#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qp3 n VAL 2 N 0.00 4.05 -4.42 2.03 0.31 -1.26 -4.77 118.33 114.27 1qp3 n VAL 2 Ca 0.00 -4.28 -0.23 0.00 -0.01 0.00 0.00 64.34 59.83 1qp3 n VAL 2 Cb 0.00 -2.41 -0.08 0.00 -0.91 0.00 0.00 33.84 30.44 1qp3 n VAL 2 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1qp3 s GLN 3 N 3.05 1.81 0.15 5.55 1.11 -1.26 -4.98 119.66 125.10 1qp3 s GLN 3 Ca 0.49 -2.08 -0.31 0.00 0.01 0.00 0.00 55.36 53.47 1qp3 s GLN 3 Cb 0.02 -0.26 -0.11 0.00 -1.01 0.00 0.00 33.01 31.66 1qp3 s GLN 3 CO 0.04 -0.52 1.75 -0.98 0.01 0.00 0.00 175.29 175.59 1qp3 s ARG 4 N -3.67 4.15 0.00 2.91 1.70 -1.26 -2.47 118.95 120.31 1qp3 s ARG 4 Ca 0.31 2.54 0.00 0.00 -0.47 0.00 0.00 55.73 58.11 1qp3 s ARG 4 Cb 0.03 -3.38 0.00 0.00 -0.57 0.00 0.00 34.95 31.03 1qp3 s ARG 4 CO 0.18 -0.77 0.00 0.41 -1.08 0.00 0.00 175.30 174.04 1qp3 n GLY 5 N 4.07 1.19 3.88 3.88 0.00 -1.01 -4.99 105.19 112.22 1qp3 n GLY 5 Ca 0.16 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1qp3 n GLY 5 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1qp3 s SER 6 N -0.55 6.46 -0.19 1.61 0.15 -1.03 -4.88 113.70 115.28 1qp3 s SER 6 Ca 0.00 1.09 -0.05 0.00 0.70 0.00 0.00 55.95 57.69 1qp3 s SER 6 Cb 0.00 -2.31 -0.03 0.00 -1.71 0.00 0.00 66.02 61.98 1qp3 s SER 6 CO 0.00 -0.44 -0.01 -0.54 1.20 0.00 0.00 173.24 173.46 1qp3 s LYS 7 N -4.03 3.65 0.24 5.44 -0.14 -1.26 -2.73 119.74 120.90 1qp3 s LYS 7 Ca 0.50 -0.51 0.10 0.00 -1.36 0.00 0.00 55.97 54.70 1qp3 s LYS 7 Cb -0.10 -3.05 -0.05 0.00 -1.68 0.00 0.00 37.83 32.95 1qp3 s LYS 7 CO 0.34 0.08 -0.18 0.14 -0.76 0.00 0.00 175.35 174.97 1qp3 s VAL 8 N 0.82 2.15 0.49 3.17 -7.23 -1.07 -2.87 120.40 115.87 1qp3 s VAL 8 Ca 0.00 -2.28 -0.14 0.00 -1.81 0.00 0.00 61.98 57.75 1qp3 s VAL 8 Cb -0.14 -2.17 -0.07 0.00 0.56 0.00 0.00 36.38 34.56 1qp3 s VAL 8 CO 0.02 -0.45 0.91 -0.13 -0.31 0.00 0.00 175.10 175.14 1qp3 s ARG 9 N -3.47 3.84 -0.27 4.82 1.81 0.12 -2.28 118.95 123.52 1qp3 s ARG 9 Ca 0.26 0.75 -0.15 0.00 -1.72 0.00 0.00 55.73 54.87 1qp3 s ARG 9 Cb -0.04 -2.22 -0.04 0.00 -0.45 0.00 0.00 34.95 32.21 1qp3 s ARG 9 CO 0.11 -0.23 0.38 0.42 -0.68 0.00 0.00 175.30 175.30 1qp3 s ILE 10 N -2.61 5.17 -0.55 1.52 -1.09 -0.77 -2.82 121.20 120.05 1qp3 s ILE 10 Ca 0.56 0.56 0.01 0.00 -2.23 0.00 0.00 60.65 59.55 1qp3 s ILE 10 Cb -0.10 -3.71 0.51 0.00 -1.58 0.00 0.00 42.46 37.57 1qp3 s ILE 10 CO 0.34 0.14 1.88 0.18 -1.23 0.00 0.00 174.94 176.25 1qp3 n LEU 11 N 5.35 6.92 -4.05 2.97 7.99 -0.93 -2.74 117.00 132.51 1qp3 n LEU 11 Ca -0.08 -4.14 -0.34 0.00 -0.01 0.00 0.00 56.01 51.43 1qp3 n LEU 11 Cb 0.51 -0.85 -0.10 0.00 -0.11 0.00 0.00 43.42 42.86 1qp3 n LEU 11 CO 0.37 1.42 0.01 -0.60 -1.51 0.00 0.00 177.39 177.09 1qp3 s ARG 12 N -3.64 2.50 0.58 3.23 3.52 -1.26 -4.93 118.95 118.96 1qp3 s ARG 12 Ca 0.60 -2.70 0.29 0.00 -0.13 0.00 0.00 55.73 53.79 1qp3 s ARG 12 Cb 0.48 -3.64 1.49 0.00 -1.56 0.00 0.00 34.95 31.72 1qp3 s ARG 12 CO 0.02 -1.18 1.92 -1.35 -0.81 0.00 0.00 175.30 173.91 1qp3 h PRO 13 N 6.67 0.00 0.00 5.12 0.11 -1.98 0.47 132.00 142.39 1qp3 h PRO 13 Ca -0.00 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.99 1qp3 h PRO 13 Cb 0.91 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 1qp3 h PRO 13 CO 0.72 0.00 -0.57 1.49 -0.21 0.00 0.00 178.00 179.43 1qp3 h GLU 14 N 0.00 0.00 -6.80 1.05 4.81 -2.01 -3.45 114.58 108.19 1qp3 h GLU 14 Ca 0.22 0.00 -0.51 0.00 -0.13 0.00 0.00 59.36 58.94 1qp3 h GLU 14 Cb 1.15 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.55 1qp3 h GLU 14 CO -0.00 0.57 0.50 0.45 -0.73 0.00 0.00 179.01 179.80 1qp3 s SER 15 N -6.59 7.19 0.57 1.04 0.15 0.17 -4.91 113.70 111.32 1qp3 s SER 15 Ca 0.01 2.31 0.26 0.00 0.70 0.00 0.00 55.95 59.22 1qp3 s SER 15 Cb 0.11 -2.63 1.65 0.00 -1.71 0.00 0.00 66.02 63.44 1qp3 s SER 15 CO 0.74 -0.21 2.22 0.22 1.20 0.00 0.00 173.24 177.41 1qp3 h TYR 16 N 3.94 0.00 -0.80 3.44 5.03 -1.86 -2.36 116.97 124.37 1qp3 h TYR 16 Ca -0.47 0.00 -0.53 0.00 2.58 0.00 0.00 58.73 60.31 1qp3 h TYR 16 Cb 1.21 0.00 -0.23 0.00 1.55 0.00 0.00 36.73 39.26 1qp3 h TYR 16 CO 0.59 0.00 0.68 0.91 -1.32 0.00 0.00 178.16 179.02 1qp3 n TRP 17 N -4.06 2.58 -1.50 -3.82 8.01 -1.26 -4.97 117.44 112.42 1qp3 n TRP 17 Ca -0.03 -2.50 -0.31 0.00 -1.31 0.00 0.00 57.50 53.35 1qp3 n TRP 17 Cb 0.09 -1.21 0.06 0.00 -2.01 0.00 0.00 31.31 28.25 1qp3 n TRP 17 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.69 176.80 1qp3 s PHE 18 N -3.02 2.86 -1.20 -5.99 5.36 -0.89 -3.36 117.98 111.74 1qp3 s PHE 18 Ca 0.51 1.49 0.00 0.00 -0.96 0.00 0.00 56.93 57.97 1qp3 s PHE 18 Cb 0.41 -2.98 0.00 0.00 -0.34 0.00 0.00 43.02 40.11 1qp3 s PHE 18 CO 0.00 -1.48 0.00 1.04 -1.46 0.00 0.00 175.22 173.33 1qp3 n GLN 19 N -3.14 -1.94 -4.42 10.12 6.02 -1.11 -4.94 117.38 117.97 1qp3 n GLN 19 Ca 0.08 0.68 -0.22 0.00 -0.01 0.00 0.00 57.00 57.53 1qp3 n GLN 19 Cb 0.53 -5.19 -0.13 0.00 1.02 0.00 0.00 30.24 26.47 1qp3 n GLN 19 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1qp3 s ASP 20 N -2.05 2.06 -0.57 1.08 1.11 -1.21 -4.94 116.67 112.14 1qp3 s ASP 20 Ca 0.00 -0.53 -0.20 0.00 0.18 0.00 0.00 52.55 52.00 1qp3 s ASP 20 Cb 0.00 -0.14 0.07 0.00 1.07 0.00 0.00 42.92 43.92 1qp3 s ASP 20 CO 0.00 0.07 0.77 -0.69 1.18 0.00 0.00 175.17 176.50 1qp3 s VAL 21 N -0.92 4.67 0.65 -1.27 1.01 -1.26 -1.84 120.40 121.43 1qp3 s VAL 21 Ca 0.04 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.53 1qp3 s VAL 21 Cb -0.09 -4.48 0.10 0.00 0.00 0.00 0.00 36.38 31.92 1qp3 s VAL 21 CO 0.02 -1.09 0.89 -0.83 0.00 0.00 0.00 175.10 174.09 1qp3 s GLY 22 N 3.22 1.77 0.07 4.51 0.00 -0.97 -4.88 107.32 111.04 1qp3 s GLY 22 Ca 0.18 -1.80 0.05 0.00 0.00 0.00 0.00 44.72 43.14 1qp3 s GLY 22 CO 0.11 -1.31 -0.07 -1.59 0.00 0.00 0.00 173.10 170.24 1qp3 s THR 23 N -2.93 3.61 -0.14 0.90 2.01 -1.03 -2.60 115.64 115.45 1qp3 s THR 23 Ca 0.64 -1.04 -0.26 0.00 0.31 0.00 0.00 61.69 61.34 1qp3 s THR 23 Cb -0.06 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.78 1qp3 s THR 23 CO 0.42 0.21 0.86 -0.69 -0.69 0.00 0.00 174.62 174.73 1qp3 s VAL 24 N -1.16 4.87 -0.10 3.82 1.01 -1.11 0.71 120.40 128.44 1qp3 s VAL 24 Ca 0.21 1.72 -0.16 0.00 0.00 0.00 0.00 61.98 63.75 1qp3 s VAL 24 Cb -0.11 -4.17 -0.27 0.00 0.00 0.00 0.00 36.38 31.82 1qp3 s VAL 24 CO 0.13 0.04 0.58 0.00 0.00 0.00 0.00 175.10 175.85 1qp3 h ALA 25 N 7.21 0.16 -1.61 5.51 0.00 -1.61 -2.68 119.26 126.24 1qp3 h ALA 25 Ca -0.31 -1.06 0.06 0.00 0.00 0.00 0.00 54.91 53.61 1qp3 h ALA 25 Cb 1.14 0.45 -0.23 0.00 0.00 0.00 0.00 17.79 19.16 1qp3 h ALA 25 CO 0.83 0.79 0.50 -1.12 0.00 0.00 0.00 179.25 180.25 1qp3 s SER 26 N -7.02 -0.41 -0.24 0.00 0.01 -1.25 -4.70 113.70 100.09 1qp3 s SER 26 Ca -0.20 0.47 -0.06 0.00 1.31 0.00 0.00 55.95 57.47 1qp3 s SER 26 Cb 0.04 0.36 -0.02 0.00 0.21 0.00 0.00 66.02 66.61 1qp3 s SER 26 CO 0.77 -0.36 0.04 -0.69 0.41 0.00 0.00 173.24 173.40 1qp3 s VAL 27 N -1.04 4.02 -0.23 3.43 1.01 -1.26 -1.34 120.40 124.99 1qp3 s VAL 27 Ca -0.03 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 1qp3 s VAL 27 Cb -0.01 -2.88 0.01 0.00 0.00 0.00 0.00 36.38 33.51 1qp3 s VAL 27 CO 0.02 0.35 -0.06 -0.62 0.00 0.00 0.00 175.10 174.79 1qp3 s ASP 28 N 1.57 4.20 -0.77 3.32 -1.08 0.10 -4.99 116.67 119.03 1qp3 s ASP 28 Ca 0.06 -0.61 -0.01 0.00 -0.52 0.00 0.00 52.55 51.47 1qp3 s ASP 28 Cb -0.15 -1.69 0.37 0.00 -1.46 0.00 0.00 42.92 40.00 1qp3 s ASP 28 CO 0.02 -0.07 1.90 0.00 0.52 0.00 0.00 175.17 177.54 1qp3 n GLN 29 N 4.74 2.84 -1.14 4.34 6.02 -1.26 -4.36 117.38 128.56 1qp3 n GLN 29 Ca -0.18 -3.62 -0.20 0.00 -0.01 0.00 0.00 57.00 52.99 1qp3 n GLN 29 Cb 0.49 -2.27 0.19 0.00 1.02 0.00 0.00 30.24 29.67 1qp3 n GLN 29 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1qp3 n SER 30 N -0.58 3.90 -2.12 1.08 2.88 -1.26 -4.93 113.62 112.59 1qp3 n SER 30 Ca 0.53 -3.46 -0.03 0.00 -1.33 0.00 0.00 58.87 54.57 1qp3 n SER 30 Cb 0.35 -0.81 0.00 0.00 -0.75 0.00 0.00 64.21 63.01 1qp3 n SER 30 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1qp3 n GLY 31 N -0.90 -1.15 3.18 0.46 0.00 -1.26 -5.09 105.19 100.43 1qp3 n GLY 31 Ca 0.54 0.49 -0.11 0.00 0.00 0.00 0.00 46.02 46.94 1qp3 n GLY 31 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1qp3 s ILE 32 N -1.67 0.13 0.56 -0.61 -4.36 -1.26 -5.03 121.20 108.96 1qp3 s ILE 32 Ca 0.11 -1.95 0.25 0.00 -0.26 0.00 0.00 60.65 58.79 1qp3 s ILE 32 Cb -0.03 -2.22 0.32 0.00 1.25 0.00 0.00 42.46 41.78 1qp3 s ILE 32 CO 0.35 -0.30 2.22 0.07 0.24 0.00 0.00 174.94 177.52 1qp3 h LYS 33 N 2.76 0.00 -2.54 0.37 2.10 -1.98 -3.35 116.57 113.92 1qp3 h LYS 33 Ca -0.36 0.00 -0.49 0.00 -2.00 0.00 0.00 60.65 57.80 1qp3 h LYS 33 Cb 1.22 0.00 -0.38 0.00 -0.90 0.00 0.00 32.23 32.17 1qp3 h LYS 33 CO 0.57 0.00 -0.76 0.71 -2.00 0.00 0.00 179.45 177.97 1qp3 s TYR 34 N -4.80 0.21 0.28 0.07 2.02 -1.26 -4.62 117.35 109.25 1qp3 s TYR 34 Ca -0.05 -0.93 0.02 0.00 -0.37 0.00 0.00 57.07 55.74 1qp3 s TYR 34 Cb 0.16 -0.77 0.61 0.00 -0.40 0.00 0.00 41.96 41.55 1qp3 s TYR 34 CO 0.59 -0.86 1.79 -1.35 -1.57 0.00 0.00 175.55 174.16 1qp3 h PRO 35 N 7.90 0.78 -5.69 -1.71 0.11 -1.71 -3.41 132.00 128.28 1qp3 h PRO 35 Ca -0.10 -0.05 -0.59 0.00 0.11 0.00 0.00 66.00 65.38 1qp3 h PRO 35 Cb 1.02 -0.18 -0.08 0.00 0.11 0.00 0.00 31.00 31.87 1qp3 h PRO 35 CO 0.35 0.52 -0.24 0.08 -0.21 0.00 0.00 178.00 178.50 1qp3 s VAL 36 N -5.93 5.21 -0.17 3.15 1.01 -0.83 0.01 120.40 122.85 1qp3 s VAL 36 Ca -0.12 0.74 -0.10 0.00 0.00 0.00 0.00 61.98 62.50 1qp3 s VAL 36 Cb 0.23 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 1qp3 s VAL 36 CO 0.80 0.41 0.17 -0.63 0.00 0.00 0.00 175.10 175.84 1qp3 s ILE 37 N 0.18 5.40 -0.07 2.22 1.01 -0.45 0.02 121.20 129.51 1qp3 s ILE 37 Ca 0.21 0.27 0.03 0.00 0.00 0.00 0.00 60.65 61.17 1qp3 s ILE 37 Cb -0.14 -3.49 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 1qp3 s ILE 37 CO 0.08 0.46 -0.16 -0.69 0.00 0.00 0.00 174.94 174.64 1qp3 s VAL 38 N 0.11 2.87 -0.20 2.92 1.01 -0.41 -1.54 120.40 125.17 1qp3 s VAL 38 Ca 0.11 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.26 1qp3 s VAL 38 Cb -0.12 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1qp3 s VAL 38 CO 0.00 0.57 0.03 -0.60 0.00 0.00 0.00 175.10 175.10 1qp3 s ARG 39 N -0.36 3.74 0.18 2.72 3.52 0.22 -2.21 118.95 126.76 1qp3 s ARG 39 Ca 0.03 -0.46 0.03 0.00 -0.13 0.00 0.00 55.73 55.21 1qp3 s ARG 39 Cb -0.12 -3.15 -0.03 0.00 -1.56 0.00 0.00 34.95 30.08 1qp3 s ARG 39 CO 0.02 0.08 0.31 -0.06 -0.81 0.00 0.00 175.30 174.84 1qp3 s PHE 40 N 0.86 3.47 -0.17 5.12 0.08 -1.08 -2.45 117.98 123.81 1qp3 s PHE 40 Ca 0.02 0.07 0.18 0.00 0.12 0.00 0.00 56.93 57.32 1qp3 s PHE 40 Cb -0.14 -1.63 -0.25 0.00 -0.57 0.00 0.00 43.02 40.42 1qp3 s PHE 40 CO 0.02 0.49 0.20 0.39 -0.10 0.00 0.00 175.22 176.22 1qp3 n GLU 41 N -0.84 0.68 -1.94 0.44 1.02 -1.26 -4.69 120.64 114.04 1qp3 n GLU 41 Ca -0.08 0.02 -0.29 0.00 -0.02 0.00 0.00 57.16 56.80 1qp3 n GLU 41 Cb 0.55 -1.56 0.08 0.00 -0.02 0.00 0.00 31.44 30.49 1qp3 n GLU 41 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1qp3 s LYS 42 N -2.60 2.10 0.00 3.49 2.20 -1.26 -5.06 119.74 118.61 1qp3 s LYS 42 Ca -0.09 0.10 0.00 0.00 -0.36 0.00 0.00 55.97 55.62 1qp3 s LYS 42 Cb 0.07 -1.99 0.00 0.00 -1.51 0.00 0.00 37.83 34.40 1qp3 s LYS 42 CO 0.83 -1.48 0.00 1.33 -0.36 0.00 0.00 175.35 175.67 1qp3 n VAL 43 N -3.23 0.00 -3.31 4.02 0.24 -1.26 -4.67 118.33 110.12 1qp3 n VAL 43 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 1qp3 n VAL 43 Cb 0.60 -0.60 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1qp3 n VAL 43 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1qp3 n ASN 44 N -1.22 0.00 0.27 -1.34 6.94 -1.25 -4.93 115.26 113.72 1qp3 n ASN 44 Ca 0.00 -0.97 0.10 0.00 -0.02 0.00 0.00 54.58 53.69 1qp3 n ASN 44 Cb 0.00 0.00 0.71 0.00 -2.36 0.00 0.00 39.78 38.13 1qp3 n ASN 44 CO 0.00 0.00 0.00 1.88 -1.03 0.00 0.00 177.26 178.11 1qp3 h TYR 45 N 0.97 0.00 0.00 -2.53 0.05 -2.00 -2.47 116.97 110.98 1qp3 h TYR 45 Ca 0.00 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.55 1qp3 h TYR 45 Cb 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.70 1qp3 h TYR 45 CO 0.00 0.03 -1.40 0.77 -1.05 0.00 0.00 178.16 176.50 1qp3 h SER 46 N 0.00 0.00 -0.01 3.88 0.02 -2.05 -3.48 113.55 111.92 1qp3 h SER 46 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1qp3 h SER 46 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1qp3 h SER 46 CO 0.00 0.83 0.00 0.61 -1.14 0.00 0.00 176.83 177.13 1qp3 n GLY 47 N 1.45 1.82 3.95 -3.77 0.00 -0.93 -5.10 105.19 102.60 1qp3 n GLY 47 Ca -0.10 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 1qp3 n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qp3 s ILE 55 N -2.01 5.04 0.00 -0.61 1.01 -1.26 -4.87 121.20 118.50 1qp3 s ILE 55 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.08 1qp3 s ILE 55 Cb 0.00 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.64 1qp3 s ILE 55 CO 0.00 -0.50 0.74 -0.46 0.00 0.00 0.00 174.94 174.72 1qp3 n ASN 56 N -1.74 0.00 -3.72 3.58 6.94 -1.26 -3.91 115.26 115.15 1qp3 n ASN 56 Ca -0.05 -1.47 -0.13 0.00 -0.02 0.00 0.00 54.58 52.91 1qp3 n ASN 56 Cb 0.56 -0.09 -0.10 0.00 -2.36 0.00 0.00 39.78 37.79 1qp3 n ASN 56 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1qp3 s THR 57 N 0.00 -0.00 0.32 5.53 -4.23 -1.26 -2.63 115.64 113.36 1qp3 s THR 57 Ca 0.00 0.01 -0.06 0.00 -1.18 0.00 0.00 61.69 60.46 1qp3 s THR 57 Cb 0.00 -0.63 0.00 0.00 1.34 0.00 0.00 72.50 73.21 1qp3 s THR 57 CO 0.00 0.00 0.48 0.20 -0.54 0.00 0.00 174.62 174.77 1qp3 s ASN 58 N 0.35 0.57 -0.04 3.99 -0.87 -0.94 -4.99 114.94 113.02 1qp3 s ASN 58 Ca -0.01 -1.32 0.07 0.00 -1.57 0.00 0.00 52.86 50.03 1qp3 s ASN 58 Cb -0.04 0.65 -0.02 0.00 -0.02 0.00 0.00 41.25 41.82 1qp3 s ASN 58 CO -0.01 -1.27 -0.25 0.20 -2.57 0.00 0.00 177.10 173.20 1qp3 s ASN 59 N -3.17 3.00 0.12 -1.22 -0.87 -1.26 -1.28 114.94 110.26 1qp3 s ASN 59 Ca 0.28 -0.48 0.03 0.00 -1.57 0.00 0.00 52.86 51.12 1qp3 s ASN 59 Cb -0.00 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.25 40.63 1qp3 s ASN 59 CO 0.17 0.28 -0.08 -0.36 -2.57 0.00 0.00 177.10 174.53 1qp3 s PHE 60 N -0.40 1.07 0.34 2.20 0.40 0.10 -4.79 117.98 116.90 1qp3 s PHE 60 Ca 0.04 -0.83 -0.19 0.00 -0.60 0.00 0.00 56.93 55.34 1qp3 s PHE 60 Cb -0.12 -0.58 -0.10 0.00 0.51 0.00 0.00 43.02 42.74 1qp3 s PHE 60 CO 0.01 -0.04 0.83 0.00 0.70 0.00 0.00 175.22 176.73 1qp3 s ALA 61 N -3.42 3.23 0.57 5.36 0.00 -1.26 -1.97 121.76 124.27 1qp3 s ALA 61 Ca 0.14 0.25 0.25 0.00 0.00 0.00 0.00 51.96 52.60 1qp3 s ALA 61 Cb 0.04 -2.96 1.64 0.00 0.00 0.00 0.00 23.12 21.83 1qp3 s ALA 61 CO -0.02 0.24 2.21 1.05 0.00 0.00 0.00 175.76 179.24 1qp3 h GLU 62 N 2.50 0.00 0.00 0.00 4.11 -1.94 0.10 114.58 119.35 1qp3 h GLU 62 Ca -0.48 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 58.90 1qp3 h GLU 62 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1qp3 h GLU 62 CO 0.64 0.00 -0.25 0.38 0.07 0.00 0.00 179.01 179.85 1qp3 h ASP 63 N 0.00 0.00 -0.75 3.06 3.04 -2.02 -2.77 116.42 116.97 1qp3 h ASP 63 Ca 0.01 0.00 -0.34 0.00 -3.24 0.00 0.00 57.03 53.46 1qp3 h ASP 63 Cb 0.07 0.00 -0.20 0.00 -1.04 0.00 0.00 39.33 38.15 1qp3 h ASP 63 CO -0.00 0.25 0.43 -0.62 -2.04 0.00 0.00 179.24 177.26 1qp3 n GLU 64 N -3.53 2.48 -3.73 4.15 1.02 0.36 -4.83 120.64 116.56 1qp3 n GLU 64 Ca -0.01 -2.51 -0.20 0.00 -0.02 0.00 0.00 57.16 54.43 1qp3 n GLU 64 Cb 0.40 -2.01 -0.18 0.00 -0.02 0.00 0.00 31.44 29.64 1qp3 n GLU 64 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1qp3 s LEU 65 N -2.63 0.44 0.06 -4.62 1.43 -1.05 -2.18 118.68 110.13 1qp3 s LEU 65 Ca 0.47 0.03 -0.01 0.00 -1.03 0.00 0.00 54.13 53.58 1qp3 s LEU 65 Cb 0.38 -0.21 -0.04 0.00 0.03 0.00 0.00 46.19 46.36 1qp3 s LEU 65 CO 0.10 -0.21 0.23 -0.69 0.23 0.00 0.00 176.35 176.01 1qp3 s VAL 66 N 1.89 5.36 -0.04 -1.59 1.01 -1.13 -4.83 120.40 121.08 1qp3 s VAL 66 Ca 0.02 -0.29 -0.28 0.00 0.00 0.00 0.00 61.98 61.43 1qp3 s VAL 66 Cb -0.12 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1qp3 s VAL 66 CO -0.03 0.15 0.90 -0.70 0.00 0.00 0.00 175.10 175.42 1qp3 s GLU 67 N -2.44 4.50 -0.39 2.72 -6.30 -1.26 0.15 118.70 115.67 1qp3 s GLU 67 Ca 0.35 1.25 0.10 0.00 -2.50 0.00 0.00 54.97 54.16 1qp3 s GLU 67 Cb -0.13 -3.47 0.30 0.00 0.00 0.00 0.00 34.13 30.82 1qp3 s GLU 67 CO 0.26 -0.07 0.64 1.33 0.02 0.00 0.00 175.26 177.45 1qp3 n VAL 68 N 4.00 -0.42 -1.88 3.70 0.24 -1.14 -4.89 118.33 117.94 1qp3 n VAL 68 Ca 0.04 -4.09 -0.30 0.00 -2.04 0.00 0.00 64.34 57.95 1qp3 n VAL 68 Cb 0.51 -0.99 0.05 0.00 -1.47 0.00 0.00 33.84 31.94 1qp3 n VAL 68 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1qp3 s GLU 69 N -1.61 2.78 0.37 7.34 2.56 -1.26 -4.89 118.70 123.98 1qp3 s GLU 69 Ca 0.37 0.43 -0.19 0.00 0.00 0.00 0.00 54.97 55.58 1qp3 s GLU 69 Cb 0.25 -2.01 -0.10 0.00 2.00 0.00 0.00 34.13 34.27 1qp3 s GLU 69 CO -0.10 -1.09 0.86 0.00 -0.56 0.00 0.00 175.26 174.37 1qp3 s ALA 70 N -3.38 3.18 1.12 6.30 0.00 -1.26 -5.04 121.76 122.69 1qp3 s ALA 70 Ca 0.59 0.27 -0.18 0.00 0.00 0.00 0.00 51.96 52.63 1qp3 s ALA 70 Cb -0.11 -2.99 0.12 0.00 0.00 0.00 0.00 23.12 20.14 1qp3 s ALA 70 CO 0.52 0.22 0.14 -2.30 0.00 0.00 0.00 175.76 174.33 1qp3 n PRO 71 N -0.33 -1.64 -3.04 0.00 -0.02 -1.26 -4.37 135.00 124.35 1qp3 n PRO 71 Ca 0.05 -0.46 -0.14 0.00 -2.02 0.00 0.00 63.50 60.92 1qp3 n PRO 71 Cb 0.53 -1.76 0.02 0.00 -0.02 0.00 0.00 33.50 32.27 1qp3 n PRO 71 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1qp3 n LYS 72 N -2.38 -2.26 -2.48 -0.52 4.81 -1.26 -5.01 118.16 109.06 1qp3 n LYS 72 Ca 0.01 1.93 -0.25 0.00 -0.87 0.00 0.00 58.31 59.14 1qp3 n LYS 72 Cb 0.61 -4.24 0.12 0.00 0.02 0.00 0.00 35.03 31.54 1qp3 n LYS 72 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1qp3 s ALA 73 N -2.00 3.47 -0.16 3.14 0.00 -1.26 -4.82 121.76 120.13 1qp3 s ALA 73 Ca 0.22 -1.64 -0.04 0.00 0.00 0.00 0.00 51.96 50.50 1qp3 s ALA 73 Cb -0.04 -2.13 0.02 0.00 0.00 0.00 0.00 23.12 20.96 1qp3 s ALA 73 CO 0.73 -1.62 0.08 1.17 0.00 0.00 0.00 175.76 176.13 1qp3 n LYS 74 N -2.98 -2.88 -0.56 0.00 4.81 -1.26 -4.92 118.16 110.37 1qp3 n LYS 74 Ca 0.15 2.37 -0.28 0.00 -0.87 0.00 0.00 58.31 59.68 1qp3 n LYS 74 Cb 0.60 -3.66 0.19 0.00 0.02 0.00 0.00 35.03 32.18 1qp3 n LYS 74 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1qp3 n PRO 75 N 1.47 -2.29 0.09 1.64 -0.02 -1.26 -4.95 135.00 129.68 1qp3 n PRO 75 Ca -0.14 -0.66 -0.23 0.00 -2.02 0.00 0.00 63.50 60.45 1qp3 n PRO 75 Cb 0.31 -1.69 -0.15 0.00 -0.02 0.00 0.00 33.50 31.95 1qp3 n PRO 75 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1qp3 h LYS 76 N -2.50 0.41 0.00 -0.52 3.64 -1.99 -3.55 116.57 112.06 1qp3 h LYS 76 Ca -0.44 -0.71 0.00 0.00 -1.27 0.00 0.00 60.65 58.23 1qp3 h LYS 76 Cb 1.18 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 33.27 1qp3 h LYS 76 CO 0.31 1.34 0.00 1.17 -2.27 0.00 0.00 179.45 180.00