#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qx7 s GLN 3 N 0.00 0.13 -0.26 0.11 2.00 -1.26 -4.96 119.66 115.43 1qx7 s GLN 3 Ca 0.00 0.30 -0.40 0.00 -2.00 0.00 0.00 55.36 53.26 1qx7 s GLN 3 Cb 0.00 0.18 -0.16 0.00 0.80 0.00 0.00 33.01 33.83 1qx7 s GLN 3 CO 0.00 -0.09 1.70 1.28 -0.50 0.00 0.00 175.29 177.69 1qx7 n LEU 4 N 5.03 2.27 -3.72 3.68 4.77 -1.26 -4.82 117.00 122.95 1qx7 n LEU 4 Ca -0.08 1.08 -0.14 0.00 -0.03 0.00 0.00 56.01 56.85 1qx7 n LEU 4 Cb 0.54 -1.13 -0.09 0.00 -2.33 0.00 0.00 43.42 40.41 1qx7 n LEU 4 CO -0.08 -0.51 0.10 0.42 -1.33 0.00 0.00 177.39 176.00 1qx7 s THR 5 N 3.25 0.01 0.00 -5.08 -4.23 -1.26 -4.97 115.64 103.36 1qx7 s THR 5 Ca 0.97 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 61.37 1qx7 s THR 5 Cb -1.08 -0.63 0.00 0.00 1.34 0.00 0.00 72.50 72.14 1qx7 s THR 5 CO 0.65 -0.06 0.07 -0.62 -0.54 0.00 0.00 174.62 174.11 1qx7 n GLU 6 N 2.36 0.00 -0.00 3.99 1.02 -1.26 0.24 120.64 126.98 1qx7 n GLU 6 Ca -0.16 0.07 -0.14 0.00 -0.02 0.00 0.00 57.16 56.91 1qx7 n GLU 6 Cb 0.57 -0.11 -0.08 0.00 -0.02 0.00 0.00 31.44 31.80 1qx7 n GLU 6 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1qx7 h GLU 7 N 0.00 -0.53 -0.73 3.49 4.81 -1.97 0.87 114.58 120.52 1qx7 h GLU 7 Ca 0.00 0.04 0.11 0.00 -0.13 0.00 0.00 59.36 59.37 1qx7 h GLU 7 Cb 0.00 0.12 -0.12 0.00 0.63 0.00 0.00 28.75 29.38 1qx7 h GLU 7 CO 0.00 -0.35 -0.43 0.37 -0.73 0.00 0.00 179.01 177.87 1qx7 h GLN 8 N -0.55 -0.13 0.95 1.92 -0.00 0.28 0.64 115.11 118.22 1qx7 h GLN 8 Ca 0.05 0.01 -0.05 0.00 -0.00 0.00 0.00 58.65 58.67 1qx7 h GLN 8 Cb 0.66 0.03 0.01 0.00 0.00 0.00 0.00 27.48 28.18 1qx7 h GLN 8 CO -0.42 -0.09 -0.46 0.82 0.00 0.00 0.00 178.83 178.68 1qx7 h ILE 9 N -0.14 0.04 -0.99 2.39 2.04 1.00 0.94 117.51 122.79 1qx7 h ILE 9 Ca 0.23 -0.03 0.37 0.00 1.00 0.00 0.00 64.86 66.42 1qx7 h ILE 9 Cb 0.55 0.04 -0.17 0.00 -0.74 0.00 0.00 36.82 36.50 1qx7 h ILE 9 CO -0.79 0.00 0.45 0.00 0.00 0.00 0.00 178.15 177.82 1qx7 h ALA 10 N -1.27 1.93 0.31 1.87 0.00 0.20 0.71 119.26 123.01 1qx7 h ALA 10 Ca -0.13 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1qx7 h ALA 10 Cb 0.98 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1qx7 h ALA 10 CO 0.21 -0.80 -0.15 0.93 0.00 0.00 0.00 179.25 179.45 1qx7 h GLU 11 N 0.08 -0.40 -1.69 0.00 5.08 0.78 -3.00 114.58 115.44 1qx7 h GLU 11 Ca 0.77 0.03 0.49 0.00 -1.00 0.00 0.00 59.36 59.65 1qx7 h GLU 11 Cb 1.92 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 31.19 1qx7 h GLU 11 CO -0.75 -0.06 1.21 0.74 -1.00 0.00 0.00 179.01 179.15 1qx7 h PHE 12 N -0.89 0.03 0.74 4.33 0.04 0.29 0.15 116.94 121.62 1qx7 h PHE 12 Ca -0.04 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.69 1qx7 h PHE 12 Cb 0.52 -0.01 0.01 0.00 2.20 0.00 0.00 35.95 38.67 1qx7 h PHE 12 CO 0.04 -0.01 -0.35 0.87 -0.60 0.00 0.00 178.31 178.25 1qx7 h LYS 13 N 0.01 -0.96 -0.98 1.51 1.79 -0.82 -2.83 116.57 114.29 1qx7 h LYS 13 Ca 0.81 0.07 0.09 0.00 -2.18 0.00 0.00 60.65 59.44 1qx7 h LYS 13 Cb 3.23 0.22 -0.12 0.00 -1.58 0.00 0.00 32.23 33.97 1qx7 h LYS 13 CO -0.03 -0.64 -0.58 1.49 -1.08 0.00 0.00 179.45 178.62 1qx7 h GLU 14 N -1.19 -0.01 -0.86 3.15 4.57 -0.69 0.62 114.58 120.17 1qx7 h GLU 14 Ca -0.10 0.00 0.16 0.00 -1.18 0.00 0.00 59.36 58.24 1qx7 h GLU 14 Cb 0.76 0.00 -0.10 0.00 -0.16 0.00 0.00 28.75 29.25 1qx7 h GLU 14 CO 0.17 -0.01 0.44 0.00 -1.18 0.00 0.00 179.01 178.43 1qx7 h ALA 15 N 0.54 1.31 -0.30 2.92 0.00 -1.58 0.95 119.26 123.09 1qx7 h ALA 15 Ca 0.17 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1qx7 h ALA 15 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1qx7 h ALA 15 CO -0.93 -0.12 0.05 0.35 0.00 0.00 0.00 179.25 178.60 1qx7 h PHE 16 N 0.60 0.53 -0.45 0.00 3.57 -0.20 -2.89 116.94 118.11 1qx7 h PHE 16 Ca 0.48 -0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.84 1qx7 h PHE 16 Cb 0.71 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 1qx7 h PHE 16 CO -0.09 0.59 -0.00 1.03 -2.23 0.00 0.00 178.31 177.60 1qx7 h SER 17 N 0.32 0.70 0.29 0.41 0.87 0.24 -2.91 113.55 113.47 1qx7 h SER 17 Ca 0.09 -0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 1qx7 h SER 17 Cb 0.34 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1qx7 h SER 17 CO 0.01 0.77 -0.03 -0.07 -0.53 0.00 0.00 176.83 176.97 1qx7 h LEU 18 N 0.68 0.00 -4.12 2.23 3.38 0.10 -3.24 115.31 114.35 1qx7 h LEU 18 Ca 0.14 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.70 1qx7 h LEU 18 Cb 0.42 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.79 1qx7 h LEU 18 CO 0.02 0.03 -0.88 0.49 0.09 0.00 0.00 178.44 178.18 1qx7 n PHE 19 N -3.30 2.04 -2.64 1.13 3.72 -1.10 -4.78 117.46 112.53 1qx7 n PHE 19 Ca -0.02 -2.08 -0.31 0.00 -0.05 0.00 0.00 57.45 54.99 1qx7 n PHE 19 Cb 0.16 -0.30 -0.01 0.00 -0.94 0.00 0.00 39.48 38.39 1qx7 n PHE 19 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1qx7 n ASP 20 N -0.67 5.33 -0.11 4.37 4.64 -1.22 -4.83 116.55 124.06 1qx7 n ASP 20 Ca 0.31 -3.72 -0.01 0.00 -1.38 0.00 0.00 54.79 49.99 1qx7 n ASP 20 Cb 0.91 -0.68 0.00 0.00 -1.04 0.00 0.00 41.12 40.31 1qx7 n ASP 20 CO 0.00 0.00 0.00 2.29 -0.82 0.00 0.00 177.20 178.67 1qx7 n LYS 21 N -0.32 -0.08 -0.33 -0.67 2.85 -1.26 0.15 118.16 118.50 1qx7 n LYS 21 Ca 0.38 0.43 0.17 0.00 -1.05 0.00 0.00 58.31 58.25 1qx7 n LYS 21 Cb 0.44 -0.64 0.34 0.00 -0.65 0.00 0.00 35.03 34.52 1qx7 n LYS 21 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1qx7 n ASP 22 N -4.40 -0.03 0.00 -5.58 9.92 -1.26 -4.82 116.55 110.38 1qx7 n ASP 22 Ca 0.02 1.62 0.00 0.00 -0.53 0.00 0.00 54.79 55.91 1qx7 n ASP 22 Cb 0.10 -0.63 0.00 0.00 -0.64 0.00 0.00 41.12 39.95 1qx7 n ASP 22 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1qx7 n GLY 23 N -1.44 1.02 2.50 0.44 0.00 0.39 -5.05 105.19 103.05 1qx7 n GLY 23 Ca 0.25 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.08 1qx7 n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1qx7 n ASP 24 N 0.00 -1.43 -3.44 1.61 5.68 -1.26 -5.02 116.55 112.70 1qx7 n ASP 24 Ca 0.00 -2.62 -0.11 0.00 -0.50 0.00 0.00 54.79 51.56 1qx7 n ASP 24 Cb 0.00 0.25 -0.01 0.00 -1.14 0.00 0.00 41.12 40.22 1qx7 n ASP 24 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qx7 n GLY 25 N 2.64 -0.14 2.54 6.12 0.00 -1.26 -4.89 105.19 110.21 1qx7 n GLY 25 Ca 0.24 0.07 -0.23 0.00 0.00 0.00 0.00 46.02 46.11 1qx7 n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qx7 s THR 26 N -4.00 -0.02 -0.02 2.61 -4.23 -1.26 -4.51 115.64 104.21 1qx7 s THR 26 Ca 0.07 -1.80 -0.30 0.00 -1.18 0.00 0.00 61.69 58.48 1qx7 s THR 26 Cb -0.04 -0.95 -0.03 0.00 1.34 0.00 0.00 72.50 72.82 1qx7 s THR 26 CO 0.28 -0.89 1.04 -0.63 -0.54 0.00 0.00 174.62 173.88 1qx7 s ILE 27 N 0.77 4.67 0.49 2.99 1.09 -1.09 -4.78 121.20 125.34 1qx7 s ILE 27 Ca 0.24 1.93 -0.09 0.00 -1.10 0.00 0.00 60.65 61.63 1qx7 s ILE 27 Cb -0.09 -4.23 -0.05 0.00 -1.06 0.00 0.00 42.46 37.03 1qx7 s ILE 27 CO -0.08 0.10 0.84 0.42 -0.10 0.00 0.00 174.94 176.12 1qx7 s THR 28 N 1.37 4.81 0.38 2.92 -4.23 -1.26 -0.91 115.64 118.72 1qx7 s THR 28 Ca 0.52 0.54 0.21 0.00 -1.18 0.00 0.00 61.69 61.78 1qx7 s THR 28 Cb -0.22 -3.82 0.39 0.00 1.34 0.00 0.00 72.50 70.20 1qx7 s THR 28 CO 0.25 -0.80 1.64 0.00 -0.54 0.00 0.00 174.62 175.18 1qx7 h THR 29 N 0.43 0.20 0.03 3.99 1.03 -1.89 0.65 112.91 117.36 1qx7 h THR 29 Ca -0.46 -0.06 -0.00 0.00 -0.01 0.00 0.00 66.41 65.87 1qx7 h THR 29 Cb 1.19 -0.00 0.00 0.00 -1.07 0.00 0.00 68.15 68.27 1qx7 h THR 29 CO 0.62 0.03 -0.02 0.50 -0.01 0.00 0.00 175.52 176.65 1qx7 h LYS 30 N 0.19 -0.04 -0.50 0.00 3.64 -1.91 -3.14 116.57 114.80 1qx7 h LYS 30 Ca 0.77 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 60.30 1qx7 h LYS 30 Cb 2.08 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.89 1qx7 h LYS 30 CO -0.55 0.64 0.44 0.93 -2.27 0.00 0.00 179.45 178.65 1qx7 h GLU 31 N -0.83 0.00 0.32 1.90 5.08 -0.66 -1.24 114.58 119.15 1qx7 h GLU 31 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1qx7 h GLU 31 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1qx7 h GLU 31 CO 0.01 0.00 -0.16 1.25 -1.00 0.00 0.00 179.01 179.11 1qx7 h LEU 32 N 0.00 -0.37 -0.10 1.33 5.85 0.15 -1.45 115.31 120.72 1qx7 h LEU 32 Ca 0.24 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.99 1qx7 h LEU 32 Cb 1.11 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.19 1qx7 h LEU 32 CO -0.00 -0.23 -0.21 1.23 -0.34 0.00 0.00 178.44 178.88 1qx7 h GLY 33 N -0.47 -0.23 -0.46 3.75 0.00 -1.26 -1.63 103.07 102.77 1qx7 h GLY 33 Ca -0.04 0.26 0.15 0.00 0.00 0.00 0.00 47.33 47.70 1qx7 h GLY 33 CO 0.07 -0.19 -0.17 -0.84 0.00 0.00 0.00 176.54 175.42 1qx7 h THR 34 N -0.29 0.27 0.00 4.70 2.02 -1.31 0.42 112.91 118.71 1qx7 h THR 34 Ca 0.09 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.27 1qx7 h THR 34 Cb 0.42 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1qx7 h THR 34 CO -0.27 0.00 0.00 0.52 0.37 0.00 0.00 175.52 176.15 1qx7 n VAL 35 N -5.48 0.00 0.00 3.16 0.31 -0.57 -0.50 118.33 115.26 1qx7 n VAL 35 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1qx7 n VAL 35 Cb 0.38 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.05 1qx7 n VAL 35 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1qx7 n ARG 37 N -0.02 0.00 0.00 5.55 1.74 0.14 -2.44 116.66 121.63 1qx7 n ARG 37 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1qx7 n ARG 37 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1qx7 n ARG 37 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1qx7 n SER 38 N 0.00 0.00 0.00 0.55 2.88 0.35 0.35 113.62 117.75 1qx7 n SER 38 Ca 0.00 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1qx7 n SER 38 Cb 0.00 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 1qx7 n SER 38 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1qx7 n LEU 39 N -1.09 0.85 0.00 2.46 4.77 -1.02 -5.00 117.00 117.96 1qx7 n LEU 39 Ca 0.00 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 1qx7 n LEU 39 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1qx7 n LEU 39 CO 0.00 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.88 1qx7 n GLY 40 N 0.03 0.55 3.88 -0.72 0.00 0.15 -5.03 105.19 104.06 1qx7 n GLY 40 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1qx7 n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qx7 s GLN 41 N -0.66 3.75 -0.69 1.61 -0.21 -1.26 -4.32 119.66 117.89 1qx7 s GLN 41 Ca 0.00 0.24 0.04 0.00 0.02 0.00 0.00 55.36 55.66 1qx7 s GLN 41 Cb 0.00 -2.60 0.28 0.00 1.00 0.00 0.00 33.01 31.69 1qx7 s GLN 41 CO 0.00 0.23 0.93 -1.71 -2.12 0.00 0.00 175.29 172.62 1qx7 n ASN 42 N -0.56 4.43 -4.73 5.90 4.05 -1.26 -2.83 115.26 120.27 1qx7 n ASN 42 Ca 0.00 -3.53 -0.42 0.00 0.45 0.00 0.00 54.58 51.09 1qx7 n ASN 42 Cb 0.53 -0.73 -0.03 0.00 1.23 0.00 0.00 39.78 40.79 1qx7 n ASN 42 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1qx7 s PRO 43 N -2.89 4.13 0.55 1.20 0.04 -1.26 -4.99 135.00 131.79 1qx7 s PRO 43 Ca 0.42 2.58 -0.15 0.00 0.04 0.00 0.00 61.00 63.89 1qx7 s PRO 43 Cb 0.18 -3.07 -0.06 0.00 0.04 0.00 0.00 34.50 31.59 1qx7 s PRO 43 CO -0.04 -0.71 1.00 0.95 0.04 0.00 0.00 177.00 178.24 1qx7 s THR 44 N 0.88 4.49 0.52 1.26 -4.23 -1.26 -4.86 115.64 112.45 1qx7 s THR 44 Ca 0.72 1.09 0.18 0.00 -1.18 0.00 0.00 61.69 62.50 1qx7 s THR 44 Cb -0.49 -3.71 0.29 0.00 1.34 0.00 0.00 72.50 69.93 1qx7 s THR 44 CO 0.36 -0.78 2.13 -0.08 -0.54 0.00 0.00 174.62 175.71 1qx7 h GLU 45 N 0.55 0.00 -0.00 3.99 4.57 -1.99 0.44 114.58 122.14 1qx7 h GLU 45 Ca -0.46 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 57.66 1qx7 h GLU 45 Cb 1.19 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1qx7 h GLU 45 CO 0.61 0.00 -0.22 0.00 -1.18 0.00 0.00 179.01 178.22 1qx7 h ALA 46 N 1.96 0.03 -0.88 2.92 0.00 -1.99 -3.02 119.26 118.27 1qx7 h ALA 46 Ca 0.04 -0.46 0.14 0.00 0.00 0.00 0.00 54.91 54.63 1qx7 h ALA 46 Cb 0.16 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 1qx7 h ALA 46 CO -0.00 0.06 0.48 1.49 0.00 0.00 0.00 179.25 181.29 1qx7 h GLU 47 N -0.54 0.68 0.00 0.00 4.81 -1.64 0.86 114.58 118.75 1qx7 h GLU 47 Ca -0.03 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1qx7 h GLU 47 Cb 0.99 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.21 1qx7 h GLU 47 CO 0.04 0.45 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.65 1qx7 h LEU 48 N 0.70 0.00 0.07 1.64 3.38 -1.01 -3.11 115.31 116.98 1qx7 h LEU 48 Ca 0.47 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.25 1qx7 h LEU 48 Cb 0.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1qx7 h LEU 48 CO -0.34 0.06 -0.96 -0.61 0.09 0.00 0.00 178.44 176.68 1qx7 h GLN 49 N 0.00 0.14 -1.99 1.13 5.75 0.69 -2.74 115.11 118.10 1qx7 h GLN 49 Ca -0.00 -0.24 0.00 0.00 -0.15 0.00 0.00 58.65 58.25 1qx7 h GLN 49 Cb 0.47 0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.11 1qx7 h GLN 49 CO 0.01 1.12 0.00 -0.25 -2.65 0.00 0.00 178.83 177.05 1qx7 n ASP 50 N -4.22 0.00 0.00 -0.69 8.00 0.66 -2.28 116.55 118.01 1qx7 n ASP 50 Ca -0.21 -0.35 0.00 0.00 0.71 0.00 0.00 54.79 54.94 1qx7 n ASP 50 Cb 0.74 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.84 1qx7 n ASP 50 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1qx7 n ILE 52 N 1.35 0.00 -0.33 0.53 2.08 -1.03 -2.08 119.36 119.88 1qx7 n ILE 52 Ca 0.00 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.29 1qx7 n ILE 52 Cb 0.00 0.00 0.10 0.00 -0.75 0.00 0.00 39.64 38.99 1qx7 n ILE 52 CO 0.00 0.00 0.00 0.78 0.56 0.00 0.00 176.55 177.89 1qx7 h ASN 53 N 0.00 0.98 0.00 4.38 -0.26 -1.64 -2.76 115.58 116.28 1qx7 h ASN 53 Ca 0.00 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.72 1qx7 h ASN 53 Cb 0.00 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.03 1qx7 h ASN 53 CO 0.00 0.69 0.00 1.21 -1.06 0.00 0.00 177.43 178.27 1qx7 n GLU 54 N -4.50 0.00 0.00 0.81 4.07 -0.88 -3.98 120.64 116.15 1qx7 n GLU 54 Ca 0.10 0.28 0.00 0.00 -0.06 0.00 0.00 57.16 57.49 1qx7 n GLU 54 Cb 0.05 -0.57 0.00 0.00 -0.06 0.00 0.00 31.44 30.86 1qx7 n GLU 54 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1qx7 n VAL 55 N -0.78 0.00 -1.39 6.31 0.31 -1.24 -4.76 118.33 116.77 1qx7 n VAL 55 Ca 0.00 0.12 -0.43 0.00 -0.01 0.00 0.00 64.34 64.02 1qx7 n VAL 55 Cb 0.00 -0.35 -0.14 0.00 -0.91 0.00 0.00 33.84 32.44 1qx7 n VAL 55 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1qx7 n ASP 56 N -0.83 0.37 -1.01 4.52 4.64 -1.04 -4.73 116.55 118.47 1qx7 n ASP 56 Ca 0.00 0.27 0.09 0.00 -1.38 0.00 0.00 54.79 53.77 1qx7 n ASP 56 Cb 0.00 -0.88 0.22 0.00 -1.04 0.00 0.00 41.12 39.42 1qx7 n ASP 56 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1qx7 n ALA 57 N 9.51 2.33 0.53 -1.67 0.00 -1.26 -4.08 120.51 125.87 1qx7 n ALA 57 Ca 0.61 -1.13 0.12 0.00 0.00 0.00 0.00 53.44 53.04 1qx7 n ALA 57 Cb 0.02 -0.71 0.20 0.00 0.00 0.00 0.00 19.45 18.96 1qx7 n ALA 57 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1qx7 n ASP 58 N 1.17 3.27 -1.01 0.00 9.92 -1.26 -4.93 116.55 123.70 1qx7 n ASP 58 Ca 0.18 -1.98 -0.10 0.00 -0.53 0.00 0.00 54.79 52.36 1qx7 n ASP 58 Cb 0.53 -0.18 -0.04 0.00 -0.64 0.00 0.00 41.12 40.78 1qx7 n ASP 58 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1qx7 n GLY 59 N 1.46 0.95 0.24 0.44 0.00 -1.26 -4.77 105.19 102.25 1qx7 n GLY 59 Ca 0.18 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.37 1qx7 n GLY 59 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1qx7 h ASN 60 N 0.00 0.00 0.00 1.61 4.21 -1.91 -3.45 115.58 116.04 1qx7 h ASN 60 Ca -0.20 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.31 1qx7 h ASN 60 Cb 0.83 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.03 1qx7 h ASN 60 CO 0.30 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 177.05 1qx7 n GLY 61 N -0.85 1.82 3.91 2.83 0.00 -1.26 -4.97 105.19 106.69 1qx7 n GLY 61 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 1qx7 n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qx7 s THR 62 N -2.32 5.02 -0.06 2.61 -4.23 -1.26 -2.61 115.64 112.79 1qx7 s THR 62 Ca 0.00 -0.05 0.02 0.00 -1.18 0.00 0.00 61.69 60.48 1qx7 s THR 62 Cb 0.00 -3.79 0.01 0.00 1.34 0.00 0.00 72.50 70.06 1qx7 s THR 62 CO 0.00 -0.48 -0.11 -0.63 -0.54 0.00 0.00 174.62 172.85 1qx7 s ILE 63 N -2.27 1.07 0.08 2.99 -1.09 -0.09 -4.88 121.20 117.01 1qx7 s ILE 63 Ca 0.44 -0.44 -0.17 0.00 -2.23 0.00 0.00 60.65 58.24 1qx7 s ILE 63 Cb -0.10 -0.98 -0.06 0.00 -1.58 0.00 0.00 42.46 39.73 1qx7 s ILE 63 CO 0.34 0.34 0.52 -0.62 -1.23 0.00 0.00 174.94 174.29 1qx7 s ASP 64 N 0.66 6.94 0.23 3.58 -1.08 -1.26 -2.66 116.67 123.08 1qx7 s ASP 64 Ca -0.14 1.14 -0.13 0.00 -0.52 0.00 0.00 52.55 52.90 1qx7 s ASP 64 Cb -0.15 -2.31 0.31 0.00 -1.46 0.00 0.00 42.92 39.30 1qx7 s ASP 64 CO 0.03 0.24 1.45 0.33 0.52 0.00 0.00 175.17 177.75 1qx7 n PHE 65 N 1.48 0.15 -0.06 -5.34 7.35 -1.26 -0.07 117.46 119.71 1qx7 n PHE 65 Ca -0.10 1.15 -0.10 0.00 -0.76 0.00 0.00 57.45 57.64 1qx7 n PHE 65 Cb 0.51 -0.93 -0.04 0.00 0.35 0.00 0.00 39.48 39.38 1qx7 n PHE 65 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1qx7 h PRO 66 N 0.00 -0.36 0.28 -7.13 0.11 -1.98 0.59 132.00 123.51 1qx7 h PRO 66 Ca 0.37 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.51 1qx7 h PRO 66 Cb 0.61 0.08 -0.04 0.00 0.11 0.00 0.00 31.00 31.76 1qx7 h PRO 66 CO -0.94 -0.24 -0.52 0.93 -0.21 0.00 0.00 178.00 177.03 1qx7 h GLU 67 N -0.37 -0.82 -0.91 1.05 5.08 -0.87 0.68 114.58 118.42 1qx7 h GLU 67 Ca 0.12 0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.62 1qx7 h GLU 67 Cb 0.58 0.19 -0.11 0.00 0.50 0.00 0.00 28.75 29.90 1qx7 h GLU 67 CO -0.47 -0.55 -0.58 0.35 -1.00 0.00 0.00 179.01 176.75 1qx7 h PHE 68 N -0.86 -1.87 -0.62 4.33 -0.00 -0.17 0.48 116.94 118.23 1qx7 h PHE 68 Ca -0.03 0.12 0.12 0.00 -0.00 0.00 0.00 57.97 58.18 1qx7 h PHE 68 Cb 0.80 0.93 -0.12 0.00 -0.00 0.00 0.00 35.95 37.57 1qx7 h PHE 68 CO -0.37 -0.39 -0.27 1.25 -0.00 0.00 0.00 178.31 178.54 1qx7 h LEU 69 N -0.06 -0.94 -7.41 0.59 5.85 0.73 -3.41 115.31 110.67 1qx7 h LEU 69 Ca 0.15 0.22 -0.36 0.00 0.84 0.00 0.00 57.88 58.73 1qx7 h LEU 69 Cb 0.44 0.51 0.09 0.00 0.37 0.00 0.00 40.66 42.07 1qx7 h LEU 69 CO -0.89 -0.27 0.94 0.41 -0.34 0.00 0.00 178.44 178.29 1qx7 n THR 70 N -5.45 0.00 0.00 1.05 -1.04 0.17 -4.66 114.28 104.35 1qx7 n THR 70 Ca 0.06 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1qx7 n THR 70 Cb 0.35 -1.63 0.00 0.00 -1.82 0.00 0.00 70.33 67.24 1qx7 n THR 70 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1qx7 n ALA 73 N 10.38 0.00 0.09 2.41 0.00 -1.26 -4.73 120.51 127.40 1qx7 n ALA 73 Ca 0.37 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.68 1qx7 n ALA 73 Cb 0.41 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.78 1qx7 n ALA 73 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1qx7 h ARG 74 N 0.00 -0.24 -4.23 0.00 2.43 -1.95 -3.37 114.38 107.02 1qx7 h ARG 74 Ca 0.00 0.02 -0.56 0.00 -0.81 0.00 0.00 59.98 58.63 1qx7 h ARG 74 Cb 0.00 0.05 0.04 0.00 -0.42 0.00 0.00 29.97 29.65 1qx7 h ARG 74 CO 0.00 0.13 2.29 1.17 -1.51 0.00 0.00 179.97 182.05 1qx7 n LYS 75 N -5.01 1.53 0.00 0.20 4.81 -1.26 -4.62 118.16 113.79 1qx7 n LYS 75 Ca -0.09 -1.67 0.00 0.00 -0.87 0.00 0.00 58.31 55.69 1qx7 n LYS 75 Cb 0.25 -2.75 0.00 0.00 0.02 0.00 0.00 35.03 32.55 1qx7 n LYS 75 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1qx7 n LYS 77 N 6.30 0.00 -0.42 1.64 5.02 -1.26 -4.26 118.16 125.18 1qx7 n LYS 77 Ca 0.47 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.69 1qx7 n LYS 77 Cb 0.32 -0.21 0.04 0.00 -0.02 0.00 0.00 35.03 35.16 1qx7 n LYS 77 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1qx7 n ASP 78 N 0.00 4.00 -3.85 4.39 10.43 -1.26 -4.75 116.55 125.51 1qx7 n ASP 78 Ca 0.00 -2.50 -0.29 0.00 2.57 0.00 0.00 54.79 54.57 1qx7 n ASP 78 Cb 0.00 -0.73 -0.16 0.00 1.84 0.00 0.00 41.12 42.07 1qx7 n ASP 78 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1qx7 s THR 79 N -0.91 1.11 0.20 -3.53 2.01 -1.26 -5.09 115.64 108.17 1qx7 s THR 79 Ca 0.14 -1.00 0.11 0.00 0.31 0.00 0.00 61.69 61.26 1qx7 s THR 79 Cb 0.12 -1.51 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 1qx7 s THR 79 CO 0.02 -0.19 -0.23 1.51 -0.69 0.00 0.00 174.62 175.03 1qx7 s ASP 80 N 1.58 3.41 0.28 3.53 -4.77 -1.26 -4.92 116.67 114.52 1qx7 s ASP 80 Ca -0.03 -0.88 -0.01 0.00 -3.30 0.00 0.00 52.55 48.34 1qx7 s ASP 80 Cb -0.18 -0.25 0.64 0.00 -1.09 0.00 0.00 42.92 42.04 1qx7 s ASP 80 CO -0.08 0.11 1.63 0.28 0.70 0.00 0.00 175.17 177.80 1qx7 h SER 81 N 3.12 -0.20 0.00 2.11 0.02 -2.00 -3.02 113.55 113.57 1qx7 h SER 81 Ca -0.46 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1qx7 h SER 81 Cb 1.21 0.33 0.00 0.00 0.14 0.00 0.00 62.40 64.09 1qx7 h SER 81 CO 0.49 -0.21 0.00 1.21 -1.14 0.00 0.00 176.83 177.19 1qx7 n GLU 82 N -5.32 0.00 -0.28 3.45 2.13 -1.26 -1.06 120.64 118.30 1qx7 n GLU 82 Ca 0.19 0.81 0.11 0.00 0.66 0.00 0.00 57.16 58.93 1qx7 n GLU 82 Cb 0.64 -1.48 0.26 0.00 0.27 0.00 0.00 31.44 31.13 1qx7 n GLU 82 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1qx7 h GLU 83 N 0.00 0.24 0.59 5.31 5.08 -1.93 0.86 114.58 124.74 1qx7 h GLU 83 Ca 0.00 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1qx7 h GLU 83 Cb 0.00 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1qx7 h GLU 83 CO 0.00 0.16 -0.51 0.93 -1.00 0.00 0.00 179.01 178.59 1qx7 h GLU 84 N 0.25 -1.04 -0.12 2.33 5.08 -1.42 -2.13 114.58 117.52 1qx7 h GLU 84 Ca 0.51 0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.96 1qx7 h GLU 84 Cb 0.98 0.24 -0.04 0.00 0.50 0.00 0.00 28.75 30.43 1qx7 h GLU 84 CO -0.60 -0.69 -0.28 0.82 -1.00 0.00 0.00 179.01 177.26 1qx7 h ILE 85 N -1.08 0.00 0.00 3.13 1.08 0.57 -0.42 117.51 120.80 1qx7 h ILE 85 Ca -0.08 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.39 1qx7 h ILE 85 Cb 0.91 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.66 1qx7 h ILE 85 CO -0.02 0.00 0.55 -0.09 -0.69 0.00 0.00 178.15 177.90 1qx7 h ARG 86 N -0.26 0.00 0.17 2.37 2.43 -0.82 0.75 114.38 119.03 1qx7 h ARG 86 Ca 0.02 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.85 1qx7 h ARG 86 Cb 0.33 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1qx7 h ARG 86 CO -0.25 0.00 -1.75 0.93 -1.51 0.00 0.00 179.97 177.39 1qx7 h GLU 87 N 0.00 0.37 0.40 0.20 4.39 -0.38 -2.92 114.58 116.63 1qx7 h GLU 87 Ca 0.00 -0.63 -0.01 0.00 0.34 0.00 0.00 59.36 59.07 1qx7 h GLU 87 Cb 1.10 0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 29.96 1qx7 h GLU 87 CO 0.00 1.28 -0.46 0.00 -1.16 0.00 0.00 179.01 178.67 1qx7 h ALA 88 N 0.17 -0.99 -0.20 3.43 0.00 0.84 -0.36 119.26 122.15 1qx7 h ALA 88 Ca -0.34 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.48 1qx7 h ALA 88 Cb 2.09 0.68 -0.01 0.00 0.00 0.00 0.00 17.79 20.55 1qx7 h ALA 88 CO 0.17 -1.10 0.16 0.74 0.00 0.00 0.00 179.25 179.22 1qx7 h PHE 89 N -0.88 0.00 0.00 0.00 0.05 -1.64 -0.70 116.94 113.76 1qx7 h PHE 89 Ca -0.04 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.75 1qx7 h PHE 89 Cb 0.79 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.74 1qx7 h PHE 89 CO -0.27 0.00 0.00 -2.13 -0.18 0.00 0.00 178.31 175.73 1qx7 n ARG 90 N -4.28 0.13 0.02 1.51 0.63 -0.18 -1.76 116.66 112.74 1qx7 n ARG 90 Ca 0.02 0.34 -0.09 0.00 -0.92 0.00 0.00 57.85 57.20 1qx7 n ARG 90 Cb 0.30 -1.74 0.05 0.00 0.45 0.00 0.00 32.46 31.52 1qx7 n ARG 90 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1qx7 h VAL 91 N 0.00 1.34 0.00 5.15 2.07 -0.71 -2.58 116.25 121.51 1qx7 h VAL 91 Ca 0.00 -1.91 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1qx7 h VAL 91 Cb 0.36 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1qx7 h VAL 91 CO 0.00 0.59 0.00 0.49 0.02 0.00 0.00 177.57 178.67 1qx7 n PHE 92 N -3.92 0.00 -3.15 1.57 3.72 -0.72 -4.19 117.46 110.76 1qx7 n PHE 92 Ca -0.04 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.98 1qx7 n PHE 92 Cb 0.64 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.16 1qx7 n PHE 92 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1qx7 n ASP 93 N -0.94 5.55 0.00 4.37 2.03 -0.97 -4.35 116.55 122.24 1qx7 n ASP 93 Ca 0.19 -3.41 0.00 0.00 0.52 0.00 0.00 54.79 52.08 1qx7 n ASP 93 Cb 0.09 -1.08 0.00 0.00 -0.72 0.00 0.00 41.12 39.40 1qx7 n ASP 93 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1qx7 n LYS 94 N 1.22 0.00 0.32 -0.67 5.02 -1.26 -1.44 118.16 121.34 1qx7 n LYS 94 Ca 0.27 0.82 0.20 0.00 -2.02 0.00 0.00 58.31 57.58 1qx7 n LYS 94 Cb 0.36 -1.47 1.07 0.00 -0.02 0.00 0.00 35.03 34.97 1qx7 n LYS 94 CO 0.00 0.00 0.00 0.38 -0.52 0.00 0.00 177.40 177.26 1qx7 h ASP 95 N 0.00 0.00 -3.38 4.39 2.03 -1.92 -3.46 116.42 114.09 1qx7 h ASP 95 Ca 0.00 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.27 1qx7 h ASP 95 Cb 0.00 0.00 0.03 0.00 -0.83 0.00 0.00 39.33 38.53 1qx7 h ASP 95 CO 0.00 0.00 -0.11 0.61 -1.03 0.00 0.00 179.24 178.71 1qx7 n GLY 96 N -1.18 0.45 0.04 7.15 0.00 -0.52 -5.00 105.19 106.13 1qx7 n GLY 96 Ca -0.02 -0.14 0.04 0.00 0.00 0.00 0.00 46.02 45.90 1qx7 n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1qx7 n ASN 97 N -1.68 2.00 0.00 1.61 2.04 -1.26 -4.94 115.26 113.03 1qx7 n ASN 97 Ca -0.01 -2.39 0.00 0.00 -0.44 0.00 0.00 54.58 51.74 1qx7 n ASN 97 Cb 0.52 -0.18 0.00 0.00 -2.53 0.00 0.00 39.78 37.59 1qx7 n ASN 97 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1qx7 n GLY 98 N -0.84 1.47 3.66 4.83 0.00 -1.26 -4.97 105.19 108.07 1qx7 n GLY 98 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1qx7 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qx7 s TYR 99 N -2.80 3.07 0.05 1.61 2.02 -1.26 -5.09 117.35 114.95 1qx7 s TYR 99 Ca 0.00 0.11 0.01 0.00 -0.37 0.00 0.00 57.07 56.81 1qx7 s TYR 99 Cb 0.00 -1.72 -0.03 0.00 -0.40 0.00 0.00 41.96 39.81 1qx7 s TYR 99 CO 0.00 0.43 -0.05 0.96 -1.57 0.00 0.00 175.55 175.32 1qx7 s ILE 100 N -0.94 0.36 -0.41 2.71 -4.36 -1.26 -4.49 121.20 112.80 1qx7 s ILE 100 Ca 0.15 -1.43 -0.28 0.00 -0.26 0.00 0.00 60.65 58.83 1qx7 s ILE 100 Cb -0.11 -1.02 -0.02 0.00 1.25 0.00 0.00 42.46 42.56 1qx7 s ILE 100 CO 0.05 -0.70 1.86 -0.55 0.24 0.00 0.00 174.94 175.84 1qx7 s SER 101 N -2.26 5.62 0.54 4.36 0.15 -1.26 -4.80 113.70 116.05 1qx7 s SER 101 Ca -0.02 1.04 0.30 0.00 0.70 0.00 0.00 55.95 57.97 1qx7 s SER 101 Cb -0.01 -2.52 1.47 0.00 -1.71 0.00 0.00 66.02 63.24 1qx7 s SER 101 CO -0.04 -1.97 1.91 0.00 1.20 0.00 0.00 173.24 174.33 1qx7 h ALA 102 N 13.92 2.74 0.09 5.45 0.00 -1.99 0.21 119.26 139.68 1qx7 h ALA 102 Ca -0.31 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1qx7 h ALA 102 Cb 1.17 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1qx7 h ALA 102 CO 1.09 -1.00 -0.04 0.00 0.00 0.00 0.00 179.25 179.29 1qx7 h ALA 103 N 1.57 -0.33 -1.34 0.00 0.00 -1.99 -2.19 119.26 114.98 1qx7 h ALA 103 Ca 0.38 -0.03 0.41 0.00 0.00 0.00 0.00 54.91 55.67 1qx7 h ALA 103 Cb 1.56 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 19.30 1qx7 h ALA 103 CO -0.00 -0.32 0.90 0.93 0.00 0.00 0.00 179.25 180.76 1qx7 h GLU 104 N -0.33 0.12 0.38 0.00 5.08 -1.82 0.53 114.58 118.53 1qx7 h GLU 104 Ca -0.01 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1qx7 h GLU 104 Cb 0.09 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1qx7 h GLU 104 CO 0.02 0.08 -0.18 1.25 -1.00 0.00 0.00 179.01 179.18 1qx7 h LEU 105 N 0.12 -0.43 -0.92 1.33 7.12 -0.62 -1.24 115.31 120.67 1qx7 h LEU 105 Ca 0.75 0.01 0.23 0.00 0.13 0.00 0.00 57.88 59.01 1qx7 h LEU 105 Cb 2.48 0.11 -0.17 0.00 -0.53 0.00 0.00 40.66 42.56 1qx7 h LEU 105 CO -0.26 -0.28 0.00 0.03 -0.13 0.00 0.00 178.44 177.79 1qx7 h ARG 106 N -0.55 0.04 0.65 1.25 2.47 0.59 -2.35 114.38 116.48 1qx7 h ARG 106 Ca -0.05 -0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.63 1qx7 h ARG 106 Cb 0.39 -0.01 0.01 0.00 -1.65 0.00 0.00 29.97 28.71 1qx7 h ARG 106 CO 0.09 0.03 -0.31 1.25 0.56 0.00 0.00 179.97 181.58 1qx7 h HIS 107 N 0.05 -0.81 0.00 3.04 2.76 -0.74 -2.04 115.15 117.41 1qx7 h HIS 107 Ca 0.53 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.68 1qx7 h HIS 107 Cb 1.03 0.27 0.00 0.00 1.55 0.00 0.00 27.41 30.25 1qx7 h HIS 107 CO -0.50 -0.50 0.00 0.28 -1.30 0.00 0.00 177.93 175.91 1qx7 n VAL 108 N -5.04 0.00 0.00 5.26 0.31 -0.47 -1.20 118.33 117.18 1qx7 n VAL 108 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1qx7 n VAL 108 Cb 0.34 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 33.15 1qx7 n VAL 108 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1qx7 n THR 110 N 0.50 0.00 0.11 2.52 -2.24 -0.77 -1.66 114.28 112.74 1qx7 n THR 110 Ca 0.00 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 1qx7 n THR 110 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 1qx7 n THR 110 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1qx7 h ASN 111 N 0.00 -0.49 1.39 3.42 2.35 -1.34 0.27 115.58 121.18 1qx7 h ASN 111 Ca 0.00 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.75 1qx7 h ASN 111 Cb 0.00 0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1qx7 h ASN 111 CO 0.00 -0.24 -0.18 0.25 -1.65 0.00 0.00 177.43 175.61 1qx7 h LEU 112 N -0.37 0.00 -0.63 1.61 5.85 -1.57 -2.81 115.31 117.38 1qx7 h LEU 112 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1qx7 h LEU 112 Cb 0.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1qx7 h LEU 112 CO -0.01 0.18 0.00 1.23 -0.34 0.00 0.00 178.44 179.50 1qx7 h GLY 113 N 2.95 0.00 0.18 3.75 0.00 -1.15 -3.22 103.07 105.59 1qx7 h GLY 113 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.95 1qx7 h GLY 113 CO 0.02 0.00 -2.33 -2.21 0.00 0.00 0.00 176.54 172.02 1qx7 n GLU 114 N -2.99 0.68 0.00 4.80 2.13 0.07 -4.28 120.64 121.05 1qx7 n GLU 114 Ca 0.03 0.17 0.06 0.00 0.66 0.00 0.00 57.16 58.07 1qx7 n GLU 114 Cb 0.42 -1.58 0.26 0.00 0.27 0.00 0.00 31.44 30.81 1qx7 n GLU 114 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1qx7 n LYS 115 N -3.27 0.00 -4.20 5.31 5.02 -1.07 -4.77 118.16 115.19 1qx7 n LYS 115 Ca -0.41 0.30 -0.17 0.00 -2.02 0.00 0.00 58.31 56.01 1qx7 n LYS 115 Cb 1.02 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 34.42 1qx7 n LYS 115 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1qx7 s LEU 116 N -3.01 2.38 0.02 -0.35 1.43 -1.22 -5.10 118.68 112.83 1qx7 s LEU 116 Ca 0.06 -0.77 0.09 0.00 -1.03 0.00 0.00 54.13 52.48 1qx7 s LEU 116 Cb 0.08 -0.46 -0.03 0.00 0.03 0.00 0.00 46.19 45.81 1qx7 s LEU 116 CO 0.22 -0.17 -0.25 0.42 0.23 0.00 0.00 176.35 176.80 1qx7 s THR 117 N -2.05 2.22 0.15 5.49 -4.23 -1.26 -4.88 115.64 111.08 1qx7 s THR 117 Ca 0.05 -1.27 -0.17 0.00 -1.18 0.00 0.00 61.69 59.11 1qx7 s THR 117 Cb -0.05 -1.85 0.07 0.00 1.34 0.00 0.00 72.50 72.01 1qx7 s THR 117 CO 0.02 0.43 1.13 0.47 -0.54 0.00 0.00 174.62 176.13 1qx7 n ASP 118 N 1.94 -0.61 -0.14 3.99 8.00 -1.26 0.17 116.55 128.64 1qx7 n ASP 118 Ca -0.17 1.29 -0.04 0.00 0.71 0.00 0.00 54.79 56.58 1qx7 n ASP 118 Cb 0.52 -0.24 0.02 0.00 -0.02 0.00 0.00 41.12 41.40 1qx7 n ASP 118 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1qx7 h GLU 119 N 0.00 -0.02 -0.55 -1.24 4.81 -1.99 0.72 114.58 116.32 1qx7 h GLU 119 Ca 0.19 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.46 1qx7 h GLU 119 Cb 0.38 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1qx7 h GLU 119 CO -0.71 -0.01 0.30 0.93 -0.73 0.00 0.00 179.01 178.79 1qx7 h GLU 120 N -0.02 0.57 -0.45 1.92 5.08 0.13 0.37 114.58 122.17 1qx7 h GLU 120 Ca 0.21 -0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.62 1qx7 h GLU 120 Cb 0.34 -0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.39 1qx7 h GLU 120 CO -0.46 0.38 0.05 0.28 -1.00 0.00 0.00 179.01 178.26 1qx7 h VAL 121 N 0.59 0.71 -0.21 3.13 2.07 0.13 -2.03 116.25 120.65 1qx7 h VAL 121 Ca 0.23 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.69 1qx7 h VAL 121 Cb 0.10 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1qx7 h VAL 121 CO -0.14 0.03 0.11 0.44 0.02 0.00 0.00 177.57 178.03 1qx7 h ASP 122 N 0.17 0.26 0.00 0.57 5.19 0.43 -2.20 116.42 120.85 1qx7 h ASP 122 Ca 0.23 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.53 1qx7 h ASP 122 Cb 0.31 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.75 1qx7 h ASP 122 CO -0.33 0.30 0.00 -0.62 -3.12 0.00 0.00 179.24 175.47 1qx7 n GLU 123 N -4.87 0.00 0.00 3.56 1.02 0.12 -1.35 120.64 119.12 1qx7 n GLU 123 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1qx7 n GLU 123 Cb 0.09 -0.91 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 1qx7 n GLU 123 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1qx7 n ILE 125 N 0.43 0.00 0.34 -3.67 5.41 -0.83 -2.82 119.36 118.22 1qx7 n ILE 125 Ca 0.00 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.62 1qx7 n ILE 125 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 1qx7 n ILE 125 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1qx7 h ARG 126 N 0.00 -0.85 0.00 0.38 3.08 -1.49 -2.97 114.38 112.54 1qx7 h ARG 126 Ca 0.00 0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1qx7 h ARG 126 Cb 0.00 0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 1qx7 h ARG 126 CO 0.00 -0.56 -0.11 1.05 -1.07 0.00 0.00 179.97 179.27 1qx7 h GLU 127 N -0.98 0.00 -6.82 0.04 4.11 -1.82 -3.44 114.58 105.67 1qx7 h GLU 127 Ca -0.09 0.00 -0.54 0.00 0.07 0.00 0.00 59.36 58.80 1qx7 h GLU 127 Cb 0.67 0.00 0.20 0.00 0.50 0.00 0.00 28.75 30.12 1qx7 h GLU 127 CO 0.15 0.11 -0.33 0.00 0.07 0.00 0.00 179.01 179.01 1qx7 n ALA 128 N -2.19 -1.70 -3.32 1.06 0.00 -1.12 -4.91 120.51 108.33 1qx7 n ALA 128 Ca -0.01 -0.42 -0.46 0.00 0.00 0.00 0.00 53.44 52.56 1qx7 n ALA 128 Cb 0.31 -1.90 -0.01 0.00 0.00 0.00 0.00 19.45 17.84 1qx7 n ALA 128 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1qx7 s ASP 129 N -1.83 6.91 0.29 0.00 -1.08 -1.26 -4.95 116.67 114.75 1qx7 s ASP 129 Ca 0.63 -2.92 -0.07 0.00 -0.52 0.00 0.00 52.55 49.68 1qx7 s ASP 129 Cb -0.28 -2.22 -0.06 0.00 -1.46 0.00 0.00 42.92 38.91 1qx7 s ASP 129 CO 0.61 -0.51 0.57 -0.63 0.52 0.00 0.00 175.17 175.73 1qx7 s ILE 130 N -0.15 4.98 0.10 4.11 1.09 -1.26 -4.53 121.20 125.53 1qx7 s ILE 130 Ca 0.22 0.21 0.01 0.00 -1.10 0.00 0.00 60.65 59.99 1qx7 s ILE 130 Cb -0.10 -3.70 0.01 0.00 -1.06 0.00 0.00 42.46 37.61 1qx7 s ILE 130 CO -0.09 -0.28 0.08 -0.90 -0.10 0.00 0.00 174.94 173.65 1qx7 n ASP 131 N -0.77 1.17 0.02 3.58 5.75 -0.95 -4.96 116.55 120.38 1qx7 n ASP 131 Ca -0.01 -1.32 -0.10 0.00 -0.01 0.00 0.00 54.79 53.35 1qx7 n ASP 131 Cb 0.53 -0.02 -0.03 0.00 -1.03 0.00 0.00 41.12 40.57 1qx7 n ASP 131 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1qx7 h GLY 132 N 0.10 -0.20 2.00 6.12 0.00 -1.99 -2.34 103.07 106.76 1qx7 h GLY 132 Ca -0.06 0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 1qx7 h GLY 132 CO 0.09 -0.18 -0.05 -0.55 0.00 0.00 0.00 176.54 175.85 1qx7 h ASP 133 N -0.27 0.00 0.00 0.19 5.19 -1.96 -3.38 116.42 116.19 1qx7 h ASP 133 Ca 0.09 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.50 1qx7 h ASP 133 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 1qx7 h ASP 133 CO -0.25 0.05 0.00 0.61 -3.12 0.00 0.00 179.24 176.53 1qx7 n GLY 134 N -0.59 0.95 3.77 2.75 0.00 -0.88 -4.70 105.19 106.50 1qx7 n GLY 134 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1qx7 n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qx7 s GLN 135 N -0.54 3.49 -0.18 1.61 -1.52 -1.26 -4.73 119.66 116.53 1qx7 s GLN 135 Ca 0.00 1.68 -0.15 0.00 -1.95 0.00 0.00 55.36 54.94 1qx7 s GLN 135 Cb 0.00 -2.15 0.05 0.00 -0.22 0.00 0.00 33.01 30.69 1qx7 s GLN 135 CO 0.00 -0.76 0.46 0.54 -0.25 0.00 0.00 175.29 175.28 1qx7 s VAL 136 N -1.68 -0.00 -0.64 1.09 0.11 -1.26 -2.23 120.40 115.78 1qx7 s VAL 136 Ca 0.70 0.02 -0.26 0.00 -2.93 0.00 0.00 61.98 59.50 1qx7 s VAL 136 Cb -0.26 -0.65 -0.05 0.00 -1.53 0.00 0.00 36.38 33.89 1qx7 s VAL 136 CO 0.30 0.01 2.08 0.21 -3.33 0.00 0.00 175.10 174.37 1qx7 s ASN 137 N 0.49 4.87 0.62 3.54 3.84 -1.26 -4.82 114.94 122.23 1qx7 s ASN 137 Ca -0.02 0.35 0.20 0.00 0.21 0.00 0.00 52.86 53.61 1qx7 s ASN 137 Cb -0.04 -2.53 0.80 0.00 -0.55 0.00 0.00 41.25 38.93 1qx7 s ASN 137 CO -0.02 -2.73 1.35 0.10 -2.79 0.00 0.00 177.10 173.00 1qx7 h TYR 138 N 15.46 0.00 -0.55 0.43 -0.00 -1.99 0.53 116.97 130.85 1qx7 h TYR 138 Ca -0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 58.73 58.52 1qx7 h TYR 138 Cb 1.15 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.86 1qx7 h TYR 138 CO 1.06 0.00 0.21 0.93 -0.00 0.00 0.00 178.16 180.36 1qx7 h GLU 139 N 0.00 0.83 -0.92 0.10 4.39 -2.00 -2.43 114.58 114.55 1qx7 h GLU 139 Ca 0.29 -0.16 0.26 0.00 0.34 0.00 0.00 59.36 60.10 1qx7 h GLU 139 Cb 2.29 -0.13 -0.15 0.00 -0.10 0.00 0.00 28.75 30.66 1qx7 h GLU 139 CO -0.00 0.73 0.24 0.93 -1.16 0.00 0.00 179.01 179.75 1qx7 h GLU 140 N 0.75 0.15 -0.44 2.33 5.08 -0.32 1.27 114.58 123.40 1qx7 h GLU 140 Ca 0.18 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.47 1qx7 h GLU 140 Cb 0.22 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1qx7 h GLU 140 CO -0.01 0.10 0.04 0.74 -1.00 0.00 0.00 179.01 178.88 1qx7 h PHE 141 N 0.15 0.80 0.04 4.33 0.05 -1.58 -2.99 116.94 117.74 1qx7 h PHE 141 Ca 0.60 -0.12 -0.00 0.00 3.82 0.00 0.00 57.97 62.26 1qx7 h PHE 141 Cb 1.27 -0.21 0.00 0.00 2.00 0.00 0.00 35.95 39.01 1qx7 h PHE 141 CO -0.27 0.77 -0.02 0.28 -0.18 0.00 0.00 178.31 178.89 1qx7 h VAL 142 N 0.59 0.99 -0.01 -0.55 2.07 0.18 -3.42 116.25 116.11 1qx7 h VAL 142 Ca 0.13 -0.09 -0.28 0.00 0.82 0.00 0.00 66.70 67.28 1qx7 h VAL 142 Cb 0.43 1.05 0.07 0.00 -1.52 0.00 0.00 31.29 31.31 1qx7 h VAL 142 CO 0.01 0.02 0.89 1.67 0.02 0.00 0.00 177.57 180.19 1qx7 n GLN 143 N -5.10 0.01 -0.76 1.57 -0.06 0.14 -5.11 117.38 108.08 1qx7 n GLN 143 Ca -0.07 -0.68 0.00 0.00 -2.00 0.00 0.00 57.00 54.25 1qx7 n GLN 143 Cb 0.07 -2.06 0.00 0.00 -4.06 0.00 0.00 30.24 24.19 1qx7 n GLN 143 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11