#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bw5 n LYS 2 N 0.00 -1.79 0.00 3.17 4.01 -1.26 -4.88 118.16 117.41 1bw5 n LYS 2 Ca 0.00 -0.48 0.00 0.00 -0.51 0.00 0.00 58.31 57.32 1bw5 n LYS 2 Cb 0.00 -2.15 0.00 0.00 -0.51 0.00 0.00 35.03 32.37 1bw5 n LYS 2 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 1bw5 n THR 3 N -4.68 0.00 -2.93 -0.18 5.66 -1.26 -5.06 114.28 105.82 1bw5 n THR 3 Ca 0.05 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.95 1bw5 n THR 3 Cb 0.54 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.30 1bw5 n THR 3 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1bw5 s THR 4 N -0.92 -0.64 0.65 1.09 2.01 -1.26 -5.14 115.64 111.42 1bw5 s THR 4 Ca 0.00 -1.44 -0.14 0.00 0.31 0.00 0.00 61.69 60.43 1bw5 s THR 4 Cb 0.00 -0.34 -0.01 0.00 0.01 0.00 0.00 72.50 72.17 1bw5 s THR 4 CO 0.00 -0.34 1.07 -0.13 -0.69 0.00 0.00 174.62 174.54 1bw5 s ARG 5 N 0.66 2.98 -0.05 4.92 0.52 -1.26 -4.99 118.95 121.74 1bw5 s ARG 5 Ca 0.31 1.19 -0.30 0.00 -0.52 0.00 0.00 55.73 56.41 1bw5 s ARG 5 Cb 0.01 -1.99 -0.03 0.00 0.52 0.00 0.00 34.95 33.47 1bw5 s ARG 5 CO -0.09 -1.08 1.08 0.08 0.02 0.00 0.00 175.30 175.31 1bw5 s VAL 6 N -2.61 4.55 0.00 3.52 1.01 -1.26 -4.86 120.40 120.75 1bw5 s VAL 6 Ca 0.63 1.83 0.00 0.00 0.00 0.00 0.00 61.98 64.44 1bw5 s VAL 6 Cb -0.17 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.03 1bw5 s VAL 6 CO 0.44 0.05 0.25 -2.11 0.00 0.00 0.00 175.10 173.73 1bw5 n ARG 7 N 4.68 0.00 -1.58 2.72 1.85 -1.26 -5.12 116.66 117.95 1bw5 n ARG 7 Ca 0.09 -0.25 -0.30 0.00 -1.00 0.00 0.00 57.85 56.39 1bw5 n ARG 7 Cb 0.48 -0.26 0.21 0.00 -1.05 0.00 0.00 32.46 31.84 1bw5 n ARG 7 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1bw5 s THR 8 N 0.00 1.84 -0.30 8.89 2.01 -1.26 -5.09 115.64 121.73 1bw5 s THR 8 Ca 0.00 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.79 1bw5 s THR 8 Cb 0.00 -2.79 0.18 0.00 0.01 0.00 0.00 72.50 69.91 1bw5 s THR 8 CO 0.00 0.00 1.28 0.54 -0.69 0.00 0.00 174.62 175.75 1bw5 s VAL 9 N -3.52 0.00 0.00 3.82 0.11 -1.26 -5.19 120.40 114.36 1bw5 s VAL 9 Ca 0.72 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.77 1bw5 s VAL 9 Cb -0.06 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.79 1bw5 s VAL 9 CO 0.54 0.00 0.01 0.00 -3.33 0.00 0.00 175.10 172.32 1bw5 n LEU 10 N 2.38 0.00 0.00 2.54 -0.00 -1.26 -5.15 117.00 115.51 1bw5 n LEU 10 Ca -0.14 -0.01 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 1bw5 n LEU 10 Cb 0.57 0.02 0.00 0.00 -0.00 0.00 0.00 43.42 44.00 1bw5 n LEU 10 CO 0.03 -0.00 0.00 -0.46 -0.00 0.00 0.00 177.39 176.96 1bw5 n ASN 11 N -0.74 1.98 0.01 1.45 0.23 -1.26 -4.98 115.26 111.95 1bw5 n ASN 11 Ca -0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1bw5 n ASN 11 Cb 0.00 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 37.72 1bw5 n ASN 11 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 1bw5 n GLU 12 N 0.00 0.00 0.00 -3.83 4.07 -1.26 -2.74 120.64 116.88 1bw5 n GLU 12 Ca 0.00 0.26 0.00 0.00 -0.06 0.00 0.00 57.16 57.36 1bw5 n GLU 12 Cb 0.00 -1.77 0.00 0.00 -0.06 0.00 0.00 31.44 29.61 1bw5 n GLU 12 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1bw5 n LYS 13 N -1.29 0.00 -0.02 5.31 5.02 -1.26 -3.29 118.16 122.63 1bw5 n LYS 13 Ca -0.00 0.05 -0.02 0.00 -2.02 0.00 0.00 58.31 56.32 1bw5 n LYS 13 Cb 0.26 -0.81 0.25 0.00 -0.02 0.00 0.00 35.03 34.71 1bw5 n LYS 13 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1bw5 h GLN 14 N 0.00 0.58 -0.66 1.97 7.50 -1.98 -3.10 115.11 119.42 1bw5 h GLN 14 Ca 0.00 -0.15 0.13 0.00 0.50 0.00 0.00 58.65 59.13 1bw5 h GLN 14 Cb 0.00 -0.07 -0.13 0.00 0.05 0.00 0.00 27.48 27.33 1bw5 h GLN 14 CO 0.00 0.63 -0.21 -0.07 -1.50 0.00 0.00 178.83 177.69 1bw5 h LEU 15 N 0.54 -0.75 -0.49 1.46 -0.00 -1.67 -2.05 115.31 112.35 1bw5 h LEU 15 Ca 0.11 0.21 0.07 0.00 -0.00 0.00 0.00 57.88 58.27 1bw5 h LEU 15 Cb 0.42 0.46 -0.09 0.00 -0.00 0.00 0.00 40.66 41.44 1bw5 h LEU 15 CO 0.02 -0.25 -0.49 -0.74 -0.00 0.00 0.00 178.44 176.99 1bw5 h HIS 16 N -0.04 -1.45 0.23 1.13 2.76 -1.53 1.18 115.15 117.43 1bw5 h HIS 16 Ca 0.31 0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.55 1bw5 h HIS 16 Cb 0.51 0.70 -0.01 0.00 1.55 0.00 0.00 27.41 30.17 1bw5 h HIS 16 CO -0.57 -0.45 -0.22 1.15 -1.30 0.00 0.00 177.93 176.54 1bw5 h THR 17 N -0.31 0.00 -0.94 6.26 2.02 -1.54 -2.43 112.91 115.98 1bw5 h THR 17 Ca 0.13 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.49 1bw5 h THR 17 Cb 0.58 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.91 1bw5 h THR 17 CO -0.64 0.00 0.60 -0.07 0.37 0.00 0.00 175.52 175.78 1bw5 h LEU 18 N -0.44 0.62 -1.41 2.58 3.38 -1.31 -1.69 115.31 117.04 1bw5 h LEU 18 Ca -0.03 0.06 0.33 0.00 0.09 0.00 0.00 57.88 58.33 1bw5 h LEU 18 Cb 0.38 -0.06 -0.10 0.00 0.09 0.00 0.00 40.66 40.97 1bw5 h LEU 18 CO -0.02 0.26 0.74 0.03 0.09 0.00 0.00 178.44 179.55 1bw5 h ARG 19 N 0.63 0.26 -0.20 1.13 2.47 0.19 0.11 114.38 118.97 1bw5 h ARG 19 Ca 0.50 -0.02 -0.17 0.00 -1.26 0.00 0.00 59.98 59.03 1bw5 h ARG 19 Cb 0.93 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.18 1bw5 h ARG 19 CO -0.25 0.17 -0.58 1.79 0.56 0.00 0.00 179.97 181.66 1bw5 h THR 20 N 0.27 1.31 0.70 2.04 1.35 -1.26 -3.25 112.91 114.07 1bw5 h THR 20 Ca 0.67 -1.82 -0.03 0.00 -0.55 0.00 0.00 66.41 64.68 1bw5 h THR 20 Cb 1.92 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 70.12 1bw5 h THR 20 CO -0.33 0.57 -0.37 0.00 -0.25 0.00 0.00 175.52 175.14 1bw5 h TYR 22 N -0.99 -0.77 -0.70 0.00 3.20 -1.62 0.72 116.97 116.81 1bw5 h TYR 22 Ca -0.09 0.06 0.20 0.00 3.14 0.00 0.00 58.73 62.04 1bw5 h TYR 22 Cb 0.78 0.41 -0.03 0.00 1.54 0.00 0.00 36.73 39.43 1bw5 h TYR 22 CO -0.06 -0.35 0.51 0.00 -1.64 0.00 0.00 178.16 176.62 1bw5 h ALA 23 N 1.00 2.66 -0.00 1.82 0.00 -1.57 -0.53 119.26 122.64 1bw5 h ALA 23 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1bw5 h ALA 23 Cb 0.52 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1bw5 h ALA 23 CO -0.59 -0.87 -0.80 0.00 0.00 0.00 0.00 179.25 176.99 1bw5 n ALA 24 N -2.67 4.22 -3.09 0.00 0.00 0.16 -4.86 120.51 114.28 1bw5 n ALA 24 Ca 0.14 -0.49 0.03 0.00 0.00 0.00 0.00 53.44 53.11 1bw5 n ALA 24 Cb 0.78 -0.63 -0.00 0.00 0.00 0.00 0.00 19.45 19.60 1bw5 n ALA 24 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1bw5 s ASN 25 N -2.61 -1.12 -0.08 0.00 3.84 0.23 -5.01 114.94 110.19 1bw5 s ASN 25 Ca 0.07 -0.28 0.01 0.00 0.21 0.00 0.00 52.86 52.87 1bw5 s ASN 25 Cb 0.13 1.53 0.13 0.00 -0.55 0.00 0.00 41.25 42.49 1bw5 s ASN 25 CO 0.70 -0.16 1.12 -0.81 -2.79 0.00 0.00 177.10 175.16 1bw5 n PRO 26 N 4.61 1.29 -2.75 0.43 -0.04 -1.11 -3.95 135.00 133.48 1bw5 n PRO 26 Ca 0.08 -0.56 -0.09 0.00 -0.04 0.00 0.00 63.50 62.89 1bw5 n PRO 26 Cb 0.58 -1.27 0.07 0.00 -0.04 0.00 0.00 33.50 32.84 1bw5 n PRO 26 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1bw5 n ARG 27 N 0.19 0.90 -1.27 0.54 0.63 -1.26 -5.10 116.66 111.29 1bw5 n ARG 27 Ca 0.10 -1.86 -0.30 0.00 -0.92 0.00 0.00 57.85 54.87 1bw5 n ARG 27 Cb 0.69 -1.25 0.11 0.00 0.45 0.00 0.00 32.46 32.46 1bw5 n ARG 27 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1bw5 s PRO 28 N 0.44 1.81 0.00 -0.14 0.04 -1.26 -5.05 135.00 130.83 1bw5 s PRO 28 Ca 0.27 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1bw5 s PRO 28 Cb 0.26 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.94 1bw5 s PRO 28 CO -0.15 -1.90 0.00 -0.25 0.04 0.00 0.00 177.00 174.75 1bw5 n ASP 29 N -3.67 0.00 -0.36 6.66 8.00 -1.26 -4.99 116.55 120.94 1bw5 n ASP 29 Ca 0.08 -0.70 0.33 0.00 0.71 0.00 0.00 54.79 55.20 1bw5 n ASP 29 Cb 0.54 0.00 0.67 0.00 -0.02 0.00 0.00 41.12 42.31 1bw5 n ASP 29 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bw5 h ALA 30 N 1.83 2.84 -3.00 2.24 0.00 -1.97 0.15 119.26 121.35 1bw5 h ALA 30 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1bw5 h ALA 30 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1bw5 h ALA 30 CO 0.00 -1.25 0.00 1.28 0.00 0.00 0.00 179.25 179.28 1bw5 n LEU 31 N -4.36 0.13 0.17 0.00 4.77 -1.26 -3.50 117.00 112.95 1bw5 n LEU 31 Ca 0.28 0.33 0.13 0.00 -0.03 0.00 0.00 56.01 56.72 1bw5 n LEU 31 Cb 1.19 0.00 0.59 0.00 -2.33 0.00 0.00 43.42 42.88 1bw5 n LEU 31 CO 0.34 0.00 0.88 0.24 -1.33 0.00 0.00 177.39 177.52 1bw5 h MET 32 N 0.00 0.00 -0.77 3.23 2.86 -1.96 -3.10 114.93 115.19 1bw5 h MET 32 Ca 0.00 0.00 0.16 0.00 -2.06 0.00 0.00 59.70 57.80 1bw5 h MET 32 Cb 0.00 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 31.56 1bw5 h MET 32 CO 0.00 0.00 0.28 0.87 1.06 0.00 0.00 176.91 179.12 1bw5 h LYS 33 N 0.00 0.37 -0.13 1.72 1.57 -0.74 -0.95 116.57 118.41 1bw5 h LYS 33 Ca 0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1bw5 h LYS 33 Cb 0.21 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1bw5 h LYS 33 CO 0.00 0.25 0.05 1.49 -0.57 0.00 0.00 179.45 180.67 1bw5 h GLU 34 N 0.38 0.20 -0.30 3.15 4.22 -1.63 -3.01 114.58 117.59 1bw5 h GLU 34 Ca 0.44 -0.04 0.02 0.00 0.08 0.00 0.00 59.36 59.87 1bw5 h GLU 34 Cb 0.72 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 1bw5 h GLU 34 CO -0.46 0.30 0.14 1.96 -2.18 0.00 0.00 179.01 178.77 1bw5 h GLN 35 N 0.06 0.28 -1.00 1.92 7.50 -1.50 -2.34 115.11 120.03 1bw5 h GLN 35 Ca 0.04 -0.02 0.22 0.00 0.50 0.00 0.00 58.65 59.40 1bw5 h GLN 35 Cb 0.17 -0.06 -0.11 0.00 0.05 0.00 0.00 27.48 27.53 1bw5 h GLN 35 CO -0.00 0.19 0.61 -0.07 -1.50 0.00 0.00 178.83 178.06 1bw5 h LEU 36 N 0.29 0.69 -0.61 1.46 3.38 -1.12 -0.68 115.31 118.72 1bw5 h LEU 36 Ca 0.13 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.33 1bw5 h LEU 36 Cb 0.06 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 40.71 1bw5 h LEU 36 CO -0.10 0.19 0.09 0.58 0.09 0.00 0.00 178.44 179.29 1bw5 h VAL 37 N 0.64 0.59 -0.77 1.22 2.07 -1.29 0.32 116.25 119.04 1bw5 h VAL 37 Ca 0.60 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 68.03 1bw5 h VAL 37 Cb 1.11 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 1bw5 h VAL 37 CO -0.39 0.04 0.41 -0.33 0.02 0.00 0.00 177.57 177.31 1bw5 h GLU 38 N 0.21 1.07 -0.35 1.57 4.39 -1.21 1.76 114.58 122.03 1bw5 h GLU 38 Ca 0.32 -0.12 0.06 0.00 0.34 0.00 0.00 59.36 59.96 1bw5 h GLU 38 Cb 0.50 -0.21 -0.05 0.00 -0.10 0.00 0.00 28.75 28.89 1bw5 h GLU 38 CO -0.44 0.79 0.02 1.98 -1.16 0.00 0.00 179.01 180.20 1bw5 h MET 39 N 1.07 0.12 -0.00 2.33 4.05 -0.82 -3.06 114.93 118.62 1bw5 h MET 39 Ca 0.27 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.68 1bw5 h MET 39 Cb 0.04 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 30.81 1bw5 h MET 39 CO -0.04 0.08 -0.52 -2.37 0.23 0.00 0.00 176.91 174.28 1bw5 n THR 40 N -5.15 0.00 -0.18 -0.77 5.66 -1.13 -4.96 114.28 107.76 1bw5 n THR 40 Ca 0.01 -0.24 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 1bw5 n THR 40 Cb 0.18 1.06 0.00 0.00 -1.55 0.00 0.00 70.33 70.02 1bw5 n THR 40 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1bw5 n GLY 41 N 1.24 1.31 3.82 1.09 0.00 0.60 -4.96 105.19 108.29 1bw5 n GLY 41 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1bw5 n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bw5 s LEU 42 N 0.00 3.22 0.94 0.99 1.02 -1.24 -4.94 118.68 118.68 1bw5 s LEU 42 Ca 0.00 1.63 -0.12 0.00 0.02 0.00 0.00 54.13 55.66 1bw5 s LEU 42 Cb 0.00 -4.50 0.16 0.00 0.02 0.00 0.00 46.19 41.87 1bw5 s LEU 42 CO 0.00 -1.30 1.09 -0.55 0.02 0.00 0.00 176.35 175.61 1bw5 s SER 43 N -3.65 3.04 0.41 2.29 0.15 -1.26 -4.70 113.70 109.98 1bw5 s SER 43 Ca 0.59 1.47 0.29 0.00 0.70 0.00 0.00 55.95 59.00 1bw5 s SER 43 Cb -0.14 -2.14 1.18 0.00 -1.71 0.00 0.00 66.02 63.21 1bw5 s SER 43 CO 0.51 -2.91 1.85 1.55 1.20 0.00 0.00 173.24 175.45 1bw5 h PRO 44 N -1.74 0.00 -0.21 5.44 0.13 -1.95 -3.26 132.00 130.41 1bw5 h PRO 44 Ca -0.51 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.67 1bw5 h PRO 44 Cb 1.30 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.35 1bw5 h PRO 44 CO 0.54 0.00 -0.38 0.00 -0.23 0.00 0.00 178.00 177.93 1bw5 h ARG 45 N 0.00 -0.39 -0.58 0.86 3.08 -2.01 -1.70 114.38 113.63 1bw5 h ARG 45 Ca 0.00 0.03 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 1bw5 h ARG 45 Cb 0.44 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 1bw5 h ARG 45 CO 0.00 -0.26 -0.05 0.28 -1.07 0.00 0.00 179.97 178.86 1bw5 h VAL 46 N -0.41 1.27 -0.41 2.04 2.07 -1.95 -3.19 116.25 115.67 1bw5 h VAL 46 Ca 0.10 -1.21 0.08 0.00 0.82 0.00 0.00 66.70 66.49 1bw5 h VAL 46 Cb 0.59 0.87 -0.09 0.00 -1.52 0.00 0.00 31.29 31.13 1bw5 h VAL 46 CO -0.43 0.44 -0.35 0.40 0.02 0.00 0.00 177.57 177.65 1bw5 h ILE 47 N 0.96 0.20 0.20 4.57 1.08 -1.44 0.43 117.51 123.51 1bw5 h ILE 47 Ca 0.16 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.62 1bw5 h ILE 47 Cb 0.62 0.20 -0.00 0.00 -3.07 0.00 0.00 36.82 34.57 1bw5 h ILE 47 CO 0.04 0.00 -0.13 -0.09 -0.69 0.00 0.00 178.15 177.28 1bw5 h ARG 48 N -0.26 -0.30 -0.51 2.37 2.43 -1.39 -3.07 114.38 113.65 1bw5 h ARG 48 Ca 0.17 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.44 1bw5 h ARG 48 Cb 0.55 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.14 1bw5 h ARG 48 CO -0.56 -0.20 0.34 -0.24 -1.51 0.00 0.00 179.97 177.81 1bw5 h VAL 49 N -0.31 0.91 0.08 0.20 3.04 -1.52 -3.07 116.25 115.58 1bw5 h VAL 49 Ca -0.03 -0.11 -0.00 0.00 -1.01 0.00 0.00 66.70 65.55 1bw5 h VAL 49 Cb 0.25 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.08 1bw5 h VAL 49 CO 0.02 0.06 -0.10 -0.25 -1.01 0.00 0.00 177.57 176.29 1bw5 h TRP 50 N 0.33 -0.29 -0.80 3.17 7.01 -0.04 -2.38 115.95 122.94 1bw5 h TRP 50 Ca 0.23 0.00 0.19 0.00 2.11 0.00 0.00 58.89 61.42 1bw5 h TRP 50 Cb 0.48 0.12 -0.12 0.00 -2.10 0.00 0.00 29.16 27.54 1bw5 h TRP 50 CO -0.00 -0.13 0.23 0.74 -2.79 0.00 0.00 178.44 176.49 1bw5 h PHE 51 N -0.19 0.37 -0.09 2.65 0.04 -1.51 -1.07 116.94 117.13 1bw5 h PHE 51 Ca -0.01 0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.82 1bw5 h PHE 51 Cb 0.17 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.25 1bw5 h PHE 51 CO -0.17 -0.10 -0.24 0.37 -0.60 0.00 0.00 178.31 177.57 1bw5 h GLN 52 N 0.29 -0.22 -0.98 1.51 4.15 -1.39 -0.55 115.11 117.92 1bw5 h GLN 52 Ca 0.47 0.02 0.15 0.00 0.77 0.00 0.00 58.65 60.06 1bw5 h GLN 52 Cb 0.85 0.05 -0.09 0.00 0.21 0.00 0.00 27.48 28.51 1bw5 h GLN 52 CO -0.54 -0.15 0.61 -0.91 -1.93 0.00 0.00 178.83 175.91 1bw5 h ASN 53 N -0.23 0.81 -0.81 -0.69 4.21 -0.91 -2.07 115.58 115.88 1bw5 h ASN 53 Ca 0.02 0.06 0.20 0.00 1.21 0.00 0.00 56.30 57.79 1bw5 h ASN 53 Cb 0.28 -0.10 -0.13 0.00 -1.12 0.00 0.00 38.32 37.26 1bw5 h ASN 53 CO -0.21 0.38 0.14 0.50 -1.29 0.00 0.00 177.43 176.96 1bw5 h LYS 54 N 0.84 0.18 -0.16 0.81 3.11 0.18 -2.19 116.57 119.34 1bw5 h LYS 54 Ca 0.51 -0.01 0.03 0.00 -2.81 0.00 0.00 60.65 58.37 1bw5 h LYS 54 Cb 0.69 -0.04 -0.07 0.00 -1.00 0.00 0.00 32.23 31.82 1bw5 h LYS 54 CO -0.28 0.12 -0.55 -0.09 -2.81 0.00 0.00 179.45 175.84 1bw5 h ARG 55 N 0.18 -0.55 0.01 1.90 2.43 -1.05 1.38 114.38 118.68 1bw5 h ARG 55 Ca 0.48 0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.71 1bw5 h ARG 55 Cb 0.90 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 1bw5 h ARG 55 CO -0.64 -0.37 -0.16 0.00 -1.51 0.00 0.00 179.97 177.30 1bw5 h LYS 57 N -0.27 0.24 -0.53 0.00 1.63 -0.94 -2.64 116.57 114.06 1bw5 h LYS 57 Ca 0.05 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.80 1bw5 h LYS 57 Cb 0.34 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 1bw5 h LYS 57 CO -0.15 0.25 0.26 0.22 -3.45 0.00 0.00 179.45 176.58 1bw5 h ASP 58 N 0.24 0.69 0.44 4.20 1.82 0.27 -2.27 116.42 121.81 1bw5 h ASP 58 Ca 0.06 -0.12 -0.03 0.00 -0.39 0.00 0.00 57.03 56.55 1bw5 h ASP 58 Cb 0.14 -0.18 -0.00 0.00 0.68 0.00 0.00 39.33 39.96 1bw5 h ASP 58 CO 0.00 0.62 -0.13 0.50 -1.61 0.00 0.00 179.24 178.62 1bw5 h LYS 59 N 0.71 0.00 0.00 0.28 3.64 -1.09 -3.44 116.57 116.68 1bw5 h LYS 59 Ca 0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1bw5 h LYS 59 Cb 0.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1bw5 h LYS 59 CO -0.02 0.13 0.00 1.63 -2.27 0.00 0.00 179.45 178.92 1bw5 n LYS 60 N -3.60 0.30 -3.95 1.90 5.02 -0.85 -4.47 118.16 112.51 1bw5 n LYS 60 Ca -0.02 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.98 1bw5 n LYS 60 Cb 0.26 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.28 1bw5 n LYS 60 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1bw5 n ARG 61 N -0.85 -4.47 -0.54 1.97 1.74 -1.26 -4.97 116.66 108.29 1bw5 n ARG 61 Ca 0.00 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.59 1bw5 n ARG 61 Cb 0.00 -5.16 0.00 0.00 -1.02 0.00 0.00 32.46 26.28 1bw5 n ARG 61 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1bw5 n SER 62 N -2.86 0.58 -4.77 0.55 3.41 -1.26 -5.07 113.62 104.20 1bw5 n SER 62 Ca -0.08 -0.42 -0.41 0.00 -0.26 0.00 0.00 58.87 57.70 1bw5 n SER 62 Cb 0.58 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.51 1bw5 n SER 62 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1bw5 s ILE 63 N 1.17 2.51 0.26 -1.33 1.01 -1.26 -4.96 121.20 118.59 1bw5 s ILE 63 Ca 0.00 0.51 -0.29 0.00 0.00 0.00 0.00 60.65 60.86 1bw5 s ILE 63 Cb 0.00 -3.32 -0.09 0.00 0.01 0.00 0.00 42.46 39.05 1bw5 s ILE 63 CO 0.00 0.12 1.28 0.00 0.00 0.00 0.00 174.94 176.34 1bw5 s MET 64 N -1.92 4.41 0.32 2.79 0.23 -1.26 -5.03 119.30 118.85 1bw5 s MET 64 Ca 0.51 2.08 -0.07 0.00 -1.03 0.00 0.00 55.69 57.18 1bw5 s MET 64 Cb -0.42 -3.15 -0.06 0.00 -1.53 0.00 0.00 34.83 29.68 1bw5 s MET 64 CO 0.56 -0.16 0.62 -1.64 -2.03 0.00 0.00 175.02 172.37 1bw5 s MET 65 N -0.95 3.68 0.00 3.16 -1.94 -1.26 -5.31 119.30 116.69 1bw5 s MET 65 Ca 0.52 0.15 0.00 0.00 -1.71 0.00 0.00 55.69 54.65 1bw5 s MET 65 Cb -0.37 -2.57 0.00 0.00 2.01 0.00 0.00 34.83 33.90 1bw5 s MET 65 CO 0.44 0.14 0.36 1.63 -0.01 0.00 0.00 175.02 177.59