#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xdz s MET 1 N 0.00 3.29 0.85 1.20 1.75 -1.14 -5.01 119.30 120.25 1xdz s MET 1 Ca 0.00 -0.75 -0.13 0.00 -1.25 0.00 0.00 55.69 53.56 1xdz s MET 1 Cb 0.00 -3.61 0.11 0.00 2.84 0.00 0.00 34.83 34.17 1xdz s MET 1 CO 0.00 -0.45 1.22 0.54 -0.65 0.00 0.00 175.02 175.67 1xdz s ASN 2 N 1.62 4.10 0.24 1.11 2.20 -1.26 -4.45 114.94 118.49 1xdz s ASN 2 Ca 0.04 0.64 -0.07 0.00 -0.94 0.00 0.00 52.86 52.54 1xdz s ASN 2 Cb -0.17 -1.01 0.27 0.00 -2.00 0.00 0.00 41.25 38.33 1xdz s ASN 2 CO 0.07 -2.15 1.88 0.40 -2.94 0.00 0.00 177.10 174.36 1xdz h ILE 3 N -1.23 1.14 -0.65 0.54 1.08 -1.99 -0.82 117.51 115.59 1xdz h ILE 3 Ca -0.46 -0.38 -0.08 0.00 -0.39 0.00 0.00 64.86 63.55 1xdz h ILE 3 Cb 1.30 -0.05 -0.03 0.00 -3.07 0.00 0.00 36.82 34.98 1xdz h ILE 3 CO 0.58 0.20 0.08 -0.08 -0.69 0.00 0.00 178.15 178.24 1xdz h GLU 4 N 1.10 1.09 -0.56 2.37 4.22 -1.98 0.80 114.58 121.60 1xdz h GLU 4 Ca 0.35 -0.30 -0.07 0.00 0.08 0.00 0.00 59.36 59.41 1xdz h GLU 4 Cb 0.01 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1xdz h GLU 4 CO -0.12 1.01 0.07 0.93 -2.18 0.00 0.00 179.01 178.72 1xdz h GLU 5 N 1.01 0.95 0.41 1.92 5.08 -1.81 0.18 114.58 122.32 1xdz h GLU 5 Ca 0.19 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1xdz h GLU 5 Cb 0.47 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1xdz h GLU 5 CO 0.02 0.92 -0.28 0.35 -1.00 0.00 0.00 179.01 179.02 1xdz h PHE 6 N 0.84 -0.73 -0.16 4.33 3.57 -0.91 0.16 116.94 124.05 1xdz h PHE 6 Ca 0.17 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1xdz h PHE 6 Cb 0.45 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 1xdz h PHE 6 CO 0.03 -0.42 0.10 1.15 -2.23 0.00 0.00 178.31 176.94 1xdz h THR 7 N -0.67 1.04 -0.16 4.41 2.02 -0.72 -2.19 112.91 116.65 1xdz h THR 7 Ca -0.04 -0.09 -0.16 0.00 0.77 0.00 0.00 66.41 66.89 1xdz h THR 7 Cb 0.56 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1xdz h THR 7 CO 0.03 0.04 -0.55 0.77 0.37 0.00 0.00 175.52 176.18 1xdz h SER 8 N 0.21 0.55 -0.61 4.18 4.64 -0.64 -1.69 113.55 120.19 1xdz h SER 8 Ca 0.06 -0.30 0.01 0.00 -0.47 0.00 0.00 61.79 61.09 1xdz h SER 8 Cb -0.02 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 61.88 1xdz h SER 8 CO -0.01 0.99 0.39 1.23 -0.87 0.00 0.00 176.83 178.57 1xdz h GLY 9 N 1.13 0.86 1.11 -0.77 0.00 -0.58 -1.81 103.07 103.01 1xdz h GLY 9 Ca 0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 47.33 46.88 1xdz h GLY 9 CO 0.10 0.29 -0.35 1.41 0.00 0.00 0.00 176.54 177.99 1xdz h LEU 10 N 0.80 0.99 -0.80 3.11 3.38 -1.30 -3.09 115.31 118.40 1xdz h LEU 10 Ca 0.23 -0.46 0.09 0.00 0.09 0.00 0.00 57.88 57.83 1xdz h LEU 10 Cb -0.06 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.34 1xdz h LEU 10 CO -0.06 1.24 0.45 0.00 0.09 0.00 0.00 178.44 180.16 1xdz h ALA 11 N 0.78 1.12 -0.09 1.53 0.00 -0.72 -0.05 119.26 121.84 1xdz h ALA 11 Ca 0.07 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1xdz h ALA 11 Cb 0.95 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1xdz h ALA 11 CO 0.09 0.09 0.08 0.93 0.00 0.00 0.00 179.25 180.44 1xdz h GLU 12 N 0.77 0.00 -0.60 0.00 5.08 -1.25 -1.47 114.58 117.10 1xdz h GLU 12 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1xdz h GLU 12 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1xdz h GLU 12 CO -0.24 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.40 1xdz n LYS 13 N -4.05 2.65 -0.38 2.33 4.76 -0.27 -4.95 118.16 118.26 1xdz n LYS 13 Ca -0.01 -2.50 0.00 0.00 -2.87 0.00 0.00 58.31 52.94 1xdz n LYS 13 Cb 0.19 -1.53 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 1xdz n LYS 13 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xdz n GLY 14 N 1.51 0.80 3.14 0.72 0.00 -0.55 -4.92 105.19 105.88 1xdz n GLY 14 Ca 0.22 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1xdz n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xdz s ILE 15 N -2.00 2.90 -0.35 -0.61 1.01 -0.19 -4.98 121.20 116.98 1xdz s ILE 15 Ca 0.00 -1.65 -0.10 0.00 0.00 0.00 0.00 60.65 58.90 1xdz s ILE 15 Cb 0.00 -2.79 0.01 0.00 0.01 0.00 0.00 42.46 39.70 1xdz s ILE 15 CO 0.00 -0.27 0.19 -0.44 0.00 0.00 0.00 174.94 174.41 1xdz s SER 16 N 1.32 5.67 0.09 3.58 0.01 -1.26 -2.06 113.70 121.05 1xdz s SER 16 Ca -0.01 -0.82 -0.27 0.00 1.31 0.00 0.00 55.95 56.15 1xdz s SER 16 Cb -0.20 -2.02 -0.06 0.00 0.21 0.00 0.00 66.02 63.95 1xdz s SER 16 CO -0.03 -0.32 0.85 -0.76 0.41 0.00 0.00 173.24 173.40 1xdz s LEU 17 N 1.58 4.49 0.71 2.44 1.43 -1.26 -5.07 118.68 123.00 1xdz s LEU 17 Ca 0.03 1.63 -0.11 0.00 -1.03 0.00 0.00 54.13 54.65 1xdz s LEU 17 Cb -0.18 -3.40 0.02 0.00 0.03 0.00 0.00 46.19 42.65 1xdz s LEU 17 CO 0.07 0.01 1.09 -0.94 0.23 0.00 0.00 176.35 176.81 1xdz s SER 18 N -0.20 5.41 0.36 2.29 1.04 -1.26 -4.88 113.70 116.46 1xdz s SER 18 Ca 0.42 1.10 0.10 0.00 0.48 0.00 0.00 55.95 58.05 1xdz s SER 18 Cb -0.22 -1.89 0.86 0.00 0.10 0.00 0.00 66.02 64.87 1xdz s SER 18 CO 0.26 -1.36 1.85 -0.65 0.98 0.00 0.00 173.24 174.33 1xdz h PRO 19 N -0.65 0.63 -0.31 4.02 0.11 -1.99 -1.51 132.00 132.29 1xdz h PRO 19 Ca -0.45 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1xdz h PRO 19 Cb 1.26 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1xdz h PRO 19 CO 0.64 0.42 0.18 -0.09 -0.21 0.00 0.00 178.00 178.94 1xdz h ARG 20 N 0.65 0.43 -0.72 1.05 2.43 -1.99 -1.04 114.38 115.18 1xdz h ARG 20 Ca 0.47 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.56 1xdz h ARG 20 Cb 0.83 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.26 1xdz h ARG 20 CO -0.22 0.34 0.28 1.96 -1.51 0.00 0.00 179.97 180.82 1xdz h GLN 21 N 0.40 1.09 -0.63 0.20 4.20 -1.72 0.17 115.11 118.82 1xdz h GLN 21 Ca 0.11 -0.20 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 1xdz h GLN 21 Cb 0.03 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.61 1xdz h GLN 21 CO -0.02 0.90 0.19 -0.07 -0.67 0.00 0.00 178.83 179.16 1xdz h LEU 22 N 1.04 0.92 -1.05 1.46 3.38 -1.17 -1.87 115.31 118.03 1xdz h LEU 22 Ca 0.24 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1xdz h LEU 22 Cb 0.22 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1xdz h LEU 22 CO -0.02 0.88 -0.13 -0.33 0.09 0.00 0.00 178.44 178.93 1xdz h GLU 23 N 0.90 0.52 -0.82 1.13 4.39 -0.72 -2.07 114.58 117.92 1xdz h GLU 23 Ca 0.20 -0.16 0.01 0.00 0.34 0.00 0.00 59.36 59.75 1xdz h GLU 23 Cb 0.29 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.85 1xdz h GLU 23 CO -0.01 0.65 0.54 1.96 -1.16 0.00 0.00 179.01 180.99 1xdz h GLN 24 N 0.48 1.08 -0.15 2.33 4.20 -0.56 -0.99 115.11 121.51 1xdz h GLN 24 Ca 0.09 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 1xdz h GLN 24 Cb 0.52 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1xdz h GLN 24 CO 0.03 0.72 -0.34 0.74 -0.67 0.00 0.00 178.83 179.31 1xdz h PHE 25 N 1.11 0.34 -0.49 2.96 0.04 -0.88 -0.44 116.94 119.58 1xdz h PHE 25 Ca 0.30 -0.08 -0.06 0.00 2.80 0.00 0.00 57.97 60.93 1xdz h PHE 25 Cb -0.12 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 37.93 1xdz h PHE 25 CO -0.01 0.61 0.07 0.93 -0.60 0.00 0.00 178.31 179.30 1xdz h GLU 26 N 0.26 0.82 -0.51 1.51 4.39 -0.78 -1.03 114.58 119.23 1xdz h GLU 26 Ca 0.03 -0.22 -0.11 0.00 0.34 0.00 0.00 59.36 59.40 1xdz h GLU 26 Cb 0.73 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 1xdz h GLU 26 CO 0.06 0.82 -0.09 -0.07 -1.16 0.00 0.00 179.01 178.57 1xdz h LEU 27 N 0.69 0.97 -0.26 1.33 3.38 -1.03 -1.09 115.31 119.30 1xdz h LEU 27 Ca 0.15 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.81 1xdz h LEU 27 Cb 0.41 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1xdz h LEU 27 CO 0.01 1.09 0.01 0.22 0.09 0.00 0.00 178.44 179.87 1xdz h TYR 28 N 0.84 0.01 0.25 1.13 -0.00 -0.94 -0.26 116.97 117.99 1xdz h TYR 28 Ca 0.13 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.88 1xdz h TYR 28 Cb 0.65 0.04 -0.02 0.00 -0.00 0.00 0.00 36.73 37.40 1xdz h TYR 28 CO 0.05 -0.03 -0.24 -0.92 -0.00 0.00 0.00 178.16 177.02 1xdz h TYR 29 N 0.09 -0.64 -0.38 -3.82 3.20 -0.93 -0.16 116.97 114.33 1xdz h TYR 29 Ca 0.12 0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.08 1xdz h TYR 29 Cb 0.15 0.25 -0.08 0.00 1.54 0.00 0.00 36.73 38.59 1xdz h TYR 29 CO -0.19 -0.35 -0.15 -0.44 -1.64 0.00 0.00 178.16 175.38 1xdz h ASP 30 N -0.52 -0.53 -0.47 -2.11 3.32 -0.98 -1.65 116.42 113.48 1xdz h ASP 30 Ca -0.01 0.14 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 1xdz h ASP 30 Cb 0.48 0.31 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 1xdz h ASP 30 CO -0.05 -0.19 -0.10 0.24 -1.72 0.00 0.00 179.24 177.42 1xdz h MET 31 N -0.08 0.94 0.10 3.56 2.86 -0.90 -1.73 114.93 119.69 1xdz h MET 31 Ca 0.19 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1xdz h MET 31 Cb 0.37 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1xdz h MET 31 CO -0.44 0.99 -0.05 1.25 1.06 0.00 0.00 176.91 179.72 1xdz h LEU 32 N 0.84 -0.12 -0.81 1.22 5.85 -0.68 -0.65 115.31 120.96 1xdz h LEU 32 Ca 0.14 -0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 1xdz h LEU 32 Cb 0.64 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 1xdz h LEU 32 CO 0.04 -0.04 -0.16 -0.37 -0.34 0.00 0.00 178.44 177.57 1xdz h VAL 33 N -0.18 1.26 -0.07 1.05 -1.51 -1.27 -0.46 116.25 115.07 1xdz h VAL 33 Ca -0.01 -1.22 -0.01 0.00 -1.23 0.00 0.00 66.70 64.23 1xdz h VAL 33 Cb 0.14 1.13 -0.00 0.00 -2.13 0.00 0.00 31.29 30.43 1xdz h VAL 33 CO 0.02 0.41 0.02 -0.08 -1.23 0.00 0.00 177.57 176.71 1xdz h GLU 34 N 0.65 0.11 0.00 5.19 4.81 -1.17 -2.97 114.58 121.19 1xdz h GLU 34 Ca 0.10 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1xdz h GLU 34 Cb 0.63 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1xdz h GLU 34 CO 0.04 0.30 -0.21 -1.49 -0.73 0.00 0.00 179.01 176.93 1xdz h TRP 35 N -0.10 0.00 0.00 0.92 4.06 -1.05 -2.57 115.95 117.21 1xdz h TRP 35 Ca 0.02 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.97 1xdz h TRP 35 Cb 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.40 1xdz h TRP 35 CO 0.00 0.21 0.00 -0.97 -3.56 0.00 0.00 178.44 174.12 1xdz h ASN 36 N 0.00 0.00 -0.08 -3.49 -0.00 -0.92 0.15 115.58 111.24 1xdz h ASN 36 Ca -0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 56.30 56.12 1xdz h ASN 36 Cb 0.75 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.06 1xdz h ASN 36 CO 0.03 0.00 -0.58 -0.33 -0.00 0.00 0.00 177.43 176.54 1xdz h GLU 37 N 0.00 0.68 0.00 6.67 5.08 -1.39 -3.34 114.58 122.28 1xdz h GLU 37 Ca 0.00 -0.45 -0.03 0.00 -1.00 0.00 0.00 59.36 57.89 1xdz h GLU 37 Cb 0.31 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1xdz h GLU 37 CO 0.00 1.07 -0.11 0.87 -1.00 0.00 0.00 179.01 179.84 1xdz h LYS 38 N 0.51 0.07 -4.60 2.33 1.57 -1.31 -3.48 116.57 111.66 1xdz h LYS 38 Ca 0.00 -0.08 -0.21 0.00 -1.87 0.00 0.00 60.65 58.49 1xdz h LYS 38 Cb 1.16 0.02 -0.15 0.00 0.08 0.00 0.00 32.23 33.34 1xdz h LYS 38 CO 0.12 0.86 -0.70 0.96 -0.57 0.00 0.00 179.45 180.12 1xdz s ILE 39 N -3.01 0.63 -0.32 1.86 -4.36 -0.09 -5.11 121.20 110.80 1xdz s ILE 39 Ca -0.17 -1.89 -0.29 0.00 -0.26 0.00 0.00 60.65 58.05 1xdz s ILE 39 Cb -0.00 -1.62 -0.01 0.00 1.25 0.00 0.00 42.46 42.07 1xdz s ILE 39 CO 0.71 -0.87 1.69 0.21 0.24 0.00 0.00 174.94 176.92 1xdz s ASN 40 N -2.97 6.07 0.00 4.36 2.47 -1.26 -3.95 114.94 119.66 1xdz s ASN 40 Ca 0.10 1.28 0.00 0.00 0.42 0.00 0.00 52.86 54.66 1xdz s ASN 40 Cb 0.05 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.32 1xdz s ASN 40 CO -0.05 -1.57 0.00 0.18 -3.72 0.00 0.00 177.10 171.94 1xdz n LEU 41 N 9.65 0.41 -3.71 3.21 4.77 -1.26 -5.05 117.00 125.01 1xdz n LEU 41 Ca 0.21 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.05 1xdz n LEU 41 Cb 0.47 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.47 1xdz n LEU 41 CO 0.68 0.07 0.12 0.28 -1.33 0.00 0.00 177.39 177.21 1xdz s THR 42 N -1.75 0.02 -0.87 -5.08 -1.32 -1.26 -4.70 115.64 100.68 1xdz s THR 42 Ca 0.00 -0.14 0.27 0.00 -1.21 0.00 0.00 61.69 60.60 1xdz s THR 42 Cb 0.00 -0.65 0.16 0.00 -1.51 0.00 0.00 72.50 70.50 1xdz s THR 42 CO 0.00 -0.08 1.66 -1.20 -2.21 0.00 0.00 174.62 172.80 1xdz n SER 43 N 2.17 0.43 -4.11 8.08 7.64 -1.26 -4.82 113.62 121.75 1xdz n SER 43 Ca -0.16 0.28 -0.30 0.00 1.01 0.00 0.00 58.87 59.70 1xdz n SER 43 Cb 0.57 -0.27 -0.17 0.00 -1.01 0.00 0.00 64.21 63.33 1xdz n SER 43 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1xdz s ILE 44 N -3.05 1.70 0.00 0.44 -1.09 -1.26 -5.01 121.20 112.93 1xdz s ILE 44 Ca 0.11 -0.77 0.00 0.00 -2.23 0.00 0.00 60.65 57.76 1xdz s ILE 44 Cb 0.16 -1.52 0.00 0.00 -1.58 0.00 0.00 42.46 39.52 1xdz s ILE 44 CO 0.62 0.48 0.00 0.35 -1.23 0.00 0.00 174.94 175.16 1xdz n THR 45 N 4.05 0.00 -2.14 2.92 -2.24 -1.26 -4.82 114.28 110.79 1xdz n THR 45 Ca -0.20 -0.15 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 1xdz n THR 45 Cb 0.52 0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 1xdz n THR 45 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1xdz s GLU 46 N -1.00 4.32 0.14 -0.78 0.41 -1.26 -4.88 118.70 115.66 1xdz s GLU 46 Ca 0.00 2.13 -0.22 0.00 -0.41 0.00 0.00 54.97 56.47 1xdz s GLU 46 Cb 0.00 -3.20 0.01 0.00 -1.78 0.00 0.00 34.13 29.16 1xdz s GLU 46 CO 0.00 -0.40 1.65 -0.22 -0.49 0.00 0.00 175.26 175.80 1xdz h LYS 47 N 6.15 -0.19 -0.14 1.61 3.64 -1.98 -0.48 116.57 125.18 1xdz h LYS 47 Ca -0.43 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.90 1xdz h LYS 47 Cb 1.21 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.06 1xdz h LYS 47 CO 0.83 -0.12 -0.16 0.87 -2.27 0.00 0.00 179.45 178.59 1xdz h LYS 48 N -0.19 0.22 -0.33 1.90 1.57 -1.92 -0.48 116.57 117.34 1xdz h LYS 48 Ca 0.12 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1xdz h LYS 48 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1xdz h LYS 48 CO -0.31 0.39 -0.06 0.93 -0.57 0.00 0.00 179.45 179.82 1xdz h GLU 49 N 0.21 0.62 -0.58 3.15 5.08 -1.63 -2.32 114.58 119.11 1xdz h GLU 49 Ca 0.04 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 1xdz h GLU 49 Cb 0.42 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1xdz h GLU 49 CO 0.03 0.79 0.25 0.28 -1.00 0.00 0.00 179.01 179.35 1xdz h VAL 50 N 0.41 1.22 -0.82 3.13 2.07 -0.40 0.13 116.25 121.99 1xdz h VAL 50 Ca 0.09 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 66.98 1xdz h VAL 50 Cb 0.55 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 1xdz h VAL 50 CO 0.03 0.26 0.53 1.88 0.02 0.00 0.00 177.57 180.28 1xdz h TYR 51 N 0.79 0.98 0.15 1.57 -1.99 -1.11 -0.51 116.97 116.86 1xdz h TYR 51 Ca 0.19 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.94 1xdz h TYR 51 Cb 0.17 -0.32 0.00 0.00 2.00 0.00 0.00 36.73 38.58 1xdz h TYR 51 CO 0.01 0.56 -0.07 1.25 -0.00 0.00 0.00 178.16 179.90 1xdz h LEU 52 N 1.02 -0.17 0.00 3.88 5.85 -1.23 0.26 115.31 124.92 1xdz h LEU 52 Ca 0.33 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1xdz h LEU 52 Cb 0.02 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1xdz h LEU 52 CO -0.12 0.40 -0.49 0.11 -0.34 0.00 0.00 178.44 178.00 1xdz h LYS 53 N -0.90 0.00 0.00 1.25 1.57 -0.74 -1.53 116.57 116.21 1xdz h LYS 53 Ca -0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1xdz h LYS 53 Cb 0.51 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1xdz h LYS 53 CO 0.03 0.00 -0.55 0.72 -0.57 0.00 0.00 179.45 179.08 1xdz n HIS 54 N -2.75 0.00 0.21 -1.35 8.25 -0.30 -4.54 115.22 114.74 1xdz n HIS 54 Ca 0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.39 1xdz n HIS 54 Cb 0.52 -0.22 -0.04 0.00 1.12 0.00 0.00 29.99 31.36 1xdz n HIS 54 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1xdz h PHE 55 N -0.40 -0.54 -0.18 4.41 0.04 -1.23 -2.07 116.94 116.97 1xdz h PHE 55 Ca -0.04 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1xdz h PHE 55 Cb 0.51 0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.82 1xdz h PHE 55 CO -0.15 -0.34 0.12 -0.92 -0.60 0.00 0.00 178.31 176.42 1xdz h TYR 56 N -1.02 0.23 -0.90 -0.55 3.20 -0.53 -1.92 116.97 115.48 1xdz h TYR 56 Ca -0.06 0.00 0.16 0.00 3.14 0.00 0.00 58.73 61.97 1xdz h TYR 56 Cb 0.45 -0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.54 1xdz h TYR 56 CO 0.02 0.17 0.49 0.22 -1.64 0.00 0.00 178.16 177.41 1xdz h ASP 57 N 0.23 0.61 -0.39 -2.11 3.58 -1.39 -1.56 116.42 115.40 1xdz h ASP 57 Ca 0.07 0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.56 1xdz h ASP 57 Cb -0.01 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 1xdz h ASP 57 CO -0.01 0.25 0.06 0.28 -2.88 0.00 0.00 179.24 176.93 1xdz h SER 58 N 0.68 0.62 0.97 2.28 0.02 -0.98 -3.10 113.55 114.04 1xdz h SER 58 Ca 0.50 -0.27 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1xdz h SER 58 Cb 0.72 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.09 1xdz h SER 58 CO -0.37 0.73 -0.03 0.40 -1.14 0.00 0.00 176.83 176.42 1xdz h ILE 59 N 0.49 0.09 -0.75 3.27 2.04 -0.55 -2.98 117.51 119.12 1xdz h ILE 59 Ca 0.12 -0.58 0.20 0.00 1.00 0.00 0.00 64.86 65.60 1xdz h ILE 59 Cb 0.38 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.95 1xdz h ILE 59 CO 0.01 0.03 0.53 0.71 0.00 0.00 0.00 178.15 179.43 1xdz h THR 60 N 0.00 0.66 -1.00 -0.27 1.35 -1.23 0.11 112.91 112.53 1xdz h THR 60 Ca -0.00 -0.04 0.22 0.00 -0.55 0.00 0.00 66.41 66.04 1xdz h THR 60 Cb 0.53 0.55 -0.12 0.00 -1.73 0.00 0.00 68.15 67.38 1xdz h THR 60 CO 0.00 0.02 0.60 0.00 -0.25 0.00 0.00 175.52 175.89 1xdz h ALA 61 N 1.64 1.72 0.00 6.62 0.00 -1.72 0.51 119.26 128.03 1xdz h ALA 61 Ca 0.37 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1xdz h ALA 61 Cb 1.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1xdz h ALA 61 CO -0.04 -0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.04 1xdz n ALA 62 N -2.32 1.69 0.24 0.00 0.00 0.37 -1.76 120.51 118.72 1xdz n ALA 62 Ca 0.25 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.81 1xdz n ALA 62 Cb 0.66 -1.29 0.38 0.00 0.00 0.00 0.00 19.45 19.20 1xdz n ALA 62 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xdz h PHE 63 N 0.00 0.00 0.00 0.00 0.04 -0.97 -3.37 116.94 112.64 1xdz h PHE 63 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1xdz h PHE 63 Cb 0.30 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.45 1xdz h PHE 63 CO 0.00 0.06 -0.92 0.66 -0.60 0.00 0.00 178.31 177.51 1xdz n TYR 64 N -3.14 0.00 -4.81 -0.55 4.01 -0.72 -5.00 117.16 106.95 1xdz n TYR 64 Ca 0.02 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.52 1xdz n TYR 64 Cb 0.45 -0.01 -0.15 0.00 -0.31 0.00 0.00 39.34 39.32 1xdz n TYR 64 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1xdz s VAL 65 N -1.93 1.34 -0.60 -0.72 -7.23 -0.78 -5.10 120.40 105.37 1xdz s VAL 65 Ca -0.00 -0.72 -0.22 0.00 -1.81 0.00 0.00 61.98 59.23 1xdz s VAL 65 Cb 0.00 -1.12 0.07 0.00 0.56 0.00 0.00 36.38 35.89 1xdz s VAL 65 CO 0.02 0.38 0.85 -0.62 -0.31 0.00 0.00 175.10 175.42 1xdz s ASP 66 N -0.34 6.21 0.11 4.85 2.15 -1.26 -4.39 116.67 123.99 1xdz s ASP 66 Ca 0.05 -0.97 0.23 0.00 0.43 0.00 0.00 52.55 52.29 1xdz s ASP 66 Cb -0.07 -2.38 0.91 0.00 -0.30 0.00 0.00 42.92 41.08 1xdz s ASP 66 CO -0.00 -1.25 1.71 0.49 -0.17 0.00 0.00 175.17 175.94 1xdz n PHE 67 N 7.14 0.39 0.26 -5.34 3.72 -1.26 -2.55 117.46 119.82 1xdz n PHE 67 Ca -0.05 0.13 0.14 0.00 -0.05 0.00 0.00 57.45 57.63 1xdz n PHE 67 Cb 0.45 -0.72 0.64 0.00 -0.94 0.00 0.00 39.48 38.92 1xdz n PHE 67 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1xdz h ASN 68 N 0.00 0.00 0.08 4.37 -0.26 -1.99 -3.06 115.58 114.72 1xdz h ASN 68 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1xdz h ASN 68 Cb 0.44 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.70 1xdz h ASN 68 CO 0.00 0.10 -0.11 0.00 -1.06 0.00 0.00 177.43 176.36 1xdz n GLN 69 N -3.29 1.37 -4.48 0.81 1.13 -1.06 -4.92 117.38 106.94 1xdz n GLN 69 Ca -0.00 -0.83 -0.23 0.00 -1.94 0.00 0.00 57.00 53.99 1xdz n GLN 69 Cb 0.33 -1.48 -0.11 0.00 0.11 0.00 0.00 30.24 29.09 1xdz n GLN 69 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1xdz s VAL 70 N -2.20 1.44 0.00 5.09 -7.23 -1.16 -5.08 120.40 111.26 1xdz s VAL 70 Ca 0.32 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.47 1xdz s VAL 70 Cb 0.20 -2.78 0.00 0.00 0.56 0.00 0.00 36.38 34.36 1xdz s VAL 70 CO 0.41 -0.05 0.00 0.59 -0.31 0.00 0.00 175.10 175.74 1xdz n ASN 71 N -0.73 3.93 -4.20 4.85 4.13 -1.26 -4.85 115.26 117.13 1xdz n ASN 71 Ca -0.03 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 55.93 1xdz n ASN 71 Cb 0.66 0.19 -0.16 0.00 -1.54 0.00 0.00 39.78 38.93 1xdz n ASN 71 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1xdz s THR 72 N -1.89 1.78 -0.00 3.41 -4.23 -1.26 -0.36 115.64 113.10 1xdz s THR 72 Ca 0.00 -0.90 0.05 0.00 -1.18 0.00 0.00 61.69 59.66 1xdz s THR 72 Cb 0.00 -1.52 -0.01 0.00 1.34 0.00 0.00 72.50 72.30 1xdz s THR 72 CO 0.00 0.50 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.79 1xdz s ILE 73 N 0.01 1.23 -0.06 2.99 -1.09 -0.06 -2.04 121.20 122.18 1xdz s ILE 73 Ca -0.06 -0.74 0.05 0.00 -2.23 0.00 0.00 60.65 57.66 1xdz s ILE 73 Cb -0.14 -1.04 -0.00 0.00 -1.58 0.00 0.00 42.46 39.70 1xdz s ILE 73 CO 0.04 0.28 -0.21 0.00 -1.23 0.00 0.00 174.94 173.82 1xdz s ASP 75 N 0.06 3.75 -0.87 0.00 -1.08 0.78 -0.78 116.67 118.53 1xdz s ASP 75 Ca -0.07 -0.47 -0.14 0.00 -0.52 0.00 0.00 52.55 51.34 1xdz s ASP 75 Cb -0.14 -1.59 0.22 0.00 -1.46 0.00 0.00 42.92 39.94 1xdz s ASP 75 CO 0.04 0.05 0.85 -0.69 0.52 0.00 0.00 175.17 175.94 1xdz s VAL 76 N 1.03 5.56 0.46 1.11 1.01 -0.79 -1.84 120.40 126.94 1xdz s VAL 76 Ca -0.01 -2.48 0.07 0.00 0.00 0.00 0.00 61.98 59.56 1xdz s VAL 76 Cb -0.15 -4.52 0.07 0.00 0.00 0.00 0.00 36.38 31.78 1xdz s VAL 76 CO -0.03 -1.10 0.59 0.61 0.00 0.00 0.00 175.10 175.16 1xdz n GLY 77 N 3.99 2.12 1.02 4.51 0.00 -1.21 -4.59 105.19 111.03 1xdz n GLY 77 Ca 0.16 -2.22 0.10 0.00 0.00 0.00 0.00 46.02 44.06 1xdz n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xdz n ALA 78 N -2.39 2.43 -0.17 4.61 0.00 -1.26 -4.90 120.51 118.84 1xdz n ALA 78 Ca -0.12 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.39 1xdz n ALA 78 Cb 0.49 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.98 1xdz n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xdz n GLY 79 N 1.40 0.67 0.55 0.00 0.00 -1.26 -4.90 105.19 101.64 1xdz n GLY 79 Ca 0.19 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.26 1xdz n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xdz n ALA 80 N -1.33 2.31 -0.46 4.61 0.00 -1.26 -4.70 120.51 119.67 1xdz n ALA 80 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1xdz n ALA 80 Cb 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.05 1xdz n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xdz n GLY 81 N 0.55 0.77 3.77 0.00 0.00 -1.26 -5.01 105.19 104.00 1xdz n GLY 81 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1xdz n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xdz s PHE 82 N -2.11 3.49 -2.52 1.61 2.99 -1.26 -0.42 117.98 119.76 1xdz s PHE 82 Ca 0.00 0.52 0.24 0.00 0.00 0.00 0.00 56.93 57.68 1xdz s PHE 82 Cb 0.00 -2.20 0.18 0.00 0.00 0.00 0.00 43.02 41.00 1xdz s PHE 82 CO 0.00 0.38 1.23 -0.35 -0.00 0.00 0.00 175.22 176.48 1xdz n PRO 83 N 3.12 1.77 0.12 0.24 -0.04 -1.26 -4.47 135.00 134.48 1xdz n PRO 83 Ca -0.15 -1.43 0.00 0.00 -0.04 0.00 0.00 63.50 61.88 1xdz n PRO 83 Cb 0.53 -1.47 0.30 0.00 -0.04 0.00 0.00 33.50 32.81 1xdz n PRO 83 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1xdz h SER 84 N 3.49 0.19 -0.07 3.54 4.64 -1.84 -2.66 113.55 120.83 1xdz h SER 84 Ca 0.00 -0.06 -0.11 0.00 -0.47 0.00 0.00 61.79 61.14 1xdz h SER 84 Cb 0.85 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.90 1xdz h SER 84 CO 0.00 0.51 -0.40 -0.07 -0.87 0.00 0.00 176.83 176.00 1xdz h LEU 85 N 0.16 0.47 -1.12 5.97 3.38 -1.11 0.29 115.31 123.36 1xdz h LEU 85 Ca 0.02 -0.66 0.10 0.00 0.09 0.00 0.00 57.88 57.43 1xdz h LEU 85 Cb 0.66 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 1xdz h LEU 85 CO 0.05 1.06 0.60 -0.65 0.09 0.00 0.00 178.44 179.59 1xdz h PRO 86 N -0.08 0.93 -0.42 1.13 0.11 -1.74 0.33 132.00 132.26 1xdz h PRO 86 Ca -0.03 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 1xdz h PRO 86 Cb 1.05 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.94 1xdz h PRO 86 CO 0.08 0.61 0.11 0.82 -0.21 0.00 0.00 178.00 179.42 1xdz h ILE 87 N 0.95 1.23 -0.98 4.15 2.04 -1.28 -2.35 117.51 121.28 1xdz h ILE 87 Ca 0.44 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.55 1xdz h ILE 87 Cb 0.41 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 1xdz h ILE 87 CO -0.20 0.27 0.65 0.50 0.00 0.00 0.00 178.15 179.37 1xdz h LYS 88 N 0.54 1.25 -0.69 2.37 1.63 0.16 0.28 116.57 122.12 1xdz h LYS 88 Ca 0.13 -0.08 -0.01 0.00 -0.85 0.00 0.00 60.65 59.85 1xdz h LYS 88 Cb 0.30 -0.28 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 1xdz h LYS 88 CO -0.00 0.83 0.40 0.82 -3.45 0.00 0.00 179.45 178.05 1xdz h ILE 89 N 1.29 1.20 0.00 2.00 2.04 -0.71 -2.00 117.51 121.33 1xdz h ILE 89 Ca 0.37 -0.47 -0.12 0.00 1.00 0.00 0.00 64.86 65.64 1xdz h ILE 89 Cb -0.08 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.26 1xdz h ILE 89 CO -0.10 0.22 -0.56 0.00 0.00 0.00 0.00 178.15 177.71 1xdz n PHE 91 N -3.70 1.37 0.35 0.00 3.72 0.92 -4.99 117.46 115.14 1xdz n PHE 91 Ca -0.01 -3.82 0.05 0.00 -0.05 0.00 0.00 57.45 53.62 1xdz n PHE 91 Cb 0.60 -0.42 0.21 0.00 -0.94 0.00 0.00 39.48 38.92 1xdz n PHE 91 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1xdz n PRO 92 N 1.24 0.03 0.30 -1.08 -0.04 -0.79 -1.81 135.00 132.86 1xdz n PRO 92 Ca 0.25 0.31 0.19 0.00 -0.04 0.00 0.00 63.50 64.21 1xdz n PRO 92 Cb 0.47 -1.50 0.92 0.00 -0.04 0.00 0.00 33.50 33.35 1xdz n PRO 92 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1xdz h HIS 93 N 0.00 0.00 -3.91 0.54 2.07 -1.94 -3.46 115.15 108.45 1xdz h HIS 93 Ca 0.00 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 57.00 1xdz h HIS 93 Cb 0.14 0.00 0.06 0.00 2.57 0.00 0.00 27.41 30.19 1xdz h HIS 93 CO 0.00 0.01 0.59 -0.51 -3.07 0.00 0.00 177.93 174.95 1xdz s LEU 94 N -6.26 4.33 -0.31 6.12 1.43 -0.75 -4.97 118.68 118.27 1xdz s LEU 94 Ca -0.02 2.56 -0.17 0.00 -1.03 0.00 0.00 54.13 55.47 1xdz s LEU 94 Cb 0.11 -3.80 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 1xdz s LEU 94 CO 0.49 -0.62 0.47 -1.00 0.23 0.00 0.00 176.35 175.92 1xdz s HIS 95 N -1.24 3.22 -0.12 0.29 3.76 0.52 -4.84 115.29 116.88 1xdz s HIS 95 Ca 0.53 0.33 0.01 0.00 -0.15 0.00 0.00 55.06 55.78 1xdz s HIS 95 Cb -0.37 -2.77 -0.01 0.00 1.11 0.00 0.00 32.58 30.54 1xdz s HIS 95 CO 0.47 -0.40 -0.16 0.08 -0.85 0.00 0.00 174.74 173.89 1xdz s VAL 96 N 2.27 2.83 -0.09 -0.90 1.01 -0.33 -0.88 120.40 124.32 1xdz s VAL 96 Ca 0.18 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.45 1xdz s VAL 96 Cb -0.16 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 1xdz s VAL 96 CO 0.11 0.54 -0.19 -0.89 0.00 0.00 0.00 175.10 174.67 1xdz s THR 97 N 0.28 2.60 -0.11 3.92 2.01 -0.08 -0.32 115.64 123.94 1xdz s THR 97 Ca -0.11 -0.85 0.03 0.00 0.31 0.00 0.00 61.69 61.07 1xdz s THR 97 Cb -0.16 -2.02 0.00 0.00 0.01 0.00 0.00 72.50 70.33 1xdz s THR 97 CO 0.06 0.56 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.69 1xdz s ILE 98 N -0.04 1.99 -0.16 1.82 1.01 -0.35 -0.16 121.20 125.32 1xdz s ILE 98 Ca -0.05 -0.96 -0.07 0.00 0.00 0.00 0.00 60.65 59.56 1xdz s ILE 98 Cb -0.14 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 1xdz s ILE 98 CO 0.04 0.54 0.09 0.54 0.00 0.00 0.00 174.94 176.15 1xdz s VAL 99 N 0.53 5.03 -0.05 2.92 0.11 -0.77 -1.35 120.40 126.83 1xdz s VAL 99 Ca -0.14 0.04 -0.10 0.00 -2.93 0.00 0.00 61.98 58.85 1xdz s VAL 99 Cb -0.17 -3.23 0.02 0.00 -1.53 0.00 0.00 36.38 31.47 1xdz s VAL 99 CO 0.05 0.52 0.24 -0.62 -3.33 0.00 0.00 175.10 171.96 1xdz s ASP 100 N -0.18 -0.17 0.02 3.54 2.15 -0.76 -3.36 116.67 117.91 1xdz s ASP 100 Ca 0.09 0.21 0.27 0.00 0.43 0.00 0.00 52.55 53.55 1xdz s ASP 100 Cb -0.12 0.38 0.94 0.00 -0.30 0.00 0.00 42.92 43.82 1xdz s ASP 100 CO 0.01 -0.26 1.73 -1.54 -0.17 0.00 0.00 175.17 174.94 1xdz n SER 101 N 2.11 0.24 -4.32 -0.34 3.41 -1.14 -1.22 113.62 112.37 1xdz n SER 101 Ca -0.18 0.24 -0.36 0.00 -0.26 0.00 0.00 58.87 58.32 1xdz n SER 101 Cb 0.57 -0.25 -0.13 0.00 -0.26 0.00 0.00 64.21 64.14 1xdz n SER 101 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1xdz s LEU 102 N -3.14 3.49 0.50 1.04 1.43 -1.26 -4.76 118.68 115.98 1xdz s LEU 102 Ca 0.13 -0.64 0.17 0.00 -1.03 0.00 0.00 54.13 52.76 1xdz s LEU 102 Cb 0.18 -1.81 1.23 0.00 0.03 0.00 0.00 46.19 45.82 1xdz s LEU 102 CO 0.60 -0.13 2.11 -1.13 0.23 0.00 0.00 176.35 178.03 1xdz h ASN 103 N 8.16 0.00 -0.41 2.29 -1.24 -1.98 -1.04 115.58 121.36 1xdz h ASN 103 Ca -0.34 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.63 1xdz h ASN 103 Cb 1.13 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.16 1xdz h ASN 103 CO 0.59 0.06 0.12 0.11 -1.29 0.00 0.00 177.43 177.02 1xdz h LYS 104 N 0.00 0.71 -0.13 6.67 1.57 -1.99 0.16 116.57 123.56 1xdz h LYS 104 Ca -0.00 -0.13 -0.21 0.00 -1.87 0.00 0.00 60.65 58.44 1xdz h LYS 104 Cb 0.10 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.30 1xdz h LYS 104 CO 0.01 0.64 -0.77 0.00 -0.57 0.00 0.00 179.45 178.76 1xdz h ARG 105 N 0.69 0.70 -0.73 3.15 3.08 -1.55 -2.56 114.38 117.16 1xdz h ARG 105 Ca 0.16 -0.57 0.07 0.00 0.07 0.00 0.00 59.98 59.71 1xdz h ARG 105 Cb 0.25 0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.35 1xdz h ARG 105 CO -0.00 1.19 0.40 0.82 -1.07 0.00 0.00 179.97 181.31 1xdz h ILE 106 N 0.48 0.93 -0.34 2.04 1.08 -0.96 -0.76 117.51 119.98 1xdz h ILE 106 Ca -0.05 -0.24 0.03 0.00 -0.39 0.00 0.00 64.86 64.21 1xdz h ILE 106 Cb 1.39 0.16 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 1xdz h ILE 106 CO 0.15 0.13 0.14 0.74 -0.69 0.00 0.00 178.15 178.62 1xdz h THR 107 N 0.71 0.94 -0.22 -0.27 2.02 -0.86 -0.50 112.91 114.74 1xdz h THR 107 Ca 0.34 -0.10 0.05 0.00 0.77 0.00 0.00 66.41 67.47 1xdz h THR 107 Cb 0.27 0.62 -0.06 0.00 -1.74 0.00 0.00 68.15 67.24 1xdz h THR 107 CO -0.22 0.05 -0.14 0.15 0.37 0.00 0.00 175.52 175.74 1xdz h PHE 108 N 0.30 -0.35 -0.74 3.16 3.57 -1.00 -2.03 116.94 119.85 1xdz h PHE 108 Ca 0.15 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.70 1xdz h PHE 108 Cb 0.10 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1xdz h PHE 108 CO -0.12 -0.21 0.47 -0.07 -2.23 0.00 0.00 178.31 176.15 1xdz h LEU 109 N -0.13 0.80 -0.39 0.59 3.38 -0.71 0.12 115.31 118.97 1xdz h LEU 109 Ca 0.12 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1xdz h LEU 109 Cb 0.32 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1xdz h LEU 109 CO -0.30 0.56 0.17 -0.33 0.09 0.00 0.00 178.44 178.64 1xdz h GLU 110 N 0.95 0.35 -0.52 1.13 5.08 -0.88 0.49 114.58 121.18 1xdz h GLU 110 Ca 0.28 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.52 1xdz h GLU 110 Cb -0.04 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1xdz h GLU 110 CO -0.09 0.23 -0.07 0.87 -1.00 0.00 0.00 179.01 178.95 1xdz h LYS 111 N 0.36 0.96 -0.06 2.33 1.79 -0.86 -1.91 116.57 119.18 1xdz h LYS 111 Ca 0.17 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1xdz h LYS 111 Cb 0.10 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.68 1xdz h LYS 111 CO -0.14 1.01 0.04 1.25 -1.08 0.00 0.00 179.45 180.53 1xdz h LEU 112 N 0.83 0.07 -0.99 2.94 5.85 -0.58 -1.19 115.31 122.24 1xdz h LEU 112 Ca 0.14 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.87 1xdz h LEU 112 Cb 0.62 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1xdz h LEU 112 CO 0.04 0.06 0.65 -1.28 -0.34 0.00 0.00 178.44 177.58 1xdz h SER 113 N 0.08 1.11 -0.31 1.25 0.87 -0.75 -0.38 113.55 115.41 1xdz h SER 113 Ca 0.02 -0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 1xdz h SER 113 Cb 0.00 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 1xdz h SER 113 CO -0.00 0.79 0.05 -0.08 -0.53 0.00 0.00 176.83 177.06 1xdz h GLU 114 N 1.30 0.51 -0.75 2.24 4.81 -1.11 -1.31 114.58 120.28 1xdz h GLU 114 Ca 0.38 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.43 1xdz h GLU 114 Cb -0.09 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1xdz h GLU 114 CO -0.10 0.60 0.30 0.00 -0.73 0.00 0.00 179.01 179.09 1xdz h ALA 115 N 0.89 1.13 0.00 2.92 0.00 -0.83 -2.20 119.26 121.17 1xdz h ALA 115 Ca 0.10 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1xdz h ALA 115 Cb 0.34 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xdz h ALA 115 CO 0.01 0.63 0.00 1.28 0.00 0.00 0.00 179.25 181.16 1xdz n LEU 116 N -4.29 0.00 -3.56 0.00 4.77 -0.19 -4.92 117.00 108.81 1xdz n LEU 116 Ca 0.07 0.48 -0.23 0.00 -0.03 0.00 0.00 56.01 56.29 1xdz n LEU 116 Cb 0.18 -0.48 0.08 0.00 -2.33 0.00 0.00 43.42 40.87 1xdz n LEU 116 CO 0.40 -0.02 0.23 0.00 -1.33 0.00 0.00 177.39 176.67 1xdz n GLN 117 N -1.48 -7.77 -2.66 3.23 6.02 -0.60 -4.98 117.38 109.14 1xdz n GLN 117 Ca 0.07 0.83 -0.40 0.00 -0.01 0.00 0.00 57.00 57.49 1xdz n GLN 117 Cb 0.31 -5.88 -0.05 0.00 1.02 0.00 0.00 30.24 25.65 1xdz n GLN 117 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1xdz s LEU 118 N -7.15 4.60 0.13 1.08 1.43 -0.60 -5.05 118.68 113.12 1xdz s LEU 118 Ca 0.50 2.03 0.03 0.00 -1.03 0.00 0.00 54.13 55.66 1xdz s LEU 118 Cb -0.22 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.35 1xdz s LEU 118 CO 0.73 0.04 0.21 -1.61 0.23 0.00 0.00 176.35 175.95 1xdz s GLU 119 N -1.12 3.25 -1.29 1.70 0.41 -1.26 -4.68 118.70 115.71 1xdz s GLU 119 Ca 0.43 -0.64 -0.06 0.00 -0.41 0.00 0.00 54.97 54.30 1xdz s GLU 119 Cb -0.28 -2.88 0.01 0.00 -1.78 0.00 0.00 34.13 29.20 1xdz s GLU 119 CO 0.34 0.54 1.11 0.09 -0.49 0.00 0.00 175.26 176.85 1xdz n ASN 120 N -0.21 -4.76 -4.51 -0.19 5.03 -1.26 -4.82 115.26 104.54 1xdz n ASN 120 Ca -0.07 -0.56 -0.33 0.00 0.87 0.00 0.00 54.58 54.48 1xdz n ASN 120 Cb 0.53 -5.03 -0.12 0.00 -1.02 0.00 0.00 39.78 34.14 1xdz n ASN 120 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1xdz s THR 121 N -3.33 3.38 -0.08 3.41 -4.23 -1.26 -1.19 115.64 112.35 1xdz s THR 121 Ca 0.37 -0.59 0.03 0.00 -1.18 0.00 0.00 61.69 60.31 1xdz s THR 121 Cb -0.16 -2.37 0.01 0.00 1.34 0.00 0.00 72.50 71.31 1xdz s THR 121 CO 0.72 0.58 -0.15 -0.89 -0.54 0.00 0.00 174.62 174.34 1xdz s THR 122 N -0.53 1.37 -0.12 3.99 2.01 0.57 -4.98 115.64 117.94 1xdz s THR 122 Ca 0.08 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.49 1xdz s THR 122 Cb -0.12 -1.23 0.00 0.00 0.01 0.00 0.00 72.50 71.17 1xdz s THR 122 CO 0.02 0.41 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.78 1xdz s PHE 123 N 0.62 2.63 -0.19 4.92 0.08 -1.26 -1.22 117.98 123.57 1xdz s PHE 123 Ca -0.15 -1.12 0.01 0.00 0.12 0.00 0.00 56.93 55.79 1xdz s PHE 123 Cb -0.16 -1.77 0.03 0.00 -0.57 0.00 0.00 43.02 40.55 1xdz s PHE 123 CO 0.04 -0.47 -0.14 0.00 -0.10 0.00 0.00 175.22 174.55 1xdz s HIS 125 N 1.34 2.78 -0.22 0.00 2.46 -1.26 -1.84 115.29 118.55 1xdz s HIS 125 Ca 0.01 0.84 -0.30 0.00 0.47 0.00 0.00 55.06 56.08 1xdz s HIS 125 Cb -0.15 -4.16 0.16 0.00 -0.13 0.00 0.00 32.58 28.29 1xdz s HIS 125 CO -0.10 -1.38 1.18 0.34 -2.47 0.00 0.00 174.74 172.32 1xdz s ASP 126 N 2.63 -0.20 0.28 9.88 -1.08 -0.35 -4.96 116.67 122.87 1xdz s ASP 126 Ca 0.51 0.21 -0.29 0.00 -0.52 0.00 0.00 52.55 52.46 1xdz s ASP 126 Cb -0.11 0.16 -0.10 0.00 -1.46 0.00 0.00 42.92 41.42 1xdz s ASP 126 CO 0.27 -0.19 1.09 -0.13 0.52 0.00 0.00 175.17 176.73 1xdz s ARG 127 N -1.08 4.65 0.43 4.34 1.81 -1.26 -2.88 118.95 124.96 1xdz s ARG 127 Ca 0.04 1.78 0.10 0.00 -1.72 0.00 0.00 55.73 55.93 1xdz s ARG 127 Cb -0.01 -3.19 0.96 0.00 -0.45 0.00 0.00 34.95 32.26 1xdz s ARG 127 CO -0.03 0.23 2.04 0.00 -0.68 0.00 0.00 175.30 176.86 1xdz h ALA 128 N 3.83 1.84 -0.49 2.13 0.00 -1.94 0.21 119.26 124.84 1xdz h ALA 128 Ca -0.47 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1xdz h ALA 128 Cb 1.21 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1xdz h ALA 128 CO 0.67 0.10 0.08 0.93 0.00 0.00 0.00 179.25 181.03 1xdz h GLU 129 N 0.45 0.77 -0.03 0.00 3.07 -1.90 -1.36 114.58 115.58 1xdz h GLU 129 Ca 0.18 -0.17 -0.07 0.00 -0.50 0.00 0.00 59.36 58.80 1xdz h GLU 129 Cb 0.16 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1xdz h GLU 129 CO -0.04 0.72 -0.25 1.15 -1.40 0.00 0.00 179.01 179.19 1xdz h THR 130 N 0.74 1.48 -0.56 1.13 2.02 -1.56 -3.31 112.91 112.85 1xdz h THR 130 Ca 0.16 -1.78 0.09 0.00 0.77 0.00 0.00 66.41 65.64 1xdz h THR 130 Cb 0.33 2.52 -0.07 0.00 -1.74 0.00 0.00 68.15 69.20 1xdz h THR 130 CO 0.00 0.50 0.19 0.15 0.37 0.00 0.00 175.52 176.73 1xdz h PHE 131 N -0.35 0.33 0.00 3.16 3.57 -0.84 -2.45 116.94 120.36 1xdz h PHE 131 Ca -0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1xdz h PHE 131 Cb 0.94 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.62 1xdz h PHE 131 CO 0.15 0.08 0.00 0.41 -2.23 0.00 0.00 178.31 176.72 1xdz n GLY 132 N -1.28 -1.23 0.04 2.40 0.00 -0.53 -1.96 105.19 102.63 1xdz n GLY 132 Ca 0.07 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1xdz n GLY 132 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xdz n GLN 133 N -2.03 0.21 -2.13 1.61 1.13 -0.93 -4.56 117.38 110.69 1xdz n GLN 133 Ca 0.03 0.03 -0.42 0.00 -1.94 0.00 0.00 57.00 54.70 1xdz n GLN 133 Cb 0.23 -1.60 -0.03 0.00 0.11 0.00 0.00 30.24 28.94 1xdz n GLN 133 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1xdz s ARG 134 N -3.13 4.27 0.43 -1.09 0.52 -0.83 -4.90 118.95 114.22 1xdz s ARG 134 Ca 0.06 2.09 0.13 0.00 -0.52 0.00 0.00 55.73 57.50 1xdz s ARG 134 Cb 0.15 -3.48 1.01 0.00 0.52 0.00 0.00 34.95 33.14 1xdz s ARG 134 CO 0.75 -0.58 1.98 -0.22 0.02 0.00 0.00 175.30 177.25 1xdz h LYS 135 N 7.66 0.41 -0.29 3.54 3.64 -1.91 -0.56 116.57 129.06 1xdz h LYS 135 Ca -0.40 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 58.84 1xdz h LYS 135 Cb 1.19 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 1xdz h LYS 135 CO 0.90 0.27 -0.28 -0.44 -2.27 0.00 0.00 179.45 177.63 1xdz h ASP 136 N 0.43 0.61 0.00 4.20 3.32 -1.95 -3.36 116.42 119.68 1xdz h ASP 136 Ca 0.27 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1xdz h ASP 136 Cb 0.49 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1xdz h ASP 136 CO -0.07 0.87 -1.12 1.33 -1.72 0.00 0.00 179.24 178.53 1xdz n VAL 137 N -4.09 0.00 -1.67 -1.35 0.24 -0.94 -4.90 118.33 105.62 1xdz n VAL 137 Ca -0.01 -0.23 -0.45 0.00 -2.04 0.00 0.00 64.34 61.61 1xdz n VAL 137 Cb 0.44 0.50 -0.04 0.00 -1.47 0.00 0.00 33.84 33.28 1xdz n VAL 137 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1xdz n ARG 138 N -1.64 2.20 -4.09 7.34 0.63 -0.26 -2.31 116.66 118.52 1xdz n ARG 138 Ca -0.01 0.79 -0.33 0.00 -0.92 0.00 0.00 57.85 57.39 1xdz n ARG 138 Cb 0.21 -2.56 -0.01 0.00 0.45 0.00 0.00 32.46 30.55 1xdz n ARG 138 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1xdz n GLU 139 N 3.33 -3.88 0.00 -0.14 1.02 0.22 -4.87 120.64 116.31 1xdz n GLU 139 Ca 0.16 0.44 0.03 0.00 -0.02 0.00 0.00 57.16 57.78 1xdz n GLU 139 Cb 0.30 -5.13 0.00 0.00 -0.02 0.00 0.00 31.44 26.58 1xdz n GLU 139 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1xdz n SER 140 N -2.76 1.09 -4.63 1.62 3.41 -0.96 -3.71 113.62 107.68 1xdz n SER 140 Ca 0.01 -1.04 -0.33 0.00 -0.26 0.00 0.00 58.87 57.24 1xdz n SER 140 Cb 0.53 0.41 -0.10 0.00 -0.26 0.00 0.00 64.21 64.79 1xdz n SER 140 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1xdz s TYR 141 N -1.03 3.01 0.18 7.33 2.02 -0.87 -4.79 117.35 123.20 1xdz s TYR 141 Ca 0.06 0.06 -0.10 0.00 -0.37 0.00 0.00 57.07 56.72 1xdz s TYR 141 Cb 0.06 -1.70 0.10 0.00 -0.40 0.00 0.00 41.96 40.02 1xdz s TYR 141 CO 0.17 0.40 1.74 -0.44 -1.57 0.00 0.00 175.55 175.84 1xdz h ASP 142 N 4.89 0.92 -3.60 2.29 3.32 -1.78 0.17 116.42 122.62 1xdz h ASP 142 Ca -0.49 -0.18 -0.26 0.00 0.02 0.00 0.00 57.03 56.12 1xdz h ASP 142 Cb 1.18 -0.24 -0.31 0.00 0.22 0.00 0.00 39.33 40.18 1xdz h ASP 142 CO 0.54 0.85 -0.70 -0.63 -1.72 0.00 0.00 179.24 177.59 1xdz s ILE 143 N -5.51 -0.03 -0.16 0.35 1.01 -0.86 -1.28 121.20 114.71 1xdz s ILE 143 Ca -0.13 0.12 -0.00 0.00 0.00 0.00 0.00 60.65 60.65 1xdz s ILE 143 Cb 0.14 -0.08 -0.00 0.00 0.01 0.00 0.00 42.46 42.52 1xdz s ILE 143 CO 0.81 0.05 -0.15 -0.69 0.00 0.00 0.00 174.94 174.97 1xdz s VAL 144 N 0.64 2.68 0.17 2.92 1.01 -0.04 -1.44 120.40 126.34 1xdz s VAL 144 Ca -0.05 -0.76 0.07 0.00 0.00 0.00 0.00 61.98 61.24 1xdz s VAL 144 Cb -0.07 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 1xdz s VAL 144 CO -0.02 0.51 -0.01 0.42 0.00 0.00 0.00 175.10 176.00 1xdz s THR 145 N 0.89 3.67 -0.24 3.92 -4.23 0.04 -0.62 115.64 119.07 1xdz s THR 145 Ca -0.04 -1.42 -0.11 0.00 -1.18 0.00 0.00 61.69 58.94 1xdz s THR 145 Cb -0.15 -2.83 0.09 0.00 1.34 0.00 0.00 72.50 70.95 1xdz s THR 145 CO -0.01 -0.09 0.55 0.00 -0.54 0.00 0.00 174.62 174.52 1xdz s ALA 146 N -1.69 -1.56 -0.38 3.99 0.00 -0.69 -1.88 121.76 119.56 1xdz s ALA 146 Ca 0.27 1.98 -0.07 0.00 0.00 0.00 0.00 51.96 54.14 1xdz s ALA 146 Cb -0.09 -1.38 0.06 0.00 0.00 0.00 0.00 23.12 21.71 1xdz s ALA 146 CO 0.18 -0.58 0.17 0.50 0.00 0.00 0.00 175.76 176.03 1xdz s ARG 147 N 2.13 2.55 0.04 0.00 3.52 -1.26 -0.87 118.95 125.06 1xdz s ARG 147 Ca -0.07 -1.35 -0.14 0.00 -0.13 0.00 0.00 55.73 54.04 1xdz s ARG 147 Cb -0.09 -3.59 0.02 0.00 -1.56 0.00 0.00 34.95 29.73 1xdz s ARG 147 CO -0.16 -0.82 0.32 0.00 -0.81 0.00 0.00 175.30 173.83 1xdz s ALA 148 N 1.38 -0.73 -0.45 6.12 0.00 -1.19 -4.65 121.76 122.25 1xdz s ALA 148 Ca 0.01 0.06 0.23 0.00 0.00 0.00 0.00 51.96 52.26 1xdz s ALA 148 Cb -0.21 0.31 0.35 0.00 0.00 0.00 0.00 23.12 23.57 1xdz s ALA 148 CO 0.02 -0.41 1.59 -0.24 0.00 0.00 0.00 175.76 176.72 1xdz h VAL 149 N 3.23 0.00 -2.00 0.00 3.04 -1.97 -3.44 116.25 115.10 1xdz h VAL 149 Ca -0.32 -0.97 -0.64 0.00 -1.01 0.00 0.00 66.70 63.77 1xdz h VAL 149 Cb 1.20 1.95 0.10 0.00 -2.01 0.00 0.00 31.29 32.53 1xdz h VAL 149 CO 0.45 0.00 0.05 0.00 -1.01 0.00 0.00 177.57 177.07 1xdz n ALA 150 N -2.09 -0.97 -1.62 3.17 0.00 -1.26 -4.85 120.51 112.89 1xdz n ALA 150 Ca 0.04 0.43 -0.47 0.00 0.00 0.00 0.00 53.44 53.44 1xdz n ALA 150 Cb 0.53 -1.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.00 1xdz n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1xdz n ARG 151 N 1.12 1.59 -0.34 0.00 1.74 -1.26 -4.67 116.66 114.84 1xdz n ARG 151 Ca 0.13 0.57 0.16 0.00 -0.77 0.00 0.00 57.85 57.94 1xdz n ARG 151 Cb 0.28 -2.13 0.37 0.00 -1.02 0.00 0.00 32.46 29.96 1xdz n ARG 151 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1xdz h LEU 152 N 3.65 0.69 -0.87 0.55 5.85 -1.89 0.72 115.31 124.02 1xdz h LEU 152 Ca -0.44 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.33 1xdz h LEU 152 Cb 1.31 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.30 1xdz h LEU 152 CO 0.72 0.19 0.14 0.77 -0.34 0.00 0.00 178.44 179.92 1xdz h SER 153 N 0.64 0.92 -0.04 1.25 4.64 -1.86 0.44 113.55 119.54 1xdz h SER 153 Ca 0.60 -0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.71 1xdz h SER 153 Cb 1.09 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1xdz h SER 153 CO -0.39 0.90 -0.07 0.58 -0.87 0.00 0.00 176.83 176.98 1xdz h VAL 154 N 0.93 1.42 -0.96 0.95 2.07 -1.46 -3.00 116.25 116.19 1xdz h VAL 154 Ca 0.20 -1.35 0.03 0.00 0.82 0.00 0.00 66.70 66.39 1xdz h VAL 154 Cb 0.35 2.22 -0.05 0.00 -1.52 0.00 0.00 31.29 32.29 1xdz h VAL 154 CO 0.00 0.37 0.63 0.25 0.02 0.00 0.00 177.57 178.84 1xdz h LEU 155 N -0.38 1.06 -0.76 2.57 5.85 -0.77 -1.97 115.31 120.91 1xdz h LEU 155 Ca 0.00 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1xdz h LEU 155 Cb 0.63 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1xdz h LEU 155 CO 0.02 0.74 0.43 0.28 -0.34 0.00 0.00 178.44 179.57 1xdz h SER 156 N 1.24 0.94 -0.39 1.25 0.02 -0.97 -0.58 113.55 115.06 1xdz h SER 156 Ca 0.37 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 61.19 1xdz h SER 156 Cb -0.06 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 1xdz h SER 156 CO -0.10 0.75 0.09 -0.08 -1.14 0.00 0.00 176.83 176.34 1xdz h GLU 157 N 1.05 0.71 -0.04 3.45 4.81 -1.22 0.04 114.58 123.37 1xdz h GLU 157 Ca 0.27 -0.14 -0.20 0.00 -0.13 0.00 0.00 59.36 59.16 1xdz h GLU 157 Cb 0.01 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 1xdz h GLU 157 CO -0.05 0.66 -0.81 -0.07 -0.73 0.00 0.00 179.01 178.01 1xdz h LEU 158 N 0.69 0.45 0.01 1.64 3.38 -1.03 -3.39 115.31 117.04 1xdz h LEU 158 Ca 0.15 -0.32 -0.41 0.00 0.09 0.00 0.00 57.88 57.39 1xdz h LEU 158 Cb 0.29 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 1xdz h LEU 158 CO 0.00 1.09 -2.26 0.00 0.09 0.00 0.00 178.44 177.36 1xdz h LEU 160 N -0.83 0.67 -0.65 0.00 3.38 -1.23 -1.29 115.31 115.37 1xdz h LEU 160 Ca -0.61 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1xdz h LEU 160 Cb 1.61 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.25 1xdz h LEU 160 CO -0.32 0.37 0.00 -2.65 0.09 0.00 0.00 178.44 175.93 1xdz n PRO 161 N -4.54 0.09 0.01 1.13 -0.02 -1.26 -1.88 135.00 128.53 1xdz n PRO 161 Ca 0.16 0.49 0.11 0.00 -2.02 0.00 0.00 63.50 62.23 1xdz n PRO 161 Cb 0.40 -1.74 0.06 0.00 -0.02 0.00 0.00 33.50 32.20 1xdz n PRO 161 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xdz n LEU 162 N -1.93 0.68 -4.72 2.45 4.77 -0.49 -0.61 117.00 117.15 1xdz n LEU 162 Ca 0.01 -0.15 -0.41 0.00 -0.03 0.00 0.00 56.01 55.42 1xdz n LEU 162 Cb 0.10 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1xdz n LEU 162 CO 0.10 0.13 0.55 -0.69 -1.33 0.00 0.00 177.39 176.15 1xdz s VAL 163 N -3.07 4.89 0.71 4.08 1.01 -0.79 -2.04 120.40 125.19 1xdz s VAL 163 Ca 0.08 1.78 -0.14 0.00 0.00 0.00 0.00 61.98 63.69 1xdz s VAL 163 Cb 0.16 -4.19 0.03 0.00 0.00 0.00 0.00 36.38 32.38 1xdz s VAL 163 CO 0.78 0.23 1.14 -1.59 0.00 0.00 0.00 175.10 175.66 1xdz s LYS 164 N 0.72 2.43 0.19 2.72 -2.85 0.05 -4.43 119.74 118.57 1xdz s LYS 164 Ca 0.45 1.47 -0.33 0.00 -1.00 0.00 0.00 55.97 56.56 1xdz s LYS 164 Cb -0.20 -1.90 -0.14 0.00 -2.06 0.00 0.00 37.83 33.54 1xdz s LYS 164 CO 0.24 -1.55 1.49 1.17 0.10 0.00 0.00 175.35 176.79 1xdz n LYS 165 N -2.76 2.04 -0.93 1.78 4.81 -1.26 -0.63 118.16 121.20 1xdz n LYS 165 Ca 0.11 0.73 0.00 0.00 -0.87 0.00 0.00 58.31 58.28 1xdz n LYS 165 Cb 0.52 -2.44 0.00 0.00 0.02 0.00 0.00 35.03 33.12 1xdz n LYS 165 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1xdz n ASN 166 N 2.80 -0.96 -2.01 3.14 3.02 0.20 -5.01 115.26 116.45 1xdz n ASN 166 Ca 0.15 0.00 -0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1xdz n ASN 166 Cb 0.29 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.85 1xdz n ASN 166 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xdz n GLY 167 N -2.07 -0.70 3.18 7.41 0.00 0.20 -4.70 105.19 108.50 1xdz n GLY 167 Ca 0.00 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 44.05 1xdz n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xdz s LEU 168 N 0.00 2.13 -0.21 0.99 1.43 -0.40 -1.01 118.68 121.61 1xdz s LEU 168 Ca 0.00 -0.44 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 1xdz s LEU 168 Cb -0.00 -0.81 -0.03 0.00 0.03 0.00 0.00 46.19 45.38 1xdz s LEU 168 CO 0.00 0.13 0.03 0.12 0.23 0.00 0.00 176.35 176.86 1xdz s PHE 169 N -0.70 3.08 -0.21 0.29 5.36 0.16 -0.86 117.98 125.10 1xdz s PHE 169 Ca 0.05 -0.37 0.02 0.00 -0.96 0.00 0.00 56.93 55.67 1xdz s PHE 169 Cb -0.08 -2.13 0.03 0.00 -0.34 0.00 0.00 43.02 40.51 1xdz s PHE 169 CO 0.01 -0.22 -0.17 0.08 -1.46 0.00 0.00 175.22 173.46 1xdz s VAL 170 N 1.09 2.10 -0.20 3.12 1.01 0.20 -0.88 120.40 126.84 1xdz s VAL 170 Ca 0.03 -1.17 -0.04 0.00 0.00 0.00 0.00 61.98 60.80 1xdz s VAL 170 Cb -0.14 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 1xdz s VAL 170 CO 0.02 0.35 -0.02 0.00 0.00 0.00 0.00 175.10 175.45 1xdz s ALA 171 N 1.23 2.95 -0.32 5.51 0.00 -0.42 -1.70 121.76 129.00 1xdz s ALA 171 Ca 0.00 -1.02 -0.13 0.00 0.00 0.00 0.00 51.96 50.81 1xdz s ALA 171 Cb -0.15 -1.71 -0.03 0.00 0.00 0.00 0.00 23.12 21.23 1xdz s ALA 171 CO -0.10 -0.19 0.25 -0.51 0.00 0.00 0.00 175.76 175.21 1xdz s LEU 172 N 1.06 4.37 0.31 0.00 1.02 -0.05 -1.18 118.68 124.22 1xdz s LEU 172 Ca 0.02 -0.27 0.03 0.00 0.02 0.00 0.00 54.13 53.92 1xdz s LEU 172 Cb -0.14 -2.17 -0.06 0.00 0.02 0.00 0.00 46.19 43.83 1xdz s LEU 172 CO 0.01 -0.20 0.08 -0.54 0.02 0.00 0.00 176.35 175.71 1xdz s LYS 173 N 1.79 1.60 0.00 1.70 1.02 0.55 -3.20 119.74 123.20 1xdz s LYS 173 Ca 0.07 -1.89 0.17 0.00 0.02 0.00 0.00 55.97 54.35 1xdz s LYS 173 Cb -0.17 -0.65 0.25 0.00 -0.52 0.00 0.00 37.83 36.74 1xdz s LYS 173 CO 0.11 -0.24 1.16 0.00 -0.92 0.00 0.00 175.35 175.46 1xdz n ALA 174 N -0.63 2.40 -2.00 5.17 0.00 -1.26 -0.98 120.51 123.20 1xdz n ALA 174 Ca -0.02 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.58 1xdz n ALA 174 Cb 0.66 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.51 1xdz n ALA 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdz n ALA 175 N 0.99 0.00 -2.52 0.00 0.00 -1.26 -4.37 120.51 113.36 1xdz n ALA 175 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1xdz n ALA 175 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1xdz n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdz n ALA 177 N -3.00 0.00 -0.04 0.00 0.00 -1.26 -5.01 120.51 111.20 1xdz n ALA 177 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 1xdz n ALA 177 Cb 0.00 0.00 0.44 0.00 0.00 0.00 0.00 19.45 19.89 1xdz n ALA 177 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1xdz h GLU 178 N 0.00 0.52 -0.13 0.00 4.81 -2.05 -2.13 114.58 115.59 1xdz h GLU 178 Ca 0.00 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 1xdz h GLU 178 Cb 0.00 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1xdz h GLU 178 CO 0.00 0.34 -0.29 1.05 -0.73 0.00 0.00 179.01 179.38 1xdz h GLU 179 N 0.53 0.42 0.00 1.92 9.09 -2.00 -2.34 114.58 122.20 1xdz h GLU 179 Ca 0.20 -0.28 -0.15 0.00 0.05 0.00 0.00 59.36 59.18 1xdz h GLU 179 Cb 0.12 0.04 -0.02 0.00 -1.65 0.00 0.00 28.75 27.24 1xdz h GLU 179 CO -0.05 0.89 -0.70 0.93 0.05 0.00 0.00 179.01 180.13 1xdz h GLU 180 N 0.02 0.00 -0.26 1.06 4.39 -1.98 -2.45 114.58 115.36 1xdz h GLU 180 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1xdz h GLU 180 Cb 0.89 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 1xdz h GLU 180 CO 0.06 0.70 0.03 1.25 -1.16 0.00 0.00 179.01 179.89 1xdz h LEU 181 N 0.00 0.42 -0.51 1.33 5.85 -1.45 0.75 115.31 121.70 1xdz h LEU 181 Ca -0.01 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.46 1xdz h LEU 181 Cb 1.36 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 1xdz h LEU 181 CO 0.09 0.59 0.30 -1.13 -0.34 0.00 0.00 178.44 177.95 1xdz h ASN 182 N 0.23 0.49 -0.64 1.25 -0.73 -1.33 0.44 115.58 115.29 1xdz h ASN 182 Ca 0.08 0.01 -0.09 0.00 1.87 0.00 0.00 56.30 58.16 1xdz h ASN 182 Cb 0.36 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.83 1xdz h ASN 182 CO 0.01 0.34 0.04 0.00 -0.37 0.00 0.00 177.43 177.45 1xdz h ALA 183 N 1.23 0.87 -0.18 1.57 0.00 -1.43 -3.04 119.26 118.27 1xdz h ALA 183 Ca 0.21 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1xdz h ALA 183 Cb 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1xdz h ALA 183 CO -0.09 0.67 0.09 0.78 0.00 0.00 0.00 179.25 180.70 1xdz h GLY 184 N 1.02 0.24 0.41 0.00 0.00 0.03 -2.04 103.07 102.72 1xdz h GLY 184 Ca 0.19 -0.07 0.12 0.00 0.00 0.00 0.00 47.33 47.57 1xdz h GLY 184 CO 0.02 0.06 0.55 0.50 0.00 0.00 0.00 176.54 177.67 1xdz h LYS 185 N 0.20 0.82 -0.28 4.80 1.57 -0.11 0.84 116.57 124.41 1xdz h LYS 185 Ca 0.07 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1xdz h LYS 185 Cb 0.01 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 1xdz h LYS 185 CO -0.05 0.54 -0.38 0.87 -0.57 0.00 0.00 179.45 179.86 1xdz h LYS 186 N 0.84 0.75 -0.57 3.15 1.79 -1.38 -2.51 116.57 118.64 1xdz h LYS 186 Ca 0.47 -0.43 -0.02 0.00 -2.18 0.00 0.00 60.65 58.48 1xdz h LYS 186 Cb 0.52 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 1xdz h LYS 186 CO -0.29 1.06 0.26 0.00 -1.08 0.00 0.00 179.45 179.40 1xdz h ALA 187 N 0.68 0.74 -0.36 3.86 0.00 -0.81 -2.04 119.26 121.33 1xdz h ALA 187 Ca 0.03 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.86 1xdz h ALA 187 Cb 0.97 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 1xdz h ALA 187 CO 0.09 0.32 0.05 0.82 0.00 0.00 0.00 179.25 180.52 1xdz h ILE 188 N 0.78 0.79 -0.28 0.00 2.04 -0.77 -0.14 117.51 119.94 1xdz h ILE 188 Ca 0.20 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.00 1xdz h ILE 188 Cb 0.14 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1xdz h ILE 188 CO -0.02 0.03 0.18 0.74 0.00 0.00 0.00 178.15 179.08 1xdz h THR 189 N 0.16 1.07 -0.77 -0.27 2.02 -1.29 0.83 112.91 114.66 1xdz h THR 189 Ca 0.17 -0.13 0.03 0.00 0.77 0.00 0.00 66.41 67.26 1xdz h THR 189 Cb 0.21 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 1xdz h THR 189 CO -0.24 0.07 0.51 0.74 0.37 0.00 0.00 175.52 176.96 1xdz h THR 190 N 0.37 1.12 -0.06 3.16 2.02 -0.83 -2.45 112.91 116.25 1xdz h THR 190 Ca 0.10 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1xdz h THR 190 Cb -0.04 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 1xdz h THR 190 CO -0.02 0.17 0.00 0.18 0.37 0.00 0.00 175.52 176.22 1xdz n LEU 191 N -4.45 0.85 0.00 2.58 4.77 -0.11 -4.55 117.00 116.09 1xdz n LEU 191 Ca 0.10 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1xdz n LEU 191 Cb 0.12 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1xdz n LEU 191 CO 0.35 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1xdz n GLY 192 N 1.01 0.82 3.93 -0.72 0.00 -0.92 -4.07 105.19 105.23 1xdz n GLY 192 Ca 0.17 -0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 1xdz n GLY 192 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xdz s GLY 193 N -2.14 2.03 -0.07 -0.02 0.00 0.25 -0.99 107.32 106.39 1xdz s GLY 193 Ca 0.00 -1.78 -0.03 0.00 0.00 0.00 0.00 44.72 42.92 1xdz s GLY 193 CO 0.00 -1.60 0.13 1.85 0.00 0.00 0.00 173.10 173.47 1xdz s GLU 194 N -4.20 0.03 -0.05 2.90 2.12 0.50 -3.88 118.70 116.11 1xdz s GLU 194 Ca 0.50 0.44 -0.30 0.00 0.36 0.00 0.00 54.97 55.97 1xdz s GLU 194 Cb -0.06 -0.27 -0.05 0.00 0.26 0.00 0.00 34.13 34.01 1xdz s GLU 194 CO 0.30 -0.25 1.57 -1.17 -0.54 0.00 0.00 175.26 175.17 1xdz s LEU 195 N 1.78 4.31 -0.18 2.70 2.96 -1.26 -0.52 118.68 128.46 1xdz s LEU 195 Ca -0.02 2.17 -0.13 0.00 -0.22 0.00 0.00 54.13 55.93 1xdz s LEU 195 Cb -0.12 -3.54 -0.21 0.00 0.50 0.00 0.00 46.19 42.82 1xdz s LEU 195 CO -0.05 -0.87 0.19 -0.62 -1.32 0.00 0.00 176.35 173.67 1xdz n GLU 196 N 6.72 0.66 -3.67 1.98 1.02 0.56 -4.92 120.64 122.99 1xdz n GLU 196 Ca 0.16 0.38 -0.15 0.00 -0.02 0.00 0.00 57.16 57.54 1xdz n GLU 196 Cb 0.43 -1.69 -0.08 0.00 -0.02 0.00 0.00 31.44 30.08 1xdz n GLU 196 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1xdz s ASN 197 N -6.97 -0.44 -0.17 1.62 -0.87 -1.08 -5.02 114.94 102.02 1xdz s ASN 197 Ca -0.28 0.57 0.01 0.00 -1.57 0.00 0.00 52.86 51.60 1xdz s ASN 197 Cb 0.07 0.61 0.01 0.00 -0.02 0.00 0.00 41.25 41.93 1xdz s ASN 197 CO 0.66 -0.41 -0.19 -0.63 -2.57 0.00 0.00 177.10 173.95 1xdz s ILE 198 N -0.79 2.22 -0.25 0.60 1.01 -1.26 -1.00 121.20 121.74 1xdz s ILE 198 Ca -0.09 -0.90 -0.08 0.00 0.00 0.00 0.00 60.65 59.58 1xdz s ILE 198 Cb -0.03 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.47 1xdz s ILE 198 CO 0.05 0.53 0.11 -1.00 0.00 0.00 0.00 174.94 174.63 1xdz s HIS 199 N 1.11 3.16 -0.12 3.97 3.76 0.38 -4.94 115.29 122.60 1xdz s HIS 199 Ca 0.00 -0.16 -0.00 0.00 -0.15 0.00 0.00 55.06 54.75 1xdz s HIS 199 Cb -0.14 -2.25 -0.02 0.00 1.11 0.00 0.00 32.58 31.28 1xdz s HIS 199 CO -0.07 -0.20 -0.13 -1.12 -0.85 0.00 0.00 174.74 172.37 1xdz s SER 200 N 1.42 4.07 0.37 1.40 0.01 -1.26 -0.95 113.70 118.76 1xdz s SER 200 Ca 0.06 -0.30 -0.15 0.00 1.31 0.00 0.00 55.95 56.87 1xdz s SER 200 Cb -0.15 -1.55 0.05 0.00 0.21 0.00 0.00 66.02 64.58 1xdz s SER 200 CO 0.05 0.18 0.75 0.72 0.41 0.00 0.00 173.24 175.36 1xdz s PHE 201 N 0.24 0.18 0.05 2.43 -0.12 -0.82 -5.02 117.98 114.93 1xdz s PHE 201 Ca -0.08 -0.80 0.07 0.00 -0.05 0.00 0.00 56.93 56.06 1xdz s PHE 201 Cb -0.15 0.74 -0.03 0.00 -0.63 0.00 0.00 43.02 42.94 1xdz s PHE 201 CO 0.05 -1.50 -0.15 0.15 -0.05 0.00 0.00 175.22 173.72 1xdz s LYS 202 N -2.52 2.14 0.19 1.99 1.02 -1.26 -0.46 119.74 120.84 1xdz s LYS 202 Ca 0.17 -0.96 -0.30 0.00 0.02 0.00 0.00 55.97 54.89 1xdz s LYS 202 Cb -0.05 -2.25 -0.08 0.00 -0.52 0.00 0.00 37.83 34.92 1xdz s LYS 202 CO 0.12 0.54 1.28 -1.17 -0.92 0.00 0.00 175.35 175.20 1xdz s LEU 203 N -1.62 4.42 0.79 3.17 2.96 0.15 -4.89 118.68 123.66 1xdz s LEU 203 Ca 0.16 2.35 -0.14 0.00 -0.22 0.00 0.00 54.13 56.28 1xdz s LEU 203 Cb -0.11 -3.61 0.04 0.00 0.50 0.00 0.00 46.19 43.01 1xdz s LEU 203 CO 0.07 -0.49 0.92 -2.65 -1.32 0.00 0.00 176.35 172.89 1xdz n PRO 204 N 2.64 0.21 0.00 0.98 -0.02 -1.26 -0.06 135.00 137.49 1xdz n PRO 204 Ca 0.06 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1xdz n PRO 204 Cb 0.43 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1xdz n PRO 204 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1xdz n ILE 205 N -2.99 0.00 0.10 4.25 5.41 -1.26 -3.91 119.36 120.95 1xdz n ILE 205 Ca 0.12 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.84 1xdz n ILE 205 Cb 0.50 0.00 0.20 0.00 -0.71 0.00 0.00 39.64 39.63 1xdz n ILE 205 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1xdz h GLU 206 N 0.00 0.22 -0.83 0.38 4.81 -1.98 -3.47 114.58 113.71 1xdz h GLU 206 Ca 0.00 -0.12 -0.27 0.00 -0.13 0.00 0.00 59.36 58.84 1xdz h GLU 206 Cb 0.00 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.29 1xdz h GLU 206 CO 0.00 0.65 -0.26 0.39 -0.73 0.00 0.00 179.01 179.05 1xdz n GLU 207 N -3.98 -0.95 -2.70 1.92 -0.58 0.91 -5.00 120.64 110.26 1xdz n GLU 207 Ca -0.02 0.92 -0.37 0.00 -0.42 0.00 0.00 57.16 57.28 1xdz n GLU 207 Cb 0.52 -5.02 -0.06 0.00 -0.57 0.00 0.00 31.44 26.31 1xdz n GLU 207 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1xdz s SER 208 N -2.79 7.18 0.38 1.62 1.04 -1.25 -4.64 113.70 115.25 1xdz s SER 208 Ca 0.00 1.91 -0.26 0.00 0.48 0.00 0.00 55.95 58.08 1xdz s SER 208 Cb 0.00 -2.58 -0.09 0.00 0.10 0.00 0.00 66.02 63.45 1xdz s SER 208 CO 0.00 -0.18 1.24 -1.81 0.98 0.00 0.00 173.24 173.47 1xdz s ASP 209 N -1.56 6.54 0.04 7.02 1.01 -1.26 -0.67 116.67 127.78 1xdz s ASP 209 Ca 0.52 2.53 0.02 0.00 0.71 0.00 0.00 52.55 56.33 1xdz s ASP 209 Cb -0.20 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.07 1xdz s ASP 209 CO 0.26 -0.68 -0.08 -0.13 0.21 0.00 0.00 175.17 174.75 1xdz s ARG 210 N -2.11 0.53 -0.02 8.23 1.81 0.39 -4.66 118.95 123.11 1xdz s ARG 210 Ca 0.54 -0.70 0.02 0.00 -1.72 0.00 0.00 55.73 53.87 1xdz s ARG 210 Cb -0.35 -0.32 0.01 0.00 -0.45 0.00 0.00 34.95 33.83 1xdz s ARG 210 CO 0.46 0.06 -0.06 -0.80 -0.68 0.00 0.00 175.30 174.27 1xdz s ASN 211 N -1.43 0.91 -0.13 0.23 0.01 -0.16 -1.94 114.94 112.44 1xdz s ASN 211 Ca -0.08 -0.14 0.03 0.00 -0.71 0.00 0.00 52.86 51.96 1xdz s ASN 211 Cb -0.09 -0.25 0.01 0.00 0.41 0.00 0.00 41.25 41.33 1xdz s ASN 211 CO 0.00 0.04 -0.22 -0.63 -1.51 0.00 0.00 177.10 174.79 1xdz s ILE 212 N 0.25 1.99 -0.18 0.60 1.01 -0.13 -0.33 121.20 124.42 1xdz s ILE 212 Ca -0.03 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.61 1xdz s ILE 212 Cb -0.08 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.60 1xdz s ILE 212 CO 0.00 0.54 0.02 -0.04 0.00 0.00 0.00 174.94 175.46 1xdz s MET 213 N 0.76 3.82 -0.20 2.79 -1.94 -0.32 -0.47 119.30 123.74 1xdz s MET 213 Ca -0.09 -0.43 -0.01 0.00 -1.71 0.00 0.00 55.69 53.46 1xdz s MET 213 Cb -0.16 -3.11 0.01 0.00 2.01 0.00 0.00 34.83 33.58 1xdz s MET 213 CO -0.00 0.21 -0.13 0.08 -0.01 0.00 0.00 175.02 175.17 1xdz s VAL 214 N 0.51 2.60 -0.09 -6.03 1.01 -0.17 -1.30 120.40 116.93 1xdz s VAL 214 Ca 0.01 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1xdz s VAL 214 Cb -0.13 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 34.08 1xdz s VAL 214 CO 0.02 0.45 -0.23 -0.63 0.00 0.00 0.00 175.10 174.70 1xdz s ILE 215 N 1.35 1.98 0.01 2.22 1.01 -0.06 -0.32 121.20 127.39 1xdz s ILE 215 Ca 0.04 -0.98 -0.17 0.00 0.00 0.00 0.00 60.65 59.55 1xdz s ILE 215 Cb -0.14 -1.72 -0.06 0.00 0.01 0.00 0.00 42.46 40.56 1xdz s ILE 215 CO -0.09 0.54 0.47 -0.60 0.00 0.00 0.00 174.94 175.27 1xdz s ARG 216 N 0.33 4.06 -0.71 2.79 6.06 0.32 -0.67 118.95 131.13 1xdz s ARG 216 Ca -0.18 0.52 -0.23 0.00 -2.50 0.00 0.00 55.73 53.34 1xdz s ARG 216 Cb -0.18 -3.25 0.06 0.00 0.06 0.00 0.00 34.95 31.65 1xdz s ARG 216 CO 0.08 0.61 1.06 0.21 -2.50 0.00 0.00 175.30 174.76 1xdz s LYS 217 N -0.87 3.18 0.10 5.12 2.47 -0.18 -0.37 119.74 129.19 1xdz s LYS 217 Ca 0.26 -0.77 0.23 0.00 -1.56 0.00 0.00 55.97 54.12 1xdz s LYS 217 Cb -0.17 -4.30 -0.06 0.00 -1.46 0.00 0.00 37.83 31.83 1xdz s LYS 217 CO 0.15 -1.90 0.91 0.44 0.16 0.00 0.00 175.35 175.10 1xdz n ILE 218 N 6.03 0.34 -3.94 5.43 -5.35 -0.16 0.62 119.36 122.34 1xdz n ILE 218 Ca 0.01 -0.45 -0.09 0.00 -0.27 0.00 0.00 62.75 61.95 1xdz n ILE 218 Cb 0.47 -0.10 -0.05 0.00 -1.74 0.00 0.00 39.64 38.22 1xdz n ILE 218 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 1xdz s LYS 219 N -3.35 1.47 0.45 6.28 -2.85 -0.72 -4.89 119.74 116.13 1xdz s LYS 219 Ca -0.01 -1.15 -0.23 0.00 -1.00 0.00 0.00 55.97 53.57 1xdz s LYS 219 Cb 0.12 0.47 -0.07 0.00 -2.06 0.00 0.00 37.83 36.29 1xdz s LYS 219 CO 0.82 -0.61 1.20 -0.80 0.10 0.00 0.00 175.35 176.06 1xdz s ASN 220 N -2.98 6.14 0.12 0.03 0.01 -1.26 -4.52 114.94 112.48 1xdz s ASN 220 Ca 0.19 2.39 -0.30 0.00 -0.71 0.00 0.00 52.86 54.43 1xdz s ASN 220 Cb -0.00 -2.61 -0.07 0.00 0.41 0.00 0.00 41.25 38.98 1xdz s ASN 220 CO 0.05 -0.95 1.15 -0.89 -1.51 0.00 0.00 177.10 174.96 1xdz s THR 221 N -1.47 3.93 0.43 1.60 2.01 -1.26 -4.54 115.64 116.34 1xdz s THR 221 Ca 0.63 1.52 -0.24 0.00 0.31 0.00 0.00 61.69 63.90 1xdz s THR 221 Cb -0.31 -3.97 -0.10 0.00 0.01 0.00 0.00 72.50 68.13 1xdz s THR 221 CO 0.38 0.19 1.05 -2.65 -0.69 0.00 0.00 174.62 172.90 1xdz n PRO 222 N 3.13 1.41 0.25 4.92 -0.02 -1.26 -4.87 135.00 138.56 1xdz n PRO 222 Ca 0.06 0.51 0.13 0.00 -2.02 0.00 0.00 63.50 62.17 1xdz n PRO 222 Cb 0.46 -2.10 0.78 0.00 -0.02 0.00 0.00 33.50 32.62 1xdz n PRO 222 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1xdz h LYS 223 N 1.56 0.00 0.00 -0.52 1.57 -2.00 -1.91 116.57 115.26 1xdz h LYS 223 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1xdz h LYS 223 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1xdz h LYS 223 CO 0.57 0.00 0.00 1.57 -0.57 0.00 0.00 179.45 181.02 1xdz h LYS 224 N 0.00 0.00 -5.81 3.15 2.10 -2.04 -3.43 116.57 110.54 1xdz h LYS 224 Ca 0.03 0.00 -0.67 0.00 -2.00 0.00 0.00 60.65 58.01 1xdz h LYS 224 Cb 0.12 0.00 -0.21 0.00 -0.90 0.00 0.00 32.23 31.24 1xdz h LYS 224 CO -0.00 0.00 -0.70 0.71 -2.00 0.00 0.00 179.45 177.46 1xdz s TYR 225 N -3.48 2.94 0.40 0.07 1.51 -0.72 -3.18 117.35 114.89 1xdz s TYR 225 Ca 0.02 -0.15 -0.23 0.00 -1.01 0.00 0.00 57.07 55.70 1xdz s TYR 225 Cb 0.09 -1.79 -0.10 0.00 -0.11 0.00 0.00 41.96 40.04 1xdz s TYR 225 CO 0.39 0.16 0.97 -1.25 -1.11 0.00 0.00 175.55 174.71 1xdz s PRO 226 N -0.34 4.30 1.06 -1.71 0.04 -1.26 -4.82 135.00 132.27 1xdz s PRO 226 Ca 0.05 1.26 -0.16 0.00 0.04 0.00 0.00 61.00 62.19 1xdz s PRO 226 Cb -0.12 -2.42 0.22 0.00 0.04 0.00 0.00 34.50 32.21 1xdz s PRO 226 CO 0.02 0.02 1.16 1.03 0.04 0.00 0.00 177.00 179.28 1xdz s ARG 227 N -2.72 -0.09 0.53 4.56 0.52 -1.19 -4.87 118.95 115.69 1xdz s ARG 227 Ca 0.58 0.01 -0.22 0.00 -0.52 0.00 0.00 55.73 55.59 1xdz s ARG 227 Cb -0.14 -1.72 -0.06 0.00 0.52 0.00 0.00 34.95 33.55 1xdz s ARG 227 CO 0.19 -2.97 1.24 1.63 0.02 0.00 0.00 175.30 175.40 1xdz n LYS 228 N -4.25 1.52 -1.37 3.54 4.76 -1.26 -4.73 118.16 116.36 1xdz n LYS 228 Ca 0.11 0.56 -0.60 0.00 -2.87 0.00 0.00 58.31 55.51 1xdz n LYS 228 Cb 0.59 -2.42 -0.11 0.00 -1.84 0.00 0.00 35.03 31.25 1xdz n LYS 228 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1xdz n PRO 229 N -0.80 0.22 0.00 1.97 -0.02 -1.26 -0.19 135.00 134.92 1xdz n PRO 229 Ca 0.11 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1xdz n PRO 229 Cb 0.44 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 1xdz n PRO 229 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xdz n GLY 230 N 6.74 2.75 0.16 -1.23 0.00 -1.26 -4.95 105.19 107.39 1xdz n GLY 230 Ca 0.48 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.41 1xdz n GLY 230 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xdz h THR 231 N 0.00 1.16 -0.78 2.61 2.02 -0.87 -1.70 112.91 115.35 1xdz h THR 231 Ca 0.00 -0.45 0.09 0.00 0.77 0.00 0.00 66.41 66.82 1xdz h THR 231 Cb 0.00 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 1xdz h THR 231 CO 0.00 0.17 0.51 -0.65 0.37 0.00 0.00 175.52 175.91 1xdz h PRO 232 N 0.40 0.69 -0.15 6.66 0.11 -1.82 0.14 132.00 138.04 1xdz h PRO 232 Ca 0.11 -0.04 -0.20 0.00 0.11 0.00 0.00 66.00 65.98 1xdz h PRO 232 Cb 0.12 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.07 1xdz h PRO 232 CO -0.01 0.46 -0.71 -0.91 -0.21 0.00 0.00 178.00 176.62 1xdz h ASN 233 N 0.72 0.75 -0.04 -2.05 2.35 -1.90 -2.09 115.58 113.31 1xdz h ASN 233 Ca 0.36 -0.47 -0.16 0.00 -0.55 0.00 0.00 56.30 55.48 1xdz h ASN 233 Cb 0.43 -0.22 0.01 0.00 0.05 0.00 0.00 38.32 38.59 1xdz h ASN 233 CO -0.13 1.24 -0.59 0.11 -1.65 0.00 0.00 177.43 176.41 1xdz h LYS 234 N 0.45 0.47 -2.34 0.81 1.57 -0.85 -3.40 116.57 113.28 1xdz h LYS 234 Ca -0.03 -0.45 -0.59 0.00 -1.87 0.00 0.00 60.65 57.71 1xdz h LYS 234 Cb 1.31 0.12 -0.39 0.00 0.08 0.00 0.00 32.23 33.34 1xdz h LYS 234 CO 0.14 1.10 -0.91 0.43 -0.57 0.00 0.00 179.45 179.64 1xdz n SER 235 N -4.20 0.79 -4.71 0.86 7.64 0.43 -5.10 113.62 109.33 1xdz n SER 235 Ca -0.09 -2.73 -0.40 0.00 1.01 0.00 0.00 58.87 56.65 1xdz n SER 235 Cb 0.66 -0.63 0.02 0.00 -1.01 0.00 0.00 64.21 63.25 1xdz n SER 235 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1xdz n PRO 236 N 2.02 1.81 -0.31 1.43 -0.02 -0.79 -4.62 135.00 134.51 1xdz n PRO 236 Ca 0.26 0.65 0.07 0.00 -2.02 0.00 0.00 63.50 62.45 1xdz n PRO 236 Cb 0.47 -2.43 0.16 0.00 -0.02 0.00 0.00 33.50 31.68 1xdz n PRO 236 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1xdz h ILE 237 N 1.81 0.13 0.00 4.25 2.04 -1.82 -3.50 117.51 120.41 1xdz h ILE 237 Ca -0.49 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1xdz h ILE 237 Cb 1.30 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1xdz h ILE 237 CO 0.58 0.00 0.00 -0.62 0.00 0.00 0.00 178.15 178.12