#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lr1 h GLU 2 N 0.00 0.00 0.00 4.33 4.81 -2.03 -2.29 114.58 119.40 1lr1 h GLU 2 Ca 0.00 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 1lr1 h GLU 2 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1lr1 h GLU 2 CO 0.00 0.60 -0.86 0.00 -0.73 0.00 0.00 179.01 178.02 1lr1 h ALA 3 N 1.32 0.52 0.10 2.92 0.00 -2.01 0.41 119.26 122.51 1lr1 h ALA 3 Ca -0.05 -0.75 -0.28 0.00 0.00 0.00 0.00 54.91 53.82 1lr1 h ALA 3 Cb 1.57 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1lr1 h ALA 3 CO 0.08 1.00 -1.38 -0.07 0.00 0.00 0.00 179.25 178.89 1lr1 h LEU 4 N 0.00 0.32 0.00 0.00 -0.00 -2.00 -3.32 115.31 110.31 1lr1 h LEU 4 Ca -0.03 -0.40 -0.20 0.00 -0.00 0.00 0.00 57.88 57.25 1lr1 h LEU 4 Cb 1.62 -0.10 -0.03 0.00 -0.00 0.00 0.00 40.66 42.14 1lr1 h LEU 4 CO 0.10 1.32 -1.22 0.50 -0.00 0.00 0.00 178.44 179.14 1lr1 h LYS 5 N 0.06 0.00 -0.59 1.13 3.11 -1.45 0.22 116.57 119.05 1lr1 h LYS 5 Ca -0.18 0.00 0.10 0.00 -2.81 0.00 0.00 60.65 57.76 1lr1 h LYS 5 Cb 1.97 0.00 -0.08 0.00 -1.00 0.00 0.00 32.23 33.12 1lr1 h LYS 5 CO 0.16 0.54 0.17 0.97 -2.81 0.00 0.00 179.45 178.49 1lr1 h ILE 6 N 0.00 0.71 -0.01 2.00 2.10 -0.27 -1.57 117.51 120.48 1lr1 h ILE 6 Ca -0.13 -0.11 0.00 0.00 1.08 0.00 0.00 64.86 65.70 1lr1 h ILE 6 Cb 1.70 0.36 0.00 0.00 -1.09 0.00 0.00 36.82 37.79 1lr1 h ILE 6 CO 0.08 0.06 -0.51 0.00 -1.08 0.00 0.00 178.15 176.70 1lr1 n LEU 7 N -5.06 1.27 -2.51 2.19 -0.00 -1.25 -4.91 117.00 106.73 1lr1 n LEU 7 Ca 0.08 -0.65 -0.21 0.00 -0.00 0.00 0.00 56.01 55.23 1lr1 n LEU 7 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.72 1lr1 n LEU 7 CO 0.20 0.26 -0.19 -3.20 -0.00 0.00 0.00 177.39 174.46 1lr1 n ASN 8 N -0.64 -5.89 -1.60 1.45 2.85 0.31 -4.53 115.26 107.22 1lr1 n ASN 8 Ca 0.05 -0.09 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 1lr1 n ASN 8 Cb 0.30 -4.84 0.00 0.00 1.24 0.00 0.00 39.78 36.48 1lr1 n ASN 8 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1lr1 n ASN 9 N -2.05 -8.42 0.27 1.20 5.03 0.52 -4.34 115.26 107.46 1lr1 n ASN 9 Ca -0.21 1.16 0.18 0.00 0.87 0.00 0.00 54.58 56.58 1lr1 n ASN 9 Cb 0.67 -4.22 0.93 0.00 -1.02 0.00 0.00 39.78 36.14 1lr1 n ASN 9 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.26 175.59 1lr1 h ILE 10 N 2.56 0.29 0.16 2.41 -2.65 -1.91 -2.83 117.51 115.53 1lr1 h ILE 10 Ca 0.00 0.00 0.01 0.00 1.03 0.00 0.00 64.86 65.90 1lr1 h ILE 10 Cb 0.00 0.87 -0.02 0.00 -2.05 0.00 0.00 36.82 35.61 1lr1 h ILE 10 CO 0.00 0.00 -0.21 0.08 0.03 0.00 0.00 178.15 178.05 1lr1 h ARG 11 N 0.00 -0.41 -0.00 0.16 0.11 -1.94 0.75 114.38 113.04 1lr1 h ARG 11 Ca 0.04 0.03 -0.15 0.00 0.10 0.00 0.00 59.98 60.00 1lr1 h ARG 11 Cb 0.35 0.09 -0.02 0.00 1.11 0.00 0.00 29.97 31.50 1lr1 h ARG 11 CO -0.00 -0.27 -0.72 0.00 0.10 0.00 0.00 179.97 179.07 1lr1 h THR 12 N -0.42 1.51 0.34 0.08 1.03 -1.70 -3.30 112.91 110.45 1lr1 h THR 12 Ca 0.01 -2.46 -0.02 0.00 -0.01 0.00 0.00 66.41 63.94 1lr1 h THR 12 Cb 0.42 2.33 0.00 0.00 -1.07 0.00 0.00 68.15 69.83 1lr1 h THR 12 CO -0.09 0.70 -0.16 0.25 -0.01 0.00 0.00 175.52 176.21 1lr1 h LEU 13 N 0.01 -0.38 -1.87 0.00 5.85 -1.26 0.41 115.31 118.07 1lr1 h LEU 13 Ca -0.01 -0.05 0.30 0.00 0.84 0.00 0.00 57.88 58.97 1lr1 h LEU 13 Cb 1.28 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.37 1lr1 h LEU 13 CO 0.10 -0.20 0.84 -0.09 -0.34 0.00 0.00 178.44 178.75 1lr1 h ARG 14 N -0.55 0.00 0.00 1.25 9.65 -0.93 0.67 114.38 124.47 1lr1 h ARG 14 Ca -0.05 0.00 -0.17 0.00 -1.10 0.00 0.00 59.98 58.67 1lr1 h ARG 14 Cb 0.41 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.96 1lr1 h ARG 14 CO 0.08 0.00 -0.96 0.00 2.80 0.00 0.00 179.97 181.88 1lr1 h ALA 15 N 1.30 0.19 -0.30 2.80 0.00 -1.57 -2.08 119.26 119.60 1lr1 h ALA 15 Ca 0.49 -1.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.36 1lr1 h ALA 15 Cb 2.16 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 20.53 1lr1 h ALA 15 CO -0.01 0.56 0.00 -0.56 0.00 0.00 0.00 179.25 179.25 1lr1 h GLN 16 N -1.00 0.45 0.00 0.00 3.07 0.10 -1.58 115.11 116.15 1lr1 h GLN 16 Ca -0.25 -0.09 -0.01 0.00 0.09 0.00 0.00 58.65 58.39 1lr1 h GLN 16 Cb 1.14 -0.07 -0.00 0.00 0.08 0.00 0.00 27.48 28.62 1lr1 h GLN 16 CO -0.15 0.47 -0.66 0.00 0.09 0.00 0.00 178.83 178.58 1lr1 h ALA 17 N 1.58 0.69 -1.47 0.06 0.00 0.13 -3.33 119.26 116.92 1lr1 h ALA 17 Ca 0.10 -0.06 0.42 0.00 0.00 0.00 0.00 54.91 55.37 1lr1 h ALA 17 Cb 0.28 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 1lr1 h ALA 17 CO 0.01 0.07 1.11 -0.09 0.00 0.00 0.00 179.25 180.35 1lr1 h ARG 18 N 0.00 0.00 -0.98 0.00 9.65 -0.54 1.07 114.38 123.58 1lr1 h ARG 18 Ca -0.01 0.00 -0.65 0.00 -1.10 0.00 0.00 59.98 58.22 1lr1 h ARG 18 Cb 1.04 0.00 -0.33 0.00 -1.39 0.00 0.00 29.97 29.30 1lr1 h ARG 18 CO 0.00 0.00 0.45 0.39 2.80 0.00 0.00 179.97 183.61 1lr1 n GLU 19 N -3.96 2.93 0.00 0.20 -0.58 -1.25 -4.96 120.64 113.02 1lr1 n GLU 19 Ca 0.32 -3.53 0.00 0.00 -0.42 0.00 0.00 57.16 53.53 1lr1 n GLU 19 Cb 1.57 -2.29 0.00 0.00 -0.57 0.00 0.00 31.44 30.15 1lr1 n GLU 19 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1lr1 n SER 20 N -0.85 1.80 -4.38 1.62 7.64 0.37 -5.14 113.62 114.67 1lr1 n SER 20 Ca 0.58 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 60.26 1lr1 n SER 20 Cb 0.72 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.82 1lr1 n SER 20 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1lr1 s THR 21 N -0.60 1.65 -0.07 0.44 2.01 -1.26 -5.01 115.64 112.80 1lr1 s THR 21 Ca 0.00 -2.16 0.18 0.00 0.31 0.00 0.00 61.69 60.02 1lr1 s THR 21 Cb 0.00 -2.26 0.18 0.00 0.01 0.00 0.00 72.50 70.43 1lr1 s THR 21 CO 0.00 -0.43 1.51 0.17 -0.69 0.00 0.00 174.62 175.18 1lr1 h LEU 22 N 2.42 0.00 -1.56 4.42 -0.00 -2.03 -2.83 115.31 115.73 1lr1 h LEU 22 Ca -0.39 0.00 0.44 0.00 -0.00 0.00 0.00 57.88 57.94 1lr1 h LEU 22 Cb 1.23 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.83 1lr1 h LEU 22 CO 0.65 0.00 1.33 -0.08 -0.00 0.00 0.00 178.44 180.33 1lr1 h GLU 23 N 0.00 0.00 -0.80 0.17 4.57 -2.00 1.22 114.58 117.74 1lr1 h GLU 23 Ca 0.00 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.25 1lr1 h GLU 23 Cb 0.29 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.81 1lr1 h GLU 23 CO 0.00 0.00 0.48 0.00 -1.18 0.00 0.00 179.01 178.31 1lr1 h THR 24 N 0.00 0.99 -0.43 0.32 1.03 -1.94 -0.98 112.91 111.90 1lr1 h THR 24 Ca 0.73 -0.29 -0.09 0.00 -0.01 0.00 0.00 66.41 66.75 1lr1 h THR 24 Cb 3.37 0.06 -0.01 0.00 -1.07 0.00 0.00 68.15 70.50 1lr1 h THR 24 CO -0.01 0.16 -0.07 0.17 -0.01 0.00 0.00 175.52 175.76 1lr1 h LEU 25 N 0.85 0.81 -2.16 0.00 8.10 0.12 0.37 115.31 123.40 1lr1 h LEU 25 Ca 0.36 -0.35 0.07 0.00 0.11 0.00 0.00 57.88 58.07 1lr1 h LEU 25 Cb 0.22 -0.22 -0.01 0.00 -0.44 0.00 0.00 40.66 40.22 1lr1 h LEU 25 CO -0.19 0.96 0.24 -0.08 -4.11 0.00 0.00 178.44 175.25 1lr1 h GLU 26 N 0.64 0.00 0.00 0.17 4.22 -1.27 3.65 114.58 121.99 1lr1 h GLU 26 Ca 0.11 0.00 -0.08 0.00 0.08 0.00 0.00 59.36 59.48 1lr1 h GLU 26 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1lr1 h GLU 26 CO 0.04 0.00 -0.45 1.49 -2.18 0.00 0.00 179.01 177.91 1lr1 h GLU 27 N 0.00 0.00 0.02 1.92 4.81 -0.17 -3.30 114.58 117.86 1lr1 h GLU 27 Ca 0.11 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.10 1lr1 h GLU 27 Cb 0.58 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 1lr1 h GLU 27 CO -0.00 0.82 -1.33 0.52 -0.73 0.00 0.00 179.01 178.29 1lr1 h MET 28 N -1.00 0.04 0.00 1.92 2.86 0.55 -3.33 114.93 115.97 1lr1 h MET 28 Ca -0.11 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1lr1 h MET 28 Cb 0.95 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.64 1lr1 h MET 28 CO -0.07 1.03 -0.02 1.25 1.06 0.00 0.00 176.91 180.16 1lr1 h LEU 29 N -0.84 0.00 -0.17 1.22 5.85 0.67 0.55 115.31 122.59 1lr1 h LEU 29 Ca -0.35 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.16 1lr1 h LEU 29 Cb 1.40 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.42 1lr1 h LEU 29 CO -0.16 0.02 -0.96 -0.08 -0.34 0.00 0.00 178.44 176.92 1lr1 h GLU 30 N 0.00 0.18 0.02 1.25 4.57 -1.27 -2.71 114.58 116.62 1lr1 h GLU 30 Ca -0.00 -0.23 -0.28 0.00 -1.18 0.00 0.00 59.36 57.67 1lr1 h GLU 30 Cb 0.05 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.68 1lr1 h GLU 30 CO 0.00 1.00 -1.54 0.87 -1.18 0.00 0.00 179.01 178.17 1lr1 h LYS 31 N 0.09 0.05 0.00 1.92 1.79 -1.36 -2.81 116.57 116.25 1lr1 h LYS 31 Ca -0.05 -0.09 -0.03 0.00 -2.18 0.00 0.00 60.65 58.29 1lr1 h LYS 31 Cb 1.62 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 32.30 1lr1 h LYS 31 CO 0.15 0.74 -0.16 1.25 -1.08 0.00 0.00 179.45 180.35 1lr1 h LEU 32 N 0.01 0.00 0.13 2.94 5.85 0.00 0.21 115.31 124.46 1lr1 h LEU 32 Ca -0.22 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.18 1lr1 h LEU 32 Cb 1.96 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.99 1lr1 h LEU 32 CO 0.10 0.16 -1.62 1.05 -0.34 0.00 0.00 178.44 177.80 1lr1 h GLU 33 N 0.00 0.28 -0.30 1.25 -0.00 -1.53 -3.28 114.58 111.01 1lr1 h GLU 33 Ca -0.00 -0.48 -0.07 0.00 -0.00 0.00 0.00 59.36 58.81 1lr1 h GLU 33 Cb 0.48 0.18 -0.02 0.00 -0.00 0.00 0.00 28.75 29.39 1lr1 h GLU 33 CO 0.02 1.23 -0.10 -0.39 -0.00 0.00 0.00 179.01 179.77 1lr1 h VAL 34 N -0.15 1.22 -0.14 -1.06 -1.51 -1.24 0.61 116.25 113.99 1lr1 h VAL 34 Ca -0.34 -0.97 0.03 0.00 -1.23 0.00 0.00 66.70 64.19 1lr1 h VAL 34 Cb 1.89 1.11 -0.03 0.00 -2.13 0.00 0.00 31.29 32.13 1lr1 h VAL 34 CO 0.09 0.32 -0.06 1.62 -1.23 0.00 0.00 177.57 178.30 1lr1 h VAL 35 N 0.46 0.79 -0.01 7.19 3.04 -0.72 -1.24 116.25 125.77 1lr1 h VAL 35 Ca 0.09 0.00 -0.15 0.00 -1.01 0.00 0.00 66.70 65.63 1lr1 h VAL 35 Cb 0.46 0.79 -0.02 0.00 -2.01 0.00 0.00 31.29 30.52 1lr1 h VAL 35 CO 0.03 0.00 -0.69 -0.37 -1.01 0.00 0.00 177.57 175.53 1lr1 h VAL 36 N -0.05 1.48 -0.96 1.51 -1.51 -1.52 -3.05 116.25 112.16 1lr1 h VAL 36 Ca 0.08 -2.33 0.24 0.00 -1.23 0.00 0.00 66.70 63.45 1lr1 h VAL 36 Cb 0.16 2.26 -0.13 0.00 -2.13 0.00 0.00 31.29 31.45 1lr1 h VAL 36 CO -0.17 0.67 0.50 -1.13 -1.23 0.00 0.00 177.57 176.21 1lr1 h ASN 37 N 0.02 0.52 -0.07 4.19 -1.24 0.14 2.94 115.58 122.07 1lr1 h ASN 37 Ca -0.01 0.15 -0.10 0.00 0.71 0.00 0.00 56.30 57.05 1lr1 h ASN 37 Cb 1.22 0.08 -0.01 0.00 0.73 0.00 0.00 38.32 40.34 1lr1 h ASN 37 CO 0.09 0.05 -0.27 -0.33 -1.29 0.00 0.00 177.43 175.68 1lr1 h GLU 38 N 0.49 0.51 0.00 6.67 5.08 -1.26 -2.75 114.58 123.32 1lr1 h GLU 38 Ca 0.61 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.68 1lr1 h GLU 38 Cb 1.17 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.40 1lr1 h GLU 38 CO -0.50 0.73 -0.35 0.00 -1.00 0.00 0.00 179.01 177.89 1lr1 h ARG 39 N 0.45 0.23 -0.97 2.33 -0.00 0.24 0.40 114.38 117.05 1lr1 h ARG 39 Ca 0.06 -0.25 0.21 0.00 -0.50 0.00 0.00 59.98 59.50 1lr1 h ARG 39 Cb 0.70 0.07 -0.09 0.00 0.00 0.00 0.00 29.97 30.66 1lr1 h ARG 39 CO 0.05 0.98 0.62 0.00 0.00 0.00 0.00 179.97 181.62 1lr1 h ARG 40 N -0.41 0.53 0.06 0.04 2.47 0.45 2.58 114.38 120.09 1lr1 h ARG 40 Ca -0.05 -0.03 -0.25 0.00 -1.26 0.00 0.00 59.98 58.40 1lr1 h ARG 40 Cb 1.11 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 29.29 1lr1 h ARG 40 CO 0.07 0.35 -1.31 0.93 0.56 0.00 0.00 179.97 180.57 1lr1 h GLU 41 N 0.55 0.13 0.07 0.04 4.39 -1.52 -3.35 114.58 114.89 1lr1 h GLU 41 Ca 0.53 -0.22 -0.27 0.00 0.34 0.00 0.00 59.36 59.74 1lr1 h GLU 41 Cb 1.13 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 1lr1 h GLU 41 CO -0.27 1.11 -1.46 0.93 -1.16 0.00 0.00 179.01 178.15 1lr1 h GLU 42 N -0.58 0.16 -0.44 2.33 5.08 0.40 -3.22 114.58 118.30 1lr1 h GLU 42 Ca -0.31 -0.27 0.08 0.00 -1.00 0.00 0.00 59.36 57.85 1lr1 h GLU 42 Cb 1.56 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.84 1lr1 h GLU 42 CO -0.05 1.13 0.05 1.49 -1.00 0.00 0.00 179.01 180.64 1lr1 h GLU 43 N -0.47 0.17 -0.69 2.33 4.22 0.44 0.36 114.58 120.94 1lr1 h GLU 43 Ca -0.34 -0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.10 1lr1 h GLU 43 Cb 1.65 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.83 1lr1 h GLU 43 CO -0.03 0.11 0.46 0.66 -2.18 0.00 0.00 179.01 178.03 1lr1 h SER 44 N 0.17 0.77 -0.75 1.04 4.64 -1.57 -0.65 113.55 117.21 1lr1 h SER 44 Ca 0.22 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 1lr1 h SER 44 Cb 0.29 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.16 1lr1 h SER 44 CO -0.31 0.55 0.44 0.00 -0.87 0.00 0.00 176.83 176.64 1lr1 h ALA 45 N 1.58 0.95 -0.42 5.18 0.00 -0.58 -0.90 119.26 125.07 1lr1 h ALA 45 Ca 0.26 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1lr1 h ALA 45 Cb -0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 1lr1 h ALA 45 CO -0.06 0.43 0.26 0.00 0.00 0.00 0.00 179.25 179.88 1lr1 h ALA 46 N 1.23 0.54 -0.83 0.00 0.00 0.10 -2.11 119.26 118.19 1lr1 h ALA 46 Ca 0.27 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1lr1 h ALA 46 Cb -0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1lr1 h ALA 46 CO -0.05 0.02 0.52 0.00 0.00 0.00 0.00 179.25 179.74 1lr1 h ALA 47 N 1.12 1.35 -0.74 0.00 0.00 -0.89 -1.30 119.26 118.79 1lr1 h ALA 47 Ca 0.15 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1lr1 h ALA 47 Cb -0.01 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 1lr1 h ALA 47 CO -0.03 0.58 0.46 0.00 0.00 0.00 0.00 179.25 180.26 1lr1 h ALA 48 N 1.43 0.98 -0.50 0.00 0.00 -0.54 -1.49 119.26 119.14 1lr1 h ALA 48 Ca 0.30 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.10 1lr1 h ALA 48 Cb -0.07 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1lr1 h ALA 48 CO -0.06 0.24 -0.05 0.93 0.00 0.00 0.00 179.25 180.31 1lr1 h GLU 49 N 0.90 0.88 -1.02 0.00 4.39 -0.79 -2.95 114.58 115.99 1lr1 h GLU 49 Ca 0.30 -0.28 0.25 0.00 0.34 0.00 0.00 59.36 59.97 1lr1 h GLU 49 Cb 0.04 -0.08 -0.11 0.00 -0.10 0.00 0.00 28.75 28.50 1lr1 h GLU 49 CO -0.12 0.91 0.62 0.28 -1.16 0.00 0.00 179.01 179.54 1lr1 h VAL 50 N 0.80 0.54 -3.15 3.13 2.07 -0.17 -3.41 116.25 116.07 1lr1 h VAL 50 Ca 0.14 -0.19 -0.17 0.00 0.82 0.00 0.00 66.70 67.30 1lr1 h VAL 50 Cb 0.55 -0.05 -0.27 0.00 -1.52 0.00 0.00 31.29 30.01 1lr1 h VAL 50 CO 0.03 0.10 -0.46 -1.61 0.02 0.00 0.00 177.57 175.66 1lr1 s GLU 51 N -5.70 0.26 -0.31 1.57 2.02 -1.11 -5.06 118.70 110.36 1lr1 s GLU 51 Ca -0.10 0.36 0.17 0.00 0.02 0.00 0.00 54.97 55.43 1lr1 s GLU 51 Cb 0.27 0.08 0.46 0.00 0.10 0.00 0.00 34.13 35.03 1lr1 s GLU 51 CO 0.80 -0.06 1.18 0.39 0.02 0.00 0.00 175.26 177.59 1lr1 n GLU 52 N 3.22 1.40 -3.72 1.61 -0.58 -1.26 -4.72 120.64 116.58 1lr1 n GLU 52 Ca -0.15 -2.75 -0.28 0.00 -0.42 0.00 0.00 57.16 53.56 1lr1 n GLU 52 Cb 0.57 -0.88 0.04 0.00 -0.57 0.00 0.00 31.44 30.60 1lr1 n GLU 52 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1lr1 n ARG 53 N -0.61 -5.99 -3.70 3.49 5.12 -1.26 -4.97 116.66 108.74 1lr1 n ARG 53 Ca 0.01 0.68 -0.11 0.00 -1.93 0.00 0.00 57.85 56.50 1lr1 n ARG 53 Cb 0.83 -5.60 -0.10 0.00 -1.16 0.00 0.00 32.46 26.43 1lr1 n ARG 53 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1lr1 s THR 54 N -3.27 -0.01 0.16 0.55 -4.23 -1.26 -5.14 115.64 102.44 1lr1 s THR 54 Ca 0.60 0.05 -0.31 0.00 -1.18 0.00 0.00 61.69 60.86 1lr1 s THR 54 Cb -0.29 -0.65 -0.08 0.00 1.34 0.00 0.00 72.50 72.81 1lr1 s THR 54 CO 0.74 0.02 1.36 -0.13 -0.54 0.00 0.00 174.62 176.07 1lr1 s ARG 55 N 1.05 4.35 -0.22 3.99 3.00 -1.26 -4.86 118.95 124.99 1lr1 s ARG 55 Ca -0.07 2.08 0.02 0.00 0.00 0.00 0.00 55.73 57.77 1lr1 s ARG 55 Cb -0.06 -3.21 0.08 0.00 0.00 0.00 0.00 34.95 31.75 1lr1 s ARG 55 CO -0.09 -0.35 0.93 1.17 0.00 0.00 0.00 175.30 176.95 1lr1 n LYS 56 N 3.23 0.25 0.00 3.54 3.00 -1.26 -5.16 118.16 121.77 1lr1 n LYS 56 Ca 0.09 -0.56 0.00 0.00 -0.00 0.00 0.00 58.31 57.84 1lr1 n LYS 56 Cb 0.42 0.03 0.00 0.00 0.00 0.00 0.00 35.03 35.48 1lr1 n LYS 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68