#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pkz n GLU 3 N 0.00 2.41 -1.81 0.00 -0.58 -1.26 -4.96 120.64 114.45 1pkz n GLU 3 Ca 0.00 0.85 -0.42 0.00 -0.42 0.00 0.00 57.16 57.18 1pkz n GLU 3 Cb 0.00 -2.64 -0.02 0.00 -0.57 0.00 0.00 31.44 28.21 1pkz n GLU 3 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1pkz s LYS 4 N -2.31 4.15 0.23 3.49 1.02 -1.26 -4.81 119.74 120.25 1pkz s LYS 4 Ca 0.58 2.53 -0.31 0.00 0.02 0.00 0.00 55.97 58.79 1pkz s LYS 4 Cb -0.46 -3.06 -0.14 0.00 -0.52 0.00 0.00 37.83 33.65 1pkz s LYS 4 CO 0.60 -0.63 1.22 -2.30 -0.92 0.00 0.00 175.35 173.32 1pkz n PRO 5 N 2.80 1.55 -4.08 -1.68 -0.02 -1.26 -4.76 135.00 127.55 1pkz n PRO 5 Ca 0.10 0.55 -0.34 0.00 -2.02 0.00 0.00 63.50 61.80 1pkz n PRO 5 Cb 0.37 -2.08 -0.15 0.00 -0.02 0.00 0.00 33.50 31.62 1pkz n PRO 5 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1pkz s LYS 6 N -0.72 3.17 -0.28 -0.52 2.20 -0.40 -1.46 119.74 121.73 1pkz s LYS 6 Ca 0.67 -0.74 -0.10 0.00 -0.36 0.00 0.00 55.97 55.45 1pkz s LYS 6 Cb -0.74 -2.75 -0.04 0.00 -1.51 0.00 0.00 37.83 32.80 1pkz s LYS 6 CO 0.54 -0.18 0.15 -0.51 -0.36 0.00 0.00 175.35 174.98 1pkz s LEU 7 N 1.32 3.86 -0.26 5.43 1.43 -0.55 -0.35 118.68 129.56 1pkz s LEU 7 Ca 0.04 -0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 52.93 1pkz s LEU 7 Cb -0.14 -2.05 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1pkz s LEU 7 CO -0.08 -0.07 0.10 -1.00 0.23 0.00 0.00 176.35 175.54 1pkz s HIS 8 N 1.70 3.12 0.06 0.29 3.76 -0.19 -0.91 115.29 123.13 1pkz s HIS 8 Ca 0.07 -0.27 -0.28 0.00 -0.15 0.00 0.00 55.06 54.43 1pkz s HIS 8 Cb -0.16 -2.28 0.09 0.00 1.11 0.00 0.00 32.58 31.35 1pkz s HIS 8 CO 0.08 -0.30 1.08 -0.47 -0.85 0.00 0.00 174.74 174.28 1pkz s TYR 9 N 1.64 -0.12 0.85 1.40 5.04 -1.19 -2.70 117.35 122.26 1pkz s TYR 9 Ca 0.07 -0.08 -0.12 0.00 -2.44 0.00 0.00 57.07 54.49 1pkz s TYR 9 Cb -0.15 0.59 0.10 0.00 0.35 0.00 0.00 41.96 42.85 1pkz s TYR 9 CO 0.06 -0.58 1.15 1.19 -1.34 0.00 0.00 175.55 176.04 1pkz n PHE 10 N -0.43 1.04 -1.71 4.97 3.72 -1.26 -1.21 117.46 122.58 1pkz n PHE 10 Ca -0.07 0.40 -0.42 0.00 -0.05 0.00 0.00 57.45 57.32 1pkz n PHE 10 Cb 0.61 -2.06 -0.02 0.00 -0.94 0.00 0.00 39.48 37.07 1pkz n PHE 10 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1pkz n ASN 11 N -3.50 3.59 -3.75 4.37 5.15 -1.26 -4.78 115.26 115.08 1pkz n ASN 11 Ca 0.13 -2.80 -0.05 0.00 -0.60 0.00 0.00 54.58 51.26 1pkz n ASN 11 Cb 0.51 -1.53 -0.02 0.00 -0.53 0.00 0.00 39.78 38.22 1pkz n ASN 11 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pkz s ALA 12 N 4.42 -1.55 0.00 5.20 0.00 -1.26 -5.04 121.76 123.53 1pkz s ALA 12 Ca 0.52 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.58 1pkz s ALA 12 Cb 0.12 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.92 1pkz s ALA 12 CO 0.01 -1.00 0.49 0.54 0.00 0.00 0.00 175.76 175.80 1pkz n ARG 13 N -0.45 0.00 0.00 0.00 1.74 -1.26 -4.73 116.66 111.96 1pkz n ARG 13 Ca -0.06 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1pkz n ARG 13 Cb 0.61 -1.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.05 1pkz n ARG 13 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pkz n GLY 14 N -0.27 2.19 0.39 -0.13 0.00 -1.26 -2.01 105.19 104.10 1pkz n GLY 14 Ca 0.00 -0.37 0.14 0.00 0.00 0.00 0.00 46.02 45.79 1pkz n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pkz n ARG 15 N 12.32 1.45 0.01 1.61 1.74 -1.26 -3.67 116.66 128.86 1pkz n ARG 15 Ca 0.00 -0.79 0.11 0.00 -0.77 0.00 0.00 57.85 56.40 1pkz n ARG 15 Cb 0.00 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 29.94 1pkz n ARG 15 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 1pkz n MET 16 N -0.08 0.23 -0.14 5.56 1.56 -1.10 -4.59 117.12 118.56 1pkz n MET 16 Ca 0.18 -0.03 -0.03 0.00 -0.27 0.00 0.00 57.70 57.55 1pkz n MET 16 Cb 0.33 -1.55 0.18 0.00 2.15 0.00 0.00 33.22 34.33 1pkz n MET 16 CO 0.00 0.00 0.00 1.49 -0.73 0.00 0.00 175.97 176.73 1pkz h GLU 17 N 0.00 0.86 0.00 2.12 4.57 -1.48 -2.22 114.58 118.43 1pkz h GLU 17 Ca 0.00 -0.18 -0.05 0.00 -1.18 0.00 0.00 59.36 57.95 1pkz h GLU 17 Cb 0.68 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 1pkz h GLU 17 CO 0.00 0.77 -0.25 0.66 -1.18 0.00 0.00 179.01 179.02 1pkz h SER 18 N 0.82 0.00 0.06 1.04 4.64 -1.84 -1.23 113.55 117.05 1pkz h SER 18 Ca 0.18 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.27 1pkz h SER 18 Cb 0.31 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1pkz h SER 18 CO -0.00 0.25 -0.86 0.74 -0.87 0.00 0.00 176.83 176.08 1pkz h THR 19 N 0.00 1.32 -0.08 2.95 2.02 -1.75 -1.60 112.91 115.78 1pkz h THR 19 Ca -0.00 -2.16 0.00 0.00 0.77 0.00 0.00 66.41 65.02 1pkz h THR 19 Cb 0.58 2.18 -0.00 0.00 -1.74 0.00 0.00 68.15 69.17 1pkz h THR 19 CO 0.03 0.67 0.05 0.03 0.37 0.00 0.00 175.52 176.67 1pkz h ARG 20 N 0.39 0.11 -0.65 6.66 3.08 -0.75 -1.03 114.38 122.19 1pkz h ARG 20 Ca -0.07 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.05 1pkz h ARG 20 Cb 1.49 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 31.45 1pkz h ARG 20 CO 0.16 0.09 0.32 -1.49 -1.07 0.00 0.00 179.97 177.99 1pkz h TRP 21 N 0.09 0.58 -0.02 3.04 4.06 -1.26 -1.39 115.95 121.06 1pkz h TRP 21 Ca 0.03 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 61.00 1pkz h TRP 21 Cb 0.01 -0.16 -0.00 0.00 -1.00 0.00 0.00 29.16 28.01 1pkz h TRP 21 CO -0.07 0.23 -0.01 1.25 -3.56 0.00 0.00 178.44 176.28 1pkz h LEU 22 N 0.57 0.04 -0.28 -4.49 5.85 -1.01 -0.20 115.31 115.79 1pkz h LEU 22 Ca 0.31 -0.46 0.01 0.00 0.84 0.00 0.00 57.88 58.59 1pkz h LEU 22 Cb 0.29 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1pkz h LEU 22 CO -0.24 0.49 0.15 -0.07 -0.34 0.00 0.00 178.44 178.43 1pkz h LEU 23 N -0.41 0.24 -0.57 2.25 3.38 -1.20 -2.10 115.31 116.90 1pkz h LEU 23 Ca 0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1pkz h LEU 23 Cb 0.48 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1pkz h LEU 23 CO 0.00 0.18 0.33 0.00 0.09 0.00 0.00 178.44 179.04 1pkz h ALA 24 N 1.13 0.73 -0.01 1.53 0.00 -1.20 -1.67 119.26 119.76 1pkz h ALA 24 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1pkz h ALA 24 Cb 0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1pkz h ALA 24 CO -0.06 0.23 0.01 0.00 0.00 0.00 0.00 179.25 179.42 1pkz h ALA 25 N 1.15 2.00 -0.08 0.00 0.00 -0.83 -1.17 119.26 120.35 1pkz h ALA 25 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1pkz h ALA 25 Cb 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1pkz h ALA 25 CO -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.21 1pkz n ALA 26 N -2.54 2.57 -1.97 0.00 0.00 -0.70 -4.75 120.51 113.12 1pkz n ALA 26 Ca -0.03 -0.38 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 1pkz n ALA 26 Cb 0.10 -1.20 -0.02 0.00 0.00 0.00 0.00 19.45 18.33 1pkz n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pkz n GLY 27 N 1.05 0.32 3.53 0.00 0.00 -0.44 -4.99 105.19 104.66 1pkz n GLY 27 Ca 0.17 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1pkz n GLY 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pkz s VAL 28 N -2.60 5.21 0.08 1.61 1.01 -0.78 -5.03 120.40 119.90 1pkz s VAL 28 Ca 0.00 -0.09 -0.31 0.00 0.00 0.00 0.00 61.98 61.58 1pkz s VAL 28 Cb 0.00 -3.79 -0.07 0.00 0.00 0.00 0.00 36.38 32.51 1pkz s VAL 28 CO 0.00 -0.08 1.44 -1.61 0.00 0.00 0.00 175.10 174.85 1pkz s GLU 29 N 1.90 4.29 0.20 2.72 2.02 -1.26 -4.42 118.70 124.14 1pkz s GLU 29 Ca 0.09 2.09 -0.01 0.00 0.02 0.00 0.00 54.97 57.17 1pkz s GLU 29 Cb -0.17 -3.37 -0.04 0.00 0.10 0.00 0.00 34.13 30.65 1pkz s GLU 29 CO 0.11 -0.52 0.13 -0.59 0.02 0.00 0.00 175.26 174.41 1pkz s PHE 30 N 1.65 1.13 0.29 1.61 -0.12 -1.26 -4.29 117.98 116.99 1pkz s PHE 30 Ca 0.66 -1.36 0.08 0.00 -0.05 0.00 0.00 56.93 56.26 1pkz s PHE 30 Cb -0.36 -0.55 -0.06 0.00 -0.63 0.00 0.00 43.02 41.43 1pkz s PHE 30 CO 0.30 -0.64 -0.10 -1.21 -0.05 0.00 0.00 175.22 173.52 1pkz s GLU 31 N -4.15 1.62 -0.02 1.99 2.02 -0.53 -5.00 118.70 114.63 1pkz s GLU 31 Ca 0.38 -1.81 0.03 0.00 0.02 0.00 0.00 54.97 53.59 1pkz s GLU 31 Cb 0.07 -1.39 -0.01 0.00 0.10 0.00 0.00 34.13 32.91 1pkz s GLU 31 CO 0.11 0.12 -0.11 -1.21 0.02 0.00 0.00 175.26 174.19 1pkz s GLU 32 N -3.66 0.97 -0.29 1.61 2.02 -1.26 -1.48 118.70 116.61 1pkz s GLU 32 Ca 0.30 -0.39 0.03 0.00 0.02 0.00 0.00 54.97 54.93 1pkz s GLU 32 Cb 0.02 -0.92 0.07 0.00 0.10 0.00 0.00 34.13 33.40 1pkz s GLU 32 CO 0.13 0.21 -0.05 0.21 0.02 0.00 0.00 175.26 175.78 1pkz s LYS 33 N -0.12 2.05 0.12 1.61 2.20 -0.09 -4.91 119.74 120.60 1pkz s LYS 33 Ca 0.02 -1.49 -0.30 0.00 -0.36 0.00 0.00 55.97 53.83 1pkz s LYS 33 Cb -0.06 -3.02 -0.06 0.00 -1.51 0.00 0.00 37.83 33.18 1pkz s LYS 33 CO -0.00 -0.68 0.99 -0.06 -0.36 0.00 0.00 175.35 175.23 1pkz s PHE 34 N 1.06 3.78 -0.30 4.03 0.08 -1.26 -3.16 117.98 122.21 1pkz s PHE 34 Ca -0.03 1.76 -0.26 0.00 0.12 0.00 0.00 56.93 58.53 1pkz s PHE 34 Cb -0.20 -3.09 0.01 0.00 -0.57 0.00 0.00 43.02 39.16 1pkz s PHE 34 CO -0.05 0.06 0.90 0.42 -0.10 0.00 0.00 175.22 176.45 1pkz s ILE 35 N -0.03 4.70 -0.06 0.64 1.01 -0.35 -4.92 121.20 122.19 1pkz s ILE 35 Ca 0.47 1.45 0.11 0.00 0.00 0.00 0.00 60.65 62.69 1pkz s ILE 35 Cb -0.24 -4.24 -0.16 0.00 0.01 0.00 0.00 42.46 37.83 1pkz s ILE 35 CO 0.31 -0.30 0.15 0.29 0.00 0.00 0.00 174.94 175.38 1pkz n LYS 36 N 6.40 1.30 -4.33 2.79 5.02 -1.26 -4.18 118.16 123.89 1pkz n LYS 36 Ca 0.07 -0.06 -0.17 0.00 -2.02 0.00 0.00 58.31 56.13 1pkz n LYS 36 Cb 0.48 -1.28 -0.10 0.00 -0.02 0.00 0.00 35.03 34.10 1pkz n LYS 36 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1pkz s SER 37 N -3.87 1.56 0.30 4.39 1.04 -1.26 -5.03 113.70 110.83 1pkz s SER 37 Ca -0.05 -1.31 0.02 0.00 0.48 0.00 0.00 55.95 55.09 1pkz s SER 37 Cb 0.05 0.07 0.48 0.00 0.10 0.00 0.00 66.02 66.73 1pkz s SER 37 CO 0.47 -0.63 1.82 0.00 0.98 0.00 0.00 173.24 175.88 1pkz h ALA 38 N 2.41 1.25 -0.58 5.32 0.00 -2.00 -2.71 119.26 122.94 1pkz h ALA 38 Ca -0.38 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1pkz h ALA 38 Cb 1.23 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1pkz h ALA 38 CO 0.63 0.50 0.30 1.49 0.00 0.00 0.00 179.25 182.18 1pkz h GLU 39 N 0.59 0.81 -0.05 0.00 4.81 -1.98 -0.10 114.58 118.66 1pkz h GLU 39 Ca 0.12 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1pkz h GLU 39 Cb 0.40 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 1pkz h GLU 39 CO 0.02 0.61 0.03 -0.44 -0.73 0.00 0.00 179.01 178.50 1pkz h ASP 40 N 0.82 0.05 -0.73 1.04 3.32 -1.89 -1.02 116.42 118.02 1pkz h ASP 40 Ca 0.21 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 1pkz h ASP 40 Cb 0.05 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1pkz h ASP 40 CO -0.03 0.05 0.35 0.25 -1.72 0.00 0.00 179.24 178.14 1pkz h LEU 41 N 0.05 0.96 -0.92 1.55 5.85 -1.43 -2.68 115.31 118.69 1pkz h LEU 41 Ca 0.02 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.64 1pkz h LEU 41 Cb 0.00 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.74 1pkz h LEU 41 CO -0.00 0.82 0.59 0.44 -0.34 0.00 0.00 178.44 179.95 1pkz h ASP 42 N 1.03 0.99 -0.33 1.25 3.32 -0.80 -1.39 116.42 120.48 1pkz h ASP 42 Ca 0.25 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.16 1pkz h ASP 42 Cb 0.12 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1pkz h ASP 42 CO -0.03 0.68 -0.32 0.50 -1.72 0.00 0.00 179.24 178.35 1pkz h LYS 43 N 1.16 0.81 -0.63 3.56 3.64 -0.89 0.07 116.57 124.29 1pkz h LYS 43 Ca 0.36 -0.42 0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1pkz h LYS 43 Cb -0.01 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 1pkz h LYS 43 CO -0.12 1.05 0.38 -0.07 -2.27 0.00 0.00 179.45 178.43 1pkz h LEU 44 N 0.59 0.61 -0.12 5.20 3.38 -1.24 -1.46 115.31 122.27 1pkz h LEU 44 Ca 0.05 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1pkz h LEU 44 Cb 0.90 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1pkz h LEU 44 CO 0.08 0.42 0.04 0.03 0.09 0.00 0.00 178.44 179.10 1pkz h ARG 45 N 0.74 0.18 -0.00 1.13 3.08 -0.95 -2.67 114.38 115.89 1pkz h ARG 45 Ca 0.26 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 60.16 1pkz h ARG 45 Cb 0.05 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1pkz h ARG 45 CO -0.12 0.30 -0.55 -0.91 -1.07 0.00 0.00 179.97 177.62 1pkz h ASN 46 N 0.02 0.00 -0.13 7.04 2.35 -0.86 -2.56 115.58 121.44 1pkz h ASN 46 Ca 0.04 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1pkz h ASN 46 Cb 0.19 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1pkz h ASN 46 CO -0.00 0.56 0.00 0.47 -1.65 0.00 0.00 177.43 176.80 1pkz n ASP 47 N -3.88 1.06 0.00 5.81 10.43 -0.56 -4.91 116.55 124.50 1pkz n ASP 47 Ca -0.01 -1.70 0.00 0.00 2.57 0.00 0.00 54.79 55.64 1pkz n ASP 47 Cb 0.56 -0.09 0.00 0.00 1.84 0.00 0.00 41.12 43.44 1pkz n ASP 47 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1pkz n GLY 48 N 0.96 0.42 0.01 0.44 0.00 -0.97 -4.93 105.19 101.12 1pkz n GLY 48 Ca 0.13 -0.82 0.12 0.00 0.00 0.00 0.00 46.02 45.45 1pkz n GLY 48 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pkz n TYR 49 N -2.99 0.07 -3.86 1.61 0.53 -1.01 -4.70 117.16 106.80 1pkz n TYR 49 Ca 0.00 0.02 -0.34 0.00 -1.02 0.00 0.00 57.90 56.56 1pkz n TYR 49 Cb 0.00 -0.29 -0.13 0.00 -1.03 0.00 0.00 39.34 37.89 1pkz n TYR 49 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 1pkz s LEU 50 N -3.17 4.97 0.30 7.72 1.43 -1.25 -4.83 118.68 123.86 1pkz s LEU 50 Ca 0.10 -2.00 0.06 0.00 -1.03 0.00 0.00 54.13 51.26 1pkz s LEU 50 Cb 0.17 -1.76 0.72 0.00 0.03 0.00 0.00 46.19 45.35 1pkz s LEU 50 CO 0.71 -0.47 1.79 -0.03 0.23 0.00 0.00 176.35 178.58 1pkz h MET 51 N 7.91 0.77 -0.21 1.70 1.85 -1.85 -1.50 114.93 123.60 1pkz h MET 51 Ca -0.11 -0.05 -0.09 0.00 -0.61 0.00 0.00 59.70 58.85 1pkz h MET 51 Cb 1.04 -0.17 -0.05 0.00 0.43 0.00 0.00 31.60 32.85 1pkz h MET 51 CO 0.63 0.51 -0.14 1.19 -0.40 0.00 0.00 176.91 178.70 1pkz n PHE 52 N -4.74 0.68 -1.75 1.39 3.72 -1.26 -4.95 117.46 110.55 1pkz n PHE 52 Ca 0.23 -1.37 -0.18 0.00 -0.05 0.00 0.00 57.45 56.08 1pkz n PHE 52 Cb 0.54 -0.36 -0.06 0.00 -0.94 0.00 0.00 39.48 38.66 1pkz n PHE 52 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1pkz n GLN 53 N -1.06 -1.29 -4.15 -1.08 1.13 -0.57 -4.98 117.38 105.38 1pkz n GLN 53 Ca 0.26 1.05 -0.15 0.00 -1.94 0.00 0.00 57.00 56.21 1pkz n GLN 53 Cb 0.88 -5.37 -0.11 0.00 0.11 0.00 0.00 30.24 25.75 1pkz n GLN 53 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1pkz s GLN 54 N -3.90 0.77 0.32 -1.09 -0.21 -1.26 -4.97 119.66 109.32 1pkz s GLN 54 Ca 0.00 -1.01 0.06 0.00 0.02 0.00 0.00 55.36 54.44 1pkz s GLN 54 Cb 0.00 -0.59 -0.01 0.00 1.00 0.00 0.00 33.01 33.41 1pkz s GLN 54 CO 0.00 0.11 0.43 0.14 -2.12 0.00 0.00 175.29 173.85 1pkz s VAL 55 N -1.81 4.22 0.48 1.09 -7.23 -1.26 -4.58 120.40 111.31 1pkz s VAL 55 Ca -0.00 -1.04 -0.23 0.00 -1.81 0.00 0.00 61.98 58.90 1pkz s VAL 55 Cb -0.07 -3.46 -0.08 0.00 0.56 0.00 0.00 36.38 33.33 1pkz s VAL 55 CO 0.01 -0.19 1.11 -2.65 -0.31 0.00 0.00 175.10 173.06 1pkz n PRO 56 N -1.57 1.43 -4.07 4.82 -0.02 -1.26 -4.99 135.00 129.33 1pkz n PRO 56 Ca -0.02 0.52 -0.15 0.00 -2.02 0.00 0.00 63.50 61.83 1pkz n PRO 56 Cb 0.58 -2.23 -0.15 0.00 -0.02 0.00 0.00 33.50 31.69 1pkz n PRO 56 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1pkz s MET 57 N -2.36 0.34 -0.12 -0.52 1.75 -1.10 -3.96 119.30 113.33 1pkz s MET 57 Ca 0.67 -0.11 0.01 0.00 -1.25 0.00 0.00 55.69 55.00 1pkz s MET 57 Cb -0.49 -0.35 0.02 0.00 2.84 0.00 0.00 34.83 36.85 1pkz s MET 57 CO 0.54 0.05 -0.13 0.08 -0.65 0.00 0.00 175.02 174.91 1pkz s VAL 58 N 0.09 1.37 -0.42 10.11 1.01 0.00 -1.02 120.40 131.55 1pkz s VAL 58 Ca -0.01 -0.54 -0.27 0.00 0.00 0.00 0.00 61.98 61.17 1pkz s VAL 58 Cb -0.04 -1.29 0.02 0.00 0.00 0.00 0.00 36.38 35.07 1pkz s VAL 58 CO -0.00 0.42 1.01 -1.61 0.00 0.00 0.00 175.10 174.91 1pkz s GLU 59 N 1.30 3.75 -0.17 2.72 2.02 0.53 -1.36 118.70 127.50 1pkz s GLU 59 Ca -0.01 0.53 -0.12 0.00 0.02 0.00 0.00 54.97 55.39 1pkz s GLU 59 Cb -0.14 -3.86 0.05 0.00 0.10 0.00 0.00 34.13 30.29 1pkz s GLU 59 CO -0.06 -1.14 0.43 -1.50 0.02 0.00 0.00 175.26 173.01 1pkz s ILE 60 N 3.85 -0.01 -1.49 -1.63 2.07 -1.02 -1.28 121.20 121.69 1pkz s ILE 60 Ca 0.42 0.05 -0.02 0.00 -1.41 0.00 0.00 60.65 59.69 1pkz s ILE 60 Cb -0.10 -0.62 0.02 0.00 0.13 0.00 0.00 42.46 41.89 1pkz s ILE 60 CO 0.24 0.02 0.31 0.47 -1.91 0.00 0.00 174.94 174.07 1pkz n ASP 61 N 3.71 -0.16 0.00 4.50 8.00 -1.26 -1.59 116.55 129.75 1pkz n ASP 61 Ca -0.19 -1.11 0.00 0.00 0.71 0.00 0.00 54.79 54.20 1pkz n ASP 61 Cb 0.56 -2.48 0.00 0.00 -0.02 0.00 0.00 41.12 39.18 1pkz n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pkz n GLY 62 N -2.12 1.71 3.89 0.44 0.00 -1.26 -5.01 105.19 102.85 1pkz n GLY 62 Ca -0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1pkz n GLY 62 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1pkz s MET 63 N -0.09 3.68 -0.74 1.61 -1.94 -0.62 -5.05 119.30 116.15 1pkz s MET 63 Ca 0.00 0.08 -0.08 0.00 -1.71 0.00 0.00 55.69 53.98 1pkz s MET 63 Cb 0.00 -2.66 0.19 0.00 2.01 0.00 0.00 34.83 34.37 1pkz s MET 63 CO 0.00 0.27 0.62 0.15 -0.01 0.00 0.00 175.02 176.05 1pkz s LYS 64 N -3.25 3.11 -0.22 2.03 -0.14 -1.26 -2.44 119.74 117.57 1pkz s LYS 64 Ca 0.45 -2.57 -0.22 0.00 -1.36 0.00 0.00 55.97 52.27 1pkz s LYS 64 Cb -0.11 -4.08 -0.02 0.00 -1.68 0.00 0.00 37.83 31.95 1pkz s LYS 64 CO 0.27 -1.23 0.72 -0.51 -0.76 0.00 0.00 175.35 173.83 1pkz s LEU 65 N -0.08 4.11 0.41 3.17 1.43 -0.46 -4.81 118.68 122.45 1pkz s LEU 65 Ca 0.18 0.92 0.07 0.00 -1.03 0.00 0.00 54.13 54.28 1pkz s LEU 65 Cb -0.15 -3.02 -0.07 0.00 0.03 0.00 0.00 46.19 42.98 1pkz s LEU 65 CO -0.06 -0.38 0.07 0.68 0.23 0.00 0.00 176.35 176.88 1pkz s VAL 66 N 2.33 2.11 0.00 -1.59 -7.23 -1.26 -0.82 120.40 113.94 1pkz s VAL 66 Ca 0.31 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 1pkz s VAL 66 Cb -0.16 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 33.79 1pkz s VAL 66 CO 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.88 1pkz n GLN 67 N -1.07 -0.04 -0.35 4.82 1.13 -1.25 -4.55 117.38 116.06 1pkz n GLN 67 Ca -0.04 0.53 -0.00 0.00 -1.94 0.00 0.00 57.00 55.55 1pkz n GLN 67 Cb 0.66 -0.42 0.05 0.00 0.11 0.00 0.00 30.24 30.65 1pkz n GLN 67 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1pkz h THR 68 N 0.03 0.03 -0.61 5.09 2.02 -1.90 -0.79 112.91 116.80 1pkz h THR 68 Ca 0.00 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 1pkz h THR 68 Cb 0.00 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 66.41 1pkz h THR 68 CO 0.00 0.00 0.18 0.03 0.37 0.00 0.00 175.52 176.10 1pkz h ARG 69 N -0.02 0.93 -0.66 6.66 3.08 -1.97 0.14 114.38 122.53 1pkz h ARG 69 Ca 0.35 -0.18 -0.05 0.00 0.07 0.00 0.00 59.98 60.17 1pkz h ARG 69 Cb 0.61 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 1pkz h ARG 69 CO -0.95 0.81 0.22 0.00 -1.07 0.00 0.00 179.97 178.97 1pkz h ALA 70 N 1.30 0.87 -0.12 0.04 0.00 -1.45 -1.08 119.26 118.81 1pkz h ALA 70 Ca 0.20 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1pkz h ALA 70 Cb 0.28 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1pkz h ALA 70 CO -0.01 0.54 -0.04 0.82 0.00 0.00 0.00 179.25 180.56 1pkz h ILE 71 N 0.96 1.30 -0.18 0.00 2.04 -0.77 -2.14 117.51 118.72 1pkz h ILE 71 Ca 0.22 -1.03 -0.02 0.00 1.00 0.00 0.00 64.86 65.03 1pkz h ILE 71 Cb 0.29 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 1pkz h ILE 71 CO -0.01 0.29 0.03 -0.07 0.00 0.00 0.00 178.15 178.40 1pkz h LEU 72 N -0.09 0.29 -0.64 1.44 3.38 -0.73 -2.00 115.31 116.96 1pkz h LEU 72 Ca 0.03 -0.26 0.08 0.00 0.09 0.00 0.00 57.88 57.82 1pkz h LEU 72 Cb 0.48 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 1pkz h LEU 72 CO 0.01 0.48 0.31 0.78 0.09 0.00 0.00 178.44 180.11 1pkz h ASN 73 N 0.09 0.41 0.26 -0.43 2.35 -1.19 -0.03 115.58 117.04 1pkz h ASN 73 Ca 0.06 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 1pkz h ASN 73 Cb 0.31 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1pkz h ASN 73 CO 0.00 0.25 -0.12 0.22 -1.65 0.00 0.00 177.43 176.13 1pkz h TYR 74 N 0.56 -0.32 -0.49 1.19 3.20 -1.25 -2.27 116.97 117.59 1pkz h TYR 74 Ca 0.31 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.23 1pkz h TYR 74 Cb 0.29 0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.61 1pkz h TYR 74 CO -0.11 -0.06 0.20 0.82 -1.64 0.00 0.00 178.16 177.36 1pkz h ILE 75 N -0.55 0.87 -0.70 1.81 2.04 -1.25 -0.05 117.51 119.69 1pkz h ILE 75 Ca -0.04 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.76 1pkz h ILE 75 Cb 0.40 0.45 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 1pkz h ILE 75 CO 0.06 0.07 0.39 0.00 0.00 0.00 0.00 178.15 178.67 1pkz h ALA 76 N 1.31 0.95 -0.17 1.87 0.00 -0.96 -2.02 119.26 120.23 1pkz h ALA 76 Ca 0.23 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1pkz h ALA 76 Cb 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1pkz h ALA 76 CO -0.21 0.06 -0.04 0.77 0.00 0.00 0.00 179.25 179.83 1pkz h SER 77 N 0.71 0.33 -0.91 0.00 0.02 -0.83 0.18 113.55 113.06 1pkz h SER 77 Ca 0.32 -0.37 0.12 0.00 -0.84 0.00 0.00 61.79 61.01 1pkz h SER 77 Cb 0.21 -0.09 -0.08 0.00 0.14 0.00 0.00 62.40 62.58 1pkz h SER 77 CO -0.19 0.63 0.54 0.50 -1.14 0.00 0.00 176.83 177.16 1pkz h LYS 78 N 0.03 0.82 -0.30 3.45 3.64 -0.77 -2.73 116.57 120.71 1pkz h LYS 78 Ca 0.04 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1pkz h LYS 78 Cb 0.48 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1pkz h LYS 78 CO 0.02 0.54 0.01 0.66 -2.27 0.00 0.00 179.45 178.41 1pkz n TYR 79 N -4.71 1.07 -3.13 1.91 4.01 -0.78 -4.97 117.16 110.56 1pkz n TYR 79 Ca 0.17 -0.94 -0.14 0.00 -0.16 0.00 0.00 57.90 56.83 1pkz n TYR 79 Cb 0.34 -0.35 0.05 0.00 -0.31 0.00 0.00 39.34 39.07 1pkz n TYR 79 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1pkz n ASN 80 N -0.49 -4.58 -0.31 7.72 2.85 -0.91 -4.91 115.26 114.62 1pkz n ASN 80 Ca 0.23 -0.31 0.08 0.00 -0.11 0.00 0.00 54.58 54.47 1pkz n ASN 80 Cb 0.94 -3.17 0.14 0.00 1.24 0.00 0.00 39.78 38.94 1pkz n ASN 80 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1pkz n LEU 81 N -3.13 2.21 -0.32 1.20 4.77 0.01 -4.60 117.00 117.14 1pkz n LEU 81 Ca 0.00 -3.12 0.08 0.00 -0.03 0.00 0.00 56.01 52.95 1pkz n LEU 81 Cb 0.54 -0.41 0.15 0.00 -2.33 0.00 0.00 43.42 41.37 1pkz n LEU 81 CO 0.38 0.87 0.46 0.00 -1.33 0.00 0.00 177.39 177.77 1pkz n TYR 82 N -1.16 0.00 -0.06 -1.77 4.19 -1.17 -1.04 117.16 116.15 1pkz n TYR 82 Ca 0.15 -1.08 0.01 0.00 3.31 0.00 0.00 57.90 60.29 1pkz n TYR 82 Cb 0.68 -0.18 -0.00 0.00 0.49 0.00 0.00 39.34 40.33 1pkz n TYR 82 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1pkz n GLY 83 N -1.17 -1.56 0.06 2.98 0.00 -1.26 -4.35 105.19 99.88 1pkz n GLY 83 Ca 0.16 -1.51 0.05 0.00 0.00 0.00 0.00 46.02 44.72 1pkz n GLY 83 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1pkz n LYS 84 N -1.69 0.65 -4.01 1.61 2.85 -1.26 -4.93 118.16 111.37 1pkz n LYS 84 Ca -0.00 -0.05 -0.12 0.00 -1.05 0.00 0.00 58.31 57.09 1pkz n LYS 84 Cb 0.03 -1.61 -0.03 0.00 -0.65 0.00 0.00 35.03 32.77 1pkz n LYS 84 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 1pkz s ASP 85 N -5.04 0.54 0.32 -5.58 1.47 -1.26 -5.05 116.67 102.06 1pkz s ASP 85 Ca -0.06 -1.31 0.03 0.00 1.18 0.00 0.00 52.55 52.38 1pkz s ASP 85 Cb 0.11 0.69 0.60 0.00 -0.34 0.00 0.00 42.92 43.99 1pkz s ASP 85 CO 0.86 -1.36 1.90 -0.29 0.68 0.00 0.00 175.17 176.96 1pkz h ILE 86 N 2.11 1.01 -0.16 2.11 2.10 -1.95 -0.96 117.51 121.77 1pkz h ILE 86 Ca -0.29 -0.32 -0.19 0.00 1.08 0.00 0.00 64.86 65.14 1pkz h ILE 86 Cb 1.24 -0.01 0.00 0.00 -1.09 0.00 0.00 36.82 36.97 1pkz h ILE 86 CO 0.38 0.17 -0.69 0.11 -1.08 0.00 0.00 178.15 177.05 1pkz h LYS 87 N 0.94 0.66 -0.10 2.19 1.57 -1.99 -1.84 116.57 118.00 1pkz h LYS 87 Ca 0.40 -0.49 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 1pkz h LYS 87 Cb 0.31 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1pkz h LYS 87 CO -0.16 1.11 -0.26 0.93 -0.57 0.00 0.00 179.45 180.50 1pkz h GLU 88 N 0.47 0.17 -0.27 3.15 5.08 -1.84 -2.57 114.58 118.77 1pkz h GLU 88 Ca -0.02 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 1pkz h GLU 88 Cb 1.28 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1pkz h GLU 88 CO 0.13 0.43 -0.34 0.00 -1.00 0.00 0.00 179.01 178.24 1pkz h ARG 89 N 0.16 0.59 -0.01 2.33 3.08 -0.93 -1.20 114.38 118.39 1pkz h ARG 89 Ca 0.03 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.81 1pkz h ARG 89 Cb 0.55 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.59 1pkz h ARG 89 CO 0.04 0.84 0.01 0.00 -1.07 0.00 0.00 179.97 179.79 1pkz h ALA 90 N 1.14 0.01 -0.11 0.04 0.00 -1.01 0.31 119.26 119.64 1pkz h ALA 90 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1pkz h ALA 90 Cb 0.82 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1pkz h ALA 90 CO 0.07 -0.49 0.07 -0.07 0.00 0.00 0.00 179.25 178.83 1pkz h LEU 91 N 0.01 0.12 -0.48 0.00 3.38 -1.41 -0.19 115.31 116.75 1pkz h LEU 91 Ca 0.00 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1pkz h LEU 91 Cb 0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1pkz h LEU 91 CO -0.00 0.09 0.24 0.40 0.09 0.00 0.00 178.44 179.26 1pkz h ILE 92 N 0.14 0.96 -0.57 1.22 2.04 -1.05 -1.64 117.51 118.62 1pkz h ILE 92 Ca 0.04 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1pkz h ILE 92 Cb -0.01 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.49 1pkz h ILE 92 CO -0.01 0.09 0.32 0.44 0.00 0.00 0.00 178.15 178.98 1pkz h ASP 93 N 0.48 0.70 -0.53 1.72 3.32 -0.13 0.36 116.42 122.35 1pkz h ASP 93 Ca 0.21 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1pkz h ASP 93 Cb 0.11 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1pkz h ASP 93 CO -0.15 0.58 0.30 -0.03 -1.72 0.00 0.00 179.24 178.22 1pkz h MET 94 N 0.76 0.73 -0.05 3.56 4.05 -0.75 -0.90 114.93 122.32 1pkz h MET 94 Ca 0.20 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 59.54 1pkz h MET 94 Cb 0.03 -0.15 -0.00 0.00 -0.80 0.00 0.00 31.60 30.68 1pkz h MET 94 CO -0.03 0.55 0.01 1.88 0.23 0.00 0.00 176.91 179.55 1pkz h TYR 95 N 0.70 0.09 0.00 1.39 -1.99 -0.96 -2.57 116.97 113.63 1pkz h TYR 95 Ca 0.19 -0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.84 1pkz h TYR 95 Cb 0.03 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 1pkz h TYR 95 CO -0.02 0.30 -0.31 -0.84 -0.00 0.00 0.00 178.16 177.28 1pkz h ILE 96 N -0.15 0.63 -0.12 -2.88 3.07 -0.78 -1.71 117.51 115.57 1pkz h ILE 96 Ca 0.02 -1.55 -0.15 0.00 1.55 0.00 0.00 64.86 64.73 1pkz h ILE 96 Cb 0.26 2.05 -0.01 0.00 -0.27 0.00 0.00 36.82 38.85 1pkz h ILE 96 CO 0.00 0.31 -0.57 -0.33 -1.05 0.00 0.00 178.15 176.51 1pkz h GLU 97 N 0.00 0.37 -0.56 0.16 4.39 -1.13 0.78 114.58 118.60 1pkz h GLU 97 Ca -0.00 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 1pkz h GLU 97 Cb 1.03 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 1pkz h GLU 97 CO 0.04 0.84 0.26 0.78 -1.16 0.00 0.00 179.01 179.78 1pkz h GLY 98 N 1.27 0.87 1.01 -3.84 0.00 -1.01 -1.34 103.07 100.03 1pkz h GLY 98 Ca 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 1pkz h GLY 98 CO 0.10 0.42 0.35 -2.22 0.00 0.00 0.00 176.54 175.18 1pkz h ILE 99 N 0.76 1.23 -0.25 2.60 2.04 -1.07 -2.33 117.51 120.48 1pkz h ILE 99 Ca 0.19 -0.62 -0.14 0.00 1.00 0.00 0.00 64.86 65.30 1pkz h ILE 99 Cb 0.13 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1pkz h ILE 99 CO -0.02 0.26 -0.41 0.00 0.00 0.00 0.00 178.15 177.98 1pkz h ALA 100 N 1.17 0.81 -0.18 1.87 0.00 -0.75 0.28 119.26 122.46 1pkz h ALA 100 Ca 0.24 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1pkz h ALA 100 Cb 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1pkz h ALA 100 CO -0.03 0.65 0.11 -0.44 0.00 0.00 0.00 179.25 179.53 1pkz h ASP 101 N 0.50 0.22 -0.32 0.00 3.32 -1.04 0.19 116.42 119.30 1pkz h ASP 101 Ca 0.04 -0.06 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 1pkz h ASP 101 Cb 0.92 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 1pkz h ASP 101 CO 0.08 0.22 -0.01 0.25 -1.72 0.00 0.00 179.24 178.06 1pkz h LEU 102 N 0.21 0.56 -0.64 1.55 5.85 -1.38 -3.00 115.31 118.45 1pkz h LEU 102 Ca 0.07 -0.32 0.09 0.00 0.84 0.00 0.00 57.88 58.56 1pkz h LEU 102 Cb 0.04 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.85 1pkz h LEU 102 CO -0.01 0.74 0.27 1.23 -0.34 0.00 0.00 178.44 180.33 1pkz h GLY 103 N 0.36 0.93 0.98 3.75 0.00 -0.30 -2.61 103.07 106.17 1pkz h GLY 103 Ca 0.09 -0.16 0.01 0.00 0.00 0.00 0.00 47.33 47.27 1pkz h GLY 103 CO 0.02 0.01 0.31 -2.09 0.00 0.00 0.00 176.54 174.78 1pkz h GLU 104 N 0.47 0.61 -0.43 4.80 4.57 -0.52 0.24 114.58 124.32 1pkz h GLU 104 Ca 0.32 -0.04 0.05 0.00 -1.18 0.00 0.00 59.36 58.52 1pkz h GLU 104 Cb 0.38 -0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.78 1pkz h GLU 104 CO -0.29 0.40 0.15 0.52 -1.18 0.00 0.00 179.01 178.61 1pkz h MET 105 N 0.63 0.31 0.01 1.92 2.86 -1.34 -1.83 114.93 117.49 1pkz h MET 105 Ca 0.18 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1pkz h MET 105 Cb -0.05 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.54 1pkz h MET 105 CO -0.05 0.21 -0.01 0.82 1.06 0.00 0.00 176.91 178.94 1pkz h ILE 106 N 0.32 1.23 -0.92 -1.22 2.04 -1.15 -2.05 117.51 115.77 1pkz h ILE 106 Ca 0.20 -0.74 0.26 0.00 1.00 0.00 0.00 64.86 65.59 1pkz h ILE 106 Cb 0.20 1.73 -0.15 0.00 -0.74 0.00 0.00 36.82 37.85 1pkz h ILE 106 CO -0.21 0.19 0.25 0.25 0.00 0.00 0.00 178.15 178.63 1pkz h LEU 107 N -0.33 -0.02 0.00 1.44 5.85 -0.82 -2.70 115.31 118.72 1pkz h LEU 107 Ca -0.00 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1pkz h LEU 107 Cb 0.32 0.30 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1pkz h LEU 107 CO 0.00 -0.21 -0.69 0.18 -0.34 0.00 0.00 178.44 177.37 1pkz n LEU 108 N -5.26 0.62 -0.19 2.25 4.77 -0.70 -4.51 117.00 113.97 1pkz n LEU 108 Ca 0.24 -0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 56.11 1pkz n LEU 108 Cb 0.77 -0.17 0.01 0.00 -2.33 0.00 0.00 43.42 41.69 1pkz n LEU 108 CO 0.04 0.11 0.64 0.25 -1.33 0.00 0.00 177.39 177.10 1pkz h LEU 109 N 0.00 -1.10 -0.26 2.23 5.85 -1.03 -0.50 115.31 120.50 1pkz h LEU 109 Ca 0.00 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1pkz h LEU 109 Cb 0.57 0.55 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1pkz h LEU 109 CO 0.00 -0.30 0.00 -0.81 -0.34 0.00 0.00 178.44 176.99 1pkz n PRO 110 N -5.43 0.65 -3.90 5.25 -0.04 -1.26 -4.89 135.00 125.37 1pkz n PRO 110 Ca 0.04 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.22 1pkz n PRO 110 Cb 0.35 -1.08 -0.12 0.00 -0.04 0.00 0.00 33.50 32.61 1pkz n PRO 110 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1pkz s VAL 111 N -1.74 2.89 -0.21 0.52 0.11 -0.20 -5.10 120.40 116.67 1pkz s VAL 111 Ca 0.00 -4.29 -0.10 0.00 -2.93 0.00 0.00 61.98 54.66 1pkz s VAL 111 Cb 0.00 -2.89 -0.05 0.00 -1.53 0.00 0.00 36.38 31.91 1pkz s VAL 111 CO 0.00 -1.01 0.13 -2.84 -3.33 0.00 0.00 175.10 168.05 1pkz s PRO 113 N -1.47 4.14 0.53 1.54 0.02 -1.26 -5.15 135.00 133.36 1pkz s PRO 113 Ca 0.25 -0.24 0.41 0.00 0.02 0.00 0.00 61.00 61.44 1pkz s PRO 113 Cb -0.04 -3.42 1.60 0.00 0.02 0.00 0.00 34.50 32.67 1pkz s PRO 113 CO -0.17 0.25 1.68 -1.35 -0.33 0.00 0.00 177.00 177.08 1pkz h PRO 114 N 6.84 0.03 -0.00 5.54 0.11 -1.99 0.97 132.00 143.49 1pkz h PRO 114 Ca -0.40 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1pkz h PRO 114 Cb 1.16 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1pkz h PRO 114 CO 0.73 0.02 -0.02 -0.85 -0.21 0.00 0.00 178.00 177.67 1pkz n GLU 115 N -4.15 1.04 -0.00 1.05 0.00 -1.26 -2.78 120.64 114.54 1pkz n GLU 115 Ca 0.35 -0.23 0.06 0.00 0.00 0.00 0.00 57.16 57.34 1pkz n GLU 115 Cb 1.59 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 31.46 1pkz n GLU 115 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1pkz n GLU 116 N -0.78 2.36 0.24 3.44 1.02 0.33 -4.79 120.64 122.45 1pkz n GLU 116 Ca 0.21 -0.03 0.09 0.00 -0.02 0.00 0.00 57.16 57.41 1pkz n GLU 116 Cb 0.19 -1.13 0.60 0.00 -0.02 0.00 0.00 31.44 31.09 1pkz n GLU 116 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1pkz h LYS 117 N 0.00 0.00 0.12 3.49 3.11 -1.46 -1.72 116.57 120.10 1pkz h LYS 117 Ca 0.00 0.00 -0.29 0.00 -2.81 0.00 0.00 60.65 57.55 1pkz h LYS 117 Cb 0.36 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.58 1pkz h LYS 117 CO 0.00 0.18 -1.45 -0.44 -2.81 0.00 0.00 179.45 174.94 1pkz h ASP 118 N 0.00 0.38 -0.48 4.20 5.19 -1.87 -2.90 116.42 120.94 1pkz h ASP 118 Ca -0.00 -0.49 -0.11 0.00 -0.62 0.00 0.00 57.03 55.81 1pkz h ASP 118 Cb 0.42 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.79 1pkz h ASP 118 CO 0.02 1.40 -0.11 0.00 -3.12 0.00 0.00 179.24 177.44 1pkz h ALA 119 N 0.54 0.84 -0.15 3.45 0.00 -1.79 -2.29 119.26 119.86 1pkz h ALA 119 Ca -0.21 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.32 1pkz h ALA 119 Cb 2.00 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.60 1pkz h ALA 119 CO 0.17 0.65 -0.05 -0.22 0.00 0.00 0.00 179.25 179.81 1pkz h LYS 120 N 0.85 0.30 -0.43 0.00 1.63 -1.41 -2.07 116.57 115.43 1pkz h LYS 120 Ca 0.13 -0.12 0.06 0.00 -0.85 0.00 0.00 60.65 59.87 1pkz h LYS 120 Cb 0.65 -0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.22 1pkz h LYS 120 CO 0.05 0.59 0.14 1.25 -3.45 0.00 0.00 179.45 178.03 1pkz h LEU 121 N -0.02 0.14 -1.02 5.20 5.85 -1.54 -0.56 115.31 123.35 1pkz h LEU 121 Ca 0.04 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1pkz h LEU 121 Cb 0.49 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1pkz h LEU 121 CO 0.02 0.11 0.50 0.00 -0.34 0.00 0.00 178.44 178.73 1pkz h ALA 122 N 1.29 1.26 -0.12 1.25 0.00 -1.37 -1.20 119.26 120.37 1pkz h ALA 122 Ca 0.20 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1pkz h ALA 122 Cb 0.20 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1pkz h ALA 122 CO -0.22 0.62 -0.42 1.25 0.00 0.00 0.00 179.25 180.48 1pkz h LEU 123 N 1.19 0.29 -0.21 0.00 5.85 -0.81 -2.10 115.31 119.52 1pkz h LEU 123 Ca 0.31 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1pkz h LEU 123 Cb -0.02 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1pkz h LEU 123 CO -0.05 0.68 -0.03 0.40 -0.34 0.00 0.00 178.44 179.10 1pkz h ILE 124 N 0.23 1.28 -0.52 4.05 2.04 -0.49 -2.07 117.51 122.03 1pkz h ILE 124 Ca 0.02 -0.99 -0.06 0.00 1.00 0.00 0.00 64.86 64.83 1pkz h ILE 124 Cb 0.85 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 1pkz h ILE 124 CO 0.07 0.30 0.09 0.11 0.00 0.00 0.00 178.15 178.71 1pkz h LYS 125 N 0.12 0.82 -0.34 2.37 1.57 -1.17 0.79 116.57 120.73 1pkz h LYS 125 Ca 0.05 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1pkz h LYS 125 Cb 0.47 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1pkz h LYS 125 CO 0.02 0.77 0.12 1.49 -0.57 0.00 0.00 179.45 181.28 1pkz h GLU 126 N 0.78 0.51 -0.32 3.15 4.22 -1.33 -1.35 114.58 120.24 1pkz h GLU 126 Ca 0.17 -0.10 -0.06 0.00 0.08 0.00 0.00 59.36 59.44 1pkz h GLU 126 Cb 0.35 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1pkz h GLU 126 CO 0.01 0.52 -0.07 0.87 -2.18 0.00 0.00 179.01 178.15 1pkz h LYS 127 N 0.40 0.53 0.03 1.92 1.57 -0.80 0.22 116.57 120.42 1pkz h LYS 127 Ca 0.11 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1pkz h LYS 127 Cb 0.21 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1pkz h LYS 127 CO -0.01 0.61 -0.01 0.82 -0.57 0.00 0.00 179.45 180.29 1pkz h ILE 128 N 0.50 1.28 -0.03 1.86 2.04 -0.54 0.94 117.51 123.54 1pkz h ILE 128 Ca 0.10 -0.98 -0.13 0.00 1.00 0.00 0.00 64.86 64.85 1pkz h ILE 128 Cb 0.43 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1pkz h ILE 128 CO 0.02 0.25 -0.56 0.50 0.00 0.00 0.00 178.15 178.36 1pkz h LYS 129 N -0.47 0.10 0.00 2.37 1.63 -1.15 -0.94 116.57 118.11 1pkz h LYS 129 Ca -0.00 -0.07 -0.17 0.00 -0.85 0.00 0.00 60.65 59.56 1pkz h LYS 129 Cb 0.44 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.04 1pkz h LYS 129 CO 0.01 0.64 -1.82 -1.71 -3.45 0.00 0.00 179.45 173.11 1pkz n ASN 130 N -3.88 1.80 -0.01 4.20 2.85 0.05 -4.48 115.26 115.79 1pkz n ASN 130 Ca -0.02 0.00 -0.02 0.00 -0.11 0.00 0.00 54.58 54.43 1pkz n ASN 130 Cb 0.58 1.04 -0.01 0.00 1.24 0.00 0.00 39.78 42.63 1pkz n ASN 130 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1pkz n ARG 131 N -2.35 0.12 -0.05 1.20 0.63 0.17 -4.78 116.66 111.60 1pkz n ARG 131 Ca -0.16 0.05 -0.08 0.00 -0.92 0.00 0.00 57.85 56.74 1pkz n ARG 131 Cb 0.77 -0.57 -0.07 0.00 0.45 0.00 0.00 32.46 33.04 1pkz n ARG 131 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 1pkz h TYR 132 N -0.23 -0.02 -0.35 -0.14 0.05 -1.18 -2.88 116.97 112.22 1pkz h TYR 132 Ca 0.00 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.80 1pkz h TYR 132 Cb 0.23 0.01 -0.03 0.00 1.01 0.00 0.00 36.73 37.95 1pkz h TYR 132 CO -0.10 0.48 0.19 0.74 -1.05 0.00 0.00 178.16 178.43 1pkz h PHE 133 N -0.99 0.36 -0.95 4.88 -1.00 -1.39 -2.22 116.94 115.64 1pkz h PHE 133 Ca -0.00 0.01 0.15 0.00 2.81 0.00 0.00 57.97 60.94 1pkz h PHE 133 Cb 0.52 -0.11 -0.08 0.00 3.61 0.00 0.00 35.95 39.89 1pkz h PHE 133 CO 0.14 0.20 0.60 -1.35 -1.61 0.00 0.00 178.31 176.29 1pkz h PRO 134 N 0.40 0.74 -0.20 1.51 0.11 -1.76 0.48 132.00 133.28 1pkz h PRO 134 Ca 0.14 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.19 1pkz h PRO 134 Cb 0.03 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 30.96 1pkz h PRO 134 CO -0.08 0.49 0.06 0.00 -0.21 0.00 0.00 178.00 178.26 1pkz h ALA 135 N 1.59 0.27 0.01 -0.75 0.00 -1.18 -1.00 119.26 118.19 1pkz h ALA 135 Ca 0.49 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 55.07 1pkz h ALA 135 Cb 0.73 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1pkz h ALA 135 CO -0.25 -0.11 -0.87 0.74 0.00 0.00 0.00 179.25 178.76 1pkz h PHE 136 N 0.16 0.21 -0.72 0.00 0.04 -1.06 -2.60 116.94 112.97 1pkz h PHE 136 Ca 0.07 -0.12 -0.04 0.00 2.80 0.00 0.00 57.97 60.68 1pkz h PHE 136 Cb 0.24 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 1pkz h PHE 136 CO 0.00 0.94 0.30 1.49 -0.60 0.00 0.00 178.31 180.44 1pkz h GLU 137 N 0.07 1.06 -0.44 1.51 4.57 -0.91 -2.40 114.58 118.06 1pkz h GLU 137 Ca -0.04 -0.18 0.00 0.00 -1.18 0.00 0.00 59.36 57.96 1pkz h GLU 137 Cb 1.51 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 1pkz h GLU 137 CO 0.13 0.87 0.29 -0.22 -1.18 0.00 0.00 179.01 178.89 1pkz h LYS 138 N 1.02 0.58 -0.59 1.92 3.64 -1.05 -1.16 116.57 120.93 1pkz h LYS 138 Ca 0.24 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1pkz h LYS 138 Cb 0.19 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1pkz h LYS 138 CO -0.02 0.39 0.18 0.28 -2.27 0.00 0.00 179.45 178.01 1pkz h VAL 139 N 0.59 1.24 -0.67 2.00 2.07 -1.42 -1.23 116.25 118.84 1pkz h VAL 139 Ca 0.16 -0.84 -0.06 0.00 0.82 0.00 0.00 66.70 66.79 1pkz h VAL 139 Cb -0.06 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1pkz h VAL 139 CO -0.03 0.32 0.18 -0.07 0.02 0.00 0.00 177.57 177.98 1pkz h LEU 140 N 0.84 0.97 -0.49 2.57 3.38 -1.14 -2.69 115.31 118.75 1pkz h LEU 140 Ca 0.19 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pkz h LEU 140 Cb 0.30 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1pkz h LEU 140 CO -0.00 0.92 0.00 0.50 0.09 0.00 0.00 178.44 179.95 1pkz h LYS 141 N 0.99 0.00 -0.46 1.13 3.64 -1.08 -0.00 116.57 120.80 1pkz h LYS 141 Ca 0.21 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.48 1pkz h LYS 141 Cb 0.32 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1pkz h LYS 141 CO -0.00 0.00 -0.18 0.66 -2.27 0.00 0.00 179.45 177.66 1pkz h SER 142 N 0.00 0.90 -0.00 4.20 4.64 -0.87 -3.27 113.55 119.14 1pkz h SER 142 Ca 0.00 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1pkz h SER 142 Cb 0.84 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1pkz h SER 142 CO 0.00 1.06 -0.27 0.00 -0.87 0.00 0.00 176.83 176.75 1pkz n HIS 143 N -4.13 0.00 -1.27 4.77 1.44 -1.22 -5.03 115.22 109.78 1pkz n HIS 143 Ca 0.01 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.62 1pkz n HIS 143 Cb 0.42 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.49 1pkz n HIS 143 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1pkz n GLY 144 N 1.11 0.93 3.97 -1.39 0.00 -0.02 -4.96 105.19 104.84 1pkz n GLY 144 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1pkz n GLY 144 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pkz s GLN 145 N -2.81 2.10 0.31 1.61 -0.21 -1.26 -5.02 119.66 114.39 1pkz s GLN 145 Ca 0.00 -0.82 0.25 0.00 0.02 0.00 0.00 55.36 54.81 1pkz s GLN 145 Cb 0.00 -2.36 0.68 0.00 1.00 0.00 0.00 33.01 32.33 1pkz s GLN 145 CO 0.00 -1.13 1.72 -0.44 -2.12 0.00 0.00 175.29 173.33 1pkz h ASP 146 N -0.31 0.00 -4.12 5.90 5.19 -1.94 -3.46 116.42 117.68 1pkz h ASP 146 Ca -0.40 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.42 1pkz h ASP 146 Cb 1.29 0.00 -0.22 0.00 0.18 0.00 0.00 39.33 40.58 1pkz h ASP 146 CO 0.48 0.00 -0.84 -0.31 -3.12 0.00 0.00 179.24 175.46 1pkz s TYR 147 N -3.18 1.91 0.22 4.55 2.02 -1.26 -4.94 117.35 116.67 1pkz s TYR 147 Ca 0.08 -0.41 -0.09 0.00 -0.37 0.00 0.00 57.07 56.29 1pkz s TYR 147 Cb 0.09 -1.04 0.23 0.00 -0.40 0.00 0.00 41.96 40.84 1pkz s TYR 147 CO 0.61 0.24 1.85 -0.07 -1.57 0.00 0.00 175.55 176.60 1pkz h LEU 148 N 4.03 0.75 -7.89 -1.29 3.38 -1.88 -3.42 115.31 108.99 1pkz h LEU 148 Ca -0.47 0.01 -0.29 0.00 0.09 0.00 0.00 57.88 57.21 1pkz h LEU 148 Cb 1.18 -0.16 -0.27 0.00 0.09 0.00 0.00 40.66 41.50 1pkz h LEU 148 CO 0.39 0.51 -0.74 -0.69 0.09 0.00 0.00 178.44 178.00 1pkz s VAL 149 N -6.10 0.31 -1.14 1.22 1.01 -1.26 -4.88 120.40 109.56 1pkz s VAL 149 Ca -0.13 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1pkz s VAL 149 Cb 0.16 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 36.25 1pkz s VAL 149 CO 0.78 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.50 1pkz n GLY 150 N 2.78 0.16 2.93 4.51 0.00 -1.26 -2.80 105.19 111.50 1pkz n GLY 150 Ca -0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 1pkz n GLY 150 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1pkz n ASN 151 N -1.23 -3.29 -3.71 1.61 5.15 -1.26 -4.93 115.26 107.60 1pkz n ASN 151 Ca -0.13 -0.06 -0.13 0.00 -0.60 0.00 0.00 54.58 53.66 1pkz n ASN 151 Cb 0.53 -2.78 -0.07 0.00 -0.53 0.00 0.00 39.78 36.92 1pkz n ASN 151 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1pkz s LYS 152 N -5.53 0.83 -0.01 1.20 -2.85 -1.12 -4.90 119.74 107.35 1pkz s LYS 152 Ca 0.20 -0.32 -0.36 0.00 -1.00 0.00 0.00 55.97 54.49 1pkz s LYS 152 Cb -0.11 0.37 -0.15 0.00 -2.06 0.00 0.00 37.83 35.88 1pkz s LYS 152 CO 0.25 -0.26 1.62 -0.11 0.10 0.00 0.00 175.35 176.95 1pkz n LEU 153 N 0.76 2.61 -4.43 2.77 7.94 -1.26 -4.55 117.00 120.85 1pkz n LEU 153 Ca -0.19 1.07 -0.21 0.00 -1.11 0.00 0.00 56.01 55.56 1pkz n LEU 153 Cb 0.58 -1.28 -0.10 0.00 0.53 0.00 0.00 43.42 43.14 1pkz n LEU 153 CO 0.21 -0.48 -0.27 -0.94 -1.11 0.00 0.00 177.39 174.81 1pkz s SER 154 N 2.10 2.17 0.62 1.96 1.04 -1.26 -4.74 113.70 115.58 1pkz s SER 154 Ca 0.88 -1.39 0.28 0.00 0.48 0.00 0.00 55.95 56.21 1pkz s SER 154 Cb -0.84 -0.02 1.50 0.00 0.10 0.00 0.00 66.02 66.75 1pkz s SER 154 CO 0.50 -0.64 1.89 0.08 0.98 0.00 0.00 173.24 176.05 1pkz h ARG 155 N 2.15 0.00 -0.51 4.02 0.11 -1.47 -1.40 114.38 117.29 1pkz h ARG 155 Ca -0.40 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.59 1pkz h ARG 155 Cb 1.25 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.31 1pkz h ARG 155 CO 0.68 0.00 -0.02 0.00 0.10 0.00 0.00 179.97 180.73 1pkz h ALA 156 N 1.39 0.69 -0.55 0.08 0.00 -1.91 0.49 119.26 119.45 1pkz h ALA 156 Ca 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1pkz h ALA 156 Cb 1.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1pkz h ALA 156 CO -0.00 0.52 0.30 -0.44 0.00 0.00 0.00 179.25 179.63 1pkz h ASP 157 N 0.78 0.69 -0.19 0.00 3.32 -1.65 -0.43 116.42 118.93 1pkz h ASP 157 Ca 0.14 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 1pkz h ASP 157 Cb 0.55 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.92 1pkz h ASP 157 CO 0.03 0.58 -0.15 0.40 -1.72 0.00 0.00 179.24 178.39 1pkz h ILE 158 N 0.74 1.33 -0.58 0.35 1.08 -1.40 -0.72 117.51 118.30 1pkz h ILE 158 Ca 0.19 -1.27 -0.08 0.00 -0.39 0.00 0.00 64.86 63.32 1pkz h ILE 158 Cb 0.05 1.75 -0.02 0.00 -3.07 0.00 0.00 36.82 35.52 1pkz h ILE 158 CO -0.03 0.38 0.07 0.45 -0.69 0.00 0.00 178.15 178.33 1pkz h HIS 159 N 0.09 1.06 0.02 1.37 3.86 -0.90 -0.84 115.15 119.82 1pkz h HIS 159 Ca 0.03 -0.16 -0.00 0.00 -1.16 0.00 0.00 60.37 59.09 1pkz h HIS 159 Cb 0.67 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.85 1pkz h HIS 159 CO 0.08 0.93 -0.01 1.25 0.86 0.00 0.00 177.93 181.03 1pkz h LEU 160 N 0.88 -0.02 -1.19 2.43 5.85 -1.02 -2.15 115.31 120.08 1pkz h LEU 160 Ca 0.17 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1pkz h LEU 160 Cb 0.46 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1pkz h LEU 160 CO 0.02 0.14 -0.03 0.58 -0.34 0.00 0.00 178.44 178.80 1pkz h VAL 161 N -0.18 1.21 -0.26 1.05 2.07 -1.05 0.09 116.25 119.17 1pkz h VAL 161 Ca -0.00 -0.84 0.04 0.00 0.82 0.00 0.00 66.70 66.71 1pkz h VAL 161 Cb 0.17 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1pkz h VAL 161 CO 0.00 0.28 0.04 -0.08 0.02 0.00 0.00 177.57 177.84 1pkz h GLU 162 N 0.50 0.14 -0.42 1.57 4.81 -1.06 -2.38 114.58 117.73 1pkz h GLU 162 Ca 0.10 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 1pkz h GLU 162 Cb 0.37 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 1pkz h GLU 162 CO 0.01 0.09 0.09 1.25 -0.73 0.00 0.00 179.01 179.73 1pkz h LEU 163 N 0.14 0.58 -0.96 1.64 5.85 -0.61 -2.28 115.31 119.68 1pkz h LEU 163 Ca 0.12 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 1pkz h LEU 163 Cb 0.13 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1pkz h LEU 163 CO -0.17 0.59 0.16 -0.07 -0.34 0.00 0.00 178.44 178.62 1pkz h LEU 164 N 0.62 0.86 -0.76 2.25 3.38 -0.61 0.14 115.31 121.18 1pkz h LEU 164 Ca 0.14 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.02 1pkz h LEU 164 Cb 0.25 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 1pkz h LEU 164 CO -0.00 0.83 0.45 1.88 0.09 0.00 0.00 178.44 181.68 1pkz h TYR 165 N 0.89 0.83 -0.21 1.13 0.05 -0.93 0.29 116.97 119.01 1pkz h TYR 165 Ca 0.20 0.03 -0.16 0.00 0.05 0.00 0.00 58.73 58.84 1pkz h TYR 165 Cb 0.29 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 1pkz h TYR 165 CO 0.02 0.41 -0.51 1.88 -1.05 0.00 0.00 178.16 178.90 1pkz h TYR 166 N 0.82 0.75 -0.63 4.88 0.05 -0.87 -2.42 116.97 119.55 1pkz h TYR 166 Ca 0.34 -0.25 -0.08 0.00 0.05 0.00 0.00 58.73 58.79 1pkz h TYR 166 Cb 0.18 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 37.75 1pkz h TYR 166 CO -0.06 0.99 0.09 0.28 -1.05 0.00 0.00 178.16 178.42 1pkz h VAL 167 N 0.47 1.26 -0.36 -2.88 2.07 -0.57 -2.17 116.25 114.07 1pkz h VAL 167 Ca 0.02 -1.01 0.03 0.00 0.82 0.00 0.00 66.70 66.55 1pkz h VAL 167 Cb 1.06 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1pkz h VAL 167 CO 0.10 0.38 0.18 -0.08 0.02 0.00 0.00 177.57 178.17 1pkz h GLU 168 N 0.97 0.36 -0.75 1.57 4.81 -0.78 -0.41 114.58 120.35 1pkz h GLU 168 Ca 0.19 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.44 1pkz h GLU 168 Cb 0.43 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 1pkz h GLU 168 CO 0.01 0.24 0.49 0.93 -0.73 0.00 0.00 179.01 179.95 1pkz h GLU 169 N 0.37 0.85 0.03 1.92 5.08 -1.11 -3.00 114.58 118.71 1pkz h GLU 169 Ca 0.15 -0.05 -0.24 0.00 -1.00 0.00 0.00 59.36 58.22 1pkz h GLU 169 Cb 0.06 -0.19 0.02 0.00 0.50 0.00 0.00 28.75 29.14 1pkz h GLU 169 CO -0.11 0.56 -0.95 1.25 -1.00 0.00 0.00 179.01 178.77 1pkz h LEU 170 N 0.87 0.78 -6.00 1.33 5.85 -0.73 -3.45 115.31 113.96 1pkz h LEU 170 Ca 0.31 -0.77 0.16 0.00 0.84 0.00 0.00 57.88 58.41 1pkz h LEU 170 Cb 0.12 -0.24 -0.21 0.00 0.37 0.00 0.00 40.66 40.70 1pkz h LEU 170 CO -0.09 1.46 -0.08 -0.62 -0.34 0.00 0.00 178.44 178.77 1pkz s ASP 171 N -7.15 -0.92 0.57 1.25 -1.08 -0.23 -5.05 116.67 104.06 1pkz s ASP 171 Ca -0.11 0.51 0.35 0.00 -0.52 0.00 0.00 52.55 52.78 1pkz s ASP 171 Cb 0.05 1.75 1.62 0.00 -1.46 0.00 0.00 42.92 44.88 1pkz s ASP 171 CO 0.89 -0.17 2.08 -1.28 0.52 0.00 0.00 175.17 177.22 1pkz h SER 172 N 7.96 0.00 1.10 -0.34 0.87 -1.74 -2.84 113.55 118.55 1pkz h SER 172 Ca -0.16 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 1pkz h SER 172 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 1pkz h SER 172 CO 0.07 0.03 -0.33 -1.54 -0.53 0.00 0.00 176.83 174.54 1pkz n SER 173 N -3.19 0.69 -0.20 6.23 3.41 -1.26 -4.14 113.62 115.16 1pkz n SER 173 Ca -0.01 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.91 1pkz n SER 173 Cb 0.25 -0.26 0.25 0.00 -0.26 0.00 0.00 64.21 64.18 1pkz n SER 173 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1pkz h LEU 174 N 0.00 0.84 -0.30 1.04 3.38 -1.85 -2.37 115.31 116.05 1pkz h LEU 174 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1pkz h LEU 174 Cb 0.71 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1pkz h LEU 174 CO 0.00 0.62 -0.04 0.00 0.09 0.00 0.00 178.44 179.12 1pkz n ILE 175 N -4.41 0.00 0.20 1.22 3.06 -1.26 -4.44 119.36 113.73 1pkz n ILE 175 Ca 0.08 -0.08 0.05 0.00 -2.50 0.00 0.00 62.75 60.30 1pkz n ILE 175 Cb 0.05 -0.14 0.42 0.00 0.54 0.00 0.00 39.64 40.51 1pkz n ILE 175 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 1pkz h SER 176 N 0.73 0.00 -0.43 9.51 4.64 -1.67 -1.53 113.55 124.81 1pkz h SER 176 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pkz h SER 176 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1pkz h SER 176 CO 0.00 0.33 0.00 -1.54 -0.87 0.00 0.00 176.83 174.75 1pkz n SER 177 N -3.87 3.70 -3.64 4.97 3.41 -1.26 -4.66 113.62 112.27 1pkz n SER 177 Ca -0.01 -2.42 -0.27 0.00 -0.26 0.00 0.00 58.87 55.90 1pkz n SER 177 Cb 0.41 -0.53 -0.11 0.00 -0.26 0.00 0.00 64.21 63.72 1pkz n SER 177 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1pkz n PHE 178 N 0.61 1.62 0.08 7.33 3.72 -0.57 -4.98 117.46 125.26 1pkz n PHE 178 Ca 0.18 -3.90 -0.04 0.00 -0.05 0.00 0.00 57.45 53.64 1pkz n PHE 178 Cb 0.74 -0.29 0.18 0.00 -0.94 0.00 0.00 39.48 39.16 1pkz n PHE 178 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1pkz h PRO 179 N 5.27 0.29 0.00 -1.08 0.13 -1.83 -2.37 132.00 132.41 1pkz h PRO 179 Ca 0.19 -0.15 -0.07 0.00 -0.87 0.00 0.00 66.00 65.10 1pkz h PRO 179 Cb 0.81 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 1pkz h PRO 179 CO 0.59 0.69 -0.34 -0.07 -0.23 0.00 0.00 178.00 178.65 1pkz h LEU 180 N 0.24 0.00 -0.11 1.56 3.38 -1.93 -1.11 115.31 117.34 1pkz h LEU 180 Ca 0.02 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 1pkz h LEU 180 Cb 0.90 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.66 1pkz h LEU 180 CO 0.07 0.34 -0.59 -0.07 0.09 0.00 0.00 178.44 178.28 1pkz h LEU 181 N 0.00 0.71 -0.78 1.67 3.38 -1.81 -1.56 115.31 116.92 1pkz h LEU 181 Ca -0.00 -0.64 0.01 0.00 0.09 0.00 0.00 57.88 57.33 1pkz h LEU 181 Cb 0.65 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1pkz h LEU 181 CO 0.04 1.24 0.52 0.11 0.09 0.00 0.00 178.44 180.44 1pkz h LYS 182 N 0.23 1.02 -0.47 1.13 1.57 -1.14 -1.30 116.57 117.60 1pkz h LYS 182 Ca -0.04 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.63 1pkz h LYS 182 Cb 1.23 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.29 1pkz h LYS 182 CO 0.12 0.68 0.08 0.00 -0.57 0.00 0.00 179.45 179.76 1pkz h ALA 183 N 1.29 1.26 -0.48 3.86 0.00 -1.15 -2.76 119.26 121.28 1pkz h ALA 183 Ca 0.29 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1pkz h ALA 183 Cb -0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1pkz h ALA 183 CO -0.06 0.51 0.01 1.25 0.00 0.00 0.00 179.25 180.96 1pkz h LEU 184 N 0.70 0.82 -0.59 0.00 5.85 -0.56 -1.79 115.31 119.73 1pkz h LEU 184 Ca 0.15 -0.30 0.07 0.00 0.84 0.00 0.00 57.88 58.64 1pkz h LEU 184 Cb 0.31 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 1pkz h LEU 184 CO 0.00 0.92 0.28 0.50 -0.34 0.00 0.00 178.44 179.80 1pkz h LYS 185 N 0.69 0.49 0.03 1.25 3.64 -1.12 -0.84 116.57 120.72 1pkz h LYS 185 Ca 0.14 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1pkz h LYS 185 Cb 0.50 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1pkz h LYS 185 CO 0.02 0.33 -0.01 1.15 -2.27 0.00 0.00 179.45 178.66 1pkz h THR 186 N 0.51 1.26 -0.04 1.00 2.02 -1.39 -1.34 112.91 114.93 1pkz h THR 186 Ca 0.28 -0.95 0.01 0.00 0.77 0.00 0.00 66.41 66.52 1pkz h THR 186 Cb 0.26 1.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.56 1pkz h THR 186 CO -0.23 0.24 -0.02 0.03 0.37 0.00 0.00 175.52 175.91 1pkz h ARG 187 N -0.46 -0.02 -0.59 6.66 3.08 -1.20 -1.96 114.38 119.90 1pkz h ARG 187 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1pkz h ARG 187 Cb 0.43 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1pkz h ARG 187 CO 0.01 -0.01 0.30 0.82 -1.07 0.00 0.00 179.97 180.01 1pkz h ILE 188 N -0.02 1.20 0.00 2.04 1.08 -1.24 -1.78 117.51 118.80 1pkz h ILE 188 Ca 0.02 -0.55 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 1pkz h ILE 188 Cb 0.05 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 34.29 1pkz h ILE 188 CO -0.05 0.23 0.00 0.28 -0.69 0.00 0.00 178.15 177.91 1pkz h SER 189 N 0.80 0.00 -0.02 1.72 0.02 -1.07 -2.29 113.55 112.70 1pkz h SER 189 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1pkz h SER 189 Cb 0.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1pkz h SER 189 CO -0.03 0.00 -0.32 0.59 -1.14 0.00 0.00 176.83 175.93 1pkz n ASN 190 N -2.50 2.27 -4.69 3.07 5.03 -0.69 -3.57 115.26 114.18 1pkz n ASN 190 Ca -0.01 -1.64 -0.44 0.00 0.87 0.00 0.00 54.58 53.37 1pkz n ASN 190 Cb 0.12 0.33 -0.02 0.00 -1.02 0.00 0.00 39.78 39.19 1pkz n ASN 190 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1pkz n LEU 191 N 0.37 3.47 -0.25 3.41 4.77 -0.86 -4.81 117.00 123.10 1pkz n LEU 191 Ca 0.10 1.14 0.04 0.00 -0.03 0.00 0.00 56.01 57.27 1pkz n LEU 191 Cb 0.49 -1.48 0.17 0.00 -2.33 0.00 0.00 43.42 40.28 1pkz n LEU 191 CO 0.24 -0.30 1.00 -0.65 -1.33 0.00 0.00 177.39 176.34 1pkz h PRO 192 N 4.43 0.40 -0.06 3.23 0.11 -1.91 -0.81 132.00 137.39 1pkz h PRO 192 Ca -0.46 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1pkz h PRO 192 Cb 1.26 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1pkz h PRO 192 CO 0.77 0.26 0.02 1.79 -0.21 0.00 0.00 178.00 180.63 1pkz h THR 193 N 0.41 1.17 -0.69 -1.15 1.35 -1.87 -2.13 112.91 109.99 1pkz h THR 193 Ca 0.40 -0.51 -0.06 0.00 -0.55 0.00 0.00 66.41 65.69 1pkz h THR 193 Cb 0.60 1.41 -0.03 0.00 -1.73 0.00 0.00 68.15 68.40 1pkz h THR 193 CO -0.40 0.14 0.21 0.58 -0.25 0.00 0.00 175.52 175.80 1pkz h VAL 194 N -0.10 1.25 -0.80 6.82 2.07 -1.69 -1.53 116.25 122.26 1pkz h VAL 194 Ca 0.02 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.65 1pkz h VAL 194 Cb 0.21 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 1pkz h VAL 194 CO -0.00 0.34 0.50 0.50 0.02 0.00 0.00 177.57 178.93 1pkz h LYS 195 N 1.03 1.08 -0.24 1.57 3.64 -1.07 0.14 116.57 122.73 1pkz h LYS 195 Ca 0.22 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1pkz h LYS 195 Cb 0.30 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1pkz h LYS 195 CO -0.01 0.75 0.09 -0.22 -2.27 0.00 0.00 179.45 177.79 1pkz h LYS 196 N 1.10 0.36 -0.95 1.90 3.64 -1.04 -2.18 116.57 119.40 1pkz h LYS 196 Ca 0.29 -0.07 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 1pkz h LYS 196 Cb -0.07 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.63 1pkz h LYS 196 CO -0.06 0.42 0.59 0.35 -2.27 0.00 0.00 179.45 178.49 1pkz h PHE 197 N 0.23 1.09 0.00 1.91 3.57 -0.47 -1.90 116.94 121.38 1pkz h PHE 197 Ca 0.08 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1pkz h PHE 197 Cb 0.20 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1pkz h PHE 197 CO -0.00 0.52 0.00 -0.07 -2.23 0.00 0.00 178.31 176.52 1pkz h LEU 198 N 1.03 0.00-10.34 0.59 3.38 -0.54 -3.41 115.31 106.02 1pkz h LEU 198 Ca 0.43 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.90 1pkz h LEU 198 Cb 0.27 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.08 1pkz h LEU 198 CO -0.21 0.00 0.41 -1.10 0.09 0.00 0.00 178.44 177.63 1pkz s GLN 199 N -3.33 3.64 0.85 1.13 -0.21 -0.71 -5.03 119.66 116.01 1pkz s GLN 199 Ca 0.06 0.76 -0.13 0.00 0.02 0.00 0.00 55.36 56.08 1pkz s GLN 199 Cb 0.08 -2.09 0.08 0.00 1.00 0.00 0.00 33.01 32.08 1pkz s GLN 199 CO 0.57 -0.52 1.03 -2.30 -2.12 0.00 0.00 175.29 171.95 1pkz n PRO 200 N -2.58 -0.04 -0.74 2.91 -0.02 -1.26 -3.39 135.00 129.87 1pkz n PRO 200 Ca 0.06 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1pkz n PRO 200 Cb 0.54 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1pkz n PRO 200 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pkz n GLY 201 N 0.69 1.12 3.93 -1.23 0.00 -1.26 -5.05 105.19 103.40 1pkz n GLY 201 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1pkz n GLY 201 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pkz s SER 202 N -3.08 4.02 0.04 1.61 1.04 -1.22 -4.98 113.70 111.12 1pkz s SER 202 Ca 0.00 0.31 0.21 0.00 0.48 0.00 0.00 55.95 56.95 1pkz s SER 202 Cb 0.00 -0.65 0.86 0.00 0.10 0.00 0.00 66.02 66.33 1pkz s SER 202 CO 0.00 -2.14 1.65 -2.65 0.98 0.00 0.00 173.24 171.08 1pkz n PRO 203 N -3.31 0.03 -1.56 4.02 -0.02 -1.26 -4.84 135.00 128.06 1pkz n PRO 203 Ca 0.12 0.19 -0.46 0.00 -2.02 0.00 0.00 63.50 61.33 1pkz n PRO 203 Cb 0.60 -1.55 -0.02 0.00 -0.02 0.00 0.00 33.50 32.51 1pkz n PRO 203 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1pkz n ARG 204 N -1.62 1.09 -4.22 -0.52 0.63 -1.26 -4.97 116.66 105.79 1pkz n ARG 204 Ca 0.05 0.38 -0.28 0.00 -0.92 0.00 0.00 57.85 57.07 1pkz n ARG 204 Cb 0.24 -1.71 -0.09 0.00 0.45 0.00 0.00 32.46 31.35 1pkz n ARG 204 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1pkz s LYS 205 N -1.29 2.23 0.67 -0.14 -0.14 -1.26 -5.02 119.74 114.79 1pkz s LYS 205 Ca 0.62 -1.06 -0.11 0.00 -1.36 0.00 0.00 55.97 54.05 1pkz s LYS 205 Cb -0.76 -2.32 -0.01 0.00 -1.68 0.00 0.00 37.83 33.06 1pkz s LYS 205 CO 0.58 0.49 1.05 -1.25 -0.76 0.00 0.00 175.35 175.46 1pkz s PRO 206 N -2.51 3.15 0.77 -1.68 0.04 -1.26 -4.83 135.00 128.69 1pkz s PRO 206 Ca 0.24 0.79 -0.15 0.00 0.04 0.00 0.00 61.00 61.93 1pkz s PRO 206 Cb -0.10 -2.03 0.05 0.00 0.04 0.00 0.00 34.50 32.46 1pkz s PRO 206 CO 0.16 -0.90 1.10 -0.35 0.04 0.00 0.00 177.00 177.04 1pkz n PRO 207 N -2.98 0.34 -2.32 0.56 -0.04 -1.26 -4.40 135.00 124.91 1pkz n PRO 207 Ca 0.07 0.18 -0.41 0.00 -0.04 0.00 0.00 63.50 63.31 1pkz n PRO 207 Cb 0.54 -2.35 -0.03 0.00 -0.04 0.00 0.00 33.50 31.62 1pkz n PRO 207 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1pkz s MET 208 N -3.77 4.51 0.25 0.54 1.75 -1.26 -5.03 119.30 116.27 1pkz s MET 208 Ca 0.73 1.98 0.06 0.00 -1.25 0.00 0.00 55.69 57.22 1pkz s MET 208 Cb -0.31 -3.15 -0.03 0.00 2.84 0.00 0.00 34.83 34.18 1pkz s MET 208 CO 0.50 0.01 0.26 0.16 -0.65 0.00 0.00 175.02 175.30 1pkz s ASP 209 N -0.59 5.82 0.30 1.11 -4.77 -1.26 -5.02 116.67 112.26 1pkz s ASP 209 Ca 0.47 -0.13 0.06 0.00 -3.30 0.00 0.00 52.55 49.65 1pkz s ASP 209 Cb -0.35 -1.57 0.79 0.00 -1.09 0.00 0.00 42.92 40.69 1pkz s ASP 209 CO 0.45 -0.05 1.70 1.05 0.70 0.00 0.00 175.17 179.02 1pkz h GLU 210 N 1.39 0.40 0.07 2.11 4.11 -2.01 -1.58 114.58 119.08 1pkz h GLU 210 Ca -0.50 -0.02 -0.25 0.00 0.07 0.00 0.00 59.36 58.66 1pkz h GLU 210 Cb 1.23 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1pkz h GLU 210 CO 0.61 0.27 -1.10 0.87 0.07 0.00 0.00 179.01 179.73 1pkz h LYS 211 N 0.42 0.32 0.00 1.06 1.57 -2.03 -3.14 116.57 114.76 1pkz h LYS 211 Ca 0.59 -0.44 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 1pkz h LYS 211 Cb 1.15 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.60 1pkz h LYS 211 CO -0.53 1.15 -0.10 0.77 -0.57 0.00 0.00 179.45 180.17 1pkz h SER 212 N 0.13 0.00 0.45 0.86 0.02 -1.70 -3.04 113.55 110.27 1pkz h SER 212 Ca -0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1pkz h SER 212 Cb 1.79 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.33 1pkz h SER 212 CO 0.18 0.10 0.00 -0.11 -1.14 0.00 0.00 176.83 175.86 1pkz n LEU 213 N -3.54 0.00 0.00 5.07 7.94 -0.99 -2.15 117.00 123.34 1pkz n LEU 213 Ca -0.02 0.28 0.09 0.00 -1.11 0.00 0.00 56.01 55.25 1pkz n LEU 213 Cb 0.23 -0.28 0.50 0.00 0.53 0.00 0.00 43.42 44.40 1pkz n LEU 213 CO 0.29 -0.06 0.73 -0.62 -1.11 0.00 0.00 177.39 176.62 1pkz n GLU 214 N -1.28 0.49 0.00 1.96 4.71 -1.15 -5.14 120.64 120.22 1pkz n GLU 214 Ca 0.11 0.03 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 1pkz n GLU 214 Cb 0.19 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.12 1pkz n GLU 214 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61