#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xdi s SER 5 N 0.00 2.60 -0.45 1.69 0.01 -1.26 -5.01 113.70 111.28 2xdi s SER 5 Ca 0.00 -2.57 -0.06 0.00 1.31 0.00 0.00 55.95 54.63 2xdi s SER 5 Cb 0.00 -0.52 -0.17 0.00 0.21 0.00 0.00 66.02 65.55 2xdi s SER 5 CO 0.00 -0.25 2.87 -0.81 0.41 0.00 0.00 173.24 175.46 2xdi n PRO 6 N 3.54 2.09 0.00 12.44 -0.04 -1.26 -4.81 135.00 146.96 2xdi n PRO 6 Ca 0.18 -1.17 0.00 0.00 -0.04 0.00 0.00 63.50 62.46 2xdi n PRO 6 Cb 0.40 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.70 2xdi n PRO 6 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2xdi n TYR 7 N 3.03 0.00 -2.74 0.54 4.19 -1.26 -4.73 117.16 116.19 2xdi n TYR 7 Ca 0.45 0.00 -0.41 0.00 3.31 0.00 0.00 57.90 61.25 2xdi n TYR 7 Cb 0.55 0.00 -0.05 0.00 0.49 0.00 0.00 39.34 40.33 2xdi n TYR 7 CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 2xdi s SER 8 N -0.47 7.55 0.00 2.98 0.01 -1.26 -4.92 113.70 117.59 2xdi s SER 8 Ca 0.00 1.85 0.00 0.00 1.31 0.00 0.00 55.95 59.11 2xdi s SER 8 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2xdi s SER 8 CO 0.00 0.02 0.42 0.00 0.41 0.00 0.00 173.24 174.09 2xdi n ALA 9 N 2.32 0.90 -1.35 1.44 0.00 -1.26 -4.84 120.51 117.71 2xdi n ALA 9 Ca 0.01 -0.42 -0.30 0.00 0.00 0.00 0.00 53.44 52.72 2xdi n ALA 9 Cb 0.48 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.98 2xdi n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xdi n ALA 10 N -0.04 6.08 -2.00 0.00 0.00 -1.26 -4.73 120.51 118.56 2xdi n ALA 10 Ca 0.00 -3.07 0.00 0.00 0.00 0.00 0.00 53.44 50.37 2xdi n ALA 10 Cb 0.40 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 18.08 2xdi n ALA 10 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2xdi n MET 11 N -0.27 0.00 0.00 0.00 0.00 -1.26 -5.13 117.12 110.46 2xdi n MET 11 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 57.70 58.21 2xdi n MET 11 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.76 2xdi n MET 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2xdi n ALA 12 N -3.00 0.00 -0.30 -5.12 0.00 -1.26 -4.94 120.51 105.89 2xdi n ALA 12 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2xdi n ALA 12 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.54 2xdi n ALA 12 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2xdi h GLU 13 N 0.00 -0.02 0.00 0.00 5.08 -1.97 -3.12 114.58 114.56 2xdi h GLU 13 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2xdi h GLU 13 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2xdi h GLU 13 CO 0.00 -0.01 -0.02 1.04 -1.00 0.00 0.00 179.01 179.02 2xdi n GLN 14 N -5.53 5.33 -0.48 2.33 6.02 -1.26 -4.99 117.38 118.80 2xdi n GLN 14 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 2xdi n GLN 14 Cb 0.42 -0.40 0.00 0.00 1.02 0.00 0.00 30.24 31.29 2xdi n GLN 14 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2xdi n ARG 15 N -0.78 0.00 0.00 -1.09 0.63 -1.18 -4.78 116.66 109.46 2xdi n ARG 15 Ca 0.00 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 57.06 2xdi n ARG 15 Cb 0.00 -2.71 0.39 0.00 0.45 0.00 0.00 32.46 30.59 2xdi n ARG 15 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 2xdi n HIS 16 N -2.00 0.00 0.12 -0.14 1.44 -1.26 -3.59 115.22 109.79 2xdi n HIS 16 Ca 0.00 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.78 2xdi n HIS 16 Cb 0.00 -0.17 0.02 0.00 0.12 0.00 0.00 29.99 29.96 2xdi n HIS 16 CO 0.00 0.00 0.00 0.37 -2.81 0.00 0.00 176.34 173.90 2xdi h GLN 17 N 0.82 0.00 0.00 -1.40 4.15 -1.98 -3.18 115.11 113.52 2xdi h GLN 17 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2xdi h GLN 17 Cb 0.48 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.17 2xdi h GLN 17 CO 0.00 0.19 0.00 -0.85 -1.93 0.00 0.00 178.83 176.24 2xdi n GLU 18 N -2.95 0.21 0.03 1.69 0.28 -1.24 -1.85 120.64 116.80 2xdi n GLU 18 Ca -0.01 0.32 -0.19 0.00 -0.16 0.00 0.00 57.16 57.12 2xdi n GLU 18 Cb 0.66 -1.82 -0.11 0.00 1.43 0.00 0.00 31.44 31.60 2xdi n GLU 18 CO 0.00 0.00 0.00 2.35 -0.16 0.00 0.00 177.13 179.32 2xdi h TRP 19 N 0.00 0.77 -0.25 -1.84 2.91 -1.73 -2.55 115.95 113.26 2xdi h TRP 19 Ca 0.00 -0.44 -0.16 0.00 1.13 0.00 0.00 58.89 59.42 2xdi h TRP 19 Cb 0.51 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.07 2xdi h TRP 19 CO 0.00 1.27 -0.48 -0.07 -1.03 0.00 0.00 178.44 178.13 2xdi h LEU 20 N 0.05 0.75 -1.48 0.65 3.38 -1.64 0.07 115.31 117.09 2xdi h LEU 20 Ca -0.11 -0.37 0.06 0.00 0.09 0.00 0.00 57.88 57.55 2xdi h LEU 20 Cb 1.51 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 42.01 2xdi h LEU 20 CO 0.16 1.11 0.42 0.03 0.09 0.00 0.00 178.44 180.24 2xdi h ARG 21 N 0.54 0.62 0.16 1.13 2.47 -1.38 1.67 114.38 119.59 2xdi h ARG 21 Ca 0.03 -0.04 -0.29 0.00 -1.26 0.00 0.00 59.98 58.42 2xdi h ARG 21 Cb 1.04 -0.14 0.01 0.00 -1.65 0.00 0.00 29.97 29.23 2xdi h ARG 21 CO 0.10 0.41 -1.32 0.35 0.56 0.00 0.00 179.97 180.07 2xdi h PHE 22 N 0.64 0.63 -0.26 3.04 3.04 -1.07 -0.90 116.94 122.06 2xdi h PHE 22 Ca 0.27 -0.46 -0.13 0.00 3.98 0.00 0.00 57.97 61.63 2xdi h PHE 22 Cb 0.26 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.73 2xdi h PHE 22 CO -0.00 1.36 -0.37 0.28 -2.02 0.00 0.00 178.31 177.56 2xdi h VAL 23 N 0.09 1.29 -0.07 1.41 2.07 0.58 0.12 116.25 121.75 2xdi h VAL 23 Ca -0.17 -1.52 -0.20 0.00 0.82 0.00 0.00 66.70 65.63 2xdi h VAL 23 Cb 2.03 1.50 0.01 0.00 -1.52 0.00 0.00 31.29 33.31 2xdi h VAL 23 CO 0.22 0.48 -0.73 -0.78 0.02 0.00 0.00 177.57 176.79 2xdi h ASP 24 N 0.49 0.76 -0.11 0.57 1.82 0.24 0.62 116.42 120.80 2xdi h ASP 24 Ca 0.05 -0.69 -0.02 0.00 -0.39 0.00 0.00 57.03 55.98 2xdi h ASP 24 Cb 0.87 -0.23 -0.00 0.00 0.68 0.00 0.00 39.33 40.65 2xdi h ASP 24 CO 0.07 1.33 -0.00 -0.07 -1.61 0.00 0.00 179.24 178.97 2xdi h LEU 25 N 0.25 0.19 -0.12 2.28 4.07 -1.07 0.51 115.31 121.42 2xdi h LEU 25 Ca -0.07 -0.31 -0.01 0.00 0.08 0.00 0.00 57.88 57.57 2xdi h LEU 25 Cb 1.39 -0.05 -0.00 0.00 1.08 0.00 0.00 40.66 43.07 2xdi h LEU 25 CO 0.15 0.46 0.03 0.25 -1.08 0.00 0.00 178.44 178.25 2xdi h LEU 26 N -0.07 0.17 -0.89 1.67 5.85 -0.80 0.75 115.31 121.98 2xdi h LEU 26 Ca 0.03 -0.22 0.08 0.00 0.84 0.00 0.00 57.88 58.62 2xdi h LEU 26 Cb 0.36 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.27 2xdi h LEU 26 CO 0.01 0.34 0.55 0.50 -0.34 0.00 0.00 178.44 179.50 2xdi h LYS 27 N -0.01 0.92 0.00 1.25 3.64 0.35 0.60 116.57 123.32 2xdi h LYS 27 Ca 0.04 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 2xdi h LYS 27 Cb 0.24 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2xdi h LYS 27 CO -0.00 0.61 -0.27 -0.91 -2.27 0.00 0.00 179.45 176.61 2xdi h ASN 28 N 0.94 0.00 0.95 4.20 4.21 0.53 -2.55 115.58 123.86 2xdi h ASN 28 Ca 0.41 0.00 -0.22 0.00 1.21 0.00 0.00 56.30 57.70 2xdi h ASN 28 Cb 0.29 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.46 2xdi h ASN 28 CO -0.22 0.27 -1.07 0.00 -1.29 0.00 0.00 177.43 175.12 2xdi h ALA 29 N 1.73 0.39 0.00 -0.83 0.00 0.45 -1.87 119.26 119.13 2xdi h ALA 29 Ca -0.00 -0.96 -0.02 0.00 0.00 0.00 0.00 54.91 53.92 2xdi h ALA 29 Cb 0.83 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2xdi h ALA 29 CO 0.03 1.28 -0.11 1.88 0.00 0.00 0.00 179.25 182.33 2xdi h TYR 30 N 0.00 0.00 0.04 0.00 0.99 0.16 -1.22 116.97 116.93 2xdi h TYR 30 Ca -0.04 0.00 -0.34 0.00 2.00 0.00 0.00 58.73 60.36 2xdi h TYR 30 Cb 1.80 0.00 -0.05 0.00 1.00 0.00 0.00 36.73 39.48 2xdi h TYR 30 CO 0.00 0.11 -1.98 0.94 -0.00 0.00 0.00 178.16 177.23 2xdi n GLN 31 N -3.14 0.68 0.07 4.88 7.27 -0.98 -4.11 117.38 122.05 2xdi n GLN 31 Ca 0.03 0.22 0.12 0.00 0.07 0.00 0.00 57.00 57.44 2xdi n GLN 31 Cb 0.54 -1.70 0.22 0.00 2.41 0.00 0.00 30.24 31.71 2xdi n GLN 31 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2xdi n ASN 32 N -3.14 0.73 0.00 1.69 2.85 -0.71 -4.91 115.26 111.77 2xdi n ASN 32 Ca -0.27 0.22 0.00 0.00 -0.11 0.00 0.00 54.58 54.42 2xdi n ASN 32 Cb 1.06 -0.04 0.00 0.00 1.24 0.00 0.00 39.78 42.04 2xdi n ASN 32 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2xdi n ASP 33 N -2.15 -2.84 -0.36 1.20 2.03 -0.46 -4.81 116.55 109.16 2xdi n ASP 33 Ca 0.04 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.39 2xdi n ASP 33 Cb 0.44 -1.97 0.15 0.00 -0.72 0.00 0.00 41.12 39.01 2xdi n ASP 33 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2xdi n LEU 34 N 0.00 1.06 -0.22 -2.67 -0.00 -1.23 -3.75 117.00 110.20 2xdi n LEU 34 Ca 0.00 -0.52 0.03 0.00 -0.00 0.00 0.00 56.01 55.53 2xdi n LEU 34 Cb 0.18 -0.12 0.14 0.00 -0.00 0.00 0.00 43.42 43.61 2xdi n LEU 34 CO 0.00 0.26 0.60 0.00 -0.00 0.00 0.00 177.39 178.25 2xdi n HIS 35 N 0.05 0.15 -0.33 1.47 1.44 -1.23 -4.28 115.22 112.49 2xdi n HIS 35 Ca 0.08 -0.07 0.06 0.00 -2.01 0.00 0.00 57.72 55.78 2xdi n HIS 35 Cb 0.18 0.00 0.15 0.00 0.12 0.00 0.00 29.99 30.44 2xdi n HIS 35 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2xdi h LEU 36 N 0.73 -0.77 0.32 2.39 -0.00 -1.90 1.60 115.31 117.68 2xdi h LEU 36 Ca 0.00 0.27 -0.02 0.00 -0.00 0.00 0.00 57.88 58.14 2xdi h LEU 36 Cb 0.16 0.55 0.00 0.00 -0.00 0.00 0.00 40.66 41.37 2xdi h LEU 36 CO 0.00 -0.31 -0.16 1.55 -0.00 0.00 0.00 178.44 179.53 2xdi h PRO 37 N 0.01 -0.42 -0.07 1.13 0.13 -1.94 -2.18 132.00 128.66 2xdi h PRO 37 Ca 0.47 0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.64 2xdi h PRO 37 Cb 0.77 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.99 2xdi h PRO 37 CO -0.93 -0.13 0.09 1.25 -0.23 0.00 0.00 178.00 178.04 2xdi h LEU 38 N -0.69 0.00 -0.72 1.56 7.12 -1.19 0.29 115.31 121.68 2xdi h LEU 38 Ca -0.04 0.00 -0.13 0.00 0.13 0.00 0.00 57.88 57.84 2xdi h LEU 38 Cb 0.48 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.60 2xdi h LEU 38 CO 0.07 0.00 -0.44 0.25 -0.13 0.00 0.00 178.44 178.19 2xdi h LEU 39 N 0.00 0.48 -0.02 2.25 5.85 0.28 0.48 115.31 124.63 2xdi h LEU 39 Ca 0.03 -0.22 -0.10 0.00 0.84 0.00 0.00 57.88 58.43 2xdi h LEU 39 Cb 0.21 -0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.11 2xdi h LEU 39 CO -0.00 0.86 -0.39 0.78 -0.34 0.00 0.00 178.44 179.35 2xdi h ASN 40 N 0.36 0.37 -0.53 1.25 2.35 -0.47 2.04 115.58 120.97 2xdi h ASN 40 Ca 0.03 -0.74 -0.06 0.00 -0.55 0.00 0.00 56.30 54.98 2xdi h ASN 40 Cb 0.92 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 39.15 2xdi h ASN 40 CO 0.08 1.06 0.12 -0.07 -1.65 0.00 0.00 177.43 176.97 2xdi h LEU 41 N -0.28 0.85 -0.06 1.61 3.38 -1.35 -2.24 115.31 117.23 2xdi h LEU 41 Ca -0.04 -0.17 -0.20 0.00 0.09 0.00 0.00 57.88 57.55 2xdi h LEU 41 Cb 1.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 2xdi h LEU 41 CO 0.08 0.84 -0.97 -0.03 0.09 0.00 0.00 178.44 178.45 2xdi h MET 42 N 0.86 0.00 -5.83 1.13 4.05 -0.00 -3.43 114.93 111.71 2xdi h MET 42 Ca 0.18 -0.01 -0.58 0.00 -0.28 0.00 0.00 59.70 59.02 2xdi h MET 42 Cb 0.34 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.14 2xdi h MET 42 CO 0.00 0.97 1.52 1.28 0.23 0.00 0.00 176.91 180.92 2xdi n LEU 43 N -3.39 2.49 -4.35 3.39 4.77 0.69 -4.92 117.00 115.69 2xdi n LEU 43 Ca -0.00 0.09 -0.18 0.00 -0.03 0.00 0.00 56.01 55.89 2xdi n LEU 43 Cb 0.92 -1.43 -0.10 0.00 -2.33 0.00 0.00 43.42 40.47 2xdi n LEU 43 CO 0.47 -0.92 -0.41 0.42 -1.33 0.00 0.00 177.39 175.61 2xdi s THR 44 N 9.02 1.56 -0.03 -5.08 -4.23 -1.26 -4.92 115.64 110.71 2xdi s THR 44 Ca 1.05 -2.15 -0.09 0.00 -1.18 0.00 0.00 61.69 59.32 2xdi s THR 44 Cb -0.52 -2.12 -0.05 0.00 1.34 0.00 0.00 72.50 71.15 2xdi s THR 44 CO 0.38 -0.54 0.47 1.55 -0.54 0.00 0.00 174.62 175.95 2xdi h PRO 45 N 2.53 -0.30 -0.40 3.99 0.13 -1.98 -1.17 132.00 134.79 2xdi h PRO 45 Ca -0.38 0.02 0.09 0.00 -0.87 0.00 0.00 66.00 64.85 2xdi h PRO 45 Cb 1.22 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 2xdi h PRO 45 CO 0.63 -0.20 0.28 0.22 -0.23 0.00 0.00 178.00 178.70 2xdi h ASP 46 N -0.76 0.14 0.13 1.44 -0.00 -1.98 0.35 116.42 115.75 2xdi h ASP 46 Ca -0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 56.99 2xdi h ASP 46 Cb 0.24 -0.03 0.00 0.00 -0.00 0.00 0.00 39.33 39.54 2xdi h ASP 46 CO 0.05 0.09 -0.06 -0.08 -0.00 0.00 0.00 179.24 179.24 2xdi h GLU 47 N 0.16 -0.16 0.00 0.28 4.81 -1.94 0.56 114.58 118.28 2xdi h GLU 47 Ca 0.19 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 2xdi h GLU 47 Cb 0.53 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2xdi h GLU 47 CO -0.03 0.25 -0.17 0.00 -0.73 0.00 0.00 179.01 178.33 2xdi h ARG 48 N -0.63 0.00 0.05 1.92 3.08 -0.46 0.45 114.38 118.79 2xdi h ARG 48 Ca -0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2xdi h ARG 48 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2xdi h ARG 48 CO 0.03 0.17 -0.02 1.49 -1.07 0.00 0.00 179.97 180.57 2xdi h GLU 49 N 0.00 -0.06 -0.41 0.04 4.22 -0.14 -1.60 114.58 116.63 2xdi h GLU 49 Ca -0.00 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 59.39 2xdi h GLU 49 Cb 0.31 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2xdi h GLU 49 CO 0.02 0.55 0.04 0.00 -2.18 0.00 0.00 179.01 177.44 2xdi h ALA 50 N 0.08 1.30 0.01 2.92 0.00 0.39 0.40 119.26 124.36 2xdi h ALA 50 Ca -0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2xdi h ALA 50 Cb 0.64 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2xdi h ALA 50 CO 0.01 0.48 -0.01 -0.07 0.00 0.00 0.00 179.25 179.66 2xdi h LEU 51 N 0.61 -0.02 -1.92 0.00 -0.00 -0.13 -0.56 115.31 113.29 2xdi h LEU 51 Ca 0.13 0.00 0.19 0.00 -0.00 0.00 0.00 57.88 58.20 2xdi h LEU 51 Cb 0.33 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.97 2xdi h LEU 51 CO 0.01 -0.01 0.58 1.23 -0.00 0.00 0.00 178.44 180.25 2xdi h GLY 52 N -0.02 0.00 0.88 0.83 0.00 -1.29 0.19 103.07 103.66 2xdi h GLY 52 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2xdi h GLY 52 CO 0.00 0.00 0.07 -0.84 0.00 0.00 0.00 176.54 175.78 2xdi h THR 53 N 0.00 1.19 -0.69 4.70 2.02 0.19 -2.29 112.91 118.02 2xdi h THR 53 Ca 0.31 -0.59 -0.05 0.00 0.77 0.00 0.00 66.41 66.86 2xdi h THR 53 Cb 1.48 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 69.01 2xdi h THR 53 CO -0.00 0.19 0.25 -0.09 0.37 0.00 0.00 175.52 176.24 2xdi h ARG 54 N 0.20 1.03 -0.85 6.66 2.43 0.99 0.19 114.38 125.04 2xdi h ARG 54 Ca 0.07 -0.19 0.07 0.00 -0.81 0.00 0.00 59.98 59.12 2xdi h ARG 54 Cb 0.23 -0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.55 2xdi h ARG 54 CO -0.00 0.86 0.52 0.28 -1.51 0.00 0.00 179.97 180.11 2xdi h VAL 55 N 1.01 1.01 0.01 0.20 2.07 -1.14 -1.05 116.25 118.36 2xdi h VAL 55 Ca 0.23 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 2xdi h VAL 55 Cb 0.23 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2xdi h VAL 55 CO -0.02 0.17 -0.18 -0.09 0.02 0.00 0.00 177.57 177.48 2xdi h ARG 56 N 0.93 0.11 -0.26 1.57 2.43 -0.85 -2.51 114.38 115.80 2xdi h ARG 56 Ca 0.38 -0.12 0.04 0.00 -0.81 0.00 0.00 59.98 59.47 2xdi h ARG 56 Cb 0.21 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.73 2xdi h ARG 56 CO -0.19 0.91 -0.53 0.82 -1.51 0.00 0.00 179.97 179.47 2xdi h ILE 57 N -0.65 0.02 -0.78 1.20 2.04 -0.35 0.84 117.51 119.83 2xdi h ILE 57 Ca -0.02 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.89 2xdi h ILE 57 Cb 0.98 0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 2xdi h ILE 57 CO 0.03 0.00 0.47 -0.37 0.00 0.00 0.00 178.15 178.29 2xdi h VAL 58 N -0.49 1.03 0.66 1.67 -1.51 -1.32 0.39 116.25 116.68 2xdi h VAL 58 Ca 0.06 -0.30 -0.03 0.00 -1.23 0.00 0.00 66.70 65.20 2xdi h VAL 58 Cb 0.64 0.08 0.01 0.00 -2.13 0.00 0.00 31.29 29.88 2xdi h VAL 58 CO -0.51 0.16 -0.32 -0.08 -1.23 0.00 0.00 177.57 175.59 2xdi h GLU 59 N 0.87 -0.86 -0.57 5.19 4.57 -0.53 -2.34 114.58 120.91 2xdi h GLU 59 Ca 0.34 0.06 0.05 0.00 -1.18 0.00 0.00 59.36 58.63 2xdi h GLU 59 Cb 0.16 0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 28.91 2xdi h GLU 59 CO -0.17 -0.56 0.38 0.93 -1.18 0.00 0.00 179.01 178.41 2xdi h GLU 60 N -0.93 0.56 -0.18 1.92 5.08 0.94 -0.84 114.58 121.12 2xdi h GLU 60 Ca -0.09 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2xdi h GLU 60 Cb 0.70 -0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.75 2xdi h GLU 60 CO 0.15 0.37 -0.39 1.25 -1.00 0.00 0.00 179.01 179.39 2xdi h LEU 61 N 0.58 -1.24 -1.56 1.33 6.46 0.29 1.82 115.31 122.99 2xdi h LEU 61 Ca 0.24 0.17 -0.04 0.00 -0.12 0.00 0.00 57.88 58.14 2xdi h LEU 61 Cb 0.21 0.52 -0.01 0.00 -0.73 0.00 0.00 40.66 40.66 2xdi h LEU 61 CO -0.07 -0.40 -0.17 0.25 -0.62 0.00 0.00 178.44 177.44 2xdi h LEU 62 N -0.43 0.00 -0.32 2.25 6.46 -1.07 -2.42 115.31 119.78 2xdi h LEU 62 Ca 0.09 0.00 -0.19 0.00 -0.12 0.00 0.00 57.88 57.67 2xdi h LEU 62 Cb 0.60 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.51 2xdi h LEU 62 CO -0.42 0.17 -0.85 -0.09 -0.62 0.00 0.00 178.44 176.63 2xdi h ARG 63 N 0.00 0.11 0.00 1.25 2.43 0.13 -3.47 114.38 114.83 2xdi h ARG 63 Ca -0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2xdi h ARG 63 Cb 0.53 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2xdi h ARG 63 CO 0.02 0.89 0.00 0.41 -1.51 0.00 0.00 179.97 179.78 2xdi n GLY 64 N 0.85 1.75 2.50 2.80 0.00 0.57 -5.05 105.19 108.61 2xdi n GLY 64 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 2xdi n GLY 64 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2xdi n GLU 65 N 0.00 2.07 -0.28 1.61 1.02 0.10 -4.91 120.64 120.25 2xdi n GLU 65 Ca 0.00 -4.17 0.11 0.00 -0.02 0.00 0.00 57.16 53.09 2xdi n GLU 65 Cb 0.00 -1.93 0.36 0.00 -0.02 0.00 0.00 31.44 29.85 2xdi n GLU 65 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2xdi h MET 66 N 3.43 0.71 0.00 3.49 2.86 -1.82 -3.35 114.93 120.24 2xdi h MET 66 Ca 0.13 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2xdi h MET 66 Cb 0.72 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.22 2xdi h MET 66 CO 0.68 0.47 0.00 0.45 1.06 0.00 0.00 176.91 179.57 2xdi n SER 67 N -4.57 0.00 0.33 1.22 2.88 -1.26 -4.84 113.62 107.38 2xdi n SER 67 Ca 0.18 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.85 2xdi n SER 67 Cb 0.46 0.00 0.69 0.00 -0.75 0.00 0.00 64.21 64.61 2xdi n SER 67 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2xdi h GLN 68 N 0.00 0.00 0.15 -1.46 4.15 -1.84 0.80 115.11 116.91 2xdi h GLN 68 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 2xdi h GLN 68 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2xdi h GLN 68 CO 0.00 0.00 -0.07 0.00 -1.93 0.00 0.00 178.83 176.83 2xdi h ARG 69 N 0.00 -0.19 -0.20 1.69 2.47 -1.92 -3.40 114.38 112.84 2xdi h ARG 69 Ca 0.00 0.01 -0.17 0.00 -1.26 0.00 0.00 59.98 58.56 2xdi h ARG 69 Cb 0.85 0.04 -0.20 0.00 -1.65 0.00 0.00 29.97 29.02 2xdi h ARG 69 CO 0.00 -0.13 -0.72 0.39 0.56 0.00 0.00 179.97 180.07 2xdi n GLU 70 N -2.84 1.74 -2.90 0.04 -0.58 -1.01 -4.83 120.64 110.26 2xdi n GLU 70 Ca -0.02 -3.27 -0.24 0.00 -0.42 0.00 0.00 57.16 53.21 2xdi n GLU 70 Cb 0.08 -1.46 -0.03 0.00 -0.57 0.00 0.00 31.44 29.46 2xdi n GLU 70 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 2xdi n LEU 71 N -0.69 3.52 0.00 -4.62 0.00 0.28 -4.76 117.00 110.74 2xdi n LEU 71 Ca 0.21 -5.33 0.00 0.00 0.00 0.00 0.00 56.01 50.89 2xdi n LEU 71 Cb 0.85 -0.20 0.00 0.00 0.00 0.00 0.00 43.42 44.07 2xdi n LEU 71 CO 0.06 2.27 -0.48 0.29 0.00 0.00 0.00 177.39 179.53 2xdi n LYS 72 N -0.16 2.02 0.03 1.96 5.02 -1.26 -2.27 118.16 123.51 2xdi n LYS 72 Ca 0.30 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.72 2xdi n LYS 72 Cb 0.52 -0.98 0.44 0.00 -0.02 0.00 0.00 35.03 34.99 2xdi n LYS 72 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2xdi n ASN 73 N -1.69 0.38 -0.57 4.39 5.15 -1.26 0.61 115.26 122.26 2xdi n ASN 73 Ca 0.00 0.32 0.12 0.00 -0.60 0.00 0.00 54.58 54.42 2xdi n ASN 73 Cb 0.24 -0.33 0.42 0.00 -0.53 0.00 0.00 39.78 39.58 2xdi n ASN 73 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2xdi n GLU 74 N -1.75 1.78 0.00 1.20 2.13 -1.26 -4.73 120.64 118.01 2xdi n GLU 74 Ca 0.06 -1.15 0.00 0.00 0.66 0.00 0.00 57.16 56.73 2xdi n GLU 74 Cb 0.37 -1.45 0.00 0.00 0.27 0.00 0.00 31.44 30.63 2xdi n GLU 74 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2xdi n PHE 75 N 0.38 0.00 0.00 4.31 7.35 -1.19 -5.01 117.46 123.29 2xdi n PHE 75 Ca 0.18 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.87 2xdi n PHE 75 Cb 0.38 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.21 2xdi n PHE 75 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2xdi n GLY 76 N 0.00 3.32 0.00 7.13 0.00 0.20 -4.88 105.19 110.96 2xdi n GLY 76 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2xdi n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdi n ALA 77 N 0.00 0.00 -3.03 4.61 0.00 -1.18 -4.32 120.51 116.59 2xdi n ALA 77 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2xdi n ALA 77 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 2xdi n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xdi n GLY 78 N 0.00 -0.51 0.17 0.00 0.00 -0.96 -4.77 105.19 99.12 2xdi n GLY 78 Ca 0.00 0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.27 2xdi n GLY 78 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2xdi h ILE 79 N -1.43 0.00 0.00 -0.61 5.03 -1.89 -3.05 117.51 115.55 2xdi h ILE 79 Ca -0.53 -0.77 0.00 0.00 -0.12 0.00 0.00 64.86 63.44 2xdi h ILE 79 Cb 1.36 1.76 0.00 0.00 -3.03 0.00 0.00 36.82 36.92 2xdi h ILE 79 CO 0.56 0.00 -0.67 0.00 -0.68 0.00 0.00 178.15 177.37 2xdi n ALA 80 N -1.97 1.80 0.09 1.87 0.00 -1.26 -4.63 120.51 116.41 2xdi n ALA 80 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.28 2xdi n ALA 80 Cb 0.48 0.23 -0.12 0.00 0.00 0.00 0.00 19.45 20.04 2xdi n ALA 80 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2xdi h THR 81 N 0.00 1.31 -0.45 0.00 2.02 -1.96 -0.03 112.91 113.80 2xdi h THR 81 Ca 0.00 -2.49 -0.08 0.00 0.77 0.00 0.00 66.41 64.62 2xdi h THR 81 Cb 0.67 2.66 -0.02 0.00 -1.74 0.00 0.00 68.15 69.71 2xdi h THR 81 CO 0.00 0.75 -0.04 -0.29 0.37 0.00 0.00 175.52 176.32 2xdi h ILE 82 N 0.27 1.24 -0.41 3.11 6.09 -1.84 -2.79 117.51 123.19 2xdi h ILE 82 Ca -0.17 -1.03 -0.06 0.00 -1.37 0.00 0.00 64.86 62.22 2xdi h ILE 82 Cb 1.87 0.94 -0.04 0.00 0.47 0.00 0.00 36.82 40.06 2xdi h ILE 82 CO 0.23 0.36 0.04 1.07 -3.07 0.00 0.00 178.15 176.78 2xdi n THR 83 N -4.20 2.52 -1.51 2.19 5.66 -1.23 -5.02 114.28 112.67 2xdi n THR 83 Ca 0.02 -1.88 -0.57 0.00 -3.05 0.00 0.00 64.05 58.57 2xdi n THR 83 Cb 0.31 -0.29 -0.07 0.00 -1.55 0.00 0.00 70.33 68.73 2xdi n THR 83 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 2xdi n ARG 84 N -0.37 0.25 -1.50 1.09 3.00 -0.02 -4.55 116.66 114.57 2xdi n ARG 84 Ca 0.28 0.09 -0.16 0.00 -0.00 0.00 0.00 57.85 58.06 2xdi n ARG 84 Cb 1.05 -1.58 -0.13 0.00 0.00 0.00 0.00 32.46 31.79 2xdi n ARG 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2xdi n GLY 85 N 1.74 -0.31 0.00 5.14 0.00 -1.26 -4.80 105.19 105.70 2xdi n GLY 85 Ca 0.19 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2xdi n GLY 85 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2xdi n SER 86 N 12.44 1.43 -3.95 1.61 2.88 -1.26 -5.13 113.62 121.64 2xdi n SER 86 Ca 0.52 -0.45 -0.30 0.00 -1.33 0.00 0.00 58.87 57.30 2xdi n SER 86 Cb 0.32 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.63 2xdi n SER 86 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2xdi s ASN 87 N 0.09 3.88 0.00 -3.46 0.01 -1.26 -5.05 114.94 109.16 2xdi s ASN 87 Ca 0.00 -1.19 0.00 0.00 -0.71 0.00 0.00 52.86 50.96 2xdi s ASN 87 Cb 0.00 -1.20 0.00 0.00 0.41 0.00 0.00 41.25 40.46 2xdi s ASN 87 CO 0.00 -0.23 0.00 -1.20 -1.51 0.00 0.00 177.10 174.16 2xdi n SER 88 N 4.66 0.00 0.17 -1.22 7.64 -1.26 -3.38 113.62 120.23 2xdi n SER 88 Ca -0.12 0.00 0.13 0.00 1.01 0.00 0.00 58.87 59.89 2xdi n SER 88 Cb 0.44 0.00 0.54 0.00 -1.01 0.00 0.00 64.21 64.18 2xdi n SER 88 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2xdi h LEU 89 N 0.00 0.00 0.00 -3.43 5.85 -1.97 -1.43 115.31 114.33 2xdi h LEU 89 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2xdi h LEU 89 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2xdi h LEU 89 CO 0.00 0.00 0.00 0.29 -0.34 0.00 0.00 178.44 178.39 2xdi n LYS 90 N -2.48 0.51 0.00 1.25 4.76 -1.26 -3.12 118.16 117.82 2xdi n LYS 90 Ca 0.02 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 2xdi n LYS 90 Cb 0.26 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 2xdi n LYS 90 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2xdi n ALA 91 N -1.17 0.83 -2.53 7.82 0.00 -0.63 -5.01 120.51 119.83 2xdi n ALA 91 Ca 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 53.44 53.44 2xdi n ALA 91 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 2xdi n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xdi n ALA 92 N -0.09 -3.38 -0.00 0.00 0.00 -0.68 -4.81 120.51 111.55 2xdi n ALA 92 Ca 0.00 0.47 -0.18 0.00 0.00 0.00 0.00 53.44 53.73 2xdi n ALA 92 Cb 0.12 -1.06 -0.09 0.00 0.00 0.00 0.00 19.45 18.42 2xdi n ALA 92 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2xdi h PRO 93 N 2.48 0.68 -0.06 0.00 0.13 -1.88 -2.36 132.00 131.00 2xdi h PRO 93 Ca 0.00 -0.62 0.02 0.00 -0.87 0.00 0.00 66.00 64.52 2xdi h PRO 93 Cb 0.08 0.15 -0.00 0.00 0.13 0.00 0.00 31.00 31.36 2xdi h PRO 93 CO 0.09 1.23 0.19 0.28 -0.23 0.00 0.00 178.00 179.56 2xdi h VAL 94 N 0.35 0.13 -0.08 1.56 2.07 -1.92 0.55 116.25 118.92 2xdi h VAL 94 Ca -0.08 0.00 -0.24 0.00 0.82 0.00 0.00 66.70 67.21 2xdi h VAL 94 Cb 1.45 0.82 0.01 0.00 -1.52 0.00 0.00 31.29 32.05 2xdi h VAL 94 CO 0.16 0.00 -0.89 -0.33 0.02 0.00 0.00 177.57 176.53 2xdi h GLU 95 N 0.00 0.69 -0.05 1.57 4.39 -1.74 -1.15 114.58 118.29 2xdi h GLU 95 Ca 0.03 -0.64 -0.02 0.00 0.34 0.00 0.00 59.36 59.07 2xdi h GLU 95 Cb 0.41 0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2xdi h GLU 95 CO -0.00 1.24 -0.03 1.25 -1.16 0.00 0.00 179.01 180.31 2xdi h LEU 96 N 0.43 0.11 -2.24 1.33 6.46 0.11 -2.51 115.31 119.00 2xdi h LEU 96 Ca -0.08 -0.43 0.01 0.00 -0.12 0.00 0.00 57.88 57.26 2xdi h LEU 96 Cb 1.52 -0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 41.42 2xdi h LEU 96 CO 0.17 0.52 0.04 -0.09 -0.62 0.00 0.00 178.44 178.47 2xdi h ARG 97 N -0.29 0.00 -0.33 1.25 2.43 -1.01 -1.31 114.38 115.11 2xdi h ARG 97 Ca 0.01 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 2xdi h ARG 97 Cb 0.48 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 2xdi h ARG 97 CO 0.01 0.00 -0.04 1.96 -1.51 0.00 0.00 179.97 180.39 2xdi h GLN 98 N 0.00 0.62 -0.26 0.20 1.08 -0.79 0.92 115.11 116.88 2xdi h GLN 98 Ca 0.02 -0.22 -0.00 0.00 -1.45 0.00 0.00 58.65 57.00 2xdi h GLN 98 Cb 0.10 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 2xdi h GLN 98 CO -0.00 0.77 0.15 2.35 -0.95 0.00 0.00 178.83 181.15 2xdi h TRP 99 N 0.41 0.35 -0.15 2.96 7.01 -0.85 -0.04 115.95 125.64 2xdi h TRP 99 Ca 0.09 -0.00 -0.05 0.00 2.11 0.00 0.00 58.89 61.04 2xdi h TRP 99 Cb 0.51 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.45 2xdi h TRP 99 CO 0.04 0.28 -0.12 -0.07 -2.79 0.00 0.00 178.44 175.78 2xdi h LEU 100 N 0.32 0.22 -1.72 0.65 3.38 -1.39 0.05 115.31 116.81 2xdi h LEU 100 Ca 0.09 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2xdi h LEU 100 Cb 0.04 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2xdi h LEU 100 CO -0.02 0.37 -0.02 -0.33 0.09 0.00 0.00 178.44 178.53 2xdi h GLU 101 N 0.22 0.00 0.11 1.13 5.08 0.44 0.58 114.58 122.13 2xdi h GLU 101 Ca 0.05 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.09 2xdi h GLU 101 Cb 0.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2xdi h GLU 101 CO 0.02 0.02 -1.64 1.49 -1.00 0.00 0.00 179.01 177.91 2xdi h GLU 102 N 0.00 0.23 0.00 2.33 4.81 0.81 -1.07 114.58 121.68 2xdi h GLU 102 Ca -0.00 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2xdi h GLU 102 Cb 0.43 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.96 2xdi h GLU 102 CO 0.00 1.06 -0.20 0.28 -0.73 0.00 0.00 179.01 179.42 2xdi h VAL 103 N 0.06 0.00 0.02 0.32 2.07 -1.12 -1.99 116.25 115.62 2xdi h VAL 103 Ca -0.28 -0.93 -0.35 0.00 0.82 0.00 0.00 66.70 65.96 2xdi h VAL 103 Cb 2.02 1.82 -0.06 0.00 -1.52 0.00 0.00 31.29 33.56 2xdi h VAL 103 CO 0.14 0.00 -2.17 0.18 0.02 0.00 0.00 177.57 175.74 2xdi n LEU 104 N -2.90 1.37 -1.74 2.57 4.77 0.17 -4.08 117.00 117.16 2xdi n LEU 104 Ca 0.03 0.11 0.07 0.00 -0.03 0.00 0.00 56.01 56.19 2xdi n LEU 104 Cb 0.52 -0.19 0.37 0.00 -2.33 0.00 0.00 43.42 41.79 2xdi n LEU 104 CO 0.35 0.64 0.82 0.18 -1.33 0.00 0.00 177.39 178.05 2xdi n LEU 105 N -3.07 5.23 0.00 2.23 4.77 -0.41 -4.63 117.00 121.12 2xdi n LEU 105 Ca -0.32 -2.65 0.00 0.00 -0.03 0.00 0.00 56.01 53.01 2xdi n LEU 105 Cb 1.07 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 2xdi n LEU 105 CO 0.40 0.63 0.49 1.17 -1.33 0.00 0.00 177.39 178.74 2xdi n LYS 106 N 0.66 0.00 0.00 3.23 4.81 -0.75 -4.81 118.16 121.31 2xdi n LYS 106 Ca 0.25 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 2xdi n LYS 106 Cb 1.08 -1.48 0.00 0.00 0.02 0.00 0.00 35.03 34.65 2xdi n LYS 106 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2xdi n SER 107 N -2.26 0.00 0.00 3.14 2.88 -1.26 -5.09 113.62 111.03 2xdi n SER 107 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2xdi n SER 107 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2xdi n SER 107 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91