#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 -1.46 4.39 -2.03 -2.24 114.58 113.24 1lr1 h GLU 2 Ca 0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 1lr1 h GLU 2 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1lr1 h GLU 2 CO 0.00 0.40 -0.25 0.00 -1.16 0.00 0.00 179.01 178.00 1lr1 h ALA 3 N 1.60 1.20 0.06 3.43 0.00 -1.99 1.08 119.26 124.65 1lr1 h ALA 3 Ca -0.00 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.48 1lr1 h ALA 3 Cb 0.90 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1lr1 h ALA 3 CO 0.05 0.32 -1.00 -0.07 0.00 0.00 0.00 179.25 178.55 1lr1 h LEU 4 N 0.00 0.20 0.00 0.00 4.07 -1.93 -3.37 115.31 114.27 1lr1 h LEU 4 Ca -0.00 -0.81 -0.07 0.00 0.08 0.00 0.00 57.88 57.08 1lr1 h LEU 4 Cb 0.60 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.27 1lr1 h LEU 4 CO 0.03 1.42 -0.37 0.50 -1.08 0.00 0.00 178.44 178.95 1lr1 h LYS 5 N -0.65 0.00 -0.10 1.13 1.63 -1.32 0.25 116.57 117.50 1lr1 h LYS 5 Ca -0.23 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.61 1lr1 h LYS 5 Cb 1.46 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 33.04 1lr1 h LYS 5 CO -0.02 0.33 -0.16 0.97 -3.45 0.00 0.00 179.45 177.13 1lr1 h ILE 6 N 0.00 0.59 0.00 2.00 2.10 0.11 -2.54 117.51 119.77 1lr1 h ILE 6 Ca -0.01 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.93 1lr1 h ILE 6 Cb 1.26 0.59 0.00 0.00 -1.09 0.00 0.00 36.82 37.59 1lr1 h ILE 6 CO 0.04 0.00 -1.03 0.00 -1.08 0.00 0.00 178.15 176.08 1lr1 n LEU 7 N -5.30 0.96 -1.93 2.19 -0.00 -1.25 -4.90 117.00 106.77 1lr1 n LEU 7 Ca -0.03 -0.47 -0.16 0.00 -0.00 0.00 0.00 56.01 55.34 1lr1 n LEU 7 Cb 0.21 -0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.63 1lr1 n LEU 7 CO 0.22 0.24 -0.16 0.59 -0.00 0.00 0.00 177.39 178.28 1lr1 n ASN 8 N -1.53 -4.81 -1.82 1.45 4.13 0.63 -4.51 115.26 108.81 1lr1 n ASN 8 Ca 0.04 -0.06 0.00 0.00 1.68 0.00 0.00 54.58 56.24 1lr1 n ASN 8 Cb 0.34 -3.88 0.00 0.00 -1.54 0.00 0.00 39.78 34.70 1lr1 n ASN 8 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1lr1 n ASN 9 N -1.14 -9.05 -0.09 6.41 5.03 0.15 -4.09 115.26 112.49 1lr1 n ASN 9 Ca -0.17 1.29 0.23 0.00 0.87 0.00 0.00 54.58 56.80 1lr1 n ASN 9 Cb 0.63 -4.79 0.68 0.00 -1.02 0.00 0.00 39.78 35.28 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 3.11 0.66 -0.68 2.41 -2.65 -1.91 -0.33 117.51 118.12 1lr1 h ILE 10 Ca 0.00 -0.02 0.11 0.00 1.03 0.00 0.00 64.86 65.98 1lr1 h ILE 10 Cb 0.00 0.62 -0.08 0.00 -2.05 0.00 0.00 36.82 35.31 1lr1 h ILE 10 CO 0.00 0.01 0.29 0.08 0.03 0.00 0.00 178.15 178.55 1lr1 h ARG 11 N 0.04 0.46 0.14 0.16 0.11 -1.95 0.41 114.38 113.75 1lr1 h ARG 11 Ca 0.34 -0.03 -0.35 0.00 0.10 0.00 0.00 59.98 60.04 1lr1 h ARG 11 Cb 1.28 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 32.25 1lr1 h ARG 11 CO -0.02 0.31 -1.85 1.15 0.10 0.00 0.00 179.97 179.66 1lr1 h THR 12 N 0.48 0.79 0.47 0.08 2.02 -1.35 -3.37 112.91 112.03 1lr1 h THR 12 Ca 0.35 -2.47 -0.02 0.00 0.77 0.00 0.00 66.41 65.03 1lr1 h THR 12 Cb 0.44 2.61 0.00 0.00 -1.74 0.00 0.00 68.15 69.47 1lr1 h THR 12 CO -0.32 0.85 -0.23 0.25 0.37 0.00 0.00 175.52 176.44 1lr1 h LEU 13 N 0.08 -0.53 -1.90 2.58 6.46 -0.88 -1.08 115.31 120.03 1lr1 h LEU 13 Ca -0.37 -0.08 0.41 0.00 -0.12 0.00 0.00 57.88 57.72 1lr1 h LEU 13 Cb 2.05 0.14 -0.07 0.00 -0.73 0.00 0.00 40.66 42.06 1lr1 h LEU 13 CO 0.13 -0.18 1.00 -0.09 -0.62 0.00 0.00 178.44 178.68 1lr1 h ARG 14 N -0.94 0.04 0.00 1.25 2.43 -0.40 0.64 114.38 117.40 1lr1 h ARG 14 Ca -0.06 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.98 1lr1 h ARG 14 Cb 0.59 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 1lr1 h ARG 14 CO 0.11 0.02 -0.78 0.00 -1.51 0.00 0.00 179.97 177.81 1lr1 h ALA 15 N 1.33 0.14 -0.45 2.80 0.00 -1.70 -2.07 119.26 119.31 1lr1 h ALA 15 Ca 0.69 -0.84 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1lr1 h ALA 15 Cb 2.66 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 20.93 1lr1 h ALA 15 CO -0.06 0.48 0.22 -0.56 0.00 0.00 0.00 179.25 179.33 1lr1 h GLN 16 N -1.00 0.62 0.00 0.00 3.07 -0.30 -1.63 115.11 115.87 1lr1 h GLN 16 Ca -0.19 -0.07 -0.02 0.00 0.09 0.00 0.00 58.65 58.46 1lr1 h GLN 16 Cb 0.98 -0.12 -0.00 0.00 0.08 0.00 0.00 27.48 28.41 1lr1 h GLN 16 CO -0.11 0.48 -0.73 0.00 0.09 0.00 0.00 178.83 178.56 1lr1 h ALA 17 N 1.62 0.67 -0.94 0.06 0.00 0.07 -3.33 119.26 117.41 1lr1 h ALA 17 Ca 0.16 -0.12 0.24 0.00 0.00 0.00 0.00 54.91 55.19 1lr1 h ALA 17 Cb 0.06 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1lr1 h ALA 17 CO -0.02 0.13 0.64 -0.09 0.00 0.00 0.00 179.25 179.91 1lr1 h ARG 18 N 0.00 0.25 -0.25 0.00 2.43 -0.54 0.46 114.38 116.73 1lr1 h ARG 18 Ca -0.02 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 1lr1 h ARG 18 Cb 1.08 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 1lr1 h ARG 18 CO 0.01 0.16 -0.12 1.05 -1.51 0.00 0.00 179.97 179.56 1lr1 h GLU 19 N 0.26 0.42 0.00 0.20 4.11 -1.67 -3.44 114.58 114.45 1lr1 h GLU 19 Ca 0.48 -0.11 0.00 0.00 0.07 0.00 0.00 59.36 59.80 1lr1 h GLU 19 Cb 1.45 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.65 1lr1 h GLU 19 CO -0.14 0.54 0.00 -1.13 0.07 0.00 0.00 179.01 178.36 1lr1 n SER 20 N -4.22 0.00 -4.79 3.06 3.41 0.16 -5.13 113.62 106.10 1lr1 n SER 20 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 1lr1 n SER 20 Cb 0.30 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.20 1lr1 n SER 20 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1lr1 s THR 21 N 3.38 3.17 -0.01 6.66 2.01 -1.25 -4.99 115.64 124.60 1lr1 s THR 21 Ca 0.00 -1.54 0.25 0.00 0.31 0.00 0.00 61.69 60.70 1lr1 s THR 21 Cb 0.00 -3.06 0.25 0.00 0.01 0.00 0.00 72.50 69.69 1lr1 s THR 21 CO 0.00 -0.16 1.74 0.17 -0.69 0.00 0.00 174.62 175.68 1lr1 h LEU 22 N 1.39 0.00 -1.46 4.42 -0.00 -1.97 -2.74 115.31 114.96 1lr1 h LEU 22 Ca -0.44 0.00 0.39 0.00 -0.00 0.00 0.00 57.88 57.83 1lr1 h LEU 22 Cb 1.25 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.86 1lr1 h LEU 22 CO 0.61 0.00 1.24 1.05 -0.00 0.00 0.00 178.44 181.34 1lr1 h GLU 23 N 0.00 0.00 -0.80 0.17 4.11 -1.96 1.17 114.58 117.27 1lr1 h GLU 23 Ca 0.00 0.00 0.13 0.00 0.07 0.00 0.00 59.36 59.56 1lr1 h GLU 23 Cb 0.09 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.25 1lr1 h GLU 23 CO 0.00 0.00 0.40 0.00 0.07 0.00 0.00 179.01 179.48 1lr1 h THR 24 N 0.00 0.77 -0.25 -1.06 1.03 -1.88 0.03 112.91 111.56 1lr1 h THR 24 Ca 0.64 -0.21 -0.04 0.00 -0.01 0.00 0.00 66.41 66.78 1lr1 h THR 24 Cb 3.11 0.10 -0.01 0.00 -1.07 0.00 0.00 68.15 70.28 1lr1 h THR 24 CO -0.01 0.11 -0.01 0.17 -0.01 0.00 0.00 175.52 175.78 1lr1 h LEU 25 N 0.62 0.44 -2.07 0.00 8.10 0.11 0.25 115.31 122.76 1lr1 h LEU 25 Ca 0.42 -0.32 0.10 0.00 0.11 0.00 0.00 57.88 58.19 1lr1 h LEU 25 Cb 0.54 -0.12 -0.01 0.00 -0.44 0.00 0.00 40.66 40.63 1lr1 h LEU 25 CO -0.33 0.66 0.34 -0.08 -4.11 0.00 0.00 178.44 174.91 1lr1 h GLU 26 N 0.22 0.00 0.00 0.17 4.22 -1.21 3.99 114.58 121.97 1lr1 h GLU 26 Ca 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.49 1lr1 h GLU 26 Cb 0.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1lr1 h GLU 26 CO 0.02 0.00 -0.12 1.49 -2.18 0.00 0.00 179.01 178.21 1lr1 h GLU 27 N 0.00 0.00 0.04 1.92 4.81 -0.14 -3.29 114.58 117.93 1lr1 h GLU 27 Ca 0.17 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 59.13 1lr1 h GLU 27 Cb 0.84 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.19 1lr1 h GLU 27 CO -0.00 0.64 -1.43 0.52 -0.73 0.00 0.00 179.01 178.01 1lr1 h MET 28 N -1.00 0.08 -0.91 1.92 2.86 0.45 -3.35 114.93 114.98 1lr1 h MET 28 Ca -0.03 -0.14 0.11 0.00 -2.06 0.00 0.00 59.70 57.58 1lr1 h MET 28 Cb 0.68 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.32 1lr1 h MET 28 CO -0.02 1.07 0.54 1.25 1.06 0.00 0.00 176.91 180.81 1lr1 h LEU 29 N -0.68 0.77 -1.81 1.22 5.85 0.75 0.61 115.31 122.02 1lr1 h LEU 29 Ca -0.36 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 1lr1 h LEU 29 Cb 1.51 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.45 1lr1 h LEU 29 CO -0.11 0.41 -0.05 -0.08 -0.34 0.00 0.00 178.44 178.27 1lr1 h GLU 30 N 0.86 0.06 0.01 1.25 4.81 -1.41 -0.05 114.58 120.11 1lr1 h GLU 30 Ca 0.45 -0.01 -0.27 0.00 -0.13 0.00 0.00 59.36 59.41 1lr1 h GLU 30 Cb 0.47 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 1lr1 h GLU 30 CO -0.27 0.11 -1.48 0.87 -0.73 0.00 0.00 179.01 177.51 1lr1 h LYS 31 N 0.06 0.03 0.00 1.92 1.79 -0.93 -2.86 116.57 116.58 1lr1 h LYS 31 Ca 0.01 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.39 1lr1 h LYS 31 Cb 0.13 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 1lr1 h LYS 31 CO 0.01 0.72 -0.20 1.25 -1.08 0.00 0.00 179.45 180.15 1lr1 h LEU 32 N 0.01 0.00 0.12 2.94 5.85 0.11 0.11 115.31 124.43 1lr1 h LEU 32 Ca -0.20 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.24 1lr1 h LEU 32 Cb 1.94 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.97 1lr1 h LEU 32 CO 0.10 0.20 -1.46 1.05 -0.34 0.00 0.00 178.44 178.00 1lr1 h GLU 33 N 0.00 0.25 -0.30 1.25 4.11 -1.10 -3.30 114.58 115.48 1lr1 h GLU 33 Ca -0.00 -0.42 -0.05 0.00 0.07 0.00 0.00 59.36 58.96 1lr1 h GLU 33 Cb 0.57 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1lr1 h GLU 33 CO 0.03 1.20 -0.02 -0.39 0.07 0.00 0.00 179.01 179.89 1lr1 h VAL 34 N -0.28 1.19 -0.06 -1.06 -1.51 -1.33 1.03 116.25 114.24 1lr1 h VAL 34 Ca -0.31 -0.78 0.03 0.00 -1.23 0.00 0.00 66.70 64.41 1lr1 h VAL 34 Cb 1.78 0.99 -0.03 0.00 -2.13 0.00 0.00 31.29 31.89 1lr1 h VAL 34 CO 0.06 0.26 -0.13 -0.37 -1.23 0.00 0.00 177.57 176.16 1lr1 h VAL 35 N 0.45 0.65 0.00 7.19 -1.51 -0.92 0.17 116.25 122.29 1lr1 h VAL 35 Ca 0.10 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.56 1lr1 h VAL 35 Cb 0.33 0.65 -0.00 0.00 -2.13 0.00 0.00 31.29 30.15 1lr1 h VAL 35 CO 0.01 0.00 -0.04 -0.37 -1.23 0.00 0.00 177.57 175.94 1lr1 h VAL 36 N -0.20 0.08 -0.94 7.19 -1.51 -1.49 -2.48 116.25 116.90 1lr1 h VAL 36 Ca 0.07 -0.84 0.13 0.00 -1.23 0.00 0.00 66.70 64.83 1lr1 h VAL 36 Cb 0.29 1.78 -0.08 0.00 -2.13 0.00 0.00 31.29 31.15 1lr1 h VAL 36 CO -0.17 0.04 0.60 -1.13 -1.23 0.00 0.00 177.57 175.67 1lr1 h ASN 37 N 0.00 0.78 0.16 4.19 -0.73 0.31 3.53 115.58 123.83 1lr1 h ASN 37 Ca -0.00 0.05 -0.27 0.00 1.87 0.00 0.00 56.30 57.95 1lr1 h ASN 37 Cb 0.78 -0.11 0.02 0.00 0.27 0.00 0.00 38.32 39.28 1lr1 h ASN 37 CO 0.01 0.40 -1.27 -0.33 -0.37 0.00 0.00 177.43 175.87 1lr1 h GLU 38 N 0.83 0.34 0.22 6.67 4.39 -1.21 -3.25 114.58 122.57 1lr1 h GLU 38 Ca 0.47 -0.58 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 1lr1 h GLU 38 Cb 0.62 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 1lr1 h GLU 38 CO -0.24 1.28 -0.11 0.00 -1.16 0.00 0.00 179.01 178.79 1lr1 h ARG 39 N -0.19 -0.29 -0.96 2.33 -0.00 -0.82 0.27 114.38 114.72 1lr1 h ARG 39 Ca -0.25 0.02 0.27 0.00 -0.50 0.00 0.00 59.98 59.53 1lr1 h ARG 39 Cb 1.84 0.07 -0.14 0.00 0.00 0.00 0.00 29.97 31.74 1lr1 h ARG 39 CO 0.15 0.09 0.48 0.00 0.00 0.00 0.00 179.97 180.69 1lr1 h ARG 40 N -0.78 0.36 0.14 0.04 2.47 0.64 1.48 114.38 118.73 1lr1 h ARG 40 Ca -0.03 -0.02 -0.31 0.00 -1.26 0.00 0.00 59.98 58.36 1lr1 h ARG 40 Cb 0.51 -0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.75 1lr1 h ARG 40 CO 0.05 0.24 -1.53 0.93 0.56 0.00 0.00 179.97 180.21 1lr1 h GLU 41 N 0.37 0.29 0.16 0.04 5.08 -1.58 -3.26 114.58 115.67 1lr1 h GLU 41 Ca 0.66 -0.49 -0.22 0.00 -1.00 0.00 0.00 59.36 58.30 1lr1 h GLU 41 Cb 1.38 0.18 0.02 0.00 0.50 0.00 0.00 28.75 30.84 1lr1 h GLU 41 CO -0.58 1.17 -0.99 1.49 -1.00 0.00 0.00 179.01 179.10 1lr1 h GLU 42 N 0.08 0.34 -0.35 2.33 4.81 0.11 -3.19 114.58 118.70 1lr1 h GLU 42 Ca -0.25 -0.57 0.04 0.00 -0.13 0.00 0.00 59.36 58.44 1lr1 h GLU 42 Cb 2.03 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 31.59 1lr1 h GLU 42 CO 0.17 1.27 0.14 0.93 -0.73 0.00 0.00 179.01 180.80 1lr1 h GLU 43 N -0.28 0.29 -0.66 1.92 4.39 0.18 0.40 114.58 120.82 1lr1 h GLU 43 Ca -0.18 -0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.61 1lr1 h GLU 43 Cb 1.74 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 30.29 1lr1 h GLU 43 CO 0.16 0.19 0.44 0.77 -1.16 0.00 0.00 179.01 179.42 1lr1 h SER 44 N 0.30 0.44 -0.37 1.42 0.02 -1.68 0.17 113.55 113.84 1lr1 h SER 44 Ca 0.16 0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.99 1lr1 h SER 44 Cb 0.11 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1lr1 h SER 44 CO -0.14 0.26 -0.26 0.00 -1.14 0.00 0.00 176.83 175.55 1lr1 h ALA 45 N 1.67 0.53 -0.84 3.77 0.00 -0.86 -1.89 119.26 121.64 1lr1 h ALA 45 Ca 0.31 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1lr1 h ALA 45 Cb 0.54 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1lr1 h ALA 45 CO -0.10 0.54 0.43 0.00 0.00 0.00 0.00 179.25 180.12 1lr1 h ALA 46 N 0.78 1.17 -0.29 0.00 0.00 0.24 -0.05 119.26 121.11 1lr1 h ALA 46 Ca 0.07 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1lr1 h ALA 46 Cb 0.83 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1lr1 h ALA 46 CO 0.07 0.64 -0.28 0.00 0.00 0.00 0.00 179.25 179.69 1lr1 h ALA 47 N 1.28 0.43 -0.37 0.00 0.00 -0.92 -2.59 119.26 117.08 1lr1 h ALA 47 Ca 0.29 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1lr1 h ALA 47 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1lr1 h ALA 47 CO -0.04 0.44 -0.06 0.00 0.00 0.00 0.00 179.25 179.58 1lr1 h ALA 48 N 0.71 0.51 -0.73 0.00 0.00 -1.10 -3.17 119.26 115.48 1lr1 h ALA 48 Ca 0.05 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 1lr1 h ALA 48 Cb 0.85 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1lr1 h ALA 48 CO 0.07 0.34 0.27 1.05 0.00 0.00 0.00 179.25 180.99 1lr1 h GLU 49 N 0.51 1.11 -2.02 0.00 4.11 -1.04 -3.01 114.58 114.24 1lr1 h GLU 49 Ca 0.10 -0.21 -0.02 0.00 0.07 0.00 0.00 59.36 59.30 1lr1 h GLU 49 Cb 0.57 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1lr1 h GLU 49 CO 0.03 0.92 -0.02 1.33 0.07 0.00 0.00 179.01 181.34 1lr1 n VAL 50 N -4.32 1.77 -3.65 -1.06 0.24 -0.98 -4.66 118.33 105.68 1lr1 n VAL 50 Ca 0.06 -0.50 -0.00 0.00 -2.04 0.00 0.00 64.34 61.85 1lr1 n VAL 50 Cb 0.19 -1.47 -0.06 0.00 -1.47 0.00 0.00 33.84 31.03 1lr1 n VAL 50 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1lr1 s GLU 51 N 0.41 0.17 0.00 7.34 2.12 -1.14 -5.02 118.70 122.59 1lr1 s GLU 51 Ca 0.06 0.28 0.00 0.00 0.36 0.00 0.00 54.97 55.67 1lr1 s GLU 51 Cb 0.03 0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.46 1lr1 s GLU 51 CO 0.00 -0.03 0.00 -0.85 -0.54 0.00 0.00 175.26 173.84 1lr1 n GLU 52 N 3.06 0.00 -2.66 4.30 0.28 -1.26 -4.92 120.64 119.44 1lr1 n GLU 52 Ca -0.17 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 56.80 1lr1 n GLU 52 Cb 0.57 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.42 1lr1 n GLU 52 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1lr1 n ARG 53 N 0.00 0.18 -1.75 3.44 0.63 -1.26 -5.13 116.66 112.77 1lr1 n ARG 53 Ca 0.00 -0.70 0.00 0.00 -0.92 0.00 0.00 57.85 56.23 1lr1 n ARG 53 Cb 0.00 -0.01 0.00 0.00 0.45 0.00 0.00 32.46 32.90 1lr1 n ARG 53 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 1lr1 n THR 54 N -0.51 -3.41 -0.00 5.15 5.66 -1.26 -4.85 114.28 115.06 1lr1 n THR 54 Ca -0.27 1.57 -0.12 0.00 -3.05 0.00 0.00 64.05 62.17 1lr1 n THR 54 Cb 0.65 -2.03 -0.08 0.00 -1.55 0.00 0.00 70.33 67.32 1lr1 n THR 54 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 1lr1 h ARG 55 N 2.67 0.07 0.00 1.09 2.47 -1.98 -3.47 114.38 115.23 1lr1 h ARG 55 Ca 0.00 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1lr1 h ARG 55 Cb 0.00 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 1lr1 h ARG 55 CO 0.00 0.30 0.00 1.17 0.56 0.00 0.00 179.97 182.00 1lr1 n LYS 56 N -4.92 0.00 0.00 0.04 3.00 -1.26 -5.24 118.16 109.78 1lr1 n LYS 56 Ca -0.07 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.25 1lr1 n LYS 56 Cb 0.15 0.00 0.07 0.00 0.00 0.00 0.00 35.03 35.25 1lr1 n LYS 56 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29