#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dv5 s ASP 3 N 0.00 3.87 0.00 0.00 1.11 -1.26 -4.97 116.67 115.43 1dv5 s ASP 3 Ca 0.00 0.49 0.27 0.00 0.18 0.00 0.00 52.55 53.49 1dv5 s ASP 3 Cb 0.00 -0.78 0.80 0.00 1.07 0.00 0.00 42.92 44.01 1dv5 s ASP 3 CO 0.00 -2.27 1.60 1.21 1.18 0.00 0.00 175.17 176.89 1dv5 n GLU 4 N -3.49 0.63 0.07 8.23 4.07 -1.26 -3.51 120.64 125.39 1dv5 n GLU 4 Ca 0.12 -0.34 0.12 0.00 -0.06 0.00 0.00 57.16 56.99 1dv5 n GLU 4 Cb 0.60 -1.49 0.46 0.00 -0.06 0.00 0.00 31.44 30.95 1dv5 n GLU 4 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1dv5 n ALA 5 N -0.89 2.01 -0.10 4.31 0.00 -1.26 -1.12 120.51 123.47 1dv5 n ALA 5 Ca 0.11 -0.01 -0.22 0.00 0.00 0.00 0.00 53.44 53.32 1dv5 n ALA 5 Cb 0.33 -1.41 -0.12 0.00 0.00 0.00 0.00 19.45 18.26 1dv5 n ALA 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1dv5 n ILE 6 N -1.98 1.56 -0.09 0.00 5.41 -1.23 -1.85 119.36 121.18 1dv5 n ILE 6 Ca 0.04 -0.11 -0.03 0.00 1.00 0.00 0.00 62.75 63.65 1dv5 n ILE 6 Cb 0.31 -2.00 0.19 0.00 -0.71 0.00 0.00 39.64 37.43 1dv5 n ILE 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1dv5 h LYS 7 N -0.89 0.75 0.10 0.38 3.11 -1.70 0.46 116.57 118.79 1dv5 h LYS 7 Ca -0.38 -0.18 -0.00 0.00 -2.81 0.00 0.00 60.65 57.28 1dv5 h LYS 7 Cb 1.40 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 32.53 1dv5 h LYS 7 CO -0.19 0.74 -0.05 -0.97 -2.81 0.00 0.00 179.45 176.17 1dv5 h ASN 8 N 0.71 -0.11 -0.59 4.20 -0.73 -1.29 -2.46 115.58 115.31 1dv5 h ASN 8 Ca 0.15 -0.45 0.08 0.00 1.87 0.00 0.00 56.30 57.95 1dv5 h ASN 8 Cb 0.39 0.03 -0.06 0.00 0.27 0.00 0.00 38.32 38.94 1dv5 h ASN 8 CO 0.01 0.53 0.26 1.23 -0.37 0.00 0.00 177.43 179.09 1dv5 h GLY 9 N -0.90 0.84 0.83 1.57 0.00 -1.29 1.14 103.07 105.26 1dv5 h GLY 9 Ca -0.01 -0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.19 1dv5 h GLY 9 CO 0.02 0.04 0.27 -2.08 0.00 0.00 0.00 176.54 174.80 1dv5 h VAL 10 N 0.47 1.02 -0.49 4.60 2.07 -0.16 1.47 116.25 125.23 1dv5 h VAL 10 Ca 0.29 -0.19 -0.13 0.00 0.82 0.00 0.00 66.70 67.49 1dv5 h VAL 10 Cb 0.29 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1dv5 h VAL 10 CO -0.25 0.10 -0.21 0.25 0.02 0.00 0.00 177.57 177.48 1dv5 h LEU 11 N 0.54 1.03 -0.38 2.57 6.46 -0.74 -0.55 115.31 124.23 1dv5 h LEU 11 Ca 0.20 -0.39 -0.05 0.00 -0.12 0.00 0.00 57.88 57.53 1dv5 h LEU 11 Cb 0.06 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 1dv5 h LEU 11 CO -0.11 1.19 0.06 -0.78 -0.62 0.00 0.00 178.44 178.18 1dv5 h ASP 12 N 0.87 0.61 0.66 1.25 3.58 0.21 0.54 116.42 124.14 1dv5 h ASP 12 Ca 0.11 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.30 1dv5 h ASP 12 Cb 0.79 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1dv5 h ASP 12 CO 0.07 0.72 0.00 -0.38 -2.88 0.00 0.00 179.24 176.76 1dv5 n ILE 13 N -4.54 0.85 -0.04 2.25 5.41 0.49 -1.02 119.36 122.77 1dv5 n ILE 13 Ca -0.01 0.28 -0.01 0.00 1.00 0.00 0.00 62.75 64.01 1dv5 n ILE 13 Cb 0.23 -1.22 -0.00 0.00 -0.71 0.00 0.00 39.64 37.94 1dv5 n ILE 13 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1dv5 h LEU 14 N 0.00 0.00 -2.45 1.39 -0.00 0.04 -2.42 115.31 111.87 1dv5 h LEU 14 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.90 1dv5 h LEU 14 Cb 0.33 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.99 1dv5 h LEU 14 CO 0.00 0.38 0.15 0.00 -0.00 0.00 0.00 178.44 178.98 1dv5 h ALA 15 N -1.35 1.39 0.12 1.53 0.00 -0.91 0.18 119.26 120.23 1dv5 h ALA 15 Ca 0.00 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 1dv5 h ALA 15 Cb 0.12 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.94 1dv5 h ALA 15 CO 0.00 -0.18 -1.13 0.22 0.00 0.00 0.00 179.25 178.16 1dv5 h ASP 16 N 0.00 0.78 0.34 0.00 1.82 -1.19 1.44 116.42 119.61 1dv5 h ASP 16 Ca 0.03 -0.84 -0.02 0.00 -0.39 0.00 0.00 57.03 55.81 1dv5 h ASP 16 Cb 0.33 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 40.10 1dv5 h ASP 16 CO -0.00 1.55 -0.17 0.25 -1.61 0.00 0.00 179.24 179.26 1dv5 h LEU 17 N 0.13 -0.39 0.05 2.28 6.46 -0.16 -3.25 115.31 120.42 1dv5 h LEU 17 Ca -0.18 -0.02 -0.09 0.00 -0.12 0.00 0.00 57.88 57.47 1dv5 h LEU 17 Cb 1.83 0.10 0.01 0.00 -0.73 0.00 0.00 40.66 41.87 1dv5 h LEU 17 CO 0.22 -0.24 -0.39 0.71 -0.62 0.00 0.00 178.44 178.11 1dv5 h THR 18 N -0.51 1.60 0.00 1.05 1.35 -1.36 -3.49 112.91 111.56 1dv5 h THR 18 Ca -0.05 -2.26 0.00 0.00 -0.55 0.00 0.00 66.41 63.55 1dv5 h THR 18 Cb 0.38 3.07 0.00 0.00 -1.73 0.00 0.00 68.15 69.87 1dv5 h THR 18 CO 0.08 0.62 0.00 0.61 -0.25 0.00 0.00 175.52 176.58 1dv5 n GLY 19 N 1.41 0.88 3.64 5.82 0.00 0.49 -5.03 105.19 112.39 1dv5 n GLY 19 Ca -0.11 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 1dv5 n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dv5 s SER 20 N -2.10 3.98 -0.15 1.61 0.01 -1.10 -4.98 113.70 110.98 1dv5 s SER 20 Ca 0.00 -1.33 0.14 0.00 1.31 0.00 0.00 55.95 56.08 1dv5 s SER 20 Cb 0.00 -0.39 -0.20 0.00 0.21 0.00 0.00 66.02 65.64 1dv5 s SER 20 CO 0.00 -0.48 0.08 -0.67 0.41 0.00 0.00 173.24 172.59 1dv5 n ASP 21 N -1.03 1.07 -0.32 2.44 2.03 -1.26 -4.13 116.55 115.35 1dv5 n ASP 21 Ca -0.05 0.00 0.18 0.00 0.52 0.00 0.00 54.79 55.44 1dv5 n ASP 21 Cb 0.67 0.97 0.36 0.00 -0.72 0.00 0.00 41.12 42.40 1dv5 n ASP 21 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1dv5 h ASP 22 N 0.00 -0.09 0.49 1.67 3.32 -1.97 1.60 116.42 121.45 1dv5 h ASP 22 Ca -0.39 0.24 -0.23 0.00 0.02 0.00 0.00 57.03 56.66 1dv5 h ASP 22 Cb 1.87 0.34 -0.00 0.00 0.22 0.00 0.00 39.33 41.76 1dv5 h ASP 22 CO 0.02 -0.28 -1.01 1.62 -1.72 0.00 0.00 179.24 177.86 1dv5 h VAL 23 N 0.10 1.46 -0.31 -1.35 3.04 -1.81 0.36 116.25 117.74 1dv5 h VAL 23 Ca 0.64 -2.68 0.09 0.00 -1.01 0.00 0.00 66.70 63.73 1dv5 h VAL 23 Cb 1.41 2.59 -0.01 0.00 -2.01 0.00 0.00 31.29 33.26 1dv5 h VAL 23 CO -0.77 0.79 0.32 0.50 -1.01 0.00 0.00 177.57 177.40 1dv5 h LYS 24 N 0.15 0.00 0.00 4.17 3.11 0.20 -3.17 116.57 121.04 1dv5 h LYS 24 Ca -0.09 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.75 1dv5 h LYS 24 Cb 1.68 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.91 1dv5 h LYS 24 CO 0.17 0.00 -0.27 1.17 -2.81 0.00 0.00 179.45 177.71 1dv5 n LYS 25 N -3.83 0.15 -1.68 1.90 0.00 0.23 -4.95 118.16 109.97 1dv5 n LYS 25 Ca 0.05 0.07 -0.45 0.00 0.00 0.00 0.00 58.31 57.97 1dv5 n LYS 25 Cb 0.47 -0.76 -0.03 0.00 0.00 0.00 0.00 35.03 34.71 1dv5 n LYS 25 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1dv5 n ASN 26 N -3.04 3.12 -2.04 3.14 3.02 0.10 -4.87 115.26 114.69 1dv5 n ASN 26 Ca -0.04 1.11 -0.26 0.00 -0.03 0.00 0.00 54.58 55.37 1dv5 n ASN 26 Cb 0.14 -1.46 0.10 0.00 -0.61 0.00 0.00 39.78 37.95 1dv5 n ASN 26 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1dv5 n LEU 27 N 2.86 6.29 -1.00 3.41 4.77 -1.26 -4.26 117.00 127.81 1dv5 n LEU 27 Ca 0.14 -4.22 -0.04 0.00 -0.03 0.00 0.00 56.01 51.86 1dv5 n LEU 27 Cb 0.31 -0.75 -0.03 0.00 -2.33 0.00 0.00 43.42 40.62 1dv5 n LEU 27 CO 0.63 1.53 0.26 -0.67 -1.33 0.00 0.00 177.39 177.81 1dv5 n ASP 28 N -0.94 -0.67 -4.44 -1.43 2.03 -1.26 -3.56 116.55 106.27 1dv5 n ASP 28 Ca 0.53 -1.34 -0.43 0.00 0.52 0.00 0.00 54.79 54.07 1dv5 n ASP 28 Cb 0.94 0.22 -0.04 0.00 -0.72 0.00 0.00 41.12 41.53 1dv5 n ASP 28 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1dv5 s LEU 29 N -0.33 4.51 -0.28 -2.67 2.96 -1.26 -4.97 118.68 116.64 1dv5 s LEU 29 Ca 0.01 -1.04 -0.41 0.00 -0.22 0.00 0.00 54.13 52.47 1dv5 s LEU 29 Cb 0.04 -2.41 -0.18 0.00 0.50 0.00 0.00 46.19 44.13 1dv5 s LEU 29 CO -0.01 -1.40 1.28 0.59 -1.32 0.00 0.00 176.35 175.49 1dv5 n ASN 30 N 7.53 0.68 -0.20 3.68 5.03 -1.26 -4.60 115.26 126.12 1dv5 n ASN 30 Ca -0.05 1.08 0.15 0.00 0.87 0.00 0.00 54.58 56.63 1dv5 n ASN 30 Cb 0.45 -0.82 0.69 0.00 -1.02 0.00 0.00 39.78 39.08 1dv5 n ASN 30 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1dv5 n LEU 31 N 2.79 0.65 0.00 3.41 4.77 0.56 -2.78 117.00 126.40 1dv5 n LEU 31 Ca 0.25 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1dv5 n LEU 31 Cb -0.01 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1dv5 n LEU 31 CO 0.72 0.11 -0.41 0.49 -1.33 0.00 0.00 177.39 176.97 1dv5 n PHE 32 N -0.61 0.00 0.37 -1.77 3.01 -1.26 0.13 117.46 117.33 1dv5 n PHE 32 Ca 0.19 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.78 1dv5 n PHE 32 Cb 0.25 0.02 0.54 0.00 -0.01 0.00 0.00 39.48 40.28 1dv5 n PHE 32 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1dv5 h GLU 33 N 0.00 0.00 0.00 -1.08 4.81 -1.93 -1.86 114.58 114.52 1dv5 h GLU 33 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1dv5 h GLU 33 Cb 0.82 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1dv5 h GLU 33 CO 0.00 0.00 -1.06 2.41 -0.73 0.00 0.00 179.01 179.63 1dv5 n THR 34 N -2.47 0.02 -1.08 0.32 -1.04 -1.12 -4.95 114.28 103.96 1dv5 n THR 34 Ca 0.02 -0.10 -0.03 0.00 -2.04 0.00 0.00 64.05 61.90 1dv5 n THR 34 Cb 0.25 0.67 -0.01 0.00 -1.82 0.00 0.00 70.33 69.43 1dv5 n THR 34 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1dv5 n GLY 35 N 1.45 0.61 0.15 3.41 0.00 -0.70 -4.90 105.19 105.21 1dv5 n GLY 35 Ca 0.03 -0.54 -0.12 0.00 0.00 0.00 0.00 46.02 45.39 1dv5 n GLY 35 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dv5 h LEU 36 N 0.00 0.47 -9.76 0.99 3.38 -1.81 -3.45 115.31 105.13 1dv5 h LEU 36 Ca -0.06 -0.36 -0.55 0.00 0.09 0.00 0.00 57.88 57.00 1dv5 h LEU 36 Cb 0.27 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.80 1dv5 h LEU 36 CO 0.09 1.15 -0.56 -0.22 0.09 0.00 0.00 178.44 178.99 1dv5 s LEU 37 N -7.70 3.23 0.10 1.67 0.20 0.35 -4.58 118.68 111.95 1dv5 s LEU 37 Ca -0.05 -0.77 0.00 0.00 0.69 0.00 0.00 54.13 54.00 1dv5 s LEU 37 Cb 0.09 -1.71 0.00 0.00 -0.43 0.00 0.00 46.19 44.15 1dv5 s LEU 37 CO 0.85 -0.25 0.00 -0.90 -0.29 0.00 0.00 176.35 175.76 1dv5 n ASP 38 N -1.10 0.78 0.00 3.68 5.75 -1.26 -4.68 116.55 119.72 1dv5 n ASP 38 Ca -0.04 0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.89 1dv5 n ASP 38 Cb 0.61 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.50 1dv5 n ASP 38 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1dv5 n SER 39 N -3.31 0.00 0.16 -1.12 3.41 -1.26 -4.95 113.62 106.55 1dv5 n SER 39 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.64 1dv5 n SER 39 Cb 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.13 1dv5 n SER 39 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1dv5 h MET 40 N 0.00 0.00 0.20 4.33 2.86 -2.01 -3.29 114.93 117.01 1dv5 h MET 40 Ca 0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1dv5 h MET 40 Cb 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1dv5 h MET 40 CO 0.00 0.49 -0.32 0.78 1.06 0.00 0.00 176.91 178.92 1dv5 h GLY 41 N 2.63 -0.67 -0.46 8.32 0.00 -1.97 -2.19 103.07 108.73 1dv5 h GLY 41 Ca -0.00 0.38 0.20 0.00 0.00 0.00 0.00 47.33 47.90 1dv5 h GLY 41 CO 0.06 -0.26 0.05 0.00 0.00 0.00 0.00 176.54 176.39 1dv5 h THR 42 N -0.60 0.29 -0.47 4.70 1.03 -1.98 0.23 112.91 116.11 1dv5 h THR 42 Ca 0.01 -0.04 0.09 0.00 -0.01 0.00 0.00 66.41 66.46 1dv5 h THR 42 Cb 0.59 0.17 -0.10 0.00 -1.07 0.00 0.00 68.15 67.74 1dv5 h THR 42 CO -0.14 0.02 -0.33 0.58 -0.01 0.00 0.00 175.52 175.65 1dv5 h VAL 43 N 0.11 0.21 0.12 0.00 2.07 -1.53 0.12 116.25 117.35 1dv5 h VAL 43 Ca 0.46 0.00 0.02 0.00 0.82 0.00 0.00 66.70 68.00 1dv5 h VAL 43 Cb 0.86 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1dv5 h VAL 43 CO -0.70 0.00 -0.25 -0.61 0.02 0.00 0.00 177.57 176.02 1dv5 h GLN 44 N -0.21 -0.44 -1.01 1.57 4.15 -0.40 -0.78 115.11 117.98 1dv5 h GLN 44 Ca 0.20 0.03 0.30 0.00 0.77 0.00 0.00 58.65 59.94 1dv5 h GLN 44 Cb 0.54 0.10 -0.14 0.00 0.21 0.00 0.00 27.48 28.19 1dv5 h GLN 44 CO -0.59 -0.30 0.59 1.25 -1.93 0.00 0.00 178.83 177.85 1dv5 h LEU 45 N -0.46 0.56 -0.88 -2.39 5.85 -0.01 1.49 115.31 119.46 1dv5 h LEU 45 Ca 0.03 0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 1dv5 h LEU 45 Cb 0.48 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 1dv5 h LEU 45 CO -0.14 -0.05 0.28 -0.07 -0.34 0.00 0.00 178.44 178.12 1dv5 h LEU 46 N 0.41 1.02 -0.79 2.25 3.38 0.60 0.37 115.31 122.53 1dv5 h LEU 46 Ca 0.70 -0.16 0.11 0.00 0.09 0.00 0.00 57.88 58.62 1dv5 h LEU 46 Cb 1.55 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 41.96 1dv5 h LEU 46 CO -0.55 0.91 0.42 0.25 0.09 0.00 0.00 178.44 179.57 1dv5 h LEU 47 N 1.07 0.57 0.00 1.67 7.12 0.29 1.05 115.31 127.09 1dv5 h LEU 47 Ca 0.25 0.06 -0.07 0.00 0.13 0.00 0.00 57.88 58.25 1dv5 h LEU 47 Cb 0.22 -0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.30 1dv5 h LEU 47 CO -0.02 0.31 -0.43 -0.33 -0.13 0.00 0.00 178.44 177.84 1dv5 h GLU 48 N 0.69 0.00 -0.00 1.25 3.07 -0.79 -3.04 114.58 115.76 1dv5 h GLU 48 Ca 0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 1dv5 h GLU 48 Cb 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1dv5 h GLU 48 CO -0.28 0.28 -0.18 -0.11 -1.40 0.00 0.00 179.01 177.32 1dv5 n LEU 49 N -3.12 0.34 -0.72 1.33 7.94 0.12 -2.28 117.00 120.61 1dv5 n LEU 49 Ca 0.02 0.15 0.07 0.00 -1.11 0.00 0.00 56.01 55.14 1dv5 n LEU 49 Cb 0.66 -0.30 0.20 0.00 0.53 0.00 0.00 43.42 44.51 1dv5 n LEU 49 CO 0.38 0.07 0.66 1.67 -1.11 0.00 0.00 177.39 179.07 1dv5 n GLN 50 N -1.26 2.88 0.08 1.96 7.27 0.34 0.21 117.38 128.84 1dv5 n GLN 50 Ca 0.10 -2.39 0.00 0.00 0.07 0.00 0.00 57.00 54.77 1dv5 n GLN 50 Cb 0.31 -1.52 0.00 0.00 2.41 0.00 0.00 30.24 31.44 1dv5 n GLN 50 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1dv5 n SER 51 N -0.01 0.62 0.20 1.69 7.64 -1.18 -4.04 113.62 118.53 1dv5 n SER 51 Ca 0.16 0.24 0.09 0.00 1.01 0.00 0.00 58.87 60.37 1dv5 n SER 51 Cb 0.63 -0.07 0.21 0.00 -1.01 0.00 0.00 64.21 63.97 1dv5 n SER 51 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1dv5 h GLN 52 N 0.00 0.00 0.00 1.43 1.08 -1.73 -3.36 115.11 112.53 1dv5 h GLN 52 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1dv5 h GLN 52 Cb 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1dv5 h GLN 52 CO 0.00 0.18 -0.97 1.19 -0.95 0.00 0.00 178.83 178.29 1dv5 n PHE 53 N -3.17 0.00 -2.67 2.96 3.01 -1.25 -5.02 117.46 111.31 1dv5 n PHE 53 Ca 0.03 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.41 1dv5 n PHE 53 Cb 0.56 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 40.06 1dv5 n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dv5 n GLY 54 N 3.22 0.27 3.83 1.37 0.00 0.04 -4.91 105.19 109.01 1dv5 n GLY 54 Ca 0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 1dv5 n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dv5 s VAL 55 N -3.12 3.20 -0.15 1.61 0.11 0.55 -4.86 120.40 117.74 1dv5 s VAL 55 Ca 0.09 0.39 0.17 0.00 -2.93 0.00 0.00 61.98 59.70 1dv5 s VAL 55 Cb -0.04 -3.22 0.44 0.00 -1.53 0.00 0.00 36.38 32.02 1dv5 s VAL 55 CO 0.26 -0.51 1.19 -0.67 -3.33 0.00 0.00 175.10 172.04 1dv5 n ASP 56 N -3.28 1.80 -4.63 3.54 -0.08 -1.26 -4.50 116.55 108.13 1dv5 n ASP 56 Ca 0.07 -3.00 -0.45 0.00 -1.51 0.00 0.00 54.79 49.90 1dv5 n ASP 56 Cb 0.57 -0.42 -0.04 0.00 2.34 0.00 0.00 41.12 43.57 1dv5 n ASP 56 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1dv5 n ALA 57 N -0.42 1.35 -2.42 -1.67 0.00 -1.26 -4.89 120.51 111.19 1dv5 n ALA 57 Ca 0.16 0.08 -0.43 0.00 0.00 0.00 0.00 53.44 53.26 1dv5 n ALA 57 Cb 0.90 -2.67 -0.02 0.00 0.00 0.00 0.00 19.45 17.66 1dv5 n ALA 57 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1dv5 s PRO 58 N 5.03 4.26 0.00 0.00 0.04 -1.26 -4.88 135.00 138.19 1dv5 s PRO 58 Ca 0.96 1.68 0.22 0.00 0.04 0.00 0.00 61.00 63.89 1dv5 s PRO 58 Cb -0.54 -3.72 0.99 0.00 0.04 0.00 0.00 34.50 31.26 1dv5 s PRO 58 CO 0.44 -0.66 1.67 0.28 0.04 0.00 0.00 177.00 178.78 1dv5 n VAL 59 N 5.21 0.10 -0.31 -0.36 0.31 -1.26 -3.05 118.33 118.97 1dv5 n VAL 59 Ca 0.13 -0.19 0.05 0.00 -0.01 0.00 0.00 64.34 64.32 1dv5 n VAL 59 Cb 0.45 0.09 0.20 0.00 -0.91 0.00 0.00 33.84 33.67 1dv5 n VAL 59 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1dv5 h SER 60 N 1.29 0.70 0.00 4.52 4.64 -2.01 -3.40 113.55 119.30 1dv5 h SER 60 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1dv5 h SER 60 Cb 0.28 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1dv5 h SER 60 CO 0.00 0.38 0.00 1.21 -0.87 0.00 0.00 176.83 177.55 1dv5 n GLU 61 N -4.74 0.00 -0.03 4.77 2.13 -1.25 -5.17 120.64 116.35 1dv5 n GLU 61 Ca 0.16 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.96 1dv5 n GLU 61 Cb 0.33 0.00 0.02 0.00 0.27 0.00 0.00 31.44 32.05 1dv5 n GLU 61 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1dv5 n PHE 62 N 0.00 -1.42 -3.15 4.31 1.16 -1.17 -4.84 117.46 112.34 1dv5 n PHE 62 Ca 0.00 -0.02 -0.45 0.00 -1.87 0.00 0.00 57.45 55.10 1dv5 n PHE 62 Cb 0.00 -0.10 -0.02 0.00 -1.61 0.00 0.00 39.48 37.75 1dv5 n PHE 62 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1dv5 s ASP 63 N -1.70 6.76 0.55 5.98 1.47 -1.26 -4.86 116.67 123.60 1dv5 s ASP 63 Ca 0.03 -2.51 0.40 0.00 1.18 0.00 0.00 52.55 51.65 1dv5 s ASP 63 Cb -0.01 -2.29 1.60 0.00 -0.34 0.00 0.00 42.92 41.88 1dv5 s ASP 63 CO 0.03 -0.75 1.75 0.08 0.68 0.00 0.00 175.17 176.95 1dv5 h ARG 64 N 8.09 0.00 -0.35 2.11 0.11 -1.91 1.88 114.38 124.31 1dv5 h ARG 64 Ca 0.14 -0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.22 1dv5 h ARG 64 Cb 1.02 -0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.08 1dv5 h ARG 64 CO 0.93 0.00 0.20 -0.22 0.10 0.00 0.00 179.97 180.98 1dv5 h LYS 65 N 0.00 0.47 0.00 0.08 1.63 -1.98 1.58 116.57 118.34 1dv5 h LYS 65 Ca 0.66 -0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 60.32 1dv5 h LYS 65 Cb 2.65 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 34.16 1dv5 h LYS 65 CO -0.01 0.34 -1.09 1.49 -3.45 0.00 0.00 179.45 176.73 1dv5 h GLU 66 N 0.48 0.00 -0.47 1.90 4.81 0.25 -3.28 114.58 118.27 1dv5 h GLU 66 Ca 0.13 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.27 1dv5 h GLU 66 Cb -0.00 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.33 1dv5 h GLU 66 CO -0.02 0.23 0.07 0.91 -0.73 0.00 0.00 179.01 179.47 1dv5 n TRP 67 N -2.89 1.63 -0.06 0.92 7.02 -0.43 -2.55 117.44 121.08 1dv5 n TRP 67 Ca -0.05 -1.03 -0.19 0.00 -1.02 0.00 0.00 57.50 55.21 1dv5 n TRP 67 Cb 0.73 -0.49 -0.13 0.00 -2.42 0.00 0.00 31.31 29.00 1dv5 n TRP 67 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 1dv5 n ASP 68 N -0.27 1.97 -4.70 -0.99 2.03 0.53 -4.86 116.55 110.26 1dv5 n ASP 68 Ca 0.30 0.05 -0.23 0.00 0.52 0.00 0.00 54.79 55.43 1dv5 n ASP 68 Cb 1.12 -0.59 -0.07 0.00 -0.72 0.00 0.00 41.12 40.86 1dv5 n ASP 68 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1dv5 s THR 69 N -2.54 3.24 0.19 5.18 -4.23 -1.26 0.21 115.64 116.42 1dv5 s THR 69 Ca -0.27 -1.77 0.04 0.00 -1.18 0.00 0.00 61.69 58.50 1dv5 s THR 69 Cb 0.08 -2.94 -0.12 0.00 1.34 0.00 0.00 72.50 70.86 1dv5 s THR 69 CO 0.70 -0.26 1.44 1.55 -0.54 0.00 0.00 174.62 177.50 1dv5 h PRO 70 N 1.68 0.18 0.20 3.99 0.13 -1.82 -2.77 132.00 133.59 1dv5 h PRO 70 Ca -0.44 -0.17 -0.01 0.00 -0.87 0.00 0.00 66.00 64.51 1dv5 h PRO 70 Cb 1.25 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1dv5 h PRO 70 CO 0.62 0.88 -0.10 -0.97 -0.23 0.00 0.00 178.00 178.21 1dv5 h ASN 71 N 0.11 -0.23 -0.69 1.44 -1.24 -1.90 1.48 115.58 114.54 1dv5 h ASN 71 Ca -0.03 -0.23 0.15 0.00 0.71 0.00 0.00 56.30 56.89 1dv5 h ASN 71 Cb 1.39 0.06 -0.04 0.00 0.73 0.00 0.00 38.32 40.46 1dv5 h ASN 71 CO 0.12 0.13 0.47 0.11 -1.29 0.00 0.00 177.43 176.97 1dv5 h LYS 72 N -0.62 0.31 0.10 6.67 1.57 -1.77 0.31 116.57 123.13 1dv5 h LYS 72 Ca -0.03 -0.02 -0.14 0.00 -1.87 0.00 0.00 60.65 58.60 1dv5 h LYS 72 Cb 0.45 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.70 1dv5 h LYS 72 CO 0.05 0.20 -0.61 0.82 -0.57 0.00 0.00 179.45 179.34 1dv5 h ILE 73 N 0.32 1.57 -0.12 1.86 2.04 -1.20 -2.83 117.51 119.13 1dv5 h ILE 73 Ca 0.34 -2.47 0.04 0.00 1.00 0.00 0.00 64.86 63.76 1dv5 h ILE 73 Cb 0.87 3.22 -0.00 0.00 -0.74 0.00 0.00 36.82 40.17 1dv5 h ILE 73 CO -0.09 0.68 0.37 0.40 0.00 0.00 0.00 178.15 179.51 1dv5 h ILE 74 N -0.56 0.12 0.00 -0.67 2.04 0.35 1.53 117.51 120.31 1dv5 h ILE 74 Ca -0.11 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.62 1dv5 h ILE 74 Cb 1.45 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 1dv5 h ILE 74 CO 0.10 0.00 -1.31 0.00 0.00 0.00 0.00 178.15 176.94 1dv5 n ALA 75 N -2.03 2.09 -0.11 1.87 0.00 -0.04 -3.52 120.51 118.76 1dv5 n ALA 75 Ca 0.01 -0.46 -0.12 0.00 0.00 0.00 0.00 53.44 52.87 1dv5 n ALA 75 Cb 0.45 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 1dv5 n ALA 75 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1dv5 h LYS 76 N 0.00 0.68 -0.50 0.00 1.79 0.24 0.18 116.57 118.96 1dv5 h LYS 76 Ca -0.12 -0.28 -0.02 0.00 -2.18 0.00 0.00 60.65 58.06 1dv5 h LYS 76 Cb 1.43 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 32.03 1dv5 h LYS 76 CO 0.03 0.87 0.25 0.28 -1.08 0.00 0.00 179.45 179.80 1dv5 h VAL 77 N 0.45 1.19 -0.31 0.50 2.07 -1.42 -1.09 116.25 117.63 1dv5 h VAL 77 Ca 0.08 -0.51 -0.08 0.00 0.82 0.00 0.00 66.70 67.01 1dv5 h VAL 77 Cb 0.64 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1dv5 h VAL 77 CO 0.04 0.20 -0.16 -0.33 0.02 0.00 0.00 177.57 177.35 1dv5 h GLU 78 N 0.66 0.55 -0.96 1.57 4.39 -1.57 -2.07 114.58 117.16 1dv5 h GLU 78 Ca 0.17 -0.18 -0.31 0.00 0.34 0.00 0.00 59.36 59.38 1dv5 h GLU 78 Cb 0.10 -0.05 -0.19 0.00 -0.10 0.00 0.00 28.75 28.51 1dv5 h GLU 78 CO -0.02 0.69 0.39 1.04 -1.16 0.00 0.00 179.01 179.95 1dv5 n GLN 79 N -4.17 2.12 0.00 2.33 3.00 0.62 -4.00 117.38 117.27 1dv5 n GLN 79 Ca 0.00 -2.10 0.00 0.00 -0.01 0.00 0.00 57.00 54.90 1dv5 n GLN 79 Cb 0.36 -1.85 0.00 0.00 0.00 0.00 0.00 30.24 28.75 1dv5 n GLN 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1dv5 n ALA 80 N -0.50 2.64 0.00 -1.58 0.00 -0.47 -4.94 120.51 115.66 1dv5 n ALA 80 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1dv5 n ALA 80 Cb 1.26 0.34 0.00 0.00 0.00 0.00 0.00 19.45 21.05 1dv5 n ALA 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54