.86 118.16 119.12 2kq7 n LYS 17 Ca -0.04 0.64 -0.09 0.00 -0.00 0.00 0.00 58.31 58.82 2kq7 n LYS 17 Cb 0.47 -5.47 0.06 0.00 0.00 0.00 0.00 35.03 30.09 2kq7 n LYS 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2kq7 h ALA 18 N 0.98 0.73 -0.54 3.14 0.00 -1.97 -3.19 119.26 118.40 2kq7 h ALA 18 Ca -0.52 -0.49 0.10 0.00 0.00 0.00 0.00 54.91 54.01 2kq7 h ALA 18 Cb 1.34 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.96 2kq7 h ALA 18 CO 0.59 0.67 0.07 1.05 0.00 0.00 0.00 179.25 181.64 2kq7 h GLU 19 N 0.47 0.19 -0.89 0.00 4.11 -2.01 -0.08 114.58 116.38 2kq7 h GLU 19 Ca 0.02 -0.01 0.09 0.00 0.07 0.00 0.00 59.36 59.53 2kq7 h GLU 19 Cb 1.03 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.17 2kq7 h GLU 19 CO 0.10 0.12 0.57 0.77 0.07 0.00 0.00 179.01 180.64 2kq7 h SER 20 N 0.19 0.81 0.84 3.06 0.02 -1.95 -0.87 113.55 115.64 2kq7 h SER 20 Ca 0.28 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.21 2kq7 h SER 20 Cb 0.41 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2kq7 h SER 20 CO -0.40 0.48 -0.43 -0.08 -1.14 0.00 0.00 176.83 175.26 2kq7 h GLU 21 N 0.89 -1.12 -0.97 3.45 4.81 -1.08 0.24 114.58 120.80 2kq7 h GLU 21 Ca 0.41 0.08 0.11 0.00 -0.13 0.00 0.00 59.36 59.83 2kq7 h GLU 21 Cb 0.39 0.25 -0.08 0.00 0.63 0.00 0.00 28.75 29.94 2kq7 h GLU 21 CO -0.17 -0.75 0.62 0.00 -0.73 0.00 0.00 179.01 177.98 2kq7 h ARG 22 N -1.16 0.92 -0.39 1.92 3.08 -1.21 -0.76 114.38 116.78 2kq7 h ARG 22 Ca -0.11 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 59.78 2kq7 h ARG 22 Cb 0.90 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 2kq7 h ARG 22 CO 0.17 0.61 -0.16 0.82 -1.07 0.00 0.00 179.97 180.33 2kq7 h ILE 23 N 0.95 1.26 -0.88 2.04 2.04 -0.96 0.23 117.51 122.19 2kq7 h ILE 23 Ca 0.47 -1.23 0.15 0.00 1.00 0.00 0.00 64.86 65.25 2kq7 h ILE 23 Cb 0.48 1.14 -0.07 0.00 -0.74 0.00 0.00 36.82 37.63 2kq7 h ILE 23 CO -0.23 0.41 0.57 0.00 0.00 0.00 0.00 178.15 178.90 2kq7 h ALA 24 N 1.17 1.87 0.03 1.87 0.00 0.10 0.16 119.26 124.46 2kq7 h ALA 24 Ca 0.10 0.02 -0.32 0.00 0.00 0.00 0.00 54.91 54.70 2kq7 h ALA 24 Cb 0.64 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2kq7 h ALA 24 CO 0.05 -0.11 -1.80 -0.25 0.00 0.00 0.00 179.25 177.14 2kq7 n ASP 25 N -4.56 1.95 0.10 0.00 8.00 -1.08 -4.18 116.55 116.79 2kq7 n ASP 25 Ca 0.17 0.31 0.19 0.00 0.71 0.00 0.00 54.79 56.17 2kq7 n ASP 25 Cb 0.48 -0.87 0.75 0.00 -0.02 0.00 0.00 41.12 41.47 2kq7 n ASP 25 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2kq7 h ARG 26 N -0.66 0.00 -5.17 -1.24 2.43 -0.36 -3.38 114.38 106.00 2kq7 h ARG 26 Ca -0.46 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.04 2kq7 h ARG 26 Cb 1.59 0.00 -0.33 0.00 -0.42 0.00 0.00 29.97 30.81 2kq7 h ARG 26 CO -0.17 0.00 -0.84 -0.06 -1.51 0.00 0.00 179.97 177.39 2kq7 s PHE 27 N -4.75 2.74 0.32 2.20 0.40 0.55 -5.04 117.98 114.39 2kq7 s PHE 27 Ca -0.05 -1.26 0.03 0.00 -0.60 0.00 0.00 56.93 55.06 2kq7 s PHE 27 Cb 0.17 -1.87 -0.02 0.00 0.51 0.00 0.00 43.02 41.81 2kq7 s PHE 27 CO 0.61 -0.58 0.33 -1.59 0.70 0.00 0.00 175.22 174.68 2kq7 s LYS 28 N 0.90 1.75 -1.46 0.44 0.00 -1.26 -4.67 119.74 115.45 2kq7 s LYS 28 Ca -0.04 -1.89 -0.06 0.00 0.00 0.00 0.00 55.97 53.98 2kq7 s LYS 28 Cb -0.15 0.36 0.03 0.00 0.00 0.00 0.00 37.83 38.07 2kq7 s LYS 28 CO -0.03 -0.67 0.56 0.09 0.00 0.00 0.00 175.35 175.30 2kq7 n ASN 29 N -1.37 -5.26 -4.37 0.03 3.02 -1.26 -4.97 115.26 101.10 2kq7 n ASN 29 Ca 0.05 -0.32 -0.22 0.00 -0.03 0.00 0.00 54.58 54.06 2kq7 n ASN 29 Cb 0.62 -4.27 -0.10 0.00 -0.61 0.00 0.00 39.78 35.42 2kq7 n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kq7 s ARG 30 N -5.80 1.72 -0.13 3.52 3.03 -1.26 -3.38 118.95 116.64 2kq7 s ARG 30 Ca 0.33 -1.98 0.02 0.00 2.03 0.00 0.00 55.73 56.14 2kq7 s ARG 30 Cb -0.16 -0.77 0.00 0.00 -1.03 0.00 0.00 34.95 32.99 2kq7 s ARG 30 CO 0.41 -0.27 -0.21 0.96 -1.13 0.00 0.00 175.30 175.06 2kq7 s ILE 31 N -3.30 2.25 -1.02 4.99 -4.36 -0.32 -4.88 121.20 114.56 2kq7 s ILE 31 Ca 0.33 -0.93 -0.24 0.00 -0.26 0.00 0.00 60.65 59.55 2kq7 s ILE 31 Cb 0.07 -1.90 -0.06 0.00 1.25 0.00 0.00 42.46 41.82 2kq7 s ILE 31 CO 0.15 0.55 1.94 -2.16 0.24 0.00 0.00 174.94 175.65 2kq7 s PRO 32 N 0.59 2.53 -0.14 0.37 0.04 -1.26 -3.94 135.00 133.18 2kq7 s PRO 32 Ca -0.12 -0.65 -0.14 0.00 0.04 0.00 0.00 61.00 60.13 2kq7 s PRO 32 Cb -0.16 -5.14 -0.05 0.00 0.04 0.00 0.00 34.50 29.19 2kq7 s PRO 32 CO 0.03 -3.63 0.30 0.14 0.04 0.00 0.00 177.00 173.89 2kq7 s VAL 33 N 10.47 5.29 -0.04 -0.36 -7.23 -1.25 -3.68 120.40 123.59 2kq7 s VAL 33 Ca 0.69 0.57 0.06 0.00 -1.81 0.00 0.00 61.98 61.50 2kq7 s VAL 33 Cb -0.04 -3.63 -0.01 0.00 0.56 0.00 0.00 36.38 33.25 2kq7 s VAL 33 CO 0.05 0.42 -0.24 -0.51 -0.31 0.00 0.00 175.10 174.51 2kq7 s ILE 34 N 0.22 1.97 -0.18 -0.62 -1.16 -1.09 -2.50 121.20 117.84 2kq7 s ILE 34 Ca 0.17 -1.03 -0.13 0.00 -0.51 0.00 0.00 60.65 59.15 2kq7 s ILE 34 Cb -0.13 -1.66 -0.05 0.00 0.61 0.00 0.00 42.46 41.23 2kq7 s ILE 34 CO 0.05 0.55 0.26 0.00 -2.81 0.00 0.00 174.94 172.99 2kq7 s GLU 36 N 0.61 2.54 -0.29 0.00 -1.05 -0.65 -4.82 118.70 115.03 2kq7 s GLU 36 Ca 0.14 -1.53 0.01 0.00 -0.15 0.00 0.00 54.97 53.44 2kq7 s GLU 36 Cb -0.13 -2.40 0.07 0.00 -0.44 0.00 0.00 34.13 31.23 2kq7 s GLU 36 CO 0.03 -0.22 -0.03 -1.59 0.95 0.00 0.00 175.26 174.40 2kq7 s LYS 37 N -4.16 2.16 0.73 -4.83 -2.85 -1.26 -3.77 119.74 105.76 2kq7 s LYS 37 Ca 0.48 -1.44 -0.16 0.00 -1.00 0.00 0.00 55.97 53.86 2kq7 s LYS 37 Cb -0.04 -3.06 0.01 0.00 -2.06 0.00 0.00 37.83 32.68 2kq7 s LYS 37 CO 0.28 -0.67 0.98 0.00 0.10 0.00 0.00 175.35 176.04 2kq7 n ALA 38 N 4.47 -0.23 1.58 0.59 0.00 -1.26 -4.89 120.51 120.76 2kq7 n ALA 38 Ca -0.10 -0.20 0.15 0.00 0.00 0.00 0.00 53.44 53.28 2kq7 n ALA 38 Cb 0.42 -2.12 0.66 0.00 0.00 0.00 0.00 19.45 18.41 2kq7 n ALA 38 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2kq7 n GLU 39 N -1.95 1.06 -2.93 0.00 0.28 -1.26 -4.04 120.64 111.80 2kq7 n GLU 39 Ca 0.13 -0.40 -0.23 0.00 -0.16 0.00 0.00 57.16 56.50 2kq7 n GLU 39 Cb 0.49 -1.49 -0.03 0.00 1.43 0.00 0.00 31.44 31.85 2kq7 n GLU 39 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2kq7 n LYS 40 N -0.62 2.42 -3.82 3.44 4.76 -1.26 -5.05 118.16 118.02 2kq7 n LYS 40 Ca 0.18 -4.25 -0.12 0.00 -2.87 0.00 0.00 58.31 51.25 2kq7 n LYS 40 Cb 0.26 -2.00 -0.12 0.00 -1.84 0.00 0.00 35.03 31.33 2kq7 n LYS 40 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2kq7 s SER 41 N -3.14 -0.14 0.00 4.39 0.01 -1.26 -5.01 113.70 108.56 2kq7 s SER 41 Ca 0.44 0.22 0.15 0.00 1.31 0.00 0.00 55.95 58.08 2kq7 s SER 41 Cb 0.33 0.32 0.57 0.00 0.21 0.00 0.00 66.02 67.46 2kq7 s SER 41 CO -0.11 -0.14 1.42 -0.67 0.41 0.00 0.00 173.24 174.15 2kq7 n ASP 42 N 2.61 1.37 -4.75 2.44 2.03 -1.26 -4.90 116.55 114.10 2kq7 n ASP 42 Ca -0.15 -1.80 -0.41 0.00 0.52 0.00 0.00 54.79 52.96 2kq7 n ASP 42 Cb 0.58 -0.13 -0.04 0.00 -0.72 0.00 0.00 41.12 40.81 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 -1.75 3.46 0.60 5.18 2.07 -1.26 -5.02 121.20 124.48 2kq7 s ILE 43 Ca 0.26 1.41 -0.17 0.00 -1.41 0.00 0.00 60.65 60.73 2kq7 s ILE 43 Cb 0.13 -3.90 -0.03 0.00 0.13 0.00 0.00 42.46 38.80 2kq7 s ILE 43 CO 0.20 0.31 1.12 -2.16 -1.91 0.00 0.00 174.94 172.50 2kq7 s PRO 44 N -1.20 3.10 -0.28 3.50 0.04 -1.26 -4.89 135.00 134.01 2kq7 s PRO 44 Ca 0.47 1.50 -0.35 0.00 0.04 0.00 0.00 61.00 62.66 2kq7 s PRO 44 Cb -0.33 -1.98 -0.11 0.00 0.04 0.00 0.00 34.50 32.12 2kq7 s PRO 44 CO 0.41 -1.03 2.08 -1.91 0.04 0.00 0.00 177.00 176.59 2kq7 n GLU 45 N -1.82 1.38 -2.74 4.56 2.13 -1.26 -4.93 120.64 117.96 2kq7 n GLU 45 Ca 0.11 0.43 -0.31 0.00 0.66 0.00 0.00 57.16 58.04 2kq7 n GLU 45 Cb 0.51 -2.52 -0.04 0.00 0.27 0.00 0.00 31.44 29.67 2kq7 n GLU 45 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 2kq7 s ILE 46 N 6.30 4.67 -1.01 6.31 2.07 -1.26 -4.94 121.20 133.32 2kq7 s ILE 46 Ca 1.04 0.91 -0.24 0.00 -1.41 0.00 0.00 60.65 60.95 2kq7 s ILE 46 Cb -0.81 -3.70 -0.09 0.00 0.13 0.00 0.00 42.46 37.98 2kq7 s ILE 46 CO 0.51 -0.52 2.02 -0.62 -1.91 0.00 0.00 174.94 174.41 2kq7 s ASP 47 N -2.96 4.76 0.20 4.50 -1.08 -1.26 -4.92 116.67 115.91 2kq7 s ASP 47 Ca 0.55 -0.99 -0.33 0.00 -0.52 0.00 0.00 52.55 51.26 2kq7 s ASP 47 Cb -0.10 -2.57 -0.13 0.00 -1.46 0.00 0.00 42.92 38.66 2kq7 s ASP 47 CO 0.28 -3.23 1.64 1.17 0.52 0.00 0.00 175.17 175.55 2kq7 n LYS 48 N 8.56 2.48 -3.60 4.34 4.81 -1.26 -4.95 118.16 128.54 2kq7 n LYS 48 Ca 0.43 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.76 2kq7 n LYS 48 Cb 0.46 -2.69 -0.01 0.00 0.02 0.00 0.00 35.03 32.81 2kq7 n LYS 48 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2kq7 s ARG 49 N 0.84 0.15 -0.02 1.64 1.81 -1.26 -5.13 118.95 116.98 2kq7 s ARG 49 Ca 0.75 -0.07 -0.30 0.00 -1.72 0.00 0.00 55.73 54.39 2kq7 s ARG 49 Cb -0.58 0.06 -0.06 0.00 -0.45 0.00 0.00 34.95 33.91 2kq7 s ARG 49 CO 0.37 -0.07 1.63 0.15 -0.68 0.00 0.00 175.30 176.70 2kq7 s LYS 50 N -2.18 4.19 -0.51 3.54 3.01 -1.26 -4.59 119.74 121.94 2kq7 s LYS 50 Ca 0.13 2.21 -0.16 0.00 -1.01 0.00 0.00 55.97 57.13 2kq7 s LYS 50 Cb 0.03 -3.87 0.10 0.00 -1.01 0.00 0.00 37.83 33.08 2kq7 s LYS 50 CO -0.05 -0.80 0.48 0.71 0.51 0.00 0.00 175.35 176.21 2kq7 s TYR 51 N 3.58 3.21 -0.80 3.18 2.02 -1.04 -5.00 117.35 122.50 2kq7 s TYR 51 Ca 0.73 -1.03 -0.25 0.00 -0.37 0.00 0.00 57.07 56.14 2kq7 s TYR 51 Cb -0.35 -3.51 -0.09 0.00 -0.40 0.00 0.00 41.96 37.61 2kq7 s TYR 51 CO 0.30 -0.94 2.19 -0.51 -1.57 0.00 0.00 175.55 175.01 2kq7 s LEU 52 N 1.81 3.06 -0.18 -1.29 2.01 -1.26 -3.94 118.68 118.88 2kq7 s LEU 52 Ca 0.05 -0.14 -0.03 0.00 0.01 0.00 0.00 54.13 54.02 2kq7 s LEU 52 Cb -0.26 -2.55 -0.02 0.00 0.01 0.00 0.00 46.19 43.37 2kq7 s LEU 52 CO 0.06 -3.25 -0.04 -0.69 1.01 0.00 0.00 176.35 173.44 2kq7 s VAL 53 N 12.32 3.67 0.61 -1.59 1.01 -1.25 -5.03 120.40 130.15 2kq7 s VAL 53 Ca 0.82 -0.42 -0.17 0.00 0.00 0.00 0.00 61.98 62.21 2kq7 s VAL 53 Cb -0.11 -2.62 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 2kq7 s VAL 53 CO 0.07 0.47 1.12 -2.16 0.00 0.00 0.00 175.10 174.59 2kq7 s PRO 54 N 0.75 3.03 0.00 2.72 0.04 -1.26 -1.18 135.00 139.10 2kq7 s PRO 54 Ca -0.02 1.48 0.15 0.00 0.04 0.00 0.00 61.00 62.65 2kq7 s PRO 54 Cb -0.15 -1.97 0.86 0.00 0.04 0.00 0.00 34.50 33.28 2kq7 s PRO 54 CO 0.02 -1.08 1.39 0.00 0.04 0.00 0.00 177.00 177.36 2kq7 n ALA 55 N -1.97 1.98 -0.09 8.56 0.00 -1.22 -1.67 120.51 126.11 2kq7 n ALA 55 Ca 0.11 -0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.55 2kq7 n ALA 55 Cb 0.52 -1.25 0.20 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.13 3.21 -4.86 0.00 9.92 -1.26 -3.81 116.55 118.60 2kq7 n ASP 56 Ca 0.10 -1.94 -0.29 0.00 -0.53 0.00 0.00 54.79 52.12 2kq7 n ASP 56 Cb 0.08 -0.28 0.08 0.00 -0.64 0.00 0.00 41.12 40.37 2kq7 n ASP 56 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2kq7 s LEU 57 N -1.07 2.55 0.12 0.64 0.20 -0.67 -4.95 118.68 115.50 2kq7 s LEU 57 Ca 0.32 0.98 0.05 0.00 0.69 0.00 0.00 54.13 56.16 2kq7 s LEU 57 Cb 0.17 -3.55 -0.04 0.00 -0.43 0.00 0.00 46.19 42.35 2kq7 s LEU 57 CO 0.23 -1.86 -0.11 0.42 -0.29 0.00 0.00 176.35 174.74 2kq7 s THR 58 N -3.41 1.14 0.20 3.68 -4.23 -1.26 -1.92 115.64 109.85 2kq7 s THR 58 Ca 0.61 -1.81 -0.11 0.00 -1.18 0.00 0.00 61.69 59.19 2kq7 s THR 58 Cb -0.12 -1.59 0.17 0.00 1.34 0.00 0.00 72.50 72.30 2kq7 s THR 58 CO 0.51 -0.58 1.68 0.58 -0.54 0.00 0.00 174.62 176.27 2kq7 h VAL 59 N 3.27 0.57 -0.66 2.29 2.07 -1.32 -1.20 116.25 121.28 2kq7 h VAL 59 Ca -0.38 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2kq7 h VAL 59 Cb 1.19 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2kq7 h VAL 59 CO 0.56 0.03 0.42 1.23 0.02 0.00 0.00 177.57 179.83 2kq7 h GLY 60 N 0.16 0.93 0.70 2.17 0.00 -1.78 -0.69 103.07 104.56 2kq7 h GLY 60 Ca 0.30 -0.36 0.05 0.00 0.00 0.00 0.00 47.33 47.32 2kq7 h GLY 60 CO -0.46 0.35 0.27 -1.61 0.00 0.00 0.00 176.54 175.10 2kq7 h GLN 61 N 0.89 0.51 -0.26 4.80 4.15 -1.52 -0.57 115.11 123.10 2kq7 h GLN 61 Ca 0.24 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.58 2kq7 h GLN 61 Cb -0.08 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.49 2kq7 h GLN 61 CO -0.05 0.34 -0.04 0.35 -1.93 0.00 0.00 178.83 177.50 2kq7 h PHE 62 N 0.53 0.54 -0.62 3.99 3.04 -1.04 -2.59 116.94 120.79 2kq7 h PHE 62 Ca 0.24 -0.11 0.06 0.00 3.98 0.00 0.00 57.97 62.14 2kq7 h PHE 62 Cb 0.16 -0.14 -0.04 0.00 2.56 0.00 0.00 35.95 38.49 2kq7 h PHE 62 CO -0.10 0.69 0.41 0.28 -2.02 0.00 0.00 178.31 177.57 2kq7 h VAL 63 N 0.25 1.00 -0.00 1.41 2.07 -0.74 -0.38 116.25 119.86 2kq7 h VAL 63 Ca 0.07 -0.21 -0.13 0.00 0.82 0.00 0.00 66.70 67.25 2kq7 h VAL 63 Cb 0.50 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2kq7 h VAL 63 CO 0.02 0.11 -0.60 1.88 0.02 0.00 0.00 177.57 179.00 2kq7 h TYR 64 N 0.61 0.01 -0.00 1.57 0.05 -0.94 -3.11 116.97 115.16 2kq7 h TYR 64 Ca 0.27 -0.01 -0.22 0.00 0.05 0.00 0.00 58.73 58.82 2kq7 h TYR 64 Cb 0.28 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.01 2kq7 h TYR 64 CO -0.00 0.61 -0.92 0.28 -1.05 0.00 0.00 178.16 177.08 2kq7 h VAL 65 N 0.01 1.41 -0.86 -2.88 2.07 -0.73 -3.26 116.25 112.01 2kq7 h VAL 65 Ca -0.01 -2.44 0.17 0.00 0.82 0.00 0.00 66.70 65.24 2kq7 h VAL 65 Cb 1.07 2.40 -0.10 0.00 -1.52 0.00 0.00 31.29 33.14 2kq7 h VAL 65 CO 0.08 0.73 0.41 0.40 0.02 0.00 0.00 177.57 179.21 2kq7 h ILE 66 N 0.22 0.64 -0.83 4.57 1.08 -1.14 0.18 117.51 122.23 2kq7 h ILE 66 Ca -0.07 -0.18 0.15 0.00 -0.39 0.00 0.00 64.86 64.36 2kq7 h ILE 66 Cb 1.56 0.06 -0.06 0.00 -3.07 0.00 0.00 36.82 35.30 2kq7 h ILE 66 CO 0.16 0.10 0.54 0.03 -0.69 0.00 0.00 178.15 178.29 2kq7 h ARG 67 N 0.54 0.55 0.00 2.37 3.08 -1.64 0.30 114.38 119.57 2kq7 h ARG 67 Ca 0.49 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.49 2kq7 h ARG 67 Cb 0.78 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 2kq7 h ARG 67 CO -0.42 0.36 -0.07 -0.22 -1.07 0.00 0.00 179.97 178.55 2kq7 h LYS 68 N 0.56 0.00 0.04 0.04 1.63 -0.83 0.30 116.57 118.31 2kq7 h LYS 68 Ca 0.41 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 60.08 2kq7 h LYS 68 Cb 0.79 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.43 2kq7 h LYS 68 CO -0.17 0.07 -0.54 -0.09 -3.45 0.00 0.00 179.45 175.27 2kq7 h ARG 69 N 0.00 0.30 -0.01 1.90 9.65 0.29 -3.32 114.38 123.19 2kq7 h ARG 69 Ca -0.00 -0.37 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 2kq7 h ARG 69 Cb 1.05 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.75 2kq7 h ARG 69 CO 0.01 1.09 -0.65 -0.89 2.80 0.00 0.00 179.97 182.34 2kq7 n ILE 70 N -4.28 0.00 -2.10 1.20 5.41 -0.37 -4.88 119.36 114.34 2kq7 n ILE 70 Ca -0.11 -0.11 -0.15 0.00 1.00 0.00 0.00 62.75 63.38 2kq7 n ILE 70 Cb 0.66 0.93 -0.02 0.00 -0.71 0.00 0.00 39.64 40.50 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 -0.83 -1.84 -1.71 0.38 2.81 0.10 -4.87 117.12 111.16 2kq7 n MET 71 Ca 0.07 0.76 -0.43 0.00 -1.81 0.00 0.00 57.70 56.29 2kq7 n MET 71 Cb 0.39 -5.26 -0.01 0.00 -0.71 0.00 0.00 33.22 27.62 2kq7 n MET 71 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2kq7 n LEU 72 N -2.57 3.74 -4.71 4.03 7.94 -1.15 -4.97 117.00 119.30 2kq7 n LEU 72 Ca -0.16 1.18 -0.30 0.00 -1.11 0.00 0.00 56.01 55.62 2kq7 n LEU 72 Cb 0.58 -1.51 0.14 0.00 0.53 0.00 0.00 43.42 43.17 2kq7 n LEU 72 CO 0.21 -0.27 0.66 -2.16 -1.11 0.00 0.00 177.39 174.72 2kq7 s PRO 73 N -1.17 1.16 0.54 1.96 0.04 -1.26 -4.94 135.00 131.32 2kq7 s PRO 73 Ca 0.61 0.78 0.32 0.00 0.04 0.00 0.00 61.00 62.75 2kq7 s PRO 73 Cb -0.57 -1.80 1.34 0.00 0.04 0.00 0.00 34.50 33.51 2kq7 s PRO 73 CO 0.56 -2.30 1.98 -1.00 0.04 0.00 0.00 177.00 176.28 2kq7 h PRO 74 N -1.59 0.00 -0.89 0.56 0.13 -2.02 -3.08 132.00 125.11 2kq7 h PRO 74 Ca -0.50 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.85 2kq7 h PRO 74 Cb 1.29 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.36 2kq7 h PRO 74 CO 0.55 0.05 0.60 0.93 -0.23 0.00 0.00 178.00 179.90 2kq7 h GLU 75 N 0.00 0.29 -5.06 0.86 5.08 -2.03 -3.42 114.58 110.30 2kq7 h GLU 75 Ca -0.00 -0.02 -0.51 0.00 -1.00 0.00 0.00 59.36 57.83 2kq7 h GLU 75 Cb 0.52 -0.07 -0.13 0.00 0.50 0.00 0.00 28.75 29.57 2kq7 h GLU 75 CO 0.01 0.19 -0.55 0.15 -1.00 0.00 0.00 179.01 177.81 2kq7 s LYS 76 N -5.31 1.80 0.08 2.33 1.02 -1.17 -5.18 119.74 113.31 2kq7 s LYS 76 Ca -0.07 -2.07 -0.06 0.00 0.02 0.00 0.00 55.97 53.79 2kq7 s LYS 76 Cb 0.22 -0.61 -0.01 0.00 -0.52 0.00 0.00 37.83 36.91 2kq7 s LYS 76 CO 0.78 -0.39 0.12 0.00 -0.92 0.00 0.00 175.35 174.94 2kq7 s ALA 77 N -3.30 -0.01 0.15 5.17 0.00 -1.26 -4.77 121.76 117.74 2kq7 s ALA 77 Ca 0.29 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 2kq7 s ALA 77 Cb 0.05 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.54 2kq7 s ALA 77 CO 0.15 -0.46 0.08 0.96 0.00 0.00 0.00 175.76 176.49 2kq7 s ILE 78 N -3.83 0.08 0.08 0.00 -4.36 -1.26 -4.53 121.20 107.38 2kq7 s ILE 78 Ca 0.05 -1.92 -0.11 0.00 -0.26 0.00 0.00 60.65 58.41 2kq7 s ILE 78 Cb 0.06 -2.14 0.01 0.00 1.25 0.00 0.00 42.46 41.63 2kq7 s ILE 78 CO -0.10 -0.36 0.25 0.72 0.24 0.00 0.00 174.94 175.69 2kq7 s PHE 79 N -4.07 0.02 -0.11 1.37 -0.71 -0.63 -5.00 117.98 108.85 2kq7 s PHE 79 Ca 0.27 -0.34 -0.01 0.00 -1.04 0.00 0.00 56.93 55.81 2kq7 s PHE 79 Cb 0.07 0.04 -0.03 0.00 -1.21 0.00 0.00 43.02 41.89 2kq7 s PHE 79 CO 0.04 -0.55 -0.07 0.42 -1.34 0.00 0.00 175.22 173.72 2kq7 s ILE 80 N -3.41 3.66 0.06 -4.49 -1.09 -1.26 -2.46 121.20 112.21 2kq7 s ILE 80 Ca 0.01 -0.47 0.06 0.00 -2.23 0.00 0.00 60.65 58.02 2kq7 s ILE 80 Cb 0.02 -2.54 -0.03 0.00 -1.58 0.00 0.00 42.46 38.33 2kq7 s ILE 80 CO -0.09 0.54 -0.16 0.72 -1.23 0.00 0.00 174.94 174.73 2kq7 s PHE 81 N -0.14 1.34 0.01 3.97 -0.12 -0.43 -4.83 117.98 117.78 2kq7 s PHE 81 Ca 0.02 -0.41 0.08 0.00 -0.05 0.00 0.00 56.93 56.57 2kq7 s PHE 81 Cb -0.13 -0.77 -0.02 0.00 -0.63 0.00 0.00 43.02 41.46 2kq7 s PHE 81 CO 0.03 0.07 -0.23 0.14 -0.05 0.00 0.00 175.22 175.18 2kq7 s VAL 82 N -1.06 1.86 -1.47 -2.49 -7.23 0.33 -1.74 120.40 108.60 2kq7 s VAL 82 Ca 0.01 -1.12 -0.08 0.00 -1.81 0.00 0.00 61.98 58.98 2kq7 s VAL 82 Cb -0.09 -1.57 0.06 0.00 0.56 0.00 0.00 36.38 35.34 2kq7 s VAL 82 CO 0.02 0.42 0.80 -3.20 -0.31 0.00 0.00 175.10 172.82 2kq7 n ASN 83 N 2.21 -2.91 -1.77 4.85 2.85 -1.26 0.08 115.26 119.31 2kq7 n ASN 83 Ca -0.16 -0.85 -0.16 0.00 -0.11 0.00 0.00 54.58 53.29 2kq7 n ASN 83 Cb 0.52 -3.70 -0.05 0.00 1.24 0.00 0.00 39.78 37.80 2kq7 n ASN 83 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2kq7 n ASP 84 N -2.90 -4.51 -4.17 1.20 8.00 -1.26 -4.94 116.55 107.96 2kq7 n ASP 84 Ca -0.11 0.31 -0.22 0.00 0.71 0.00 0.00 54.79 55.48 2kq7 n ASP 84 Cb 0.59 -3.99 -0.14 0.00 -0.02 0.00 0.00 41.12 37.56 2kq7 n ASP 84 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2kq7 s THR 85 N -2.53 1.29 -0.58 -3.53 2.01 0.11 -5.10 115.64 107.31 2kq7 s THR 85 Ca 0.00 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.01 2kq7 s THR 85 Cb 0.00 -1.14 0.14 0.00 0.01 0.00 0.00 72.50 71.51 2kq7 s THR 85 CO 0.00 0.10 0.34 -0.22 -0.69 0.00 0.00 174.62 174.16 2kq7 s LEU 86 N -1.06 4.59 0.98 4.42 2.96 -1.26 -0.51 118.68 128.79 2kq7 s LEU 86 Ca 0.04 -3.13 -0.12 0.00 -0.22 0.00 0.00 54.13 50.70 2kq7 s LEU 86 Cb -0.08 -1.69 0.18 0.00 0.50 0.00 0.00 46.19 45.10 2kq7 s LEU 86 CO 0.01 -0.23 1.09 -2.16 -1.32 0.00 0.00 176.35 173.74 2kq7 s PRO 87 N -0.45 0.61 0.89 0.98 0.04 -1.26 -5.03 135.00 130.78 2kq7 s PRO 87 Ca 0.18 0.60 -0.11 0.00 0.04 0.00 0.00 61.00 61.71 2kq7 s PRO 87 Cb -0.22 -1.75 0.12 0.00 0.04 0.00 0.00 34.50 32.70 2kq7 s PRO 87 CO -0.03 -2.63 1.09 -1.25 0.04 0.00 0.00 177.00 174.22 2kq7 s PRO 88 N -4.95 1.32 0.45 0.56 0.04 -1.26 -4.93 135.00 126.23 2kq7 s PRO 88 Ca 0.65 0.84 0.23 0.00 0.04 0.00 0.00 61.00 62.76 2kq7 s PRO 88 Cb -0.18 -1.81 1.08 0.00 0.04 0.00 0.00 34.50 33.62 2kq7 s PRO 88 CO 0.57 -2.20 1.92 1.79 0.04 0.00 0.00 177.00 179.12 2kq7 h THR 89 N -1.52 0.73 0.00 1.26 1.35 -1.96 -2.00 112.91 110.78 2kq7 h THR 89 Ca -0.49 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.41 2kq7 h THR 89 Cb 1.28 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 2kq7 h THR 89 CO 0.54 0.22 0.00 0.00 -0.25 0.00 0.00 175.52 176.04 2kq7 n ALA 90 N -2.30 2.17 -2.06 6.62 0.00 -1.26 -2.74 120.51 120.94 2kq7 n ALA 90 Ca -0.01 -0.10 -0.43 0.00 0.00 0.00 0.00 53.44 52.91 2kq7 n ALA 90 Cb 0.35 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 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 -2.86 3.38 0.12 0.00 0.00 -0.75 -4.89 121.76 116.76 2kq7 s ALA 91 Ca 0.16 0.65 -0.31 0.00 0.00 0.00 0.00 51.96 52.46 2kq7 s ALA 91 Cb 0.16 -3.82 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 2kq7 s ALA 91 CO 0.43 -1.77 1.26 -1.17 0.00 0.00 0.00 175.76 174.51 2kq7 s LEU 92 N 4.87 4.40 0.30 0.00 1.98 -1.26 -1.81 118.68 127.16 2kq7 s LEU 92 Ca 0.73 2.19 0.01 0.00 -2.89 0.00 0.00 54.13 54.17 2kq7 s LEU 92 Cb -0.28 -3.59 0.56 0.00 0.66 0.00 0.00 46.19 43.54 2kq7 s LEU 92 CO 0.29 -0.50 1.89 0.24 -1.89 0.00 0.00 176.35 176.39 2kq7 h MET 93 N 6.24 0.97 0.00 1.98 2.86 -1.66 0.67 114.93 125.98 2kq7 h MET 93 Ca -0.43 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.11 2kq7 h MET 93 Cb 1.21 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 2kq7 h MET 93 CO 0.80 0.64 -0.20 1.03 1.06 0.00 0.00 176.91 180.24 2kq7 h SER 94 N 1.00 0.00 0.60 1.22 0.87 -1.79 0.28 113.55 115.72 2kq7 h SER 94 Ca 0.41 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.70 2kq7 h SER 94 Cb 0.30 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 2kq7 h SER 94 CO -0.17 0.20 -1.42 0.00 -0.53 0.00 0.00 176.83 174.91 2kq7 h ALA 95 N 1.80 0.37 0.00 6.23 0.00 -1.27 -3.21 119.26 123.18 2kq7 h ALA 95 Ca -0.00 -1.11 -0.01 0.00 0.00 0.00 0.00 54.91 53.79 2kq7 h ALA 95 Cb 0.45 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2kq7 h ALA 95 CO 0.03 1.24 -0.05 0.82 0.00 0.00 0.00 179.25 181.28 2kq7 h ILE 96 N 0.04 1.23 -0.43 0.00 1.08 -0.70 -3.31 117.51 115.42 2kq7 h ILE 96 Ca -0.19 -1.94 0.12 0.00 -0.39 0.00 0.00 64.86 62.47 2kq7 h ILE 96 Cb 1.95 2.34 -0.02 0.00 -3.07 0.00 0.00 36.82 38.02 2kq7 h ILE 96 CO 0.14 0.42 0.39 0.22 -0.69 0.00 0.00 178.15 178.62 2kq7 h TYR 97 N -1.00 0.00 -0.41 1.37 3.20 -0.63 0.33 116.97 119.82 2kq7 h TYR 97 Ca -0.01 0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.94 2kq7 h TYR 97 Cb 0.72 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 38.90 2kq7 h TYR 97 CO 0.19 0.00 -0.25 0.37 -1.64 0.00 0.00 178.16 176.83 2kq7 h GLN 98 N 0.00 -0.17 0.00 1.82 4.15 -1.64 -0.26 115.11 119.01 2kq7 h GLN 98 Ca 0.20 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.64 2kq7 h GLN 98 Cb 0.97 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.70 2kq7 h GLN 98 CO -0.00 -0.11 -1.21 -1.91 -1.93 0.00 0.00 178.83 173.66 2kq7 n GLU 99 N -5.40 0.57 -0.56 1.69 4.07 -0.78 -4.22 120.64 116.01 2kq7 n GLU 99 Ca 0.02 -0.05 0.06 0.00 -0.06 0.00 0.00 57.16 57.12 2kq7 n GLU 99 Cb 0.31 -1.44 0.27 0.00 -0.06 0.00 0.00 31.44 30.53 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 -1.68 1.32 -3.36 4.31 8.25 0.11 -4.91 115.22 119.25 2kq7 n HIS 100 Ca 0.02 -0.48 -0.38 0.00 -0.26 0.00 0.00 57.72 56.62 2kq7 n HIS 100 Cb 0.37 -0.32 -0.06 0.00 1.12 0.00 0.00 29.99 31.10 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 -2.05 4.15 1.07 -0.41 -2.85 -0.14 -4.22 119.74 115.28 2kq7 s LYS 101 Ca 0.38 0.54 -0.19 0.00 -1.00 0.00 0.00 55.97 55.70 2kq7 s LYS 101 Cb 0.27 -3.30 0.05 0.00 -2.06 0.00 0.00 37.83 32.79 2kq7 s LYS 101 CO 0.14 0.50 -0.15 -3.47 0.10 0.00 0.00 175.35 172.47 2kq7 n ASP 102 N 2.38 -2.54 0.14 0.03 2.03 0.10 -4.63 116.55 114.07 2kq7 n ASP 102 Ca -0.10 -0.02 0.19 0.00 0.52 0.00 0.00 54.79 55.37 2kq7 n ASP 102 Cb 0.52 -0.94 0.77 0.00 -0.72 0.00 0.00 41.12 40.75 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 -1.82 0.00 -0.55 -0.67 1.57 -1.97 0.51 116.57 113.64 2kq7 h LYS 103 Ca -0.50 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 57.88 2kq7 h LYS 103 Cb 1.35 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 33.35 2kq7 h LYS 103 CO 0.35 0.00 -0.73 -3.47 -0.57 0.00 0.00 179.45 175.03 2kq7 n ASP 104 N -3.64 4.06 -2.25 0.86 2.03 -1.26 -5.03 116.55 111.32 2kq7 n ASP 104 Ca 0.05 -3.79 -0.03 0.00 0.52 0.00 0.00 54.79 51.54 2kq7 n ASP 104 Cb 0.53 -0.39 -0.02 0.00 -0.72 0.00 0.00 41.12 40.51 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 -0.82 -5.04 3.32 0.27 0.00 0.17 -5.09 105.19 98.00 2kq7 n GLY 105 Ca 0.37 0.77 0.03 0.00 0.00 0.00 0.00 46.02 47.19 2kq7 n GLY 105 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2kq7 s PHE 106 N -0.51 -0.14 -0.28 1.61 5.36 -1.26 -4.68 117.98 118.09 2kq7 s PHE 106 Ca -0.13 0.25 -0.24 0.00 -0.96 0.00 0.00 56.93 55.84 2kq7 s PHE 106 Cb 0.01 0.08 -0.00 0.00 -0.34 0.00 0.00 43.02 42.77 2kq7 s PHE 106 CO 0.36 -0.07 0.82 -1.17 -1.46 0.00 0.00 175.22 173.70 2kq7 s LEU 107 N 1.83 4.07 -0.36 6.12 1.98 -1.24 0.03 118.68 131.10 2kq7 s LEU 107 Ca -0.02 0.86 -0.09 0.00 -2.89 0.00 0.00 54.13 51.99 2kq7 s LEU 107 Cb -0.02 -3.15 0.03 0.00 0.66 0.00 0.00 46.19 43.72 2kq7 s LEU 107 CO -0.15 -0.58 0.17 -0.31 -1.89 0.00 0.00 176.35 173.60 2kq7 s TYR 108 N 2.93 3.25 -0.13 5.38 2.02 -1.26 -2.67 117.35 126.88 2kq7 s TYR 108 Ca 0.34 -1.15 0.01 0.00 -0.37 0.00 0.00 57.07 55.90 2kq7 s TYR 108 Cb -0.15 -2.40 -0.01 0.00 -0.40 0.00 0.00 41.96 39.01 2kq7 s TYR 108 CO 0.10 -0.69 -0.17 0.14 -1.57 0.00 0.00 175.55 173.36 2kq7 s VAL 109 N 1.49 2.60 -0.15 0.71 -7.23 -1.02 -4.35 120.40 112.46 2kq7 s VAL 109 Ca 0.01 -0.81 -0.03 0.00 -1.81 0.00 0.00 61.98 59.33 2kq7 s VAL 109 Cb -0.19 -2.07 -0.02 0.00 0.56 0.00 0.00 36.38 34.66 2kq7 s VAL 109 CO 0.05 0.53 -0.06 -0.89 -0.31 0.00 0.00 175.10 174.43 2kq7 s THR 110 N 0.48 3.70 -0.09 5.32 2.01 -0.71 -1.64 115.64 124.70 2kq7 s THR 110 Ca -0.12 -0.43 -0.01 0.00 0.31 0.00 0.00 61.69 61.45 2kq7 s THR 110 Cb -0.16 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 2kq7 s THR 110 CO 0.05 0.50 -0.06 -0.72 -0.69 0.00 0.00 174.62 173.70 2kq7 s TYR 111 N 0.39 2.98 0.11 4.92 1.13 -1.25 -1.31 117.35 124.32 2kq7 s TYR 111 Ca -0.05 -0.07 -0.26 0.00 -1.41 0.00 0.00 57.07 55.28 2kq7 s TYR 111 Cb -0.15 -1.78 0.07 0.00 -1.10 0.00 0.00 41.96 39.00 2kq7 s TYR 111 CO 0.03 0.23 0.84 0.45 -2.51 0.00 0.00 175.55 174.60 2kq7 s SER 112 N -0.48 -0.33 -0.09 -0.18 0.15 -1.03 -4.54 113.70 107.21 2kq7 s SER 112 Ca 0.07 -0.20 0.10 0.00 0.70 0.00 0.00 55.95 56.62 2kq7 s SER 112 Cb -0.12 0.50 0.45 0.00 -1.71 0.00 0.00 66.02 65.13 2kq7 s SER 112 CO 0.02 -0.86 1.27 0.61 1.20 0.00 0.00 173.24 175.48 2kq7 n GLY 113 N -0.37 1.87 3.34 9.45 0.00 -1.26 -1.60 105.19 116.63 2kq7 n GLY 113 Ca -0.09 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.80 1.04 -0.01 1.61 -1.05 -1.26 -4.85 118.70 112.38 2kq7 s GLU 114 Ca 0.31 -0.49 0.10 0.00 -0.15 0.00 0.00 54.97 54.74 2kq7 s GLU 114 Cb 0.21 0.46 -0.14 0.00 -0.44 0.00 0.00 34.13 34.23 2kq7 s GLU 114 CO 0.13 -0.39 0.26 -1.71 0.95 0.00 0.00 175.26 174.50 2kq7 n ASN 115 N 0.10 2.14 -2.34 0.83 4.05 -1.26 -4.95 115.26 113.83 2kq7 n ASN 115 Ca -0.17 -0.20 -0.04 0.00 0.45 0.00 0.00 54.58 54.61 2kq7 n ASN 115 Cb 0.62 1.32 -0.01 0.00 1.23 0.00 0.00 39.78 42.94 2kq7 n ASN 115 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 2kq7 n THR 116 N -1.66 0.00 -0.01 -0.44 -2.24 -1.26 -5.10 114.28 103.57 2kq7 n THR 116 Ca -0.01 -0.33 -0.01 0.00 -2.27 0.00 0.00 64.05 61.43 2kq7 n THR 116 Cb 0.22 0.07 -0.00 0.00 -2.10 0.00 0.00 70.33 68.52 2kq7 n THR 116 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2kq7 n PHE 117 N -0.17 0.00 -1.80 4.78 3.01 -1.26 -4.94 117.46 117.08 2kq7 n PHE 117 Ca -0.03 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.16 2kq7 n PHE 117 Cb 0.09 -0.04 -0.05 0.00 -0.01 0.00 0.00 39.48 39.47 2kq7 n PHE 117 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2kq7 s GLY 118 N -4.94 -0.25 0.00 1.37 0.00 -1.26 -5.22 107.32 97.01 2kq7 s GLY 118 Ca -0.02 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 43.92 2kq7 s GLY 118 CO 0.02 3.84 0.43 -2.13 0.00 0.00 0.00 173.10 175.26