#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xdi n SER 5 N 0.00 3.88 -4.78 2.61 7.64 -1.26 -5.07 113.62 116.65 2xdi n SER 5 Ca 0.00 -3.35 -0.35 0.00 1.01 0.00 0.00 58.87 56.18 2xdi n SER 5 Cb 0.00 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 2xdi n SER 5 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2xdi s PRO 6 N -2.15 3.38 0.06 1.43 0.04 -1.26 -4.93 135.00 131.57 2xdi s PRO 6 Ca 0.34 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.63 2xdi s PRO 6 Cb 0.07 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.50 2xdi s PRO 6 CO -0.05 -0.82 1.85 -0.47 0.04 0.00 0.00 177.00 177.55 2xdi s TYR 7 N -1.86 1.77 -0.99 0.56 5.04 -1.26 -3.04 117.35 117.58 2xdi s TYR 7 Ca 0.71 -0.16 -0.10 0.00 -2.44 0.00 0.00 57.07 55.08 2xdi s TYR 7 Cb -0.22 -4.16 -0.02 0.00 0.35 0.00 0.00 41.96 37.91 2xdi s TYR 7 CO 0.27 -4.96 0.78 0.43 -1.34 0.00 0.00 175.55 170.73 2xdi n SER 8 N 6.66 -6.14 0.01 4.32 7.64 -1.26 -4.89 113.62 119.95 2xdi n SER 8 Ca 0.18 -0.72 -0.12 0.00 1.01 0.00 0.00 58.87 59.22 2xdi n SER 8 Cb 0.40 -4.01 -0.06 0.00 -1.01 0.00 0.00 64.21 59.53 2xdi n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2xdi h ALA 9 N 0.60 0.07 -5.99 -0.43 0.00 -1.94 -3.46 119.26 108.11 2xdi h ALA 9 Ca -0.49 -0.04 -0.41 0.00 0.00 0.00 0.00 54.91 53.97 2xdi h ALA 9 Cb 1.27 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 19.12 2xdi h ALA 9 CO 0.42 -0.41 -0.74 0.00 0.00 0.00 0.00 179.25 178.52 2xdi n ALA 10 N -2.14 -1.54 -1.15 0.00 0.00 -1.26 -4.83 120.51 109.59 2xdi n ALA 10 Ca -0.06 0.17 -0.18 0.00 0.00 0.00 0.00 53.44 53.37 2xdi n ALA 10 Cb 0.06 -4.12 -0.13 0.00 0.00 0.00 0.00 19.45 15.26 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 -4.65 2.28 -1.16 0.00 0.00 -1.26 -4.44 117.12 107.89 2xdi n MET 11 Ca -0.08 -1.43 -0.21 0.00 0.00 0.00 0.00 57.70 55.98 2xdi n MET 11 Cb 0.59 -2.11 0.17 0.00 0.00 0.00 0.00 33.22 31.88 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 2.22 5.39 -1.78 -5.12 0.00 -1.26 -4.78 120.51 115.19 2xdi n ALA 12 Ca 0.47 -3.02 -0.19 0.00 0.00 0.00 0.00 53.44 50.70 2xdi n ALA 12 Cb 0.77 -1.31 -0.07 0.00 0.00 0.00 0.00 19.45 18.84 2xdi n ALA 12 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2xdi s GLU 13 N -3.34 1.89 -1.30 0.00 -1.05 -1.26 -3.21 118.70 110.43 2xdi s GLU 13 Ca 0.55 -0.13 -0.07 0.00 -0.15 0.00 0.00 54.97 55.17 2xdi s GLU 13 Cb 0.47 -4.96 0.01 0.00 -0.44 0.00 0.00 34.13 29.20 2xdi s GLU 13 CO 0.07 -4.31 1.13 0.94 0.95 0.00 0.00 175.26 174.04 2xdi n GLN 14 N 8.63 -7.57 0.00 -4.83 7.27 -1.26 -4.86 117.38 114.76 2xdi n GLN 14 Ca 0.44 0.82 0.00 0.00 0.07 0.00 0.00 57.00 58.32 2xdi n GLN 14 Cb 0.45 -5.81 0.00 0.00 2.41 0.00 0.00 30.24 27.29 2xdi n GLN 14 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 2xdi n ARG 15 N -4.75 0.54 0.00 3.69 0.63 -1.20 -4.73 116.66 110.84 2xdi n ARG 15 Ca -0.05 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.92 2xdi n ARG 15 Cb 0.58 -0.65 0.17 0.00 0.45 0.00 0.00 32.46 33.01 2xdi n ARG 15 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 2xdi n HIS 16 N -1.41 0.00 0.16 -0.14 -0.00 -1.26 -1.48 115.22 111.09 2xdi n HIS 16 Ca 0.00 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.26 2xdi n HIS 16 Cb 0.15 -0.44 0.08 0.00 -0.12 0.00 0.00 29.99 29.66 2xdi n HIS 16 CO 0.00 0.00 0.00 -0.56 0.46 0.00 0.00 176.34 176.24 2xdi h GLN 17 N 0.00 0.00 0.00 1.57 3.07 -1.90 -3.10 115.11 114.75 2xdi h GLN 17 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2xdi h GLN 17 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.67 2xdi h GLN 17 CO 0.00 0.17 0.00 1.05 0.09 0.00 0.00 178.83 180.14 2xdi h GLU 18 N 0.00 0.00 0.14 0.06 -0.00 -1.59 -2.49 114.58 110.70 2xdi h GLU 18 Ca -0.01 0.00 -0.29 0.00 -0.00 0.00 0.00 59.36 59.05 2xdi h GLU 18 Cb 1.16 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 29.93 2xdi h GLU 18 CO 0.02 0.00 -1.26 2.35 -0.00 0.00 0.00 179.01 180.13 2xdi h TRP 19 N 0.00 0.84 -0.14 2.06 -0.00 -1.66 -2.57 115.95 114.49 2xdi h TRP 19 Ca 0.00 -0.56 -0.18 0.00 -0.00 0.00 0.00 58.89 58.16 2xdi h TRP 19 Cb 0.59 -0.06 -0.00 0.00 -0.00 0.00 0.00 29.16 29.69 2xdi h TRP 19 CO 0.00 1.41 -0.64 -0.07 -0.00 0.00 0.00 178.44 179.14 2xdi h LEU 20 N 0.20 0.60 -1.19 0.65 3.38 -1.62 -2.10 115.31 115.23 2xdi h LEU 20 Ca -0.18 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.36 2xdi h LEU 20 Cb 1.94 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.50 2xdi h LEU 20 CO 0.23 1.09 -0.23 -0.09 0.09 0.00 0.00 178.44 179.52 2xdi h ARG 21 N 0.38 0.27 0.05 1.13 9.65 -1.49 0.75 114.38 125.12 2xdi h ARG 21 Ca -0.01 -0.09 -0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2xdi h ARG 21 Cb 1.21 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.76 2xdi h ARG 21 CO 0.12 0.50 -0.02 0.74 2.80 0.00 0.00 179.97 184.10 2xdi h PHE 22 N 0.25 -0.06 -0.70 2.20 0.05 -1.28 1.49 116.94 118.90 2xdi h PHE 22 Ca 0.04 -0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.83 2xdi h PHE 22 Cb 0.55 0.02 -0.03 0.00 2.00 0.00 0.00 35.95 38.49 2xdi h PHE 22 CO 0.01 0.53 0.43 -0.39 -0.18 0.00 0.00 178.31 178.71 2xdi h VAL 23 N -0.73 1.20 -0.03 -0.55 -1.51 -1.24 0.42 116.25 113.81 2xdi h VAL 23 Ca -0.01 -0.43 -0.12 0.00 -1.23 0.00 0.00 66.70 64.92 2xdi h VAL 23 Cb 0.62 0.23 -0.02 0.00 -2.13 0.00 0.00 31.29 29.99 2xdi h VAL 23 CO 0.01 0.20 -0.53 -0.78 -1.23 0.00 0.00 177.57 175.24 2xdi h ASP 24 N 0.95 0.08 0.10 4.19 3.58 0.53 0.54 116.42 126.39 2xdi h ASP 24 Ca 0.25 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 2xdi h ASP 24 Cb -0.04 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2xdi h ASP 24 CO -0.05 0.60 -0.05 0.25 -2.88 0.00 0.00 179.24 177.11 2xdi h LEU 25 N 0.06 -0.12 0.07 2.28 5.85 0.33 0.27 115.31 124.04 2xdi h LEU 25 Ca -0.00 -0.39 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 2xdi h LEU 25 Cb 0.96 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2xdi h LEU 25 CO 0.07 0.36 -0.03 0.25 -0.34 0.00 0.00 178.44 178.75 2xdi h LEU 26 N -0.63 -0.07 -0.78 2.25 5.85 -0.13 -0.73 115.31 121.07 2xdi h LEU 26 Ca -0.01 -0.06 0.16 0.00 0.84 0.00 0.00 57.88 58.80 2xdi h LEU 26 Cb 0.50 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 41.45 2xdi h LEU 26 CO 0.02 0.01 0.31 0.50 -0.34 0.00 0.00 178.44 178.95 2xdi h LYS 27 N -0.16 0.41 -0.06 1.25 3.11 0.10 1.57 116.57 122.79 2xdi h LYS 27 Ca -0.01 -0.02 0.02 0.00 -2.81 0.00 0.00 60.65 57.82 2xdi h LYS 27 Cb 0.13 -0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.27 2xdi h LYS 27 CO 0.01 0.27 0.05 -0.97 -2.81 0.00 0.00 179.45 176.01 2xdi h ASN 28 N 0.43 0.00 -0.03 4.20 -1.24 0.45 -1.52 115.58 117.86 2xdi h ASN 28 Ca 0.44 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.44 2xdi h ASN 28 Cb 0.71 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.76 2xdi h ASN 28 CO -0.44 0.00 -0.03 0.00 -1.29 0.00 0.00 177.43 175.67 2xdi h ALA 29 N 1.96 0.04 0.00 1.57 0.00 0.37 -2.42 119.26 120.78 2xdi h ALA 29 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2xdi h ALA 29 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2xdi h ALA 29 CO -0.00 -0.19 0.00 1.88 0.00 0.00 0.00 179.25 180.94 2xdi h TYR 30 N -0.39 0.00 0.23 0.00 -1.99 -0.54 0.22 116.97 114.51 2xdi h TYR 30 Ca 0.00 0.00 -0.33 0.00 2.00 0.00 0.00 58.73 60.40 2xdi h TYR 30 Cb 0.52 0.00 0.04 0.00 2.00 0.00 0.00 36.73 39.29 2xdi h TYR 30 CO 0.09 0.00 -1.44 0.37 -0.00 0.00 0.00 178.16 177.18 2xdi h GLN 31 N 0.00 0.55 -0.00 4.88 5.75 -1.04 -3.27 115.11 121.98 2xdi h GLN 31 Ca 0.00 -0.90 0.00 0.00 -0.15 0.00 0.00 58.65 57.60 2xdi h GLN 31 Cb 0.20 0.33 0.00 0.00 1.07 0.00 0.00 27.48 29.08 2xdi h GLN 31 CO 0.00 1.43 -0.52 -1.71 -2.65 0.00 0.00 178.83 175.38 2xdi n ASN 32 N -3.72 0.56 0.00 -0.69 2.85 -0.90 -4.92 115.26 108.43 2xdi n ASN 32 Ca -0.16 -0.33 0.00 0.00 -0.11 0.00 0.00 54.58 53.98 2xdi n ASN 32 Cb 1.09 0.29 0.00 0.00 1.24 0.00 0.00 39.78 42.40 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 -1.46 -4.40 -0.90 1.20 2.03 0.72 -4.82 116.55 108.91 2xdi n ASP 33 Ca 0.06 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.42 2xdi n ASP 33 Cb 0.34 -2.26 0.18 0.00 -0.72 0.00 0.00 41.12 38.66 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 2.58 -0.05 -2.67 -0.00 -1.19 -3.99 117.00 111.67 2xdi n LEU 34 Ca 0.00 -1.30 0.13 0.00 -0.00 0.00 0.00 56.01 54.84 2xdi n LEU 34 Cb 0.28 -0.39 0.75 0.00 -0.00 0.00 0.00 43.42 44.05 2xdi n LEU 34 CO 0.00 0.48 0.98 0.00 -0.00 0.00 0.00 177.39 178.85 2xdi n HIS 35 N 0.49 0.01 -0.36 1.47 1.44 -1.25 -4.21 115.22 112.80 2xdi n HIS 35 Ca 0.13 -0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.86 2xdi n HIS 35 Cb 0.49 0.00 0.09 0.00 0.12 0.00 0.00 29.99 30.69 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 0.20 -1.16 -0.61 2.39 3.38 -1.93 1.81 115.31 119.40 2xdi h LEU 36 Ca 0.00 0.30 -0.13 0.00 0.09 0.00 0.00 57.88 58.14 2xdi h LEU 36 Cb 0.04 0.68 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2xdi h LEU 36 CO 0.00 -0.31 -0.31 1.55 0.09 0.00 0.00 178.44 179.46 2xdi h PRO 37 N -0.00 0.77 0.00 1.13 0.13 -1.95 -2.29 132.00 129.79 2xdi h PRO 37 Ca 0.41 -0.35 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 2xdi h PRO 37 Cb 0.66 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.78 2xdi h PRO 37 CO -1.00 0.98 -0.07 1.25 -0.23 0.00 0.00 178.00 178.93 2xdi h LEU 38 N 0.65 0.00 -0.12 1.56 7.12 -0.08 -0.72 115.31 123.72 2xdi h LEU 38 Ca 0.07 0.00 -0.14 0.00 0.13 0.00 0.00 57.88 57.95 2xdi h LEU 38 Cb 0.84 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.98 2xdi h LEU 38 CO 0.07 0.07 -0.45 0.25 -0.13 0.00 0.00 178.44 178.24 2xdi h LEU 39 N 0.00 0.61 -0.02 2.25 5.85 0.30 0.35 115.31 124.65 2xdi h LEU 39 Ca -0.00 -0.62 -0.26 0.00 0.84 0.00 0.00 57.88 57.84 2xdi h LEU 39 Cb 0.68 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 41.54 2xdi h LEU 39 CO 0.01 1.12 -1.10 0.78 -0.34 0.00 0.00 178.44 178.91 2xdi h ASN 40 N 0.12 0.60 0.56 1.25 4.21 -1.37 1.94 115.58 122.89 2xdi h ASN 40 Ca -0.02 -0.54 -0.10 0.00 1.21 0.00 0.00 56.30 56.84 2xdi h ASN 40 Cb 1.09 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 38.09 2xdi h ASN 40 CO 0.10 1.37 -0.49 0.25 -1.29 0.00 0.00 177.43 177.36 2xdi h LEU 41 N 0.20 0.00 0.00 1.61 5.85 -1.16 -3.16 115.31 118.65 2xdi h LEU 41 Ca -0.12 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.45 2xdi h LEU 41 Cb 1.77 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.78 2xdi h LEU 41 CO 0.19 0.49 -2.08 0.80 -0.34 0.00 0.00 178.44 177.51 2xdi n MET 42 N -3.86 0.67 -4.29 1.25 1.56 0.12 -4.95 117.12 107.62 2xdi n MET 42 Ca -0.01 -0.10 -0.18 0.00 -0.27 0.00 0.00 57.70 57.14 2xdi n MET 42 Cb 0.52 -1.55 -0.15 0.00 2.15 0.00 0.00 33.22 34.19 2xdi n MET 42 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 2xdi s LEU 43 N -4.97 1.88 0.00 -0.89 1.43 0.66 -5.02 118.68 111.77 2xdi s LEU 43 Ca -0.08 -0.15 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 2xdi s LEU 43 Cb 0.11 -0.43 0.00 0.00 0.03 0.00 0.00 46.19 45.90 2xdi s LEU 43 CO 0.87 0.07 0.00 0.35 0.23 0.00 0.00 176.35 177.87 2xdi n THR 44 N 3.13 0.00 0.03 5.49 -2.24 -1.26 -3.87 114.28 115.55 2xdi n THR 44 Ca -0.16 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.43 2xdi n THR 44 Cb 0.56 -0.92 -0.13 0.00 -2.10 0.00 0.00 70.33 67.74 2xdi n THR 44 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2xdi h PRO 45 N 0.00 0.34 0.00 -0.78 0.13 -1.97 -3.08 132.00 126.63 2xdi h PRO 45 Ca 0.00 -0.46 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2xdi h PRO 45 Cb 0.00 0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.29 2xdi h PRO 45 CO 0.00 1.17 -0.00 0.22 -0.23 0.00 0.00 178.00 179.16 2xdi h ASP 46 N -0.27 0.00 -0.00 1.44 3.58 -1.98 -0.95 116.42 118.24 2xdi h ASP 46 Ca -0.11 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.32 2xdi h ASP 46 Cb 1.47 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.52 2xdi h ASP 46 CO 0.13 0.00 -0.07 -0.33 -2.88 0.00 0.00 179.24 176.09 2xdi h GLU 47 N 0.00 0.05 -0.77 0.28 4.39 -1.92 0.14 114.58 116.75 2xdi h GLU 47 Ca -0.00 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 2xdi h GLU 47 Cb 0.04 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.67 2xdi h GLU 47 CO 0.00 0.81 0.39 -0.09 -1.16 0.00 0.00 179.01 178.97 2xdi h ARG 48 N -0.68 1.10 -0.12 2.33 2.43 -1.27 2.14 114.38 120.31 2xdi h ARG 48 Ca -0.01 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 58.99 2xdi h ARG 48 Cb 0.84 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.18 2xdi h ARG 48 CO 0.01 0.84 -0.01 1.49 -1.51 0.00 0.00 179.97 180.79 2xdi h GLU 49 N 1.08 0.22 -0.03 0.20 4.57 -1.25 -2.07 114.58 117.31 2xdi h GLU 49 Ca 0.27 -0.08 -0.13 0.00 -1.18 0.00 0.00 59.36 58.25 2xdi h GLU 49 Cb 0.08 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 2xdi h GLU 49 CO -0.04 0.49 -0.56 0.00 -1.18 0.00 0.00 179.01 177.72 2xdi h ALA 50 N 0.72 1.01 -0.86 2.92 0.00 -0.36 -1.95 119.26 120.74 2xdi h ALA 50 Ca 0.03 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2xdi h ALA 50 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2xdi h ALA 50 CO 0.01 0.71 0.00 -0.11 0.00 0.00 0.00 179.25 179.85 2xdi n LEU 51 N -3.88 0.17 -0.37 0.00 0.00 0.72 -0.93 117.00 112.71 2xdi n LEU 51 Ca -0.02 0.76 0.37 0.00 0.00 0.00 0.00 56.01 57.13 2xdi n LEU 51 Cb 0.58 -0.36 0.76 0.00 0.00 0.00 0.00 43.42 44.40 2xdi n LEU 51 CO 0.42 -0.36 1.35 1.23 0.00 0.00 0.00 177.39 180.03 2xdi h GLY 52 N 0.00 0.00 1.04 -3.96 0.00 -1.48 0.94 103.07 99.60 2xdi h GLY 52 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2xdi h GLY 52 CO 0.00 0.00 0.18 -0.84 0.00 0.00 0.00 176.54 175.88 2xdi h THR 53 N 0.00 1.26 -0.04 4.70 2.02 -0.99 -2.36 112.91 117.50 2xdi h THR 53 Ca 0.61 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 66.88 2xdi h THR 53 Cb 2.48 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 69.48 2xdi h THR 53 CO -0.01 0.35 0.02 0.03 0.37 0.00 0.00 175.52 176.28 2xdi h ARG 54 N 0.97 0.06 -0.89 6.66 -0.00 0.28 1.24 114.38 122.69 2xdi h ARG 54 Ca 0.21 -0.01 0.20 0.00 -0.50 0.00 0.00 59.98 59.88 2xdi h ARG 54 Cb 0.34 -0.01 -0.06 0.00 0.00 0.00 0.00 29.97 30.23 2xdi h ARG 54 CO -0.00 0.15 0.59 0.28 0.00 0.00 0.00 179.97 180.99 2xdi h VAL 55 N -0.05 0.68 0.09 2.04 2.07 -1.30 0.49 116.25 120.27 2xdi h VAL 55 Ca 0.01 -0.13 -0.22 0.00 0.82 0.00 0.00 66.70 67.18 2xdi h VAL 55 Cb 0.11 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2xdi h VAL 55 CO -0.00 0.07 -1.13 -0.09 0.02 0.00 0.00 177.57 176.44 2xdi h ARG 56 N 0.39 0.19 -0.57 1.57 2.43 -0.81 -2.57 114.38 115.02 2xdi h ARG 56 Ca 0.46 -0.32 0.10 0.00 -0.81 0.00 0.00 59.98 59.41 2xdi h ARG 56 Cb 1.17 0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 30.76 2xdi h ARG 56 CO -0.17 1.16 0.14 0.97 -1.51 0.00 0.00 179.97 180.56 2xdi h ILE 57 N -0.49 0.69 -0.17 1.20 2.10 0.24 0.27 117.51 121.35 2xdi h ILE 57 Ca -0.25 -0.10 -0.07 0.00 1.08 0.00 0.00 64.86 65.53 2xdi h ILE 57 Cb 1.59 0.39 -0.00 0.00 -1.09 0.00 0.00 36.82 37.70 2xdi h ILE 57 CO 0.03 0.05 -0.17 0.58 -1.08 0.00 0.00 178.15 177.56 2xdi h VAL 58 N 0.28 1.34 0.16 2.19 2.07 -1.07 0.63 116.25 121.85 2xdi h VAL 58 Ca 0.29 -1.33 0.02 0.00 0.82 0.00 0.00 66.70 66.50 2xdi h VAL 58 Cb 0.41 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.97 2xdi h VAL 58 CO -0.36 0.40 -0.30 -0.08 0.02 0.00 0.00 177.57 177.24 2xdi h GLU 59 N 0.06 -0.53 -0.27 1.57 4.81 -0.91 -1.98 114.58 117.33 2xdi h GLU 59 Ca 0.03 0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.18 2xdi h GLU 59 Cb 0.70 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 2xdi h GLU 59 CO 0.04 -0.35 -0.32 0.93 -0.73 0.00 0.00 179.01 178.58 2xdi h GLU 60 N -0.55 0.56 -0.15 1.92 3.07 -0.52 -2.31 114.58 116.60 2xdi h GLU 60 Ca 0.02 -0.25 0.02 0.00 -0.50 0.00 0.00 59.36 58.65 2xdi h GLU 60 Cb 0.56 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.43 2xdi h GLU 60 CO -0.15 0.81 -0.17 1.25 -1.40 0.00 0.00 179.01 179.35 2xdi h LEU 61 N 0.48 -0.59 -1.58 1.33 5.85 0.10 2.05 115.31 122.95 2xdi h LEU 61 Ca 0.06 0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.92 2xdi h LEU 61 Cb 0.79 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 2xdi h LEU 61 CO 0.06 -0.12 0.38 -0.07 -0.34 0.00 0.00 178.44 178.35 2xdi h LEU 62 N -0.11 0.44 -1.35 2.25 3.38 -1.44 0.11 115.31 118.59 2xdi h LEU 62 Ca 0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 2xdi h LEU 62 Cb 0.18 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2xdi h LEU 62 CO -0.20 0.29 -0.08 -0.09 0.09 0.00 0.00 178.44 178.45 2xdi h ARG 63 N 0.51 0.34 -5.77 1.13 9.65 0.41 -3.47 114.38 117.18 2xdi h ARG 63 Ca 0.25 -0.07 -0.32 0.00 -1.10 0.00 0.00 59.98 58.73 2xdi h ARG 63 Cb 0.33 -0.05 0.15 0.00 -1.39 0.00 0.00 29.97 29.01 2xdi h ARG 63 CO -0.07 0.44 -0.88 0.41 2.80 0.00 0.00 179.97 182.67 2xdi n GLY 64 N -0.89 -1.10 0.16 2.80 0.00 0.65 -4.91 105.19 101.90 2xdi n GLY 64 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.55 2xdi n GLY 64 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2xdi n GLU 65 N -3.59 0.00 -1.88 1.61 0.28 -1.25 -4.89 120.64 110.91 2xdi n GLU 65 Ca -0.08 -0.52 -0.36 0.00 -0.16 0.00 0.00 57.16 56.04 2xdi n GLU 65 Cb 0.61 -0.39 0.04 0.00 1.43 0.00 0.00 31.44 33.12 2xdi n GLU 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2xdi n MET 66 N 0.00 2.89 -1.37 3.44 0.00 -1.26 -4.81 117.12 116.01 2xdi n MET 66 Ca 0.00 -3.66 -0.13 0.00 0.00 0.00 0.00 57.70 53.92 2xdi n MET 66 Cb 0.55 -2.27 -0.05 0.00 0.00 0.00 0.00 33.22 31.44 2xdi n MET 66 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2xdi n SER 67 N -0.62 -5.38 -0.39 3.17 7.64 -1.26 -4.79 113.62 111.98 2xdi n SER 67 Ca 0.53 0.32 0.38 0.00 1.01 0.00 0.00 58.87 61.11 2xdi n SER 67 Cb 0.43 -4.01 0.68 0.00 -1.01 0.00 0.00 64.21 60.30 2xdi n SER 67 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2xdi h GLN 68 N 0.04 0.00 0.00 1.43 4.15 -1.90 1.45 115.11 120.27 2xdi h GLN 68 Ca -0.26 0.00 -0.28 0.00 0.77 0.00 0.00 58.65 58.88 2xdi h GLN 68 Cb 1.11 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.76 2xdi h GLN 68 CO 0.38 0.00 -1.67 0.54 -1.93 0.00 0.00 178.83 176.15 2xdi n ARG 69 N -3.73 0.63 -0.19 1.69 1.74 -1.26 -4.01 116.66 111.53 2xdi n ARG 69 Ca 0.30 0.30 0.12 0.00 -0.77 0.00 0.00 57.85 57.80 2xdi n ARG 69 Cb 1.58 -1.80 0.22 0.00 -1.02 0.00 0.00 32.46 31.44 2xdi n ARG 69 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2xdi n GLU 70 N -3.03 2.53 -1.98 5.56 2.13 0.41 -4.34 120.64 121.92 2xdi n GLU 70 Ca -0.16 -2.32 -0.24 0.00 0.66 0.00 0.00 57.16 55.11 2xdi n GLU 70 Cb 1.03 -1.52 0.02 0.00 0.27 0.00 0.00 31.44 31.25 2xdi n GLU 70 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2xdi n LEU 71 N 1.52 4.97 0.03 4.31 7.94 0.32 -4.66 117.00 131.43 2xdi n LEU 71 Ca 0.20 -4.72 0.00 0.00 -1.11 0.00 0.00 56.01 50.37 2xdi n LEU 71 Cb 0.61 -0.36 0.00 0.00 0.53 0.00 0.00 43.42 44.20 2xdi n LEU 71 CO 0.16 2.08 -0.23 0.29 -1.11 0.00 0.00 177.39 178.58 2xdi n LYS 72 N -0.72 0.00 0.00 1.96 5.02 -1.26 -4.69 118.16 118.46 2xdi n LYS 72 Ca 0.44 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.81 2xdi n LYS 72 Cb 0.96 -0.38 0.49 0.00 -0.02 0.00 0.00 35.03 36.08 2xdi n LYS 72 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2xdi n ASN 73 N -3.12 0.00 -0.51 4.39 0.23 -1.26 -0.08 115.26 114.90 2xdi n ASN 73 Ca 0.00 -1.21 0.06 0.00 -0.53 0.00 0.00 54.58 52.90 2xdi n ASN 73 Cb 0.23 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 38.09 2xdi n ASN 73 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 2xdi n GLU 74 N -0.80 2.67 0.00 -3.83 2.13 -1.26 -4.76 120.64 114.79 2xdi n GLU 74 Ca 0.12 -2.28 0.00 0.00 0.66 0.00 0.00 57.16 55.67 2xdi n GLU 74 Cb 0.06 -1.43 0.00 0.00 0.27 0.00 0.00 31.44 30.33 2xdi n GLU 74 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2xdi n PHE 75 N -0.30 -1.17 -1.92 4.31 3.01 -1.04 -4.99 117.46 115.36 2xdi n PHE 75 Ca 0.13 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.54 2xdi n PHE 75 Cb 0.57 0.26 -0.01 0.00 -0.01 0.00 0.00 39.48 40.29 2xdi n PHE 75 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2xdi n GLY 76 N -1.24 -0.10 3.24 1.37 0.00 0.88 -4.84 105.19 104.49 2xdi n GLY 76 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2xdi n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdi s ALA 77 N -1.90 -0.92 0.00 4.61 0.00 -1.26 -4.87 121.76 117.42 2xdi s ALA 77 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.21 2xdi s ALA 77 Cb 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 23.12 22.37 2xdi s ALA 77 CO 0.00 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.95 2xdi n GLY 78 N 3.69 2.35 1.79 0.00 0.00 -1.26 -4.79 105.19 106.97 2xdi n GLY 78 Ca -0.19 -0.29 -0.14 0.00 0.00 0.00 0.00 46.02 45.39 2xdi n GLY 78 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2xdi n ILE 79 N 0.00 2.56 0.00 -0.61 2.08 -1.26 -3.70 119.36 118.43 2xdi n ILE 79 Ca 0.00 -1.41 0.00 0.00 0.56 0.00 0.00 62.75 61.90 2xdi n ILE 79 Cb 0.00 -1.26 0.00 0.00 -0.75 0.00 0.00 39.64 37.63 2xdi n ILE 79 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2xdi n ALA 80 N 0.36 1.84 0.08 -1.39 0.00 -1.26 -4.61 120.51 115.53 2xdi n ALA 80 Ca 0.26 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.59 2xdi n ALA 80 Cb 0.64 0.22 -0.04 0.00 0.00 0.00 0.00 19.45 20.26 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 1.45 0.00 0.00 2.02 -1.98 -0.09 112.91 114.31 2xdi h THR 81 Ca 0.00 -2.59 -0.04 0.00 0.77 0.00 0.00 66.41 64.55 2xdi h THR 81 Cb 0.84 2.50 -0.01 0.00 -1.74 0.00 0.00 68.15 69.74 2xdi h THR 81 CO 0.00 0.76 -0.18 0.40 0.37 0.00 0.00 175.52 176.87 2xdi h ILE 82 N 0.17 1.04 0.00 3.11 2.04 -1.84 -2.82 117.51 119.21 2xdi h ILE 82 Ca -0.07 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.13 2xdi h ILE 82 Cb 1.60 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 39.02 2xdi h ILE 82 CO 0.16 0.18 -0.42 0.41 0.00 0.00 0.00 178.15 178.48 2xdi n THR 83 N -4.19 1.98 0.00 -0.27 -1.04 -1.18 -5.06 114.28 104.52 2xdi n THR 83 Ca -0.02 -2.84 0.00 0.00 -2.04 0.00 0.00 64.05 59.14 2xdi n THR 83 Cb 0.25 -0.16 0.00 0.00 -1.82 0.00 0.00 70.33 68.60 2xdi n THR 83 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2xdi n ARG 84 N -1.08 0.99 -1.51 -2.82 1.85 -0.05 -4.71 116.66 109.33 2xdi n ARG 84 Ca 0.17 0.00 -0.49 0.00 -1.00 0.00 0.00 57.85 56.53 2xdi n ARG 84 Cb 0.70 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 32.08 2xdi n ARG 84 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2xdi n GLY 85 N 0.00 -0.66 1.94 2.89 0.00 -1.26 -4.74 105.19 103.36 2xdi n GLY 85 Ca 0.00 0.46 -0.11 0.00 0.00 0.00 0.00 46.02 46.38 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 1.78 5.33 -2.71 1.61 2.88 -1.26 -4.70 113.62 116.56 2xdi n SER 86 Ca 0.16 -2.51 -0.22 0.00 -1.33 0.00 0.00 58.87 54.97 2xdi n SER 86 Cb 0.24 -1.36 -0.08 0.00 -0.75 0.00 0.00 64.21 62.26 2xdi n SER 86 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2xdi n ASN 87 N 2.23 5.96 -0.06 -3.46 2.85 -1.26 -4.44 115.26 117.07 2xdi n ASN 87 Ca 0.36 -2.40 -0.07 0.00 -0.11 0.00 0.00 54.58 52.36 2xdi n ASN 87 Cb 0.83 -1.29 -0.05 0.00 1.24 0.00 0.00 39.78 40.50 2xdi n ASN 87 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2xdi h SER 88 N 4.57 0.00 0.00 1.20 0.02 -1.99 -3.29 113.55 114.06 2xdi h SER 88 Ca 0.47 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2xdi h SER 88 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 2xdi h SER 88 CO 1.02 0.77 0.25 0.25 -1.14 0.00 0.00 176.83 177.98 2xdi h LEU 89 N -1.00 0.00 0.00 5.07 5.85 -1.95 1.04 115.31 124.32 2xdi h LEU 89 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2xdi h LEU 89 Cb 0.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2xdi h LEU 89 CO -0.02 0.00 0.00 0.29 -0.34 0.00 0.00 178.44 178.37 2xdi n LYS 90 N -2.47 0.70 -0.14 1.25 5.02 -1.24 -3.21 118.16 118.07 2xdi n LYS 90 Ca -0.02 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2xdi n LYS 90 Cb 0.29 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 2xdi n LYS 90 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2xdi n ALA 91 N -1.07 1.28 -2.83 7.82 0.00 0.35 -5.07 120.51 120.99 2xdi n ALA 91 Ca 0.18 -0.48 -0.06 0.00 0.00 0.00 0.00 53.44 53.08 2xdi n ALA 91 Cb 0.11 -0.10 0.01 0.00 0.00 0.00 0.00 19.45 19.47 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 0.00 -3.17 0.00 0.00 0.00 -0.51 -4.86 120.51 111.98 2xdi n ALA 92 Ca 0.00 0.87 -0.17 0.00 0.00 0.00 0.00 53.44 54.14 2xdi n ALA 92 Cb 0.54 -2.62 -0.11 0.00 0.00 0.00 0.00 19.45 17.27 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 2.45 0.38 -0.14 0.00 0.13 -1.88 -2.68 132.00 130.26 2xdi h PRO 93 Ca -0.02 -0.41 0.04 0.00 -0.87 0.00 0.00 66.00 64.74 2xdi h PRO 93 Cb 0.62 0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 2xdi h PRO 93 CO 0.16 1.09 0.35 0.28 -0.23 0.00 0.00 178.00 179.64 2xdi h VAL 94 N -0.15 0.15 -0.05 1.56 2.07 -1.92 0.34 116.25 118.25 2xdi h VAL 94 Ca -0.07 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2xdi h VAL 94 Cb 1.28 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2xdi h VAL 94 CO 0.11 0.00 -0.02 -0.08 0.02 0.00 0.00 177.57 177.60 2xdi h GLU 95 N 0.00 0.10 -0.03 1.57 4.57 -1.81 0.28 114.58 119.26 2xdi h GLU 95 Ca 0.07 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 2xdi h GLU 95 Cb 0.76 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.34 2xdi h GLU 95 CO -0.00 0.49 -0.02 1.25 -1.18 0.00 0.00 179.01 179.55 2xdi h LEU 96 N -0.29 0.06 -2.22 1.64 5.85 -0.49 -2.48 115.31 117.39 2xdi h LEU 96 Ca 0.01 -0.46 0.05 0.00 0.84 0.00 0.00 57.88 58.32 2xdi h LEU 96 Cb 0.46 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2xdi h LEU 96 CO 0.01 0.51 0.18 -0.09 -0.34 0.00 0.00 178.44 178.71 2xdi h ARG 97 N -0.38 0.00 -0.05 1.25 2.43 -0.70 -1.20 114.38 115.73 2xdi h ARG 97 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2xdi h ARG 97 Cb 0.49 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2xdi h ARG 97 CO 0.01 0.00 -0.01 1.96 -1.51 0.00 0.00 179.97 180.41 2xdi h GLN 98 N 0.00 0.10 -0.92 0.20 1.08 -0.00 -1.55 115.11 114.01 2xdi h GLN 98 Ca 0.08 -0.04 0.11 0.00 -1.45 0.00 0.00 58.65 57.35 2xdi h GLN 98 Cb 0.45 -0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.79 2xdi h GLN 98 CO -0.00 0.44 0.55 2.35 -0.95 0.00 0.00 178.83 181.23 2xdi h TRP 99 N -0.26 1.00 -0.61 2.96 7.01 -0.89 0.15 115.95 125.32 2xdi h TRP 99 Ca 0.01 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 60.98 2xdi h TRP 99 Cb 0.41 -0.31 -0.03 0.00 -2.10 0.00 0.00 29.16 27.13 2xdi h TRP 99 CO 0.05 0.40 0.14 -0.07 -2.79 0.00 0.00 178.44 176.17 2xdi h LEU 100 N 0.90 0.90 -0.58 0.65 3.38 -1.34 -2.52 115.31 116.70 2xdi h LEU 100 Ca 0.45 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.33 2xdi h LEU 100 Cb 0.43 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.87 2xdi h LEU 100 CO -0.26 0.88 0.20 -0.08 0.09 0.00 0.00 178.44 179.28 2xdi h GLU 101 N 0.91 0.37 0.18 1.13 4.57 0.32 1.40 114.58 123.46 2xdi h GLU 101 Ca 0.19 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.34 2xdi h GLU 101 Cb 0.34 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 2xdi h GLU 101 CO 0.00 0.24 -0.09 1.49 -1.18 0.00 0.00 179.01 179.48 2xdi h GLU 102 N 0.38 -0.23 0.00 1.92 4.81 -0.97 2.30 114.58 122.78 2xdi h GLU 102 Ca 0.29 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 2xdi h GLU 102 Cb 0.35 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.78 2xdi h GLU 102 CO -0.30 -0.14 0.00 0.28 -0.73 0.00 0.00 179.01 178.12 2xdi n VAL 103 N -5.19 0.81 -0.04 0.32 0.31 -0.82 -0.06 118.33 113.67 2xdi n VAL 103 Ca -0.09 0.17 -0.19 0.00 -0.01 0.00 0.00 64.34 64.22 2xdi n VAL 103 Cb 0.13 -1.05 -0.14 0.00 -0.91 0.00 0.00 33.84 31.87 2xdi n VAL 103 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2xdi n LEU 104 N -2.09 2.48 -1.85 7.52 4.77 0.48 -4.02 117.00 124.28 2xdi n LEU 104 Ca 0.03 0.12 0.07 0.00 -0.03 0.00 0.00 56.01 56.20 2xdi n LEU 104 Cb 0.24 -0.89 0.39 0.00 -2.33 0.00 0.00 43.42 40.84 2xdi n LEU 104 CO 0.20 0.83 0.86 0.00 -1.33 0.00 0.00 177.39 177.94 2xdi n LEU 105 N -3.36 5.58 0.00 2.23 -0.00 0.76 -4.78 117.00 117.44 2xdi n LEU 105 Ca -0.35 -2.83 0.00 0.00 -0.00 0.00 0.00 56.01 52.83 2xdi n LEU 105 Cb 1.04 -0.68 0.00 0.00 -0.00 0.00 0.00 43.42 43.78 2xdi n LEU 105 CO 0.39 0.63 0.00 1.17 -0.00 0.00 0.00 177.39 179.57 2xdi n LYS 106 N 0.64 0.00 -3.76 1.47 4.81 0.92 -4.91 118.16 117.33 2xdi n LYS 106 Ca 0.27 0.00 -0.19 0.00 -0.87 0.00 0.00 58.31 57.52 2xdi n LYS 106 Cb 1.16 -0.36 -0.05 0.00 0.02 0.00 0.00 35.03 35.80 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 0.00 1.21 0.00 3.14 2.88 -1.26 -5.07 113.62 114.52 2xdi n SER 107 Ca 0.00 -2.58 0.00 0.00 -1.33 0.00 0.00 58.87 54.96 2xdi n SER 107 Cb 0.00 0.74 0.00 0.00 -0.75 0.00 0.00 64.21 64.20 2xdi n SER 107 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14