#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dn0 s ASN 2 N 0.00 -0.07 0.28 6.12 2.20 -1.26 -5.03 114.94 117.18 3dn0 s ASN 2 Ca 0.00 -0.94 -0.01 0.00 -0.94 0.00 0.00 52.86 50.98 3dn0 s ASN 2 Cb 0.00 0.78 0.47 0.00 -2.00 0.00 0.00 41.25 40.50 3dn0 s ASN 2 CO 0.00 -1.52 1.88 -0.29 -2.94 0.00 0.00 177.10 174.23 3dn0 h ILE 3 N 2.00 1.04 0.09 0.54 6.09 -1.96 0.18 117.51 125.49 3dn0 h ILE 3 Ca -0.28 -0.38 -0.00 0.00 -1.37 0.00 0.00 64.86 62.83 3dn0 h ILE 3 Cb 1.25 -0.16 0.00 0.00 0.47 0.00 0.00 36.82 38.38 3dn0 h ILE 3 CO 0.35 0.20 -0.04 -0.26 -3.07 0.00 0.00 178.15 175.33 3dn0 h PHE 4 N 1.10 -0.11 -0.65 2.19 0.04 -1.99 -0.48 116.94 117.04 3dn0 h PHE 4 Ca 0.44 -0.00 -0.06 0.00 2.80 0.00 0.00 57.97 61.15 3dn0 h PHE 4 Cb 0.26 0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.42 3dn0 h PHE 4 CO -0.00 0.09 0.17 0.93 -0.60 0.00 0.00 178.31 178.90 3dn0 h GLU 5 N -0.30 1.02 0.46 1.51 5.08 -1.84 -1.38 114.58 119.14 3dn0 h GLU 5 Ca -0.01 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 3dn0 h GLU 5 Cb 0.25 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3dn0 h GLU 5 CO 0.02 0.89 -0.22 1.98 -1.00 0.00 0.00 179.01 180.68 3dn0 h MET 6 N 0.98 -0.60 -0.29 2.33 4.05 -0.54 -1.84 114.93 119.01 3dn0 h MET 6 Ca 0.21 0.04 -0.07 0.00 -0.28 0.00 0.00 59.70 59.60 3dn0 h MET 6 Cb 0.32 0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.24 3dn0 h MET 6 CO -0.00 -0.38 -0.11 -0.07 0.23 0.00 0.00 176.91 176.57 3dn0 h LEU 7 N -0.65 0.47 -0.73 3.39 3.38 -1.05 -1.81 115.31 118.31 3dn0 h LEU 7 Ca -0.06 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.84 3dn0 h LEU 7 Cb 0.49 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 3dn0 h LEU 7 CO 0.10 0.62 0.44 -0.09 0.09 0.00 0.00 178.44 179.60 3dn0 h ARG 8 N 0.45 0.80 0.10 1.13 9.65 -1.11 0.23 114.38 125.63 3dn0 h ARG 8 Ca 0.09 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 3dn0 h ARG 8 Cb 0.47 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 3dn0 h ARG 8 CO 0.03 0.53 -0.05 0.82 2.80 0.00 0.00 179.97 184.10 3dn0 h ILE 9 N 0.83 0.95 -0.21 1.20 2.04 -0.88 -0.90 117.51 120.53 3dn0 h ILE 9 Ca 0.31 -0.16 -0.10 0.00 1.00 0.00 0.00 64.86 65.90 3dn0 h ILE 9 Cb 0.11 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 3dn0 h ILE 9 CO -0.15 0.04 -0.30 0.44 0.00 0.00 0.00 178.15 178.18 3dn0 h ASP 10 N -0.20 0.44 0.00 1.72 3.32 -0.99 -3.31 116.42 117.40 3dn0 h ASP 10 Ca -0.01 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.80 3dn0 h ASP 10 Cb 0.16 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3dn0 h ASP 10 CO 0.02 0.73 -2.00 -0.62 -1.72 0.00 0.00 179.24 175.65 3dn0 n GLU 11 N -4.09 0.68 -0.22 3.56 -0.58 0.78 -5.08 120.64 115.70 3dn0 n GLU 11 Ca -0.01 -0.15 0.03 0.00 -0.42 0.00 0.00 57.16 56.62 3dn0 n GLU 11 Cb 0.43 -1.48 -0.01 0.00 -0.57 0.00 0.00 31.44 29.82 3dn0 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dn0 n GLY 12 N 1.47 -1.78 2.72 0.62 0.00 -0.34 -4.42 105.19 103.45 3dn0 n GLY 12 Ca -0.09 -1.29 -0.21 0.00 0.00 0.00 0.00 46.02 44.42 3dn0 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dn0 s LEU 13 N 0.00 0.35 -0.05 0.99 2.96 -1.26 -4.27 118.68 117.40 3dn0 s LEU 13 Ca 0.00 -0.00 0.00 0.00 -0.22 0.00 0.00 54.13 53.91 3dn0 s LEU 13 Cb 0.00 -0.28 0.02 0.00 0.50 0.00 0.00 46.19 46.43 3dn0 s LEU 13 CO 0.00 -0.22 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.64 3dn0 s ARG 14 N 2.08 0.82 0.00 1.98 0.52 -0.80 -5.01 118.95 118.53 3dn0 s ARG 14 Ca 0.05 -0.07 0.26 0.00 -0.52 0.00 0.00 55.73 55.45 3dn0 s ARG 14 Cb -0.12 -0.90 0.66 0.00 0.52 0.00 0.00 34.95 35.11 3dn0 s ARG 14 CO -0.04 -0.13 1.51 1.28 0.02 0.00 0.00 175.30 177.93 3dn0 n LEU 15 N 4.31 0.74 -4.43 2.53 4.77 -1.26 0.30 117.00 123.95 3dn0 n LEU 15 Ca -0.21 -0.11 -0.30 0.00 -0.03 0.00 0.00 56.01 55.36 3dn0 n LEU 15 Cb 0.51 -0.19 -0.13 0.00 -2.33 0.00 0.00 43.42 41.28 3dn0 n LEU 15 CO 0.20 0.15 -0.52 -0.75 -1.33 0.00 0.00 177.39 175.15 3dn0 s LYS 16 N -2.75 1.87 0.07 3.23 2.20 -1.26 -0.57 119.74 122.52 3dn0 s LYS 16 Ca 0.18 -1.10 -0.37 0.00 -0.36 0.00 0.00 55.97 54.32 3dn0 s LYS 16 Cb 0.18 -2.09 -0.17 0.00 -1.51 0.00 0.00 37.83 34.25 3dn0 s LYS 16 CO 0.61 0.51 1.37 -0.89 -0.36 0.00 0.00 175.35 176.58 3dn0 n ILE 17 N 1.35 0.02 -4.24 5.43 5.41 -0.51 -4.73 119.36 122.09 3dn0 n ILE 17 Ca -0.16 -0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.45 3dn0 n ILE 17 Cb 0.52 -0.86 -0.10 0.00 -0.71 0.00 0.00 39.64 38.50 3dn0 n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3dn0 s TYR 18 N 0.66 1.30 -0.17 1.39 1.13 0.23 -4.96 117.35 116.93 3dn0 s TYR 18 Ca 0.85 -1.30 -0.10 0.00 -1.41 0.00 0.00 57.07 55.11 3dn0 s TYR 18 Cb -0.96 -0.69 -0.05 0.00 -1.10 0.00 0.00 41.96 39.17 3dn0 s TYR 18 CO 0.48 -0.52 0.18 0.15 -2.51 0.00 0.00 175.55 173.33 3dn0 s LYS 19 N -4.11 4.04 0.32 -3.49 1.02 -1.26 0.40 119.74 116.67 3dn0 s LYS 19 Ca 0.38 -0.11 -0.05 0.00 0.02 0.00 0.00 55.97 56.20 3dn0 s LYS 19 Cb 0.07 -3.37 0.08 0.00 -0.52 0.00 0.00 37.83 34.09 3dn0 s LYS 19 CO 0.12 0.40 0.31 -0.40 -0.92 0.00 0.00 175.35 174.86 3dn0 n ASP 20 N 3.16 -1.03 0.28 2.83 5.68 0.57 -4.79 116.55 123.25 3dn0 n ASP 20 Ca -0.16 -0.77 0.14 0.00 -0.50 0.00 0.00 54.79 53.49 3dn0 n ASP 20 Cb 0.53 -0.28 0.81 0.00 -1.14 0.00 0.00 41.12 41.04 3dn0 n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3dn0 h THR 21 N -1.71 0.55 -0.06 2.12 1.35 -1.99 -1.47 112.91 111.71 3dn0 h THR 21 Ca -0.11 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 3dn0 h THR 21 Cb 0.34 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 3dn0 h THR 21 CO 0.08 0.07 0.00 -0.62 -0.25 0.00 0.00 175.52 174.79 3dn0 n GLU 22 N -3.74 1.78 -0.61 4.72 -0.58 -1.26 -4.94 120.64 116.01 3dn0 n GLU 22 Ca -0.02 -1.14 0.00 0.00 -0.42 0.00 0.00 57.16 55.57 3dn0 n GLU 22 Cb 0.17 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 3dn0 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dn0 n GLY 23 N 1.20 0.69 3.84 0.62 0.00 -0.55 -5.06 105.19 105.92 3dn0 n GLY 23 Ca 0.18 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 3dn0 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dn0 s TYR 24 N -2.00 3.69 0.21 1.61 2.02 -1.26 -4.71 117.35 116.92 3dn0 s TYR 24 Ca 0.00 0.90 -0.32 0.00 -0.37 0.00 0.00 57.07 57.27 3dn0 s TYR 24 Cb 0.00 -2.23 -0.13 0.00 -0.40 0.00 0.00 41.96 39.20 3dn0 s TYR 24 CO 0.00 0.64 1.65 0.66 -1.57 0.00 0.00 175.55 176.93 3dn0 n TYR 25 N 1.93 2.62 -3.82 2.71 4.01 -1.23 -0.31 117.16 123.07 3dn0 n TYR 25 Ca -0.15 0.16 -0.09 0.00 -0.16 0.00 0.00 57.90 57.66 3dn0 n TYR 25 Cb 0.53 -2.62 -0.07 0.00 -0.31 0.00 0.00 39.34 36.87 3dn0 n TYR 25 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3dn0 s THR 26 N 0.83 0.13 0.12 -0.72 2.01 0.16 -1.04 115.64 117.13 3dn0 s THR 26 Ca 0.74 -1.08 -0.10 0.00 0.31 0.00 0.00 61.69 61.56 3dn0 s THR 26 Cb -0.56 -1.31 0.00 0.00 0.01 0.00 0.00 72.50 70.64 3dn0 s THR 26 CO 0.37 -0.60 0.25 -0.51 -0.69 0.00 0.00 174.62 173.45 3dn0 s ILE 27 N -3.85 0.11 0.00 1.82 2.07 -0.52 -0.60 121.20 120.22 3dn0 s ILE 27 Ca 0.05 -1.16 0.00 0.00 -1.41 0.00 0.00 60.65 58.13 3dn0 s ILE 27 Cb 0.04 -1.48 0.00 0.00 0.13 0.00 0.00 42.46 41.15 3dn0 s ILE 27 CO -0.11 -0.48 0.00 0.61 -1.91 0.00 0.00 174.94 173.04 3dn0 n GLY 28 N -0.14 2.81 3.05 1.50 0.00 0.15 -1.07 105.19 111.50 3dn0 n GLY 28 Ca -0.13 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 3dn0 n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dn0 n ILE 29 N 0.00 4.71 -2.99 -0.61 5.41 -1.26 -1.91 119.36 122.71 3dn0 n ILE 29 Ca 0.00 -5.67 -0.21 0.00 1.00 0.00 0.00 62.75 57.87 3dn0 n ILE 29 Cb 0.00 -2.24 0.04 0.00 -0.71 0.00 0.00 39.64 36.73 3dn0 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dn0 n GLY 30 N 1.71 -0.42 3.48 7.39 0.00 -1.24 -4.89 105.19 111.22 3dn0 n GLY 30 Ca 0.25 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.91 3dn0 n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dn0 s HIS 31 N -3.14 2.58 0.13 1.61 5.04 -0.23 -4.93 115.29 116.35 3dn0 s HIS 31 Ca 0.30 -0.42 -0.33 0.00 -1.54 0.00 0.00 55.06 53.07 3dn0 s HIS 31 Cb -0.13 -4.37 -0.12 0.00 0.04 0.00 0.00 32.58 28.00 3dn0 s HIS 31 CO 0.37 -1.74 1.74 -0.11 -2.34 0.00 0.00 174.74 172.66 3dn0 n LEU 32 N 8.09 3.68 -0.07 8.88 7.94 -1.26 -1.45 117.00 142.81 3dn0 n LEU 32 Ca -0.02 1.03 -0.22 0.00 -1.11 0.00 0.00 56.01 55.69 3dn0 n LEU 32 Cb 0.46 -1.49 -0.12 0.00 0.53 0.00 0.00 43.42 42.79 3dn0 n LEU 32 CO 0.66 0.01 -0.99 0.18 -1.11 0.00 0.00 177.39 176.14 3dn0 n LEU 33 N 4.76 2.47 -3.55 -1.96 4.77 -0.21 -4.94 117.00 118.34 3dn0 n LEU 33 Ca 0.18 0.18 -0.08 0.00 -0.03 0.00 0.00 56.01 56.26 3dn0 n LEU 33 Cb 0.33 -0.99 -0.03 0.00 -2.33 0.00 0.00 43.42 40.40 3dn0 n LEU 33 CO 0.66 0.72 0.81 0.28 -1.33 0.00 0.00 177.39 178.52 3dn0 s THR 34 N -2.50 0.00 -2.04 -5.08 -1.32 -1.21 -4.86 115.64 98.63 3dn0 s THR 34 Ca -0.29 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.44 3dn0 s THR 34 Cb 0.08 -1.00 0.24 0.00 -1.51 0.00 0.00 72.50 70.31 3dn0 s THR 34 CO 0.65 0.00 1.46 0.29 -2.21 0.00 0.00 174.62 174.80 3dn0 n LYS 35 N 0.08 1.17 -2.08 7.08 5.02 -1.26 -3.53 118.16 124.64 3dn0 n LYS 35 Ca -0.07 -0.80 -0.41 0.00 -2.02 0.00 0.00 58.31 55.02 3dn0 n LYS 35 Cb 0.60 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 34.10 3dn0 n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3dn0 s SER 36 N -2.38 6.73 0.00 4.39 0.15 -1.26 -4.92 113.70 116.41 3dn0 s SER 36 Ca 0.25 2.70 0.27 0.00 0.70 0.00 0.00 55.95 59.87 3dn0 s SER 36 Cb 0.19 -2.64 1.59 0.00 -1.71 0.00 0.00 66.02 63.45 3dn0 s SER 36 CO 0.49 -0.58 1.97 -0.81 1.20 0.00 0.00 173.24 175.51 3dn0 n PRO 37 N 1.09 0.78 -2.87 5.44 -0.04 -1.26 -4.69 135.00 133.45 3dn0 n PRO 37 Ca 0.01 0.01 -0.42 0.00 -0.04 0.00 0.00 63.50 63.06 3dn0 n PRO 37 Cb 0.41 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.33 3dn0 n PRO 37 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3dn0 s SER 38 N -2.10 6.87 0.30 3.54 0.15 -1.26 -4.95 113.70 116.26 3dn0 s SER 38 Ca 0.39 1.09 0.02 0.00 0.70 0.00 0.00 55.95 58.14 3dn0 s SER 38 Cb 0.19 -2.45 0.48 0.00 -1.71 0.00 0.00 66.02 62.53 3dn0 s SER 38 CO 0.33 -0.51 1.82 0.25 1.20 0.00 0.00 173.24 176.34 3dn0 h LEU 39 N 9.05 0.61 -0.86 3.45 5.85 -2.00 -2.19 115.31 129.22 3dn0 h LEU 39 Ca -0.24 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 3dn0 h LEU 39 Cb 1.10 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.93 3dn0 h LEU 39 CO 0.88 0.68 0.41 0.78 -0.34 0.00 0.00 178.44 180.84 3dn0 h ASN 40 N 0.61 1.12 -0.89 1.25 2.35 -1.98 -0.09 115.58 117.96 3dn0 h ASN 40 Ca 0.13 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 3dn0 h ASN 40 Cb 0.38 -0.29 -0.04 0.00 0.05 0.00 0.00 38.32 38.42 3dn0 h ASN 40 CO 0.01 0.95 0.52 0.00 -1.65 0.00 0.00 177.43 177.26 3dn0 h ALA 41 N 1.22 1.13 -0.18 -0.83 0.00 -1.88 -1.18 119.26 117.56 3dn0 h ALA 41 Ca 0.29 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3dn0 h ALA 41 Cb 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3dn0 h ALA 41 CO -0.04 0.60 0.04 0.00 0.00 0.00 0.00 179.25 179.86 3dn0 h ALA 42 N 1.28 0.24 -0.82 0.00 0.00 -0.78 -1.95 119.26 117.23 3dn0 h ALA 42 Ca 0.32 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dn0 h ALA 42 Cb -0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3dn0 h ALA 42 CO -0.06 -0.12 0.49 0.87 0.00 0.00 0.00 179.25 180.43 3dn0 h LYS 43 N 0.10 1.11 -0.09 0.00 1.57 -0.92 -0.72 116.57 117.62 3dn0 h LYS 43 Ca 0.06 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3dn0 h LYS 43 Cb 0.26 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 3dn0 h LYS 43 CO 0.00 0.78 0.05 1.03 -0.57 0.00 0.00 179.45 180.74 3dn0 h SER 44 N 1.13 0.11 -0.83 0.86 0.87 -1.07 -0.87 113.55 113.75 3dn0 h SER 44 Ca 0.29 -0.04 0.05 0.00 -1.23 0.00 0.00 61.79 60.86 3dn0 h SER 44 Cb -0.04 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 61.84 3dn0 h SER 44 CO -0.05 0.12 0.52 -0.33 -0.53 0.00 0.00 176.83 176.55 3dn0 h GLU 45 N 0.09 0.95 0.16 2.24 4.39 -0.99 -1.75 114.58 119.66 3dn0 h GLU 45 Ca 0.03 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.68 3dn0 h GLU 45 Cb 0.03 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.46 3dn0 h GLU 45 CO -0.01 0.63 -0.13 1.25 -1.16 0.00 0.00 179.01 179.59 3dn0 h LEU 46 N 0.97 -0.34 -0.61 1.33 5.85 -0.80 0.64 115.31 122.35 3dn0 h LEU 46 Ca 0.35 0.03 0.10 0.00 0.84 0.00 0.00 57.88 59.19 3dn0 h LEU 46 Cb 0.09 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.16 3dn0 h LEU 46 CO -0.15 -0.20 0.22 0.44 -0.34 0.00 0.00 178.44 178.42 3dn0 h ASP 47 N -0.30 0.22 -0.86 1.25 3.32 -0.94 -0.12 116.42 118.98 3dn0 h ASP 47 Ca -0.00 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 3dn0 h ASP 47 Cb 0.28 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 3dn0 h ASP 47 CO -0.02 0.13 0.42 0.50 -1.72 0.00 0.00 179.24 178.55 3dn0 h LYS 48 N 0.40 1.24 -0.47 3.56 3.64 -1.05 0.39 116.57 124.28 3dn0 h LYS 48 Ca 0.31 -0.18 -0.13 0.00 -1.27 0.00 0.00 60.65 59.38 3dn0 h LYS 48 Cb 0.39 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3dn0 h LYS 48 CO -0.31 0.94 -0.21 0.00 -2.27 0.00 0.00 179.45 177.60 3dn0 h ALA 49 N 1.23 0.66 0.04 5.00 0.00 -0.01 -3.31 119.26 122.86 3dn0 h ALA 49 Ca 0.30 -0.39 -0.30 0.00 0.00 0.00 0.00 54.91 54.52 3dn0 h ALA 49 Cb 0.11 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 3dn0 h ALA 49 CO -0.04 0.65 -1.65 0.82 0.00 0.00 0.00 179.25 179.03 3dn0 h ILE 50 N 0.83 0.95 0.00 0.00 1.08 -0.91 -3.49 117.51 115.96 3dn0 h ILE 50 Ca 0.11 -2.74 0.00 0.00 -0.39 0.00 0.00 64.86 61.84 3dn0 h ILE 50 Cb 0.79 2.52 0.00 0.00 -3.07 0.00 0.00 36.82 37.06 3dn0 h ILE 50 CO 0.07 0.65 0.00 0.61 -0.69 0.00 0.00 178.15 178.78 3dn0 n GLY 51 N 1.62 0.81 3.40 5.37 0.00 0.14 -5.07 105.19 111.45 3dn0 n GLY 51 Ca -0.17 -0.61 -0.11 0.00 0.00 0.00 0.00 46.02 45.13 3dn0 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dn0 s ARG 52 N -2.01 1.21 -0.66 1.61 1.70 -1.13 -5.05 118.95 114.63 3dn0 s ARG 52 Ca 0.00 -0.65 -0.27 0.00 -0.47 0.00 0.00 55.73 54.34 3dn0 s ARG 52 Cb 0.00 0.53 0.02 0.00 -0.57 0.00 0.00 34.95 34.92 3dn0 s ARG 52 CO 0.00 -0.51 1.42 1.21 -1.08 0.00 0.00 175.30 176.35 3dn0 s ASN 53 N -2.80 6.00 -0.17 -2.89 3.84 -1.26 -4.35 114.94 113.31 3dn0 s ASN 53 Ca 0.03 -0.06 0.13 0.00 0.21 0.00 0.00 52.86 53.18 3dn0 s ASN 53 Cb 0.00 -2.55 -0.24 0.00 -0.55 0.00 0.00 41.25 37.92 3dn0 s ASN 53 CO -0.11 -1.88 0.16 0.35 -2.79 0.00 0.00 177.10 172.83 3dn0 n THR 54 N 6.69 1.47 -4.05 -5.21 -2.24 -1.26 -5.02 114.28 104.66 3dn0 n THR 54 Ca 0.09 -0.80 -0.43 0.00 -2.27 0.00 0.00 64.05 60.65 3dn0 n THR 54 Cb 0.50 -0.77 0.01 0.00 -2.10 0.00 0.00 70.33 67.97 3dn0 n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3dn0 n ASN 55 N -2.91 -3.63 0.00 3.42 5.15 -1.26 -3.81 115.26 112.22 3dn0 n ASN 55 Ca -0.32 -1.25 0.00 0.00 -0.60 0.00 0.00 54.58 52.41 3dn0 n ASN 55 Cb 1.11 -1.93 0.00 0.00 -0.53 0.00 0.00 39.78 38.43 3dn0 n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dn0 n GLY 56 N -2.09 1.18 3.03 8.20 0.00 -1.26 -5.02 105.19 109.22 3dn0 n GLY 56 Ca -0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.65 3dn0 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dn0 s VAL 57 N -2.63 1.02 0.34 1.61 1.01 -1.25 -1.42 120.40 119.08 3dn0 s VAL 57 Ca 0.00 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.58 3dn0 s VAL 57 Cb 0.00 -0.92 -0.07 0.00 0.00 0.00 0.00 36.38 35.40 3dn0 s VAL 57 CO 0.00 0.32 -0.03 0.27 0.00 0.00 0.00 175.10 175.66 3dn0 s ILE 58 N 0.35 1.78 0.62 2.22 -4.36 0.26 -4.88 121.20 117.20 3dn0 s ILE 58 Ca -0.07 -2.08 -0.06 0.00 -0.26 0.00 0.00 60.65 58.17 3dn0 s ILE 58 Cb -0.12 -2.71 0.03 0.00 1.25 0.00 0.00 42.46 40.91 3dn0 s ILE 58 CO 0.02 -0.14 0.93 0.42 0.24 0.00 0.00 174.94 176.41 3dn0 s THR 59 N -2.90 3.13 0.19 8.37 -4.23 -1.26 -4.78 115.64 114.17 3dn0 s THR 59 Ca 0.33 -0.13 -0.12 0.00 -1.18 0.00 0.00 61.69 60.59 3dn0 s THR 59 Cb 0.06 -3.27 0.11 0.00 1.34 0.00 0.00 72.50 70.74 3dn0 s THR 59 CO 0.15 -0.28 1.84 0.50 -0.54 0.00 0.00 174.62 176.29 3dn0 h LYS 60 N -0.30 0.88 -0.55 3.99 3.64 -1.99 -0.45 116.57 121.80 3dn0 h LYS 60 Ca -0.45 -0.08 0.07 0.00 -1.27 0.00 0.00 60.65 58.92 3dn0 h LYS 60 Cb 1.28 -0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.85 3dn0 h LYS 60 CO 0.60 0.62 0.24 -0.44 -2.27 0.00 0.00 179.45 178.20 3dn0 h ASP 61 N 0.89 0.29 -0.50 4.20 5.19 -1.99 0.15 116.42 124.65 3dn0 h ASP 61 Ca 0.24 0.05 -0.06 0.00 -0.62 0.00 0.00 57.03 56.64 3dn0 h ASP 61 Cb -0.04 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.46 3dn0 h ASP 61 CO -0.05 0.20 0.10 -0.33 -3.12 0.00 0.00 179.24 176.04 3dn0 h GLU 62 N 0.45 0.82 -0.53 3.56 5.08 -1.85 -0.58 114.58 121.54 3dn0 h GLU 62 Ca 0.26 -0.21 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3dn0 h GLU 62 Cb 0.24 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 3dn0 h GLU 62 CO -0.22 0.81 0.27 0.00 -1.00 0.00 0.00 179.01 178.87 3dn0 h ALA 63 N 0.98 0.68 -0.17 3.43 0.00 -0.59 -1.90 119.26 121.68 3dn0 h ALA 63 Ca 0.15 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 3dn0 h ALA 63 Cb 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3dn0 h ALA 63 CO 0.01 -0.06 -0.34 0.93 0.00 0.00 0.00 179.25 179.79 3dn0 h GLU 64 N 0.53 0.35 0.16 0.00 5.08 -0.78 -1.09 114.58 118.83 3dn0 h GLU 64 Ca 0.23 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3dn0 h GLU 64 Cb 0.13 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3dn0 h GLU 64 CO -0.15 0.65 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.21 3dn0 h LYS 65 N 0.30 -0.20 -0.97 2.33 3.64 -0.65 -0.91 116.57 120.11 3dn0 h LYS 65 Ca 0.04 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3dn0 h LYS 65 Cb 0.74 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.55 3dn0 h LYS 65 CO 0.06 -0.11 0.64 -0.07 -2.27 0.00 0.00 179.45 177.70 3dn0 h LEU 66 N -0.24 1.08 -0.05 5.20 3.38 -1.21 -2.18 115.31 121.29 3dn0 h LEU 66 Ca -0.02 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.94 3dn0 h LEU 66 Cb 0.19 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3dn0 h LEU 66 CO 0.04 0.75 -0.00 0.15 0.09 0.00 0.00 178.44 179.46 3dn0 h PHE 67 N 1.26 -0.01 -0.65 1.13 3.57 -1.00 0.96 116.94 122.21 3dn0 h PHE 67 Ca 0.38 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.91 3dn0 h PHE 67 Cb -0.04 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 3dn0 h PHE 67 CO -0.00 -0.01 0.40 -0.97 -2.23 0.00 0.00 178.31 175.49 3dn0 h ASN 68 N 0.01 0.64 -0.84 0.41 -0.73 -0.98 -0.39 115.58 113.71 3dn0 h ASN 68 Ca 0.02 0.00 0.01 0.00 1.87 0.00 0.00 56.30 58.20 3dn0 h ASN 68 Cb 0.03 -0.13 -0.04 0.00 0.27 0.00 0.00 38.32 38.44 3dn0 h ASN 68 CO -0.04 0.45 0.56 1.56 -0.37 0.00 0.00 177.43 179.58 3dn0 h GLN 69 N 0.78 1.10 -0.30 6.67 4.20 -1.01 -1.25 115.11 125.29 3dn0 h GLN 69 Ca 0.26 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.82 3dn0 h GLN 69 Cb 0.04 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 3dn0 h GLN 69 CO -0.11 0.73 -0.16 -0.44 -0.67 0.00 0.00 178.83 178.18 3dn0 h ASP 70 N 1.13 0.65 -0.14 1.46 3.32 -0.21 0.14 116.42 122.77 3dn0 h ASP 70 Ca 0.31 -0.41 0.01 0.00 0.02 0.00 0.00 57.03 56.96 3dn0 h ASP 70 Cb -0.13 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.23 3dn0 h ASP 70 CO -0.07 0.92 0.06 0.58 -1.72 0.00 0.00 179.24 179.01 3dn0 h VAL 71 N 0.38 0.98 -0.30 -1.35 2.07 -0.97 -0.78 116.25 116.28 3dn0 h VAL 71 Ca 0.06 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.59 3dn0 h VAL 71 Cb 0.68 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 3dn0 h VAL 71 CO 0.05 0.02 -0.03 0.44 0.02 0.00 0.00 177.57 178.07 3dn0 h ASP 72 N 0.13 -0.17 -0.78 0.57 5.19 -1.11 -1.76 116.42 118.50 3dn0 h ASP 72 Ca 0.06 0.08 0.07 0.00 -0.62 0.00 0.00 57.03 56.61 3dn0 h ASP 72 Cb 0.03 0.14 -0.05 0.00 0.18 0.00 0.00 39.33 39.63 3dn0 h ASP 72 CO -0.06 -0.05 0.51 0.00 -3.12 0.00 0.00 179.24 176.52 3dn0 h ALA 73 N 1.27 1.65 -0.17 3.45 0.00 -0.37 -0.74 119.26 124.36 3dn0 h ALA 73 Ca 0.14 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3dn0 h ALA 73 Cb 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3dn0 h ALA 73 CO -0.26 0.22 -0.03 0.00 0.00 0.00 0.00 179.25 179.18 3dn0 h ALA 74 N 1.58 0.23 -0.19 0.00 0.00 -0.59 -0.16 119.26 120.13 3dn0 h ALA 74 Ca 0.34 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3dn0 h ALA 74 Cb 0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3dn0 h ALA 74 CO -0.12 -0.02 0.06 0.28 0.00 0.00 0.00 179.25 179.46 3dn0 h VAL 75 N 0.03 0.95 -0.28 0.00 2.07 -0.95 -1.11 116.25 116.95 3dn0 h VAL 75 Ca 0.04 -0.05 -0.08 0.00 0.82 0.00 0.00 66.70 67.43 3dn0 h VAL 75 Cb 0.45 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 3dn0 h VAL 75 CO 0.01 0.03 -0.18 0.03 0.02 0.00 0.00 177.57 177.48 3dn0 h ARG 76 N 0.16 0.51 -0.32 1.57 2.47 -1.09 -1.48 114.38 116.20 3dn0 h ARG 76 Ca 0.08 -0.17 0.01 0.00 -1.26 0.00 0.00 59.98 58.64 3dn0 h ARG 76 Cb 0.05 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.31 3dn0 h ARG 76 CO -0.09 0.67 0.20 0.78 0.56 0.00 0.00 179.97 182.09 3dn0 h GLY 77 N 0.97 0.45 0.83 0.04 0.00 -0.67 -1.78 103.07 102.91 3dn0 h GLY 77 Ca 0.08 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.28 3dn0 h GLY 77 CO 0.04 0.14 0.06 -2.22 0.00 0.00 0.00 176.54 174.55 3dn0 h ILE 78 N 0.40 0.94 0.00 2.60 2.04 -0.77 -2.65 117.51 120.07 3dn0 h ILE 78 Ca 0.12 -0.05 -0.06 0.00 1.00 0.00 0.00 64.86 65.87 3dn0 h ILE 78 Cb -0.01 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 3dn0 h ILE 78 CO -0.05 0.03 -0.30 -0.07 0.00 0.00 0.00 178.15 177.75 3dn0 h LEU 79 N 0.14 0.00 0.00 1.44 3.38 -1.10 -2.21 115.31 116.96 3dn0 h LEU 79 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3dn0 h LEU 79 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3dn0 h LEU 79 CO -0.09 0.30 -0.24 0.54 0.09 0.00 0.00 178.44 179.04 3dn0 n ARG 80 N -3.91 0.05 -3.44 1.13 1.74 -0.68 -4.78 116.66 106.77 3dn0 n ARG 80 Ca -0.02 0.02 -0.39 0.00 -0.77 0.00 0.00 57.85 56.70 3dn0 n ARG 80 Cb 0.38 -1.54 -0.09 0.00 -1.02 0.00 0.00 32.46 30.19 3dn0 n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3dn0 s ASN 81 N -3.23 6.26 0.49 0.55 3.84 -0.85 -4.97 114.94 117.04 3dn0 s ASN 81 Ca 0.12 0.29 0.21 0.00 0.21 0.00 0.00 52.86 53.69 3dn0 s ASN 81 Cb 0.17 -2.20 1.27 0.00 -0.55 0.00 0.00 41.25 39.95 3dn0 s ASN 81 CO 0.62 -0.12 2.06 0.00 -2.79 0.00 0.00 177.10 176.86 3dn0 h ALA 82 N 7.95 1.53 0.03 1.71 0.00 -1.87 -0.56 119.26 128.05 3dn0 h ALA 82 Ca -0.33 -0.12 -0.26 0.00 0.00 0.00 0.00 54.91 54.19 3dn0 h ALA 82 Cb 1.17 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 3dn0 h ALA 82 CO 0.65 0.17 -1.34 0.87 0.00 0.00 0.00 179.25 179.60 3dn0 h LYS 83 N 0.00 0.07 0.12 0.00 1.57 -1.93 -3.39 116.57 113.00 3dn0 h LYS 83 Ca -0.00 -0.11 -0.36 0.00 -1.87 0.00 0.00 60.65 58.31 3dn0 h LYS 83 Cb 0.28 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 3dn0 h LYS 83 CO 0.02 0.88 -1.93 -0.07 -0.57 0.00 0.00 179.45 177.78 3dn0 h LEU 84 N 0.02 0.39 -0.25 2.94 3.38 -1.71 -3.40 115.31 116.69 3dn0 h LEU 84 Ca -0.15 -0.85 0.06 0.00 0.09 0.00 0.00 57.88 57.03 3dn0 h LEU 84 Cb 1.90 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 42.47 3dn0 h LEU 84 CO 0.12 1.76 -0.12 0.50 0.09 0.00 0.00 178.44 180.79 3dn0 h LYS 85 N 0.07 -0.09 -0.88 1.13 3.64 -0.97 -0.57 116.57 118.90 3dn0 h LYS 85 Ca -0.40 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 58.98 3dn0 h LYS 85 Cb 2.04 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 33.84 3dn0 h LYS 85 CO 0.10 -0.06 0.50 -1.35 -2.27 0.00 0.00 179.45 176.38 3dn0 h PRO 86 N -0.09 1.21 -0.25 1.90 0.11 -1.78 0.19 132.00 133.28 3dn0 h PRO 86 Ca 0.13 -0.13 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 3dn0 h PRO 86 Cb 0.29 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 3dn0 h PRO 86 CO -0.31 0.87 0.08 0.28 -0.21 0.00 0.00 178.00 178.71 3dn0 h VAL 87 N 1.22 1.19 -0.19 3.15 2.07 -1.66 -1.90 116.25 120.11 3dn0 h VAL 87 Ca 0.31 -0.59 0.01 0.00 0.82 0.00 0.00 66.70 67.25 3dn0 h VAL 87 Cb -0.01 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3dn0 h VAL 87 CO -0.05 0.19 0.11 0.22 0.02 0.00 0.00 177.57 178.06 3dn0 h TYR 88 N 0.24 0.20 -0.68 1.57 3.20 -0.75 -2.20 116.97 118.55 3dn0 h TYR 88 Ca 0.08 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.08 3dn0 h TYR 88 Cb 0.22 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.38 3dn0 h TYR 88 CO -0.00 0.12 0.46 -0.44 -1.64 0.00 0.00 178.16 176.66 3dn0 h ASP 89 N 0.23 0.38 1.48 -2.11 3.32 -0.52 -2.28 116.42 116.92 3dn0 h ASP 89 Ca 0.07 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3dn0 h ASP 89 Cb -0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.48 3dn0 h ASP 89 CO -0.04 0.21 0.00 0.77 -1.72 0.00 0.00 179.24 178.47 3dn0 h SER 90 N 0.41 0.00 -3.57 6.45 4.64 -0.70 -3.46 113.55 117.32 3dn0 h SER 90 Ca 0.33 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 61.15 3dn0 h SER 90 Cb 0.71 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.80 3dn0 h SER 90 CO -0.10 0.00 0.07 -0.76 -0.87 0.00 0.00 176.83 175.17 3dn0 s LEU 91 N -5.55 3.84 0.87 5.97 1.43 -0.86 -5.06 118.68 119.31 3dn0 s LEU 91 Ca 0.06 1.01 -0.12 0.00 -1.03 0.00 0.00 54.13 54.06 3dn0 s LEU 91 Cb 0.08 -3.89 0.11 0.00 0.03 0.00 0.00 46.19 42.52 3dn0 s LEU 91 CO 0.59 -0.39 1.11 1.51 0.23 0.00 0.00 176.35 179.39 3dn0 s ASP 92 N -3.34 3.84 0.36 2.29 -4.77 -1.26 -4.81 116.67 108.98 3dn0 s ASP 92 Ca 0.49 1.23 0.05 0.00 -3.30 0.00 0.00 52.55 51.02 3dn0 s ASP 92 Cb -0.10 -1.90 0.70 0.00 -1.09 0.00 0.00 42.92 40.52 3dn0 s ASP 92 CO 0.34 -2.37 1.94 0.00 0.70 0.00 0.00 175.17 175.78 3dn0 h ALA 93 N -1.37 1.49 -0.08 2.11 0.00 -1.98 -1.06 119.26 118.38 3dn0 h ALA 93 Ca -0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 3dn0 h ALA 93 Cb 1.30 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3dn0 h ALA 93 CO 0.59 0.38 0.01 0.28 0.00 0.00 0.00 179.25 180.51 3dn0 h VAL 94 N 0.52 1.22 0.00 0.00 2.07 -1.94 -2.35 116.25 115.77 3dn0 h VAL 94 Ca 0.12 -0.69 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 3dn0 h VAL 94 Cb 0.19 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 3dn0 h VAL 94 CO -0.00 0.19 -0.37 0.03 0.02 0.00 0.00 177.57 177.44 3dn0 h ARG 95 N -0.11 0.00 -0.77 1.57 3.08 -1.77 -2.07 114.38 114.31 3dn0 h ARG 95 Ca 0.02 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.09 3dn0 h ARG 95 Cb 0.30 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.30 3dn0 h ARG 95 CO 0.00 0.37 0.50 0.00 -1.07 0.00 0.00 179.97 179.77 3dn0 h ARG 96 N 0.00 0.97 -0.60 0.04 3.08 -1.06 -1.35 114.38 115.46 3dn0 h ARG 96 Ca -0.00 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.01 3dn0 h ARG 96 Cb 0.74 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 3dn0 h ARG 96 CO 0.05 0.64 0.37 0.00 -1.07 0.00 0.00 179.97 179.96 3dn0 h ALA 97 N 1.30 0.77 -0.77 0.04 0.00 -0.83 -0.47 119.26 119.31 3dn0 h ALA 97 Ca 0.29 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.25 3dn0 h ALA 97 Cb -0.05 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.49 3dn0 h ALA 97 CO -0.09 0.11 0.45 0.00 0.00 0.00 0.00 179.25 179.72 3dn0 h ALA 98 N 1.26 1.05 -0.11 0.00 0.00 -1.11 0.56 119.26 120.91 3dn0 h ALA 98 Ca 0.24 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3dn0 h ALA 98 Cb 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3dn0 h ALA 98 CO -0.09 0.14 0.07 0.00 0.00 0.00 0.00 179.25 179.36 3dn0 h ALA 99 N 1.39 0.14 -0.70 0.00 0.00 -0.67 -2.24 119.26 117.18 3dn0 h ALA 99 Ca 0.35 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.26 3dn0 h ALA 99 Cb 0.22 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3dn0 h ALA 99 CO -0.19 -0.36 0.44 0.82 0.00 0.00 0.00 179.25 179.96 3dn0 h ILE 100 N 0.12 1.11 -0.27 0.00 2.04 -0.73 -2.30 117.51 117.47 3dn0 h ILE 100 Ca 0.04 -0.30 0.06 0.00 1.00 0.00 0.00 64.86 65.66 3dn0 h ILE 100 Cb 0.02 0.16 -0.06 0.00 -0.74 0.00 0.00 36.82 36.20 3dn0 h ILE 100 CO -0.01 0.16 -0.14 -1.13 0.00 0.00 0.00 178.15 177.03 3dn0 h ASN 101 N 0.87 -0.47 -0.19 1.72 -0.73 -0.66 0.14 115.58 116.26 3dn0 h ASN 101 Ca 0.28 0.11 0.04 0.00 1.87 0.00 0.00 56.30 58.59 3dn0 h ASN 101 Cb 0.00 0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.81 3dn0 h ASN 101 CO -0.10 -0.18 -0.03 0.24 -0.37 0.00 0.00 177.43 177.00 3dn0 h MET 102 N -0.11 0.03 -0.61 6.67 2.86 -1.16 -1.98 114.93 120.64 3dn0 h MET 102 Ca 0.14 -0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.75 3dn0 h MET 102 Cb 0.33 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 3dn0 h MET 102 CO -0.34 0.02 0.24 0.28 1.06 0.00 0.00 176.91 178.17 3dn0 h VAL 103 N 0.03 1.23 -0.71 -2.22 2.07 -0.95 -0.52 116.25 115.18 3dn0 h VAL 103 Ca 0.09 -0.72 0.13 0.00 0.82 0.00 0.00 66.70 67.02 3dn0 h VAL 103 Cb 0.13 0.57 -0.09 0.00 -1.52 0.00 0.00 31.29 30.38 3dn0 h VAL 103 CO -0.18 0.28 0.26 0.15 0.02 0.00 0.00 177.57 178.10 3dn0 h PHE 104 N 0.84 0.44 0.06 1.57 3.04 -0.54 0.24 116.94 122.59 3dn0 h PHE 104 Ca 0.20 0.04 -0.26 0.00 3.98 0.00 0.00 57.97 61.93 3dn0 h PHE 104 Cb 0.20 -0.09 0.02 0.00 2.56 0.00 0.00 35.95 38.65 3dn0 h PHE 104 CO 0.01 0.05 -1.06 0.37 -2.02 0.00 0.00 178.31 175.67 3dn0 h GLN 105 N 0.41 0.62 0.00 1.11 4.15 -0.70 -3.40 115.11 117.29 3dn0 h GLN 105 Ca 0.38 -0.74 0.00 0.00 0.77 0.00 0.00 58.65 59.06 3dn0 h GLN 105 Cb 0.56 0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.48 3dn0 h GLN 105 CO -0.39 1.32 -0.11 -1.33 -1.93 0.00 0.00 178.83 176.39 3dn0 n MET 106 N -3.89 6.27 -0.52 1.69 2.81 -0.26 -5.11 117.12 118.10 3dn0 n MET 106 Ca -0.12 -0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.84 3dn0 n MET 106 Cb 0.89 -0.56 -0.02 0.00 -0.71 0.00 0.00 33.22 32.82 3dn0 n MET 106 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dn0 n GLY 107 N 1.13 -2.07 0.33 3.03 0.00 0.84 -2.39 105.19 106.08 3dn0 n GLY 107 Ca 0.00 -1.36 0.02 0.00 0.00 0.00 0.00 46.02 44.68 3dn0 n GLY 107 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3dn0 h GLU 108 N -0.50 0.78 -0.09 1.61 5.08 -1.94 -2.34 114.58 117.19 3dn0 h GLU 108 Ca -0.02 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 3dn0 h GLU 108 Cb 0.49 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3dn0 h GLU 108 CO 0.01 0.52 -0.41 1.79 -1.00 0.00 0.00 179.01 179.93 3dn0 h THR 109 N 0.81 1.31 -0.21 1.13 1.35 -1.98 -2.40 112.91 112.91 3dn0 h THR 109 Ca 0.22 -1.49 -0.12 0.00 -0.55 0.00 0.00 66.41 64.47 3dn0 h THR 109 Cb -0.08 1.69 -0.01 0.00 -1.73 0.00 0.00 68.15 68.02 3dn0 h THR 109 CO -0.05 0.44 -0.39 1.23 -0.25 0.00 0.00 175.52 176.50 3dn0 h GLY 110 N 1.22 0.52 0.60 5.82 0.00 -1.06 -3.11 103.07 107.06 3dn0 h GLY 110 Ca 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3dn0 h GLY 110 CO 0.06 0.46 -0.15 3.33 0.00 0.00 0.00 176.54 180.23 3dn0 n VAL 111 N -4.03 0.00 -0.23 4.60 0.24 -0.95 -4.21 118.33 113.75 3dn0 n VAL 111 Ca -0.01 -0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 3dn0 n VAL 111 Cb 0.50 0.10 0.24 0.00 -1.47 0.00 0.00 33.84 33.21 3dn0 n VAL 111 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dn0 h ALA 112 N 3.68 1.45 0.00 2.33 0.00 -1.36 -1.69 119.26 123.67 3dn0 h ALA 112 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dn0 h ALA 112 Cb 0.41 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3dn0 h ALA 112 CO 0.00 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.17 3dn0 n GLY 113 N -1.41 -0.92 1.53 0.00 0.00 -1.26 -3.90 105.19 99.22 3dn0 n GLY 113 Ca 0.08 -0.11 -0.07 0.00 0.00 0.00 0.00 46.02 45.92 3dn0 n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dn0 n PHE 114 N -1.22 1.50 -0.13 1.61 3.01 -0.63 -4.61 117.46 116.99 3dn0 n PHE 114 Ca 0.12 -0.94 -0.07 0.00 1.01 0.00 0.00 57.45 57.58 3dn0 n PHE 114 Cb 0.15 -0.52 -0.00 0.00 -0.01 0.00 0.00 39.48 39.09 3dn0 n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 3dn0 h THR 115 N 1.15 0.27 -0.60 4.37 2.02 -1.78 0.60 112.91 118.94 3dn0 h THR 115 Ca 0.22 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.32 3dn0 h THR 115 Cb 1.77 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 3dn0 h THR 115 CO 0.49 0.00 0.07 0.78 0.37 0.00 0.00 175.52 177.23 3dn0 h ASN 116 N -0.21 0.98 -0.22 4.18 2.35 -1.95 -1.08 115.58 119.62 3dn0 h ASN 116 Ca 0.19 -0.28 0.04 0.00 -0.55 0.00 0.00 56.30 55.70 3dn0 h ASN 116 Cb 0.51 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.59 3dn0 h ASN 116 CO -0.54 1.01 -0.00 0.28 -1.65 0.00 0.00 177.43 176.53 3dn0 h SER 117 N 0.92 -0.09 -0.51 5.81 0.02 -1.81 -1.86 113.55 116.03 3dn0 h SER 117 Ca 0.18 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.22 3dn0 h SER 117 Cb 0.47 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.06 3dn0 h SER 117 CO 0.02 -0.02 0.27 -0.07 -1.14 0.00 0.00 176.83 175.89 3dn0 h LEU 118 N 0.07 0.39 -0.25 5.07 3.38 -0.56 -0.22 115.31 123.19 3dn0 h LEU 118 Ca 0.11 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3dn0 h LEU 118 Cb 0.14 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3dn0 h LEU 118 CO -0.18 0.27 0.07 -0.09 0.09 0.00 0.00 178.44 178.60 3dn0 h ARG 119 N 0.52 0.17 -0.70 1.13 2.43 -1.02 -1.14 114.38 115.77 3dn0 h ARG 119 Ca 0.22 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 3dn0 h ARG 119 Cb 0.11 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 3dn0 h ARG 119 CO -0.15 0.11 0.38 0.52 -1.51 0.00 0.00 179.97 179.33 3dn0 h MET 120 N 0.18 0.98 -0.58 0.20 2.86 -0.79 -0.95 114.93 116.82 3dn0 h MET 120 Ca 0.11 -0.12 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 3dn0 h MET 120 Cb 0.09 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.53 3dn0 h MET 120 CO -0.13 0.73 0.38 -0.07 1.06 0.00 0.00 176.91 178.88 3dn0 h LEU 121 N 0.96 0.65 -1.06 1.22 3.38 -0.86 -0.49 115.31 119.10 3dn0 h LEU 121 Ca 0.25 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 3dn0 h LEU 121 Cb 0.04 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3dn0 h LEU 121 CO -0.04 0.46 0.20 -0.61 0.09 0.00 0.00 178.44 178.55 3dn0 h GLN 122 N 0.76 0.87 0.00 1.13 4.15 -0.87 -1.20 115.11 119.96 3dn0 h GLN 122 Ca 0.21 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3dn0 h GLN 122 Cb -0.07 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.47 3dn0 h GLN 122 CO -0.06 0.74 0.00 1.04 -1.93 0.00 0.00 178.83 178.62 3dn0 n GLN 123 N -4.30 0.21 -2.66 1.69 6.02 -0.39 -4.90 117.38 113.04 3dn0 n GLN 123 Ca 0.05 0.12 -0.21 0.00 -0.01 0.00 0.00 57.00 56.94 3dn0 n GLN 123 Cb 0.19 -1.50 0.01 0.00 1.02 0.00 0.00 30.24 29.96 3dn0 n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3dn0 n LYS 124 N -1.35 -3.03 -2.51 -1.09 5.02 -0.46 -4.92 118.16 109.83 3dn0 n LYS 124 Ca 0.08 0.96 -0.43 0.00 -2.02 0.00 0.00 58.31 56.90 3dn0 n LYS 124 Cb 0.18 -5.68 0.00 0.00 -0.02 0.00 0.00 35.03 29.51 3dn0 n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3dn0 n ARG 125 N -3.41 3.51 -0.02 1.97 1.74 -0.30 -4.88 116.66 115.27 3dn0 n ARG 125 Ca -0.19 -3.59 -0.10 0.00 -0.77 0.00 0.00 57.85 53.20 3dn0 n ARG 125 Cb 0.66 -2.99 -0.04 0.00 -1.02 0.00 0.00 32.46 29.07 3dn0 n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3dn0 h TRP 126 N 6.22 0.07 -0.41 -1.55 -0.00 -1.89 0.20 115.95 118.59 3dn0 h TRP 126 Ca 0.38 0.01 -0.03 0.00 -0.00 0.00 0.00 58.89 59.25 3dn0 h TRP 126 Cb 0.71 -0.01 -0.02 0.00 -0.00 0.00 0.00 29.16 29.84 3dn0 h TRP 126 CO 1.22 0.03 0.15 -0.44 -0.00 0.00 0.00 178.44 179.39 3dn0 h ASP 127 N 0.10 0.59 -0.50 -3.49 5.19 -1.89 -0.24 116.42 116.17 3dn0 h ASP 127 Ca 0.06 -0.19 -0.04 0.00 -0.62 0.00 0.00 57.03 56.25 3dn0 h ASP 127 Cb 0.05 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.38 3dn0 h ASP 127 CO -0.08 0.61 0.17 -0.33 -3.12 0.00 0.00 179.24 176.50 3dn0 h GLU 128 N 0.52 0.77 -0.46 3.56 5.08 -1.92 -1.79 114.58 120.34 3dn0 h GLU 128 Ca 0.14 -0.16 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 3dn0 h GLU 128 Cb 0.23 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.31 3dn0 h GLU 128 CO -0.01 0.71 0.20 0.00 -1.00 0.00 0.00 179.01 178.92 3dn0 h ALA 129 N 1.02 0.57 -0.59 3.43 0.00 -0.46 -1.37 119.26 121.87 3dn0 h ALA 129 Ca 0.16 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3dn0 h ALA 129 Cb 0.25 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3dn0 h ALA 129 CO -0.01 -0.17 0.38 0.00 0.00 0.00 0.00 179.25 179.45 3dn0 h ALA 130 N 1.27 0.75 -0.07 0.00 0.00 -0.70 0.39 119.26 120.90 3dn0 h ALA 130 Ca 0.21 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3dn0 h ALA 130 Cb 0.16 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3dn0 h ALA 130 CO -0.18 0.21 0.04 0.28 0.00 0.00 0.00 179.25 179.60 3dn0 h VAL 131 N 0.80 1.05 -0.51 0.00 2.07 -1.14 -2.74 116.25 115.77 3dn0 h VAL 131 Ca 0.21 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 3dn0 h VAL 131 Cb -0.06 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3dn0 h VAL 131 CO -0.04 0.04 0.32 -1.13 0.02 0.00 0.00 177.57 176.77 3dn0 h ASN 132 N 0.06 0.61 -0.58 0.57 -0.73 -0.74 -2.72 115.58 112.05 3dn0 h ASN 132 Ca 0.03 -0.05 0.06 0.00 1.87 0.00 0.00 56.30 58.21 3dn0 h ASN 132 Cb 0.03 -0.15 -0.03 0.00 0.27 0.00 0.00 38.32 38.43 3dn0 h ASN 132 CO -0.00 0.48 0.39 -0.07 -0.37 0.00 0.00 177.43 177.85 3dn0 h LEU 133 N 0.69 0.48 -0.48 0.34 3.38 -0.88 -1.95 115.31 116.88 3dn0 h LEU 133 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3dn0 h LEU 133 Cb -0.02 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3dn0 h LEU 133 CO -0.04 0.31 0.00 0.00 0.09 0.00 0.00 178.44 178.80 3dn0 h ALA 134 N 1.69 1.00 -0.51 1.53 0.00 -1.17 -3.36 119.26 118.43 3dn0 h ALA 134 Ca 0.25 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.43 3dn0 h ALA 134 Cb 0.31 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 17.99 3dn0 h ALA 134 CO -0.07 0.00 2.55 1.63 0.00 0.00 0.00 179.25 183.35 3dn0 n LYS 135 N -2.45 3.41 -3.56 0.00 5.02 -0.73 -4.63 118.16 115.21 3dn0 n LYS 135 Ca 0.03 -3.12 -0.14 0.00 -2.02 0.00 0.00 58.31 53.06 3dn0 n LYS 135 Cb 0.34 -3.03 -0.05 0.00 -0.02 0.00 0.00 35.03 32.27 3dn0 n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3dn0 s SER 136 N 1.73 -0.48 0.25 4.39 1.04 -1.26 -5.02 113.70 114.35 3dn0 s SER 136 Ca 0.45 0.26 -0.04 0.00 0.48 0.00 0.00 55.95 57.09 3dn0 s SER 136 Cb 0.12 0.50 0.39 0.00 0.10 0.00 0.00 66.02 67.13 3dn0 s SER 136 CO -0.04 -0.71 1.83 -0.09 0.98 0.00 0.00 173.24 175.22 3dn0 h ARG 137 N 2.81 0.89 -0.20 4.02 2.43 -1.93 -2.17 114.38 120.22 3dn0 h ARG 137 Ca -0.30 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 58.87 3dn0 h ARG 137 Cb 1.21 -0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 30.48 3dn0 h ARG 137 CO 0.40 0.59 -0.35 2.35 -1.51 0.00 0.00 179.97 181.45 3dn0 h TRP 138 N 0.91 -0.99 -0.29 2.20 7.01 -1.95 0.31 115.95 123.15 3dn0 h TRP 138 Ca 0.40 0.05 -0.00 0.00 2.11 0.00 0.00 58.89 61.44 3dn0 h TRP 138 Cb 0.28 0.47 -0.01 0.00 -2.10 0.00 0.00 29.16 27.79 3dn0 h TRP 138 CO -0.04 -0.42 0.17 -0.92 -2.79 0.00 0.00 178.44 174.44 3dn0 h TYR 139 N -0.39 0.39 -0.62 2.65 3.20 -1.78 -0.82 116.97 119.61 3dn0 h TYR 139 Ca 0.11 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 3dn0 h TYR 139 Cb 0.57 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.68 3dn0 h TYR 139 CO -0.47 0.31 0.22 -0.91 -1.64 0.00 0.00 178.16 175.67 3dn0 h ASN 140 N 0.37 0.85 0.39 -2.11 4.21 -0.72 -1.13 115.58 117.44 3dn0 h ASN 140 Ca 0.10 -0.13 -0.32 0.00 1.21 0.00 0.00 56.30 57.17 3dn0 h ASN 140 Cb 0.03 -0.22 0.02 0.00 -1.12 0.00 0.00 38.32 37.03 3dn0 h ASN 140 CO -0.02 0.78 -1.48 1.56 -1.29 0.00 0.00 177.43 176.98 3dn0 h GLN 141 N 0.90 0.39 -2.22 0.81 1.08 -0.31 -3.39 115.11 112.37 3dn0 h GLN 141 Ca 0.21 -0.66 -0.59 0.00 -1.45 0.00 0.00 58.65 56.16 3dn0 h GLN 141 Cb 0.21 0.25 -0.41 0.00 -0.05 0.00 0.00 27.48 27.48 3dn0 h GLN 141 CO -0.01 1.30 -0.79 0.25 -0.95 0.00 0.00 178.83 178.62 3dn0 n THR 142 N -3.59 1.02 -0.15 -0.54 -2.24 -0.32 -4.99 114.28 103.48 3dn0 n THR 142 Ca -0.16 -4.66 -0.09 0.00 -2.27 0.00 0.00 64.05 56.87 3dn0 n THR 142 Cb 1.07 -2.03 -0.01 0.00 -2.10 0.00 0.00 70.33 67.26 3dn0 n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3dn0 h PRO 143 N 4.32 0.69 -0.45 -0.78 0.13 -1.41 -0.90 132.00 133.59 3dn0 h PRO 143 Ca 0.16 -0.17 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 3dn0 h PRO 143 Cb 0.76 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 3dn0 h PRO 143 CO 0.67 0.70 0.18 -0.91 -0.23 0.00 0.00 178.00 178.40 3dn0 h ASN 144 N 0.55 0.63 -0.21 1.44 4.21 -1.94 0.21 115.58 120.48 3dn0 h ASN 144 Ca 0.13 -0.17 -0.05 0.00 1.21 0.00 0.00 56.30 57.42 3dn0 h ASN 144 Cb 0.32 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 37.35 3dn0 h ASN 144 CO 0.00 0.63 -0.06 -0.09 -1.29 0.00 0.00 177.43 176.62 3dn0 h ARG 145 N 0.59 0.42 -0.77 0.81 2.43 -1.96 -2.48 114.38 113.42 3dn0 h ARG 145 Ca 0.15 -0.16 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 3dn0 h ARG 145 Cb 0.20 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 3dn0 h ARG 145 CO -0.01 0.67 0.50 0.00 -1.51 0.00 0.00 179.97 179.61 3dn0 h ALA 146 N 0.73 1.00 -0.67 2.80 0.00 -0.99 -1.49 119.26 120.64 3dn0 h ALA 146 Ca 0.05 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.00 3dn0 h ALA 146 Cb 0.52 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 3dn0 h ALA 146 CO 0.02 0.32 0.36 0.87 0.00 0.00 0.00 179.25 180.82 3dn0 h LYS 147 N 0.98 0.62 -0.23 0.00 1.57 -0.52 0.21 116.57 119.20 3dn0 h LYS 147 Ca 0.30 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 3dn0 h LYS 147 Cb -0.03 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 3dn0 h LYS 147 CO -0.09 0.41 0.11 0.00 -0.57 0.00 0.00 179.45 179.31 3dn0 h ARG 148 N 0.64 0.33 -0.37 3.15 3.08 -0.91 -0.03 114.38 120.27 3dn0 h ARG 148 Ca 0.31 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.30 3dn0 h ARG 148 Cb 0.25 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 3dn0 h ARG 148 CO -0.21 0.34 0.16 0.28 -1.07 0.00 0.00 179.97 179.46 3dn0 h VAL 149 N 0.24 1.18 -0.33 2.04 2.07 -0.90 -1.74 116.25 118.81 3dn0 h VAL 149 Ca 0.08 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3dn0 h VAL 149 Cb 0.12 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 3dn0 h VAL 149 CO -0.01 0.20 0.15 0.40 0.02 0.00 0.00 177.57 178.33 3dn0 h ILE 150 N 0.45 1.17 -1.00 4.57 2.04 -0.53 -1.34 117.51 122.87 3dn0 h ILE 150 Ca 0.12 -0.48 0.10 0.00 1.00 0.00 0.00 64.86 65.60 3dn0 h ILE 150 Cb 0.16 0.87 -0.08 0.00 -0.74 0.00 0.00 36.82 37.04 3dn0 h ILE 150 CO -0.01 0.17 0.64 0.74 0.00 0.00 0.00 178.15 179.69 3dn0 h THR 151 N 0.40 0.98 -0.43 -0.27 2.02 -0.88 0.41 112.91 115.14 3dn0 h THR 151 Ca 0.11 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 3dn0 h THR 151 Cb 0.14 -0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.35 3dn0 h THR 151 CO -0.01 0.19 0.24 0.74 0.37 0.00 0.00 175.52 177.05 3dn0 h THR 152 N 1.06 1.16 -0.67 3.16 2.02 -0.65 -0.53 112.91 118.46 3dn0 h THR 152 Ca 0.47 -0.41 -0.08 0.00 0.77 0.00 0.00 66.41 67.16 3dn0 h THR 152 Cb 0.37 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 3dn0 h THR 152 CO -0.23 0.17 0.10 -0.26 0.37 0.00 0.00 175.52 175.67 3dn0 h PHE 153 N 0.57 1.19 -0.48 3.16 0.04 -0.29 -0.02 116.94 121.10 3dn0 h PHE 153 Ca 0.15 -0.17 -0.05 0.00 2.80 0.00 0.00 57.97 60.70 3dn0 h PHE 153 Cb 0.06 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 37.86 3dn0 h PHE 153 CO -0.02 1.00 0.09 -0.09 -0.60 0.00 0.00 178.31 178.69 3dn0 h ARG 154 N 1.04 0.79 0.00 1.51 2.43 0.13 -3.37 114.38 116.91 3dn0 h ARG 154 Ca 0.20 -0.21 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 3dn0 h ARG 154 Cb 0.46 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 3dn0 h ARG 154 CO 0.02 0.79 -1.90 0.25 -1.51 0.00 0.00 179.97 177.61 3dn0 n THR 155 N -4.44 0.45 -1.45 0.20 -2.24 -0.24 -4.76 114.28 101.80 3dn0 n THR 155 Ca 0.01 -0.50 -0.14 0.00 -2.27 0.00 0.00 64.05 61.15 3dn0 n THR 155 Cb 0.24 -0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 68.24 3dn0 n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dn0 n GLY 156 N 1.75 1.37 3.62 3.38 0.00 -0.03 -5.01 105.19 110.27 3dn0 n GLY 156 Ca -0.13 -0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.25 3dn0 n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dn0 s THR 157 N -2.53 1.93 -0.66 2.61 -4.23 -1.26 -4.82 115.64 106.68 3dn0 s THR 157 Ca 0.00 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.65 3dn0 s THR 157 Cb 0.00 -2.95 0.70 0.00 1.34 0.00 0.00 72.50 71.58 3dn0 s THR 157 CO 0.00 0.00 1.58 0.79 -0.54 0.00 0.00 174.62 176.45 3dn0 n TRP 158 N -0.97 1.65 -0.29 3.99 7.02 -1.26 -4.53 117.44 123.05 3dn0 n TRP 158 Ca -0.06 -0.60 0.14 0.00 -1.02 0.00 0.00 57.50 55.96 3dn0 n TRP 158 Cb 0.67 -0.38 0.39 0.00 -2.42 0.00 0.00 31.31 29.57 3dn0 n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3dn0 h ASP 159 N 3.57 0.65 0.77 -0.99 5.19 -1.96 -0.60 116.42 123.05 3dn0 h ASP 159 Ca 0.00 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 3dn0 h ASP 159 Cb 1.63 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 41.07 3dn0 h ASP 159 CO 0.35 0.29 0.00 0.00 -3.12 0.00 0.00 179.24 176.76 3dn0 n ALA 160 N -2.42 1.76 0.57 3.45 0.00 -1.26 -2.61 120.51 120.00 3dn0 n ALA 160 Ca 0.20 0.03 0.07 0.00 0.00 0.00 0.00 53.44 53.73 3dn0 n ALA 160 Cb 0.55 -1.37 0.02 0.00 0.00 0.00 0.00 19.45 18.66 3dn0 n ALA 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3dn0 n TYR 161 N -2.04 0.00 -2.46 0.00 4.02 -0.26 -4.91 117.16 111.52 3dn0 n TYR 161 Ca 0.03 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.54 3dn0 n TYR 161 Cb 0.24 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.53 3dn0 n TYR 161 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3dn0 s LYS 162 N -1.39 4.33 0.00 -0.72 -0.14 -1.07 -2.88 119.74 117.87 3dn0 s LYS 162 Ca 0.13 1.70 0.00 0.00 -1.36 0.00 0.00 55.97 56.43 3dn0 s LYS 162 Cb 0.11 -2.82 0.00 0.00 -1.68 0.00 0.00 37.83 33.43 3dn0 s LYS 162 CO 0.25 -0.04 0.00 0.27 -0.76 0.00 0.00 175.35 175.07 3dn0 n ASN 163 N 0.45 -4.13 -0.66 2.83 0.23 -1.26 -5.06 115.26 107.66 3dn0 n ASN 163 Ca 0.02 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.21 3dn0 n ASN 163 Cb 0.47 -2.76 0.36 0.00 -2.08 0.00 0.00 39.78 35.77 3dn0 n ASN 163 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51