#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l72 s LEU 13 N 0.00 4.32 -0.13 4.31 1.43 -1.26 -5.11 118.68 122.24 3l72 s LEU 13 Ca 0.00 0.28 -0.01 0.00 -1.03 0.00 0.00 54.13 53.36 3l72 s LEU 13 Cb 0.00 -2.80 -0.02 0.00 0.03 0.00 0.00 46.19 43.40 3l72 s LEU 13 CO 0.00 0.20 -0.08 -0.69 0.23 0.00 0.00 176.35 176.01 3l72 s VAL 14 N -1.43 3.50 -0.64 -1.59 1.01 -1.26 -5.07 120.40 114.91 3l72 s VAL 14 Ca 0.32 -0.51 -0.25 0.00 0.00 0.00 0.00 61.98 61.54 3l72 s VAL 14 Cb -0.13 -2.49 0.05 0.00 0.00 0.00 0.00 36.38 33.81 3l72 s VAL 14 CO 0.24 0.52 1.08 -0.62 0.00 0.00 0.00 175.10 176.32 3l72 s ASP 15 N 0.18 6.24 0.66 3.32 3.68 -1.26 -4.87 116.67 124.62 3l72 s ASP 15 Ca -0.04 -0.54 0.12 0.00 2.13 0.00 0.00 52.55 54.22 3l72 s ASP 15 Cb -0.14 -2.48 0.67 0.00 -1.45 0.00 0.00 42.92 39.52 3l72 s ASP 15 CO 0.04 -1.51 1.38 1.55 0.13 0.00 0.00 175.17 176.76 3l72 h PRO 16 N 9.63 0.00 0.81 4.34 0.13 -1.96 0.91 132.00 145.86 3l72 h PRO 16 Ca -0.27 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.82 3l72 h PRO 16 Cb 1.06 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.20 3l72 h PRO 16 CO 1.19 0.00 -0.39 1.25 -0.23 0.00 0.00 178.00 179.82 3l72 h LEU 17 N 0.00 -0.93 -1.39 1.56 5.85 -1.92 -2.00 115.31 116.49 3l72 h LEU 17 Ca 0.00 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.83 3l72 h LEU 17 Cb 1.44 0.24 -0.05 0.00 0.37 0.00 0.00 40.66 42.67 3l72 h LEU 17 CO 0.00 -0.57 0.49 0.71 -0.34 0.00 0.00 178.44 178.73 3l72 h THR 18 N -1.29 0.98 0.64 1.05 1.35 -1.23 0.19 112.91 114.60 3l72 h THR 18 Ca -0.11 -0.25 -0.03 0.00 -0.55 0.00 0.00 66.41 65.47 3l72 h THR 18 Cb 0.84 0.20 0.01 0.00 -1.73 0.00 0.00 68.15 67.47 3l72 h THR 18 CO 0.18 0.13 -0.31 0.74 -0.25 0.00 0.00 175.52 176.02 3l72 h THR 19 N 0.72 0.35 0.00 6.82 2.02 -1.47 -2.13 112.91 119.21 3l72 h THR 19 Ca 0.33 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 67.45 3l72 h THR 19 Cb 0.35 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 3l72 h THR 19 CO -0.12 0.01 -0.01 0.40 0.37 0.00 0.00 175.52 176.18 3l72 h ILE 20 N -0.91 0.02 -0.43 3.11 2.04 -0.95 -1.57 117.51 118.83 3l72 h ILE 20 Ca -0.09 -0.46 -0.12 0.00 1.00 0.00 0.00 64.86 65.19 3l72 h ILE 20 Cb 0.68 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 3l72 h ILE 20 CO 0.15 0.01 -0.22 0.03 0.00 0.00 0.00 178.15 178.11 3l72 h ARG 21 N 0.00 0.87 0.06 2.37 2.47 -0.36 -2.56 114.38 117.24 3l72 h ARG 21 Ca -0.00 -0.36 -0.00 0.00 -1.26 0.00 0.00 59.98 58.36 3l72 h ARG 21 Cb 0.45 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 3l72 h ARG 21 CO 0.00 1.00 -0.03 0.93 0.56 0.00 0.00 179.97 182.43 3l72 h GLU 22 N 0.75 -0.08 -0.72 0.04 5.08 -0.64 -2.58 114.58 116.43 3l72 h GLU 22 Ca 0.10 0.01 0.30 0.00 -1.00 0.00 0.00 59.36 58.76 3l72 h GLU 22 Cb 0.76 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.90 3l72 h GLU 22 CO 0.06 -0.05 0.40 1.58 -1.00 0.00 0.00 179.01 180.00 3l72 n HIS 23 N -2.30 0.80 -0.03 4.33 -0.00 -0.83 0.43 115.22 117.61 3l72 n HIS 23 Ca -0.01 0.80 -0.15 0.00 0.46 0.00 0.00 57.72 58.83 3l72 n HIS 23 Cb 0.03 -1.23 -0.10 0.00 -0.12 0.00 0.00 29.99 28.57 3l72 n HIS 23 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3l72 h GLU 25 N -0.23 0.00 -1.28 0.00 5.08 0.40 0.30 114.58 118.86 3l72 h GLU 25 Ca -0.02 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.97 3l72 h GLU 25 Cb 0.96 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.04 3l72 h GLU 25 CO 0.06 0.00 0.47 1.04 -1.00 0.00 0.00 179.01 179.58 3l72 n GLN 26 N -2.80 1.90 -4.82 2.33 1.13 -1.06 -3.72 117.38 110.34 3l72 n GLN 26 Ca -0.02 -1.87 -0.32 0.00 -1.94 0.00 0.00 57.00 52.86 3l72 n GLN 26 Cb 0.29 -1.73 -0.13 0.00 0.11 0.00 0.00 30.24 28.78 3l72 n GLN 26 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3l72 s THR 27 N -2.52 2.84 0.33 5.09 2.01 0.11 -5.00 115.64 118.50 3l72 s THR 27 Ca 0.36 -0.98 0.11 0.00 0.31 0.00 0.00 61.69 61.50 3l72 s THR 27 Cb 0.29 -2.14 0.32 0.00 0.01 0.00 0.00 72.50 70.98 3l72 s THR 27 CO 0.02 0.47 1.68 -0.08 -0.69 0.00 0.00 174.62 176.02 3l72 h GLU 28 N 4.97 0.39 -0.01 4.92 4.81 -1.89 0.18 114.58 127.95 3l72 h GLU 28 Ca -0.47 -0.02 -0.20 0.00 -0.13 0.00 0.00 59.36 58.54 3l72 h GLU 28 Cb 1.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 3l72 h GLU 28 CO 0.49 0.26 -0.86 0.87 -0.73 0.00 0.00 179.01 179.03 3l72 h LYS 29 N 0.40 0.28 0.01 1.92 1.57 -1.95 -2.66 116.57 116.14 3l72 h LYS 29 Ca 0.68 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 59.17 3l72 h LYS 29 Cb 1.45 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.84 3l72 h LYS 29 CO -0.57 0.99 -0.00 0.00 -0.57 0.00 0.00 179.45 179.30 3l72 h VAL 31 N -0.71 0.34 -0.87 0.00 2.07 -0.79 2.76 116.25 119.06 3l72 h VAL 31 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3l72 h VAL 31 Cb 0.69 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 3l72 h VAL 31 CO 0.00 0.00 0.53 0.11 0.02 0.00 0.00 177.57 178.23 3l72 h LYS 32 N -0.09 1.17 0.01 1.57 1.57 -1.54 0.54 116.57 119.81 3l72 h LYS 32 Ca 0.24 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3l72 h LYS 32 Cb 0.47 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3l72 h LYS 32 CO -0.59 0.82 -0.13 0.00 -0.57 0.00 0.00 179.45 178.98 3l72 h ALA 33 N 1.39 -0.00 -0.60 3.86 0.00 -0.67 -2.38 119.26 120.86 3l72 h ALA 33 Ca 0.31 -0.49 0.17 0.00 0.00 0.00 0.00 54.91 54.91 3l72 h ALA 33 Cb -0.06 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3l72 h ALA 33 CO -0.06 0.03 0.48 -0.09 0.00 0.00 0.00 179.25 179.61 3l72 h ARG 34 N -0.79 0.00 0.13 0.00 9.65 0.49 -1.18 114.38 122.67 3l72 h ARG 34 Ca -0.02 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 3l72 h ARG 34 Cb 1.01 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.59 3l72 h ARG 34 CO 0.02 0.00 -0.06 1.49 2.80 0.00 0.00 179.97 184.22 3l72 h GLU 35 N 0.00 -0.16 -0.97 0.20 4.81 -0.89 -3.12 114.58 114.45 3l72 h GLU 35 Ca 0.28 0.01 0.32 0.00 -0.13 0.00 0.00 59.36 59.84 3l72 h GLU 35 Cb 1.25 0.04 -0.17 0.00 0.63 0.00 0.00 28.75 30.50 3l72 h GLU 35 CO -0.00 0.11 0.32 0.00 -0.73 0.00 0.00 179.01 178.70 3l72 h ARG 36 N -1.00 0.10 0.06 1.92 3.08 -0.71 -2.34 114.38 115.48 3l72 h ARG 36 Ca -0.02 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 3l72 h ARG 36 Cb 0.34 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3l72 h ARG 36 CO 0.03 0.06 -0.03 1.25 -1.07 0.00 0.00 179.97 180.21 3l72 h LEU 37 N 0.10 -0.07 -1.10 3.04 5.85 -1.37 -2.69 115.31 119.07 3l72 h LEU 37 Ca 0.69 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.41 3l72 h LEU 37 Cb 1.59 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.64 3l72 h LEU 37 CO -0.77 -0.04 0.56 -0.33 -0.34 0.00 0.00 178.44 177.52 3l72 h GLU 38 N -0.08 0.00 0.11 1.25 5.08 -1.37 1.02 114.58 120.58 3l72 h GLU 38 Ca -0.01 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.16 3l72 h GLU 38 Cb 0.06 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.33 3l72 h GLU 38 CO 0.01 0.00 -0.81 -0.07 -1.00 0.00 0.00 179.01 177.15 3l72 h LEU 39 N 0.00 0.53 1.01 1.33 3.38 -1.33 -2.39 115.31 117.83 3l72 h LEU 39 Ca 0.00 -0.89 -0.05 0.00 0.09 0.00 0.00 57.88 57.03 3l72 h LEU 39 Cb 1.11 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.71 3l72 h LEU 39 CO 0.00 1.37 -0.48 0.00 0.09 0.00 0.00 178.44 179.42 3l72 n ASP 41 N -5.67 -0.76 -0.14 0.00 2.03 -0.44 -0.53 116.55 111.04 3l72 n ASP 41 Ca -0.17 1.58 -0.05 0.00 0.52 0.00 0.00 54.79 56.67 3l72 n ASP 41 Cb 0.53 -0.29 -0.04 0.00 -0.72 0.00 0.00 41.12 40.60 3l72 n ASP 41 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3l72 h ALA 42 N 0.86 -0.33 -0.64 -1.67 0.00 -1.24 0.40 119.26 116.63 3l72 h ALA 42 Ca 0.23 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 3l72 h ALA 42 Cb 0.46 1.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 3l72 h ALA 42 CO -0.87 -0.49 0.16 0.07 0.00 0.00 0.00 179.25 178.12 3l72 h ARG 43 N -0.06 1.01 -0.48 0.00 0.11 -0.75 -1.49 114.38 112.72 3l72 h ARG 43 Ca 0.06 -0.22 -0.09 0.00 0.10 0.00 0.00 59.98 59.83 3l72 h ARG 43 Cb 0.21 -0.14 -0.02 0.00 1.11 0.00 0.00 29.97 31.12 3l72 h ARG 43 CO -0.36 0.89 -0.05 0.28 0.10 0.00 0.00 179.97 180.83 3l72 h VAL 44 N 0.96 1.25 -0.46 0.08 2.07 -0.24 -3.05 116.25 116.88 3l72 h VAL 44 Ca 0.21 -1.10 -0.12 0.00 0.82 0.00 0.00 66.70 66.51 3l72 h VAL 44 Cb 0.33 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 3l72 h VAL 44 CO -0.00 0.38 -0.18 0.28 0.02 0.00 0.00 177.57 178.08 3l72 h SER 45 N 0.76 0.94 -0.94 0.57 0.02 0.10 -3.29 113.55 111.72 3l72 h SER 45 Ca 0.14 -0.39 -0.56 0.00 -0.84 0.00 0.00 61.79 60.14 3l72 h SER 45 Cb 0.53 -0.26 -0.14 0.00 0.14 0.00 0.00 62.40 62.67 3l72 h SER 45 CO 0.03 1.12 1.21 -1.54 -1.14 0.00 0.00 176.83 176.50 3l72 n SER 46 N -4.19 7.03 -3.42 3.07 3.41 -0.59 -4.85 113.62 114.08 3l72 n SER 46 Ca -0.00 -3.08 -0.11 0.00 -0.26 0.00 0.00 58.87 55.42 3l72 n SER 46 Cb 0.43 -1.31 -0.02 0.00 -0.26 0.00 0.00 64.21 63.04 3l72 n SER 46 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3l72 s ARG 47 N -1.06 1.89 -0.36 4.33 0.52 -1.24 -4.95 118.95 118.08 3l72 s ARG 47 Ca 0.59 -1.46 0.13 0.00 -0.52 0.00 0.00 55.73 54.47 3l72 s ARG 47 Cb 0.30 0.52 0.42 0.00 0.52 0.00 0.00 34.95 36.71 3l72 s ARG 47 CO -0.15 -0.83 1.20 0.43 0.02 0.00 0.00 175.30 175.97 3l72 n SER 48 N -1.04 -0.43 0.00 0.23 7.64 -1.26 -4.97 113.62 113.79 3l72 n SER 48 Ca -0.03 -2.54 0.00 0.00 1.01 0.00 0.00 58.87 57.32 3l72 n SER 48 Cb 0.61 0.34 0.00 0.00 -1.01 0.00 0.00 64.21 64.14 3l72 n SER 48 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3l72 n HIS 49 N -0.42 0.00 -4.19 1.43 8.25 -1.26 -5.18 115.22 113.84 3l72 n HIS 49 Ca 0.02 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.33 3l72 n HIS 49 Cb 0.84 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.84 3l72 n HIS 49 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3l72 s THR 50 N 0.00 1.01 -0.11 1.59 -1.32 -1.26 -5.05 115.64 110.50 3l72 s THR 50 Ca 0.00 -1.69 -0.01 0.00 -1.21 0.00 0.00 61.69 58.78 3l72 s THR 50 Cb 0.00 -1.42 -0.25 0.00 -1.51 0.00 0.00 72.50 69.32 3l72 s THR 50 CO 0.00 -0.56 0.42 -0.62 -2.21 0.00 0.00 174.62 171.65 3l72 n GLU 51 N 0.49 0.72 -0.99 7.08 -0.58 -1.26 -4.98 120.64 121.13 3l72 n GLU 51 Ca -0.15 0.26 -0.31 0.00 -0.42 0.00 0.00 57.16 56.54 3l72 n GLU 51 Cb 0.58 -1.72 0.01 0.00 -0.57 0.00 0.00 31.44 29.73 3l72 n GLU 51 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3l72 n GLU 52 N -3.35 0.00 -3.78 3.49 2.13 -1.26 -5.01 120.64 112.85 3l72 n GLU 52 Ca -0.28 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.41 3l72 n GLU 52 Cb 1.05 -0.80 -0.09 0.00 0.27 0.00 0.00 31.44 31.88 3l72 n GLU 52 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 3l72 s GLN 53 N -0.81 0.63 -0.30 5.31 -0.21 -1.26 -5.06 119.66 117.96 3l72 s GLN 53 Ca 0.45 -0.23 0.06 0.00 0.02 0.00 0.00 55.36 55.66 3l72 s GLN 53 Cb -0.39 0.28 0.56 0.00 1.00 0.00 0.00 33.01 34.46 3l72 s GLN 53 CO 0.53 -0.17 1.64 0.00 -2.12 0.00 0.00 175.29 175.17 3l72 h THR 55 N 1.58 0.00 -0.95 0.00 2.02 -1.99 -1.00 112.91 112.57 3l72 h THR 55 Ca 0.33 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.65 3l72 h THR 55 Cb 2.20 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 68.46 3l72 h THR 55 CO 0.70 0.00 -0.41 1.21 0.37 0.00 0.00 175.52 177.40 3l72 n GLU 56 N -4.51 -0.26 -0.19 6.66 2.13 -1.26 0.22 120.64 123.43 3l72 n GLU 56 Ca -0.09 1.46 -0.03 0.00 0.66 0.00 0.00 57.16 59.16 3l72 n GLU 56 Cb 0.33 -2.16 0.17 0.00 0.27 0.00 0.00 31.44 30.06 3l72 n GLU 56 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3l72 h GLU 57 N 0.00 0.95 -0.32 5.31 3.07 -1.87 -1.97 114.58 119.76 3l72 h GLU 57 Ca 0.30 -0.16 -0.00 0.00 -0.50 0.00 0.00 59.36 59.00 3l72 h GLU 57 Cb 0.54 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 3l72 h GLU 57 CO -0.93 0.78 0.18 1.25 -1.40 0.00 0.00 179.01 178.89 3l72 h LEU 58 N 0.93 0.39 -0.22 1.33 5.85 0.12 -2.69 115.31 121.02 3l72 h LEU 58 Ca 0.22 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.88 3l72 h LEU 58 Cb 0.19 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3l72 h LEU 58 CO -0.02 0.34 0.11 -0.26 -0.34 0.00 0.00 178.44 178.28 3l72 h PHE 59 N 0.40 0.21 -0.77 1.25 0.04 -0.44 -0.83 116.94 116.80 3l72 h PHE 59 Ca 0.11 0.01 0.18 0.00 2.80 0.00 0.00 57.97 61.07 3l72 h PHE 59 Cb 0.03 -0.06 -0.13 0.00 2.20 0.00 0.00 35.95 37.99 3l72 h PHE 59 CO -0.04 0.12 0.10 -0.44 -0.60 0.00 0.00 178.31 177.46 3l72 h ASP 60 N 0.24 -0.17 0.63 2.17 3.32 -1.16 0.48 116.42 121.92 3l72 h ASP 60 Ca 0.09 0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 3l72 h ASP 60 Cb 0.02 0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.86 3l72 h ASP 60 CO -0.06 -0.13 -0.30 0.15 -1.72 0.00 0.00 179.24 177.18 3l72 h PHE 61 N 0.17 -0.78 -1.01 4.55 3.57 -1.09 -2.33 116.94 120.01 3l72 h PHE 61 Ca 0.44 -0.02 0.24 0.00 3.53 0.00 0.00 57.97 62.16 3l72 h PHE 61 Cb 0.80 0.26 -0.11 0.00 2.79 0.00 0.00 35.95 39.69 3l72 h PHE 61 CO -0.34 -0.49 0.63 -0.07 -2.23 0.00 0.00 178.31 175.81 3l72 h LEU 62 N -0.97 0.61 0.35 0.59 3.38 -0.57 0.41 115.31 119.11 3l72 h LEU 62 Ca -0.09 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3l72 h LEU 62 Cb 0.65 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3l72 h LEU 62 CO 0.14 0.14 -0.17 -0.74 0.09 0.00 0.00 178.44 177.90 3l72 h HIS 63 N 0.55 -0.44 0.06 1.13 2.76 -0.01 0.28 115.15 119.48 3l72 h HIS 63 Ca 0.61 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.76 3l72 h HIS 63 Cb 1.25 0.15 0.00 0.00 1.55 0.00 0.00 27.41 30.36 3l72 h HIS 63 CO -0.00 -0.24 -0.03 0.00 -1.30 0.00 0.00 177.93 176.35 3l72 h ALA 64 N 0.11 -0.08 0.79 5.26 0.00 -0.43 0.35 119.26 125.27 3l72 h ALA 64 Ca -0.05 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 3l72 h ALA 64 Cb 0.39 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3l72 h ALA 64 CO 0.08 -0.47 -0.46 -0.09 0.00 0.00 0.00 179.25 178.31 3l72 h ARG 65 N -0.23 -1.13 -0.86 0.00 2.43 -0.26 -1.69 114.38 112.65 3l72 h ARG 65 Ca -0.01 0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.26 3l72 h ARG 65 Cb 0.20 0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 29.96 3l72 h ARG 65 CO 0.01 -0.75 0.57 -0.44 -1.51 0.00 0.00 179.97 177.85 3l72 h ASP 66 N -1.17 0.96 -0.40 -3.80 3.45 -0.47 0.17 116.42 115.15 3l72 h ASP 66 Ca -0.11 -0.02 0.04 0.00 0.43 0.00 0.00 57.03 57.37 3l72 h ASP 66 Cb 0.93 -0.23 -0.04 0.00 -0.56 0.00 0.00 39.33 39.43 3l72 h ASP 66 CO 0.12 0.68 0.18 -0.74 -1.57 0.00 0.00 179.24 177.91 3l72 h HIS 67 N 1.12 0.33 0.18 4.55 2.76 -0.15 -2.21 115.15 121.73 3l72 h HIS 67 Ca 0.33 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.51 3l72 h HIS 67 Cb -0.06 -0.09 -0.00 0.00 1.55 0.00 0.00 27.41 28.80 3l72 h HIS 67 CO -0.00 0.16 -0.11 0.00 -1.30 0.00 0.00 177.93 176.68 3l72 h VAL 69 N -0.28 0.53 0.51 0.00 2.07 -0.56 -2.08 116.25 116.43 3l72 h VAL 69 Ca -0.02 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3l72 h VAL 69 Cb 0.24 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 3l72 h VAL 69 CO 0.02 0.08 -0.45 0.00 0.02 0.00 0.00 177.57 177.24 3l72 h ALA 70 N 1.64 -1.03 0.00 1.67 0.00 -1.11 0.46 119.26 120.90 3l72 h ALA 70 Ca 0.61 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3l72 h ALA 70 Cb 1.44 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.85 3l72 h ALA 70 CO -0.34 -1.11 0.40 0.45 0.00 0.00 0.00 179.25 178.65 3l72 h HIS 71 N -0.95 0.00 0.00 0.00 3.86 -1.41 -3.32 115.15 113.33 3l72 h HIS 71 Ca -0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3l72 h HIS 71 Cb 0.82 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.29 3l72 h HIS 71 CO -0.20 0.00 0.00 1.63 0.86 0.00 0.00 177.93 180.22 3l72 n LYS 72 N -2.07 0.00 -0.04 2.45 5.02 -0.79 -4.88 118.16 117.85 3l72 n LYS 72 Ca -0.01 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.31 3l72 n LYS 72 Cb 0.42 -0.33 0.06 0.00 -0.02 0.00 0.00 35.03 35.15 3l72 n LYS 72 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3l72 n LEU 73 N -3.36 0.02 0.25 -0.35 7.94 0.16 0.06 117.00 121.70 3l72 n LEU 73 Ca 0.00 0.20 0.16 0.00 -1.11 0.00 0.00 56.01 55.26 3l72 n LEU 73 Cb 0.00 -0.09 0.60 0.00 0.53 0.00 0.00 43.42 44.46 3l72 n LEU 73 CO 0.00 -0.21 0.95 -0.26 -1.11 0.00 0.00 177.39 176.76 3l72 h PHE 74 N 0.00 0.00 -0.22 1.96 0.05 -1.80 -3.06 116.94 113.86 3l72 h PHE 74 Ca 0.09 0.00 -0.14 0.00 3.82 0.00 0.00 57.97 61.74 3l72 h PHE 74 Cb 0.22 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.16 3l72 h PHE 74 CO -0.02 0.00 -0.43 -0.91 -0.18 0.00 0.00 178.31 176.77 3l72 h ASN 75 N 0.00 0.58 0.81 2.17 2.35 -0.73 -2.84 115.58 117.91 3l72 h ASN 75 Ca 0.00 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 3l72 h ASN 75 Cb 0.55 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.76 3l72 h ASN 75 CO 0.00 0.93 -0.15 0.29 -1.65 0.00 0.00 177.43 176.85 3l72 n LYS 76 N -4.02 0.05 -3.58 0.81 5.02 -1.16 -4.84 118.16 110.44 3l72 n LYS 76 Ca -0.02 -0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.93 3l72 n LYS 76 Cb 0.53 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 3l72 n LYS 76 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3l72 s LEU 77 N -2.96 4.29 0.00 -0.35 1.43 -1.07 -4.99 118.68 115.03 3l72 s LEU 77 Ca 0.14 0.74 0.27 0.00 -1.03 0.00 0.00 54.13 54.26 3l72 s LEU 77 Cb 0.19 -3.21 0.86 0.00 0.03 0.00 0.00 46.19 44.05 3l72 s LEU 77 CO 0.57 0.09 1.64 1.17 0.23 0.00 0.00 176.35 180.05