#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pm6 s TYR 2 N 0.00 3.14 -0.14 2.03 2.02 -1.26 -1.44 117.35 121.71 1pm6 s TYR 2 Ca 0.00 0.10 -0.07 0.00 -0.37 0.00 0.00 57.07 56.73 1pm6 s TYR 2 Cb 0.00 -3.07 -0.04 0.00 -0.40 0.00 0.00 41.96 38.45 1pm6 s TYR 2 CO 0.00 -0.66 0.10 -1.17 -1.57 0.00 0.00 175.55 172.25 1pm6 s LEU 3 N 2.54 4.11 0.53 -1.29 2.96 0.64 -4.86 118.68 123.31 1pm6 s LEU 3 Ca 0.20 0.30 -0.22 0.00 -0.22 0.00 0.00 54.13 54.19 1pm6 s LEU 3 Cb -0.15 -2.01 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 1pm6 s LEU 3 CO 0.15 0.32 1.36 -0.89 -1.32 0.00 0.00 176.35 175.97 1pm6 s THR 4 N -0.49 2.09 0.26 3.68 2.01 -1.26 -0.54 115.64 121.38 1pm6 s THR 4 Ca 0.11 0.07 -0.06 0.00 0.31 0.00 0.00 61.69 62.13 1pm6 s THR 4 Cb -0.12 -3.04 0.30 0.00 0.01 0.00 0.00 72.50 69.66 1pm6 s THR 4 CO 0.02 0.00 1.63 0.25 -0.69 0.00 0.00 174.62 175.83 1pm6 h LEU 5 N 1.59 -0.36 -0.23 4.42 6.46 -1.85 0.25 115.31 125.59 1pm6 h LEU 5 Ca -0.51 0.21 -0.01 0.00 -0.12 0.00 0.00 57.88 57.45 1pm6 h LEU 5 Cb 1.29 0.36 -0.01 0.00 -0.73 0.00 0.00 40.66 41.58 1pm6 h LEU 5 CO 0.58 -0.20 0.12 -0.61 -0.62 0.00 0.00 178.44 177.71 1pm6 h GLN 6 N 0.10 0.33 -0.10 1.25 -0.00 -1.93 -2.09 115.11 112.68 1pm6 h GLN 6 Ca 0.44 -0.04 -0.07 0.00 -0.00 0.00 0.00 58.65 58.98 1pm6 h GLN 6 Cb 0.80 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.21 1pm6 h GLN 6 CO -0.70 0.31 -0.27 0.93 0.00 0.00 0.00 178.83 179.10 1pm6 h GLU 7 N 0.26 0.17 0.36 1.69 3.07 -1.73 -1.15 114.58 117.25 1pm6 h GLU 7 Ca 0.08 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1pm6 h GLU 7 Cb 0.08 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1pm6 h GLU 7 CO -0.01 0.43 -0.22 2.35 -1.40 0.00 0.00 179.01 180.16 1pm6 h TRP 8 N 0.16 -0.58 -0.39 4.33 7.01 -0.50 -0.71 115.95 125.27 1pm6 h TRP 8 Ca 0.02 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.09 1pm6 h TRP 8 Cb 0.56 0.21 -0.06 0.00 -2.10 0.00 0.00 29.16 27.77 1pm6 h TRP 8 CO 0.01 -0.34 0.02 -0.97 -2.79 0.00 0.00 178.44 174.37 1pm6 h ASN 9 N -0.56 -0.11 -0.69 2.65 -1.24 -1.27 -0.46 115.58 113.90 1pm6 h ASN 9 Ca -0.04 0.08 0.02 0.00 0.71 0.00 0.00 56.30 57.07 1pm6 h ASN 9 Cb 0.46 0.14 -0.04 0.00 0.73 0.00 0.00 38.32 39.61 1pm6 h ASN 9 CO 0.04 -0.02 0.46 0.00 -1.29 0.00 0.00 177.43 176.62 1pm6 h ALA 10 N 1.33 1.54 -0.06 1.57 0.00 -1.27 -3.06 119.26 119.31 1pm6 h ALA 10 Ca 0.19 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 1pm6 h ALA 10 Cb 0.26 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1pm6 h ALA 10 CO -0.30 0.42 -0.56 0.00 0.00 0.00 0.00 179.25 178.81 1pm6 h ARG 11 N 0.91 0.17 -6.90 0.00 -0.00 -0.81 -3.46 114.38 104.28 1pm6 h ARG 11 Ca 0.26 -0.11 -0.53 0.00 -0.50 0.00 0.00 59.98 59.10 1pm6 h ARG 11 Cb -0.06 0.01 0.09 0.00 0.00 0.00 0.00 29.97 30.02 1pm6 h ARG 11 CO -0.06 0.69 0.76 -0.65 0.00 0.00 0.00 179.97 180.71 1pm6 s GLN 12 N -3.81 4.17 -0.54 0.04 -1.52 -0.21 -4.90 119.66 112.88 1pm6 s GLN 12 Ca -0.03 2.48 -0.28 0.00 -1.95 0.00 0.00 55.36 55.58 1pm6 s GLN 12 Cb 0.12 -3.00 0.02 0.00 -0.22 0.00 0.00 33.01 29.93 1pm6 s GLN 12 CO 0.78 -0.46 1.32 0.50 -0.25 0.00 0.00 175.29 177.18 1pm6 s ARG 13 N -1.76 3.44 0.00 2.91 3.52 -1.26 -3.74 118.95 122.06 1pm6 s ARG 13 Ca 0.53 0.45 0.00 0.00 -0.13 0.00 0.00 55.73 56.58 1pm6 s ARG 13 Cb -0.45 -4.06 0.00 0.00 -1.56 0.00 0.00 34.95 28.88 1pm6 s ARG 13 CO 0.58 -1.77 0.00 -2.13 -0.81 0.00 0.00 175.30 171.17 1pm6 n ARG 14 N 8.46 0.00 -2.33 5.12 0.00 -1.26 -5.05 116.66 121.61 1pm6 n ARG 14 Ca 0.12 0.47 -0.39 0.00 -0.00 0.00 0.00 57.85 58.04 1pm6 n ARG 14 Cb 0.49 -1.39 -0.03 0.00 0.00 0.00 0.00 32.46 31.53 1pm6 n ARG 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1pm6 s PRO 15 N -0.97 4.30 0.00 -0.14 0.04 -1.24 -5.03 135.00 131.95 1pm6 s PRO 15 Ca 0.00 1.88 0.00 0.00 0.04 0.00 0.00 61.00 62.92 1pm6 s PRO 15 Cb 0.00 -2.90 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1pm6 s PRO 15 CO 0.00 -0.12 0.00 0.54 0.04 0.00 0.00 177.00 177.46 1pm6 n ARG 16 N 0.55 0.00 -3.62 4.56 1.74 -1.26 -5.12 116.66 113.50 1pm6 n ARG 16 Ca 0.02 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.96 1pm6 n ARG 16 Cb 0.45 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.83 1pm6 n ARG 16 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1pm6 s SER 17 N -0.23 -0.39 0.36 0.55 1.04 -1.26 -5.05 113.70 108.72 1pm6 s SER 17 Ca 0.00 0.20 0.03 0.00 0.48 0.00 0.00 55.95 56.67 1pm6 s SER 17 Cb 0.00 0.45 0.68 0.00 0.10 0.00 0.00 66.02 67.25 1pm6 s SER 17 CO 0.00 -0.64 2.01 -0.07 0.98 0.00 0.00 173.24 175.52 1pm6 h LEU 18 N 3.07 0.68 -1.19 2.42 3.38 -2.00 -2.15 115.31 119.52 1pm6 h LEU 18 Ca -0.30 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1pm6 h LEU 18 Cb 1.19 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.74 1pm6 h LEU 18 CO 0.41 0.49 0.40 -0.33 0.09 0.00 0.00 178.44 179.51 1pm6 h GLU 19 N 0.80 0.96 -0.21 1.13 4.39 -1.98 -0.66 114.58 119.01 1pm6 h GLU 19 Ca 0.23 -0.09 0.03 0.00 0.34 0.00 0.00 59.36 59.87 1pm6 h GLU 19 Cb -0.05 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.36 1pm6 h GLU 19 CO -0.05 0.69 0.01 1.79 -1.16 0.00 0.00 179.01 180.29 1pm6 h THR 20 N 0.98 0.86 -0.44 1.13 1.35 -1.81 -1.47 112.91 113.49 1pm6 h THR 20 Ca 0.25 -0.03 0.07 0.00 -0.55 0.00 0.00 66.41 66.16 1pm6 h THR 20 Cb -0.01 0.77 -0.06 0.00 -1.73 0.00 0.00 68.15 67.13 1pm6 h THR 20 CO -0.04 0.01 0.08 0.58 -0.25 0.00 0.00 175.52 175.90 1pm6 h VAL 21 N 0.08 0.76 -0.57 6.82 2.07 -1.38 -1.66 116.25 122.37 1pm6 h VAL 21 Ca 0.10 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 1pm6 h VAL 21 Cb 0.12 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1pm6 h VAL 21 CO -0.16 0.04 0.30 -0.09 0.02 0.00 0.00 177.57 177.68 1pm6 h ARG 22 N 0.22 0.81 -0.49 1.57 1.12 -1.02 -1.36 114.38 115.22 1pm6 h ARG 22 Ca 0.22 -0.10 -0.03 0.00 -1.11 0.00 0.00 59.98 58.96 1pm6 h ARG 22 Cb 0.28 -0.15 -0.02 0.00 -0.01 0.00 0.00 29.97 30.06 1pm6 h ARG 22 CO -0.29 0.63 0.19 0.07 -3.11 0.00 0.00 179.97 177.46 1pm6 h ARG 23 N 0.77 0.70 -0.27 0.20 0.11 -1.22 -1.87 114.38 112.82 1pm6 h ARG 23 Ca 0.20 -0.10 -0.07 0.00 0.10 0.00 0.00 59.98 60.10 1pm6 h ARG 23 Cb 0.07 -0.13 -0.02 0.00 1.11 0.00 0.00 29.97 31.01 1pm6 h ARG 23 CO -0.03 0.59 -0.14 -1.49 0.10 0.00 0.00 179.97 178.99 1pm6 h TRP 24 N 0.70 0.49 0.66 4.08 6.55 -1.05 0.44 115.95 127.81 1pm6 h TRP 24 Ca 0.17 -0.08 -0.03 0.00 0.95 0.00 0.00 58.89 59.90 1pm6 h TRP 24 Cb 0.16 -0.13 0.01 0.00 -0.86 0.00 0.00 29.16 28.33 1pm6 h TRP 24 CO 0.01 0.59 -0.32 0.28 -1.05 0.00 0.00 178.44 177.95 1pm6 h VAL 25 N 0.42 0.25 -0.83 1.49 2.07 -1.19 0.67 116.25 119.14 1pm6 h VAL 25 Ca 0.08 -0.22 0.14 0.00 0.82 0.00 0.00 66.70 67.52 1pm6 h VAL 25 Cb 0.51 0.31 -0.09 0.00 -1.52 0.00 0.00 31.29 30.50 1pm6 h VAL 25 CO 0.03 0.02 0.42 0.03 0.02 0.00 0.00 177.57 178.10 1pm6 h ARG 26 N -1.05 0.59 -0.08 1.57 2.47 -1.33 -2.48 114.38 114.08 1pm6 h ARG 26 Ca -0.09 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.59 1pm6 h ARG 26 Cb 0.72 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.90 1pm6 h ARG 26 CO 0.15 0.39 0.00 -1.91 0.56 0.00 0.00 179.97 179.16 1pm6 n GLU 27 N -4.88 1.23 -3.39 0.04 2.13 0.14 -4.98 120.64 110.94 1pm6 n GLU 27 Ca 0.16 -0.36 -0.17 0.00 0.66 0.00 0.00 57.16 57.45 1pm6 n GLU 27 Cb 0.42 -1.20 0.07 0.00 0.27 0.00 0.00 31.44 31.00 1pm6 n GLU 27 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1pm6 n SER 28 N -0.32 -4.27 -0.09 4.31 7.64 -0.93 -5.01 113.62 114.95 1pm6 n SER 28 Ca 0.09 -0.70 -0.16 0.00 1.01 0.00 0.00 58.87 59.11 1pm6 n SER 28 Cb 0.12 -4.97 -0.07 0.00 -1.01 0.00 0.00 64.21 58.28 1pm6 n SER 28 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1pm6 n ARG 29 N -3.74 0.40 -2.58 1.43 5.12 0.21 -4.95 116.66 112.55 1pm6 n ARG 29 Ca -0.18 0.14 -0.43 0.00 -1.93 0.00 0.00 57.85 55.45 1pm6 n ARG 29 Cb 0.64 -1.23 -0.02 0.00 -1.16 0.00 0.00 32.46 30.69 1pm6 n ARG 29 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1pm6 s ILE 30 N -2.33 4.11 -0.08 0.55 1.01 -1.22 -0.73 121.20 122.50 1pm6 s ILE 30 Ca -0.24 1.06 0.04 0.00 0.00 0.00 0.00 60.65 61.52 1pm6 s ILE 30 Cb 0.08 -4.66 -0.00 0.00 0.01 0.00 0.00 42.46 37.89 1pm6 s ILE 30 CO 0.35 -1.17 -0.22 0.12 0.00 0.00 0.00 174.94 174.02 1pm6 s PHE 31 N 4.73 2.27 0.61 3.97 5.36 -0.36 -3.53 117.98 131.03 1pm6 s PHE 31 Ca 0.46 -0.83 -0.16 0.00 -0.96 0.00 0.00 56.93 55.44 1pm6 s PHE 31 Cb -0.07 -1.52 -0.02 0.00 -0.34 0.00 0.00 43.02 41.06 1pm6 s PHE 31 CO 0.29 -0.32 1.10 -1.25 -1.46 0.00 0.00 175.22 173.58 1pm6 s PRO 32 N 0.22 3.07 0.63 10.12 0.04 -1.26 -2.10 135.00 145.71 1pm6 s PRO 32 Ca -0.13 1.41 -0.16 0.00 0.04 0.00 0.00 61.00 62.17 1pm6 s PRO 32 Cb -0.16 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 1pm6 s PRO 32 CO 0.06 -1.04 1.11 -1.25 0.04 0.00 0.00 177.00 175.92 1pm6 s PRO 33 N -3.85 2.97 0.56 0.56 0.04 -1.23 -4.72 135.00 129.33 1pm6 s PRO 33 Ca 0.68 1.41 -0.16 0.00 0.04 0.00 0.00 61.00 62.96 1pm6 s PRO 33 Cb -0.20 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 32.31 1pm6 s PRO 33 CO 0.36 -1.12 1.02 -1.25 0.04 0.00 0.00 177.00 176.05 1pm6 s PRO 34 N -3.94 3.64 -0.38 0.56 0.04 -1.26 -4.92 135.00 128.74 1pm6 s PRO 34 Ca 0.68 1.05 -0.20 0.00 0.04 0.00 0.00 61.00 62.57 1pm6 s PRO 34 Cb -0.20 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.26 1pm6 s PRO 34 CO 0.38 -0.53 0.62 0.08 0.04 0.00 0.00 177.00 177.59 1pm6 s VAL 35 N -2.58 4.89 -0.49 -0.36 1.01 -0.64 -4.83 120.40 117.40 1pm6 s VAL 35 Ca 0.61 0.40 -0.27 0.00 0.00 0.00 0.00 61.98 62.72 1pm6 s VAL 35 Cb -0.13 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.18 1pm6 s VAL 35 CO 0.35 -0.39 1.06 -0.75 0.00 0.00 0.00 175.10 175.37 1pm6 s LYS 36 N 2.70 3.61 -0.88 2.72 2.36 -1.26 -0.82 119.74 128.17 1pm6 s LYS 36 Ca 0.23 0.35 -0.10 0.00 -2.55 0.00 0.00 55.97 53.89 1pm6 s LYS 36 Cb -0.14 -3.93 0.23 0.00 -1.05 0.00 0.00 37.83 32.93 1pm6 s LYS 36 CO 0.16 -1.36 0.82 -0.51 1.55 0.00 0.00 175.35 176.01 1pm6 s ASP 37 N 2.46 6.65 0.00 1.43 1.11 -0.24 -4.88 116.67 123.19 1pm6 s ASP 37 Ca 0.43 -3.05 0.00 0.00 0.18 0.00 0.00 52.55 50.11 1pm6 s ASP 37 Cb -0.08 -2.14 0.00 0.00 1.07 0.00 0.00 42.92 41.77 1pm6 s ASP 37 CO 0.29 -0.44 0.00 0.61 1.18 0.00 0.00 175.17 176.81 1pm6 n GLY 38 N 3.42 1.25 1.53 0.21 0.00 -1.26 -3.45 105.19 106.89 1pm6 n GLY 38 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1pm6 n GLY 38 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1pm6 n ARG 39 N 0.00 0.00 -2.75 1.61 0.00 -1.26 -5.13 116.66 109.12 1pm6 n ARG 39 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.52 1pm6 n ARG 39 Cb 0.00 -0.18 -0.06 0.00 0.00 0.00 0.00 32.46 32.21 1pm6 n ARG 39 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1pm6 s GLU 40 N -1.89 4.18 -0.19 -0.14 2.02 -1.22 -5.07 118.70 116.38 1pm6 s GLU 40 Ca 0.00 1.08 -0.06 0.00 0.02 0.00 0.00 54.97 56.01 1pm6 s GLU 40 Cb 0.00 -2.18 -0.03 0.00 0.10 0.00 0.00 34.13 32.02 1pm6 s GLU 40 CO 0.00 -0.07 0.03 0.71 0.02 0.00 0.00 175.26 175.95 1pm6 s TYR 41 N -2.25 3.14 -0.56 1.61 1.51 -1.26 -1.08 117.35 118.46 1pm6 s TYR 41 Ca 0.61 -0.16 -0.21 0.00 -1.01 0.00 0.00 57.07 56.30 1pm6 s TYR 41 Cb -0.09 -2.07 0.06 0.00 -0.11 0.00 0.00 41.96 39.75 1pm6 s TYR 41 CO 0.16 -0.02 0.78 -0.51 -1.11 0.00 0.00 175.55 174.85 1pm6 s LEU 42 N 0.65 4.68 -0.28 -1.29 1.43 -0.00 -2.30 118.68 121.56 1pm6 s LEU 42 Ca 0.01 -0.83 -0.16 0.00 -1.03 0.00 0.00 54.13 52.12 1pm6 s LEU 42 Cb -0.14 -2.53 -0.03 0.00 0.03 0.00 0.00 46.19 43.53 1pm6 s LEU 42 CO 0.02 -1.11 0.44 -0.36 0.23 0.00 0.00 176.35 175.57 1pm6 s PHE 43 N 3.25 3.24 0.41 0.29 0.40 0.29 -1.62 117.98 124.24 1pm6 s PHE 43 Ca 0.20 0.44 -0.26 0.00 -0.60 0.00 0.00 56.93 56.71 1pm6 s PHE 43 Cb -0.18 -2.68 -0.09 0.00 0.51 0.00 0.00 43.02 40.58 1pm6 s PHE 43 CO 0.13 -0.30 1.36 -1.58 0.70 0.00 0.00 175.22 175.53 1pm6 s HIS 44 N 2.20 2.72 -0.65 0.36 2.46 -1.26 -0.26 115.29 120.86 1pm6 s HIS 44 Ca 0.18 1.34 -0.20 0.00 0.47 0.00 0.00 55.06 56.85 1pm6 s HIS 44 Cb -0.16 -3.78 -0.17 0.00 -0.13 0.00 0.00 32.58 28.34 1pm6 s HIS 44 CO 0.10 -2.41 1.87 -0.85 -2.47 0.00 0.00 174.74 170.98 1pm6 n GLU 45 N 0.16 1.32 0.00 2.88 0.28 -0.52 -1.78 120.64 122.97 1pm6 n GLU 45 Ca 0.03 -1.61 0.00 0.00 -0.16 0.00 0.00 57.16 55.42 1pm6 n GLU 45 Cb 0.42 -2.75 0.00 0.00 1.43 0.00 0.00 31.44 30.54 1pm6 n GLU 45 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1pm6 n SER 46 N 7.10 0.00 -4.66 -1.84 2.88 -1.26 -4.91 113.62 110.93 1pm6 n SER 46 Ca 0.46 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.58 1pm6 n SER 46 Cb 0.35 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.78 1pm6 n SER 46 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pm6 s ALA 47 N 0.00 3.53 0.08 -1.46 0.00 -0.74 -4.72 121.76 118.45 1pm6 s ALA 47 Ca 0.00 1.28 0.06 0.00 0.00 0.00 0.00 51.96 53.30 1pm6 s ALA 47 Cb 0.00 -3.86 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 1pm6 s ALA 47 CO 0.00 -1.65 -0.16 0.14 0.00 0.00 0.00 175.76 174.09 1pm6 s VAL 48 N 4.69 1.28 -0.40 0.00 -7.23 -0.89 -4.84 120.40 113.01 1pm6 s VAL 48 Ca 0.89 -1.39 -0.28 0.00 -1.81 0.00 0.00 61.98 59.40 1pm6 s VAL 48 Cb -0.42 -1.22 -0.03 0.00 0.56 0.00 0.00 36.38 35.27 1pm6 s VAL 48 CO 0.41 -0.19 1.97 -1.59 -0.31 0.00 0.00 175.10 175.39 1pm6 s LYS 49 N -1.82 2.97 -0.63 4.82 0.00 -1.26 -1.23 119.74 122.60 1pm6 s LYS 49 Ca 0.01 1.34 -0.27 0.00 0.00 0.00 0.00 55.97 57.05 1pm6 s LYS 49 Cb -0.10 -4.32 -0.00 0.00 0.00 0.00 0.00 37.83 33.41 1pm6 s LYS 49 CO 0.03 -2.29 1.61 0.54 0.00 0.00 0.00 175.35 175.24 1pm6 s VAL 50 N 8.34 3.54 -0.68 1.79 0.11 0.09 -4.95 120.40 128.65 1pm6 s VAL 50 Ca 0.83 0.36 -0.27 0.00 -2.93 0.00 0.00 61.98 59.97 1pm6 s VAL 50 Cb -0.21 -4.30 0.00 0.00 -1.53 0.00 0.00 36.38 30.34 1pm6 s VAL 50 CO 0.30 -1.21 1.58 -0.62 -3.33 0.00 0.00 175.10 171.82 1pm6 s ASP 51 N 6.11 5.70 -0.69 3.54 2.15 -1.26 -4.95 116.67 127.27 1pm6 s ASP 51 Ca 0.56 -0.06 -0.26 0.00 0.43 0.00 0.00 52.55 53.21 1pm6 s ASP 51 Cb -0.11 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 39.94 1pm6 s ASP 51 CO 0.20 -2.12 1.83 -0.22 -0.17 0.00 0.00 175.17 174.70 1pm6 s LEU 52 N 7.46 3.26 -0.10 -1.34 0.20 -1.26 -4.95 118.68 121.94 1pm6 s LEU 52 Ca 0.52 0.03 0.02 0.00 0.69 0.00 0.00 54.13 55.38 1pm6 s LEU 52 Cb -0.10 -2.54 0.01 0.00 -0.43 0.00 0.00 46.19 43.13 1pm6 s LEU 52 CO 0.17 -2.41 -0.15 0.21 -0.29 0.00 0.00 176.35 173.89 1pm6 s ASN 53 N 7.75 2.37 0.35 3.68 2.47 -1.26 -5.13 114.94 125.17 1pm6 s ASN 53 Ca 0.65 -0.41 -0.28 0.00 0.42 0.00 0.00 52.86 53.24 1pm6 s ASN 53 Cb -0.11 -1.06 -0.11 0.00 -1.45 0.00 0.00 41.25 38.52 1pm6 s ASN 53 CO 0.15 0.02 1.42 0.00 -3.72 0.00 0.00 177.10 174.97 1pm6 s ARG 54 N 0.95 4.21 -0.47 0.43 1.04 -1.26 -4.95 118.95 118.90 1pm6 s ARG 54 Ca -0.08 2.43 -0.28 0.00 -1.04 0.00 0.00 55.73 56.77 1pm6 s ARG 54 Cb -0.15 -3.01 -0.00 0.00 -2.04 0.00 0.00 34.95 29.75 1pm6 s ARG 54 CO -0.01 -0.41 1.58 -1.25 -0.04 0.00 0.00 175.30 175.17 1pm6 s PRO 55 N -1.86 3.29 -0.12 3.89 0.04 -1.26 -4.98 135.00 134.00 1pm6 s PRO 55 Ca 0.52 0.86 -0.11 0.00 0.04 0.00 0.00 61.00 62.31 1pm6 s PRO 55 Cb -0.44 -4.15 0.03 0.00 0.04 0.00 0.00 34.50 29.98 1pm6 s PRO 55 CO 0.58 -1.93 0.31 0.54 0.04 0.00 0.00 177.00 176.54 1pm6 s VAL 56 N 6.55 -0.00 0.12 -0.36 0.11 -1.26 -5.18 120.40 120.38 1pm6 s VAL 56 Ca 0.64 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.74 1pm6 s VAL 56 Cb -0.15 -0.44 -0.04 0.00 -1.53 0.00 0.00 36.38 34.22 1pm6 s VAL 56 CO 0.29 0.00 -0.11 0.28 -3.33 0.00 0.00 175.10 172.23 1pm6 s THR 57 N 0.20 1.12 0.57 5.04 -1.32 -1.26 -5.18 115.64 114.80 1pm6 s THR 57 Ca -0.00 -1.80 0.08 0.00 -1.21 0.00 0.00 61.69 58.76 1pm6 s THR 57 Cb -0.02 -1.56 0.08 0.00 -1.51 0.00 0.00 72.50 69.48 1pm6 s THR 57 CO 0.00 -0.58 0.78 -0.83 -2.21 0.00 0.00 174.62 171.78 1pm6 s GLY 58 N -2.68 1.77 0.03 6.08 0.00 -1.26 -5.16 107.32 106.09 1pm6 s GLY 58 Ca 0.10 -2.01 -0.02 0.00 0.00 0.00 0.00 44.72 42.79 1pm6 s GLY 58 CO 0.01 -1.58 0.01 -0.45 0.00 0.00 0.00 173.10 171.09 1pm6 s SER 59 N -4.62 0.25 -0.07 1.64 0.15 -1.26 -5.17 113.70 104.61 1pm6 s SER 59 Ca 0.61 -0.56 0.01 0.00 0.70 0.00 0.00 55.95 56.72 1pm6 s SER 59 Cb -0.06 0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.42 1pm6 s SER 59 CO 0.39 -0.40 -0.09 -0.22 1.20 0.00 0.00 173.24 174.12 1pm6 s LEU 60 N -1.82 1.41 -0.12 3.45 2.96 -1.26 -5.14 118.68 118.15 1pm6 s LEU 60 Ca -0.10 -0.25 -0.01 0.00 -0.22 0.00 0.00 54.13 53.56 1pm6 s LEU 60 Cb -0.05 -0.72 0.03 0.00 0.50 0.00 0.00 46.19 45.96 1pm6 s LEU 60 CO -0.03 -0.03 -0.05 -0.22 -1.32 0.00 0.00 176.35 174.70 1pm6 s LEU 61 N 1.03 1.18 0.30 -0.68 2.96 -1.26 -5.15 118.68 117.05 1pm6 s LEU 61 Ca -0.08 -0.38 -0.11 0.00 -0.22 0.00 0.00 54.13 53.34 1pm6 s LEU 61 Cb -0.15 -0.77 -0.07 0.00 0.50 0.00 0.00 46.19 45.71 1pm6 s LEU 61 CO -0.00 -0.16 0.64 -1.59 -1.32 0.00 0.00 176.35 173.92 1pm6 s LYS 62 N 1.75 3.84 0.38 1.98 -2.85 -1.26 -5.12 119.74 118.46 1pm6 s LYS 62 Ca 0.04 0.40 -0.10 0.00 -1.00 0.00 0.00 55.97 55.30 1pm6 s LYS 62 Cb -0.13 -2.54 -0.07 0.00 -2.06 0.00 0.00 37.83 33.03 1pm6 s LYS 62 CO -0.07 0.19 0.73 -0.98 0.10 0.00 0.00 175.35 175.32 1pm6 s ARG 63 N -3.13 3.79 0.04 1.78 1.70 -1.26 -5.12 118.95 116.75 1pm6 s ARG 63 Ca 0.50 0.44 -0.01 0.00 -0.47 0.00 0.00 55.73 56.19 1pm6 s ARG 63 Cb -0.11 -2.43 -0.04 0.00 -0.57 0.00 0.00 34.95 31.80 1pm6 s ARG 63 CO 0.23 0.03 0.20 -1.50 -1.08 0.00 0.00 175.30 173.17 1pm6 s ILE 64 N -2.27 5.38 -0.24 4.99 2.07 -1.26 -5.12 121.20 124.74 1pm6 s ILE 64 Ca 0.51 -0.34 0.00 0.00 -1.41 0.00 0.00 60.65 59.41 1pm6 s ILE 64 Cb -0.10 -3.59 0.07 0.00 0.13 0.00 0.00 42.46 38.96 1pm6 s ILE 64 CO 0.29 0.19 -0.03 -0.60 -1.91 0.00 0.00 174.94 172.88 1pm6 s ARG 65 N -2.35 1.46 0.27 3.50 3.00 -1.26 -5.14 118.95 118.43 1pm6 s ARG 65 Ca 0.33 -0.99 -0.14 0.00 -1.00 0.00 0.00 55.73 53.93 1pm6 s ARG 65 Cb -0.13 -2.54 -0.08 0.00 0.00 0.00 0.00 34.95 32.20 1pm6 s ARG 65 CO 0.25 -0.65 0.66 0.54 0.00 0.00 0.00 175.30 176.10 1pm6 s ASN 66 N 1.43 6.75 0.00 -2.12 4.22 -1.26 -5.12 114.94 118.84 1pm6 s ASN 66 Ca -0.03 1.16 0.00 0.00 -2.14 0.00 0.00 52.86 51.85 1pm6 s ASN 66 Cb -0.19 -2.32 0.00 0.00 1.28 0.00 0.00 41.25 40.02 1pm6 s ASN 66 CO -0.08 -0.12 0.00 0.61 -2.04 0.00 0.00 177.10 175.47 1pm6 n GLY 67 N -0.10 2.15 3.35 0.45 0.00 -1.26 -5.18 105.19 104.59 1pm6 n GLY 67 Ca 0.01 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.07 1pm6 n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pm6 s LYS 68 N 4.00 1.15 0.06 1.61 0.00 -1.26 -5.19 119.74 120.10 1pm6 s LYS 68 Ca 0.00 -1.09 0.02 0.00 0.00 0.00 0.00 55.97 54.90 1pm6 s LYS 68 Cb 0.00 0.40 -0.03 0.00 0.00 0.00 0.00 37.83 38.20 1pm6 s LYS 68 CO 0.00 -0.43 -0.08 -1.59 0.00 0.00 0.00 175.35 173.25 1pm6 s LYS 69 N -3.94 0.61 0.14 1.78 -2.85 -1.26 -5.18 119.74 109.04 1pm6 s LYS 69 Ca 0.14 -0.90 0.08 0.00 -1.00 0.00 0.00 55.97 54.30 1pm6 s LYS 69 Cb 0.03 -0.31 -0.04 0.00 -2.06 0.00 0.00 37.83 35.45 1pm6 s LYS 69 CO -0.02 0.04 -0.19 0.00 0.10 0.00 0.00 175.35 175.29 1pm6 s ALA 70 N -1.86 1.86 -0.01 0.59 0.00 -1.26 -5.10 121.76 115.98 1pm6 s ALA 70 Ca -0.05 -1.37 -0.23 0.00 0.00 0.00 0.00 51.96 50.31 1pm6 s ALA 70 Cb -0.07 -0.19 -0.15 0.00 0.00 0.00 0.00 23.12 22.72 1pm6 s ALA 70 CO -0.01 0.26 1.03 -0.22 0.00 0.00 0.00 175.76 176.83 1pm6 h LYS 71 N 3.58 -0.47 -0.03 0.00 3.64 -2.11 -3.59 116.57 117.61 1pm6 h LYS 71 Ca -0.43 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1pm6 h LYS 71 Cb 1.20 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 1pm6 h LYS 71 CO 0.47 -0.15 0.00 -1.13 -2.27 0.00 0.00 179.45 176.37