#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e0g n LEU 2 N 0.00 0.18 -4.90 -3.43 4.77 -1.26 -5.00 117.00 107.36 2e0g n LEU 2 Ca 0.00 0.26 -0.21 0.00 -0.03 0.00 0.00 56.01 56.03 2e0g n LEU 2 Cb 0.00 0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 2e0g n LEU 2 CO 0.00 -0.70 0.05 -0.44 -1.33 0.00 0.00 177.39 174.97 2e0g s SER 3 N -5.03 5.04 0.13 -1.43 0.01 -1.26 -4.97 113.70 106.19 2e0g s SER 3 Ca 0.00 -0.80 -0.27 0.00 1.31 0.00 0.00 55.95 56.19 2e0g s SER 3 Cb 0.00 -0.37 -0.03 0.00 0.21 0.00 0.00 66.02 65.82 2e0g s SER 3 CO 0.00 -0.78 1.60 -0.07 0.41 0.00 0.00 173.24 174.40 2e0g h LEU 4 N 0.89 -1.10 -0.03 2.44 3.38 -2.00 -1.76 115.31 117.13 2e0g h LEU 4 Ca -0.40 0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.75 2e0g h LEU 4 Cb 1.27 0.46 -0.05 0.00 0.09 0.00 0.00 40.66 42.43 2e0g h LEU 4 CO 0.55 -0.39 -0.50 -0.25 0.09 0.00 0.00 178.44 177.95 2e0g h TRP 5 N -0.43 -1.47 -0.78 1.13 7.01 -1.96 -1.10 115.95 118.34 2e0g h TRP 5 Ca 0.09 0.05 0.13 0.00 2.11 0.00 0.00 58.89 61.27 2e0g h TRP 5 Cb 0.58 0.64 -0.14 0.00 -2.10 0.00 0.00 29.16 28.14 2e0g h TRP 5 CO -0.43 -0.52 -0.35 1.96 -2.79 0.00 0.00 178.44 176.30 2e0g h GLN 6 N -0.60 -0.08 -0.37 2.65 1.08 -1.89 0.13 115.11 116.03 2e0g h GLN 6 Ca 0.02 0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.29 2e0g h GLN 6 Cb 0.66 0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 28.04 2e0g h GLN 6 CO -0.35 -0.05 -0.08 0.37 -0.95 0.00 0.00 178.83 177.77 2e0g h GLN 7 N -0.08 0.02 -0.89 1.46 4.15 -0.69 -1.01 115.11 118.07 2e0g h GLN 7 Ca 0.29 -0.00 0.14 0.00 0.77 0.00 0.00 58.65 59.85 2e0g h GLN 7 Cb 0.57 -0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.17 2e0g h GLN 7 CO -0.83 0.01 0.49 0.00 -1.93 0.00 0.00 178.83 176.58 2e0g h LEU 9 N 0.73 -1.01 -0.82 0.00 3.38 -0.04 -1.07 115.31 116.47 2e0g h LEU 9 Ca 0.47 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.57 2e0g h LEU 9 Cb 0.61 0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.55 2e0g h LEU 9 CO -0.33 -0.68 0.46 0.00 0.09 0.00 0.00 178.44 177.98 2e0g h ALA 10 N -1.35 1.17 -0.72 1.53 0.00 -0.99 -0.81 119.26 118.09 2e0g h ALA 10 Ca -0.12 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2e0g h ALA 10 Cb 0.92 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 2e0g h ALA 10 CO 0.20 0.08 0.46 -0.09 0.00 0.00 0.00 179.25 179.90 2e0g h ARG 11 N 0.77 0.96 0.77 0.00 9.65 -0.46 0.19 114.38 126.25 2e0g h ARG 11 Ca 0.40 -0.07 -0.04 0.00 -1.10 0.00 0.00 59.98 59.17 2e0g h ARG 11 Cb 0.38 -0.21 0.01 0.00 -1.39 0.00 0.00 29.97 28.76 2e0g h ARG 11 CO -0.26 0.65 -0.37 1.25 2.80 0.00 0.00 179.97 184.04 2e0g h LEU 12 N 0.98 -0.88 -1.66 3.80 7.12 0.20 0.35 115.31 125.22 2e0g h LEU 12 Ca 0.26 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.29 2e0g h LEU 12 Cb -0.08 0.23 0.00 0.00 -0.53 0.00 0.00 40.66 40.27 2e0g h LEU 12 CO -0.05 -0.52 0.00 -0.61 -0.13 0.00 0.00 178.44 177.13 2e0g h GLN 13 N -1.24 0.00 0.06 1.25 5.75 -1.32 -1.96 115.11 117.66 2e0g h GLN 13 Ca -0.11 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.22 2e0g h GLN 13 Cb 0.80 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.35 2e0g h GLN 13 CO 0.17 0.00 -0.88 0.22 -2.65 0.00 0.00 178.83 175.70 2e0g h ASP 14 N 0.00 0.21 0.36 -0.69 1.82 -0.38 -3.34 116.42 114.40 2e0g h ASP 14 Ca 0.00 -0.84 -0.05 0.00 -0.39 0.00 0.00 57.03 55.75 2e0g h ASP 14 Cb 0.23 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.17 2e0g h ASP 14 CO 0.00 1.38 -0.23 -0.08 -1.61 0.00 0.00 179.24 178.70 2e0g h GLU 15 N -0.66 0.00 -2.35 0.28 4.22 -0.03 -3.46 114.58 112.58 2e0g h GLU 15 Ca -0.20 0.00 0.12 0.00 0.08 0.00 0.00 59.36 59.36 2e0g h GLU 15 Cb 1.43 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.55 2e0g h GLU 15 CO 0.00 0.23 0.47 -0.51 -2.18 0.00 0.00 179.01 177.03 2e0g s LEU 16 N -7.89 -0.33 0.00 1.64 1.02 -0.76 -5.02 118.68 107.34 2e0g s LEU 16 Ca -0.03 -0.10 0.15 0.00 0.02 0.00 0.00 54.13 54.17 2e0g s LEU 16 Cb 0.14 2.10 0.74 0.00 0.02 0.00 0.00 46.19 49.19 2e0g s LEU 16 CO 0.67 -0.72 1.41 -0.81 0.02 0.00 0.00 176.35 176.92 2e0g n PRO 17 N -0.31 0.19 -1.53 1.29 -0.04 -1.26 -3.80 135.00 129.54 2e0g n PRO 17 Ca -0.09 0.16 -0.36 0.00 -0.04 0.00 0.00 63.50 63.17 2e0g n PRO 17 Cb 0.62 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.48 2e0g n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e0g n ALA 18 N -1.30 0.55 1.02 0.55 0.00 -1.26 -4.73 120.51 115.34 2e0g n ALA 18 Ca 0.07 -0.66 0.12 0.00 0.00 0.00 0.00 53.44 52.97 2e0g n ALA 18 Cb 0.12 -2.75 0.28 0.00 0.00 0.00 0.00 19.45 17.11 2e0g n ALA 18 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2e0g n THR 19 N 7.68 0.00 -0.33 0.00 -1.04 -1.26 -4.26 114.28 115.07 2e0g n THR 19 Ca 0.52 -0.01 0.11 0.00 -2.04 0.00 0.00 64.05 62.64 2e0g n THR 19 Cb 0.28 0.21 0.24 0.00 -1.82 0.00 0.00 70.33 69.25 2e0g n THR 19 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2e0g h GLU 20 N 0.07 0.02 -0.73 -2.82 4.39 -2.00 0.55 114.58 114.07 2e0g h GLU 20 Ca 0.00 -0.00 0.16 0.00 0.34 0.00 0.00 59.36 59.86 2e0g h GLU 20 Cb 0.50 -0.01 -0.11 0.00 -0.10 0.00 0.00 28.75 29.03 2e0g h GLU 20 CO 0.00 0.02 0.14 0.27 -1.16 0.00 0.00 179.01 178.28 2e0g h PHE 21 N 0.03 0.21 0.00 4.33 -0.00 -1.93 0.91 116.94 120.48 2e0g h PHE 21 Ca 0.54 0.04 0.00 0.00 -0.00 0.00 0.00 57.97 58.56 2e0g h PHE 21 Cb 1.05 0.02 0.00 0.00 -0.00 0.00 0.00 35.95 37.02 2e0g h PHE 21 CO -0.54 -0.12 0.00 1.03 -0.00 0.00 0.00 178.31 178.69 2e0g h SER 22 N 0.23 0.00 0.17 -0.68 0.87 -0.19 0.26 113.55 114.21 2e0g h SER 22 Ca 0.41 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.74 2e0g h SER 22 Cb 0.70 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.62 2e0g h SER 22 CO -0.53 0.00 -2.06 0.23 -0.53 0.00 0.00 176.83 173.94 2e0g n MET 23 N -2.91 0.67 -0.82 2.24 2.81 0.29 -3.31 117.12 116.08 2e0g n MET 23 Ca -0.03 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.81 2e0g n MET 23 Cb 0.06 -1.59 0.21 0.00 -0.71 0.00 0.00 33.22 31.19 2e0g n MET 23 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 2e0g n TRP 24 N -2.67 1.33 0.00 2.03 7.02 0.46 -4.58 117.44 121.04 2e0g n TRP 24 Ca -0.20 -1.55 0.00 0.00 -1.02 0.00 0.00 57.50 54.73 2e0g n TRP 24 Cb 0.94 -0.53 0.00 0.00 -2.42 0.00 0.00 31.31 29.30 2e0g n TRP 24 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2e0g n ILE 25 N -1.05 0.00 -0.02 -0.99 2.08 0.76 -4.80 119.36 115.34 2e0g n ILE 25 Ca 0.35 0.00 -0.14 0.00 0.56 0.00 0.00 62.75 63.52 2e0g n ILE 25 Cb 1.11 -0.00 -0.08 0.00 -0.75 0.00 0.00 39.64 39.91 2e0g n ILE 25 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2e0g h ARG 26 N 0.00 -0.51 0.00 0.38 2.47 -1.69 0.13 114.38 115.17 2e0g h ARG 26 Ca 0.00 0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 2e0g h ARG 26 Cb 0.00 0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.44 2e0g h ARG 26 CO 0.00 -0.34 0.00 -0.35 0.56 0.00 0.00 179.97 179.84 2e0g n PRO 27 N -5.43 0.02 -2.25 0.04 -0.04 -1.26 -4.77 135.00 121.31 2e0g n PRO 27 Ca -0.05 0.25 -0.26 0.00 -0.04 0.00 0.00 63.50 63.40 2e0g n PRO 27 Cb 0.37 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.44 2e0g n PRO 27 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2e0g s LEU 28 N -2.96 2.85 -0.21 1.53 1.43 0.46 -4.90 118.68 116.89 2e0g s LEU 28 Ca 0.07 0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.30 2e0g s LEU 28 Cb 0.09 -2.55 0.06 0.00 0.03 0.00 0.00 46.19 43.82 2e0g s LEU 28 CO 0.25 -1.97 0.03 -1.58 0.23 0.00 0.00 176.35 173.31 2e0g s GLN 29 N -5.38 0.79 -0.02 1.70 -0.44 -0.36 -4.94 119.66 111.02 2e0g s GLN 29 Ca 0.66 -0.54 -0.24 0.00 -2.50 0.00 0.00 55.36 52.74 2e0g s GLN 29 Cb -0.07 -2.17 -0.04 0.00 -1.64 0.00 0.00 33.01 29.08 2e0g s GLN 29 CO 0.47 -0.65 0.74 0.00 0.50 0.00 0.00 175.29 176.35 2e0g s ALA 30 N 1.78 3.34 -0.24 1.58 0.00 -1.26 -0.57 121.76 126.40 2e0g s ALA 30 Ca -0.01 0.22 -0.06 0.00 0.00 0.00 0.00 51.96 52.11 2e0g s ALA 30 Cb -0.17 -2.99 -0.02 0.00 0.00 0.00 0.00 23.12 19.94 2e0g s ALA 30 CO -0.09 -0.04 0.01 -2.00 0.00 0.00 0.00 175.76 173.65 2e0g s GLU 31 N 0.45 3.49 -0.32 0.00 2.12 -0.18 -4.92 118.70 119.34 2e0g s GLU 31 Ca 0.39 -0.57 -0.19 0.00 0.36 0.00 0.00 54.97 54.97 2e0g s GLU 31 Cb -0.19 -3.16 -0.01 0.00 0.26 0.00 0.00 34.13 31.02 2e0g s GLU 31 CO 0.21 -0.20 0.55 -0.51 -0.54 0.00 0.00 175.26 174.76 2e0g s LEU 32 N 1.54 4.21 -0.54 2.70 1.02 -1.26 -0.79 118.68 125.57 2e0g s LEU 32 Ca 0.06 0.22 0.02 0.00 0.02 0.00 0.00 54.13 54.45 2e0g s LEU 32 Cb -0.15 -2.67 0.44 0.00 0.02 0.00 0.00 46.19 43.83 2e0g s LEU 32 CO 0.00 -0.44 1.66 -0.24 0.02 0.00 0.00 176.35 177.34 2e0g n SER 33 N 5.76 6.44 0.00 2.29 2.88 -0.03 -4.92 113.62 126.04 2e0g n SER 33 Ca -0.03 -3.78 0.00 0.00 -1.33 0.00 0.00 58.87 53.73 2e0g n SER 33 Cb 0.49 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 63.23 2e0g n SER 33 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2e0g n ASP 34 N -0.75 0.00 -0.66 -3.46 -0.08 -1.26 -3.66 116.55 106.68 2e0g n ASP 34 Ca 0.53 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.81 2e0g n ASP 34 Cb 0.71 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.17 2e0g n ASP 34 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2e0g n ASN 35 N 2.54 0.12 -3.62 1.67 4.13 -1.26 -4.98 115.26 113.86 2e0g n ASN 35 Ca 0.00 -1.87 -0.26 0.00 1.68 0.00 0.00 54.58 54.13 2e0g n ASN 35 Cb 0.00 -0.17 -0.17 0.00 -1.54 0.00 0.00 39.78 37.90 2e0g n ASN 35 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2e0g s THR 36 N 0.00 -0.05 -0.75 3.41 2.01 -1.24 -1.61 115.64 117.41 2e0g s THR 36 Ca 0.05 -0.21 -0.18 0.00 0.31 0.00 0.00 61.69 61.66 2e0g s THR 36 Cb 0.06 -0.62 0.14 0.00 0.01 0.00 0.00 72.50 72.09 2e0g s THR 36 CO -0.02 -0.29 0.85 -0.22 -0.69 0.00 0.00 174.62 174.24 2e0g s LEU 37 N 2.12 5.65 0.50 4.42 0.20 0.14 -0.85 118.68 130.87 2e0g s LEU 37 Ca 0.02 -1.95 -0.11 0.00 0.69 0.00 0.00 54.13 52.79 2e0g s LEU 37 Cb -0.16 -2.31 -0.05 0.00 -0.43 0.00 0.00 46.19 43.24 2e0g s LEU 37 CO -0.10 -0.96 0.88 0.00 -0.29 0.00 0.00 176.35 175.88 2e0g s ALA 38 N 2.02 3.24 -0.12 5.97 0.00 0.03 -0.05 121.76 132.85 2e0g s ALA 38 Ca 0.19 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.99 2e0g s ALA 38 Cb -0.15 -2.86 0.02 0.00 0.00 0.00 0.00 23.12 20.14 2e0g s ALA 38 CO -0.02 -0.31 -0.13 -0.51 0.00 0.00 0.00 175.76 174.79 2e0g s LEU 39 N -4.44 1.56 -0.26 0.00 2.01 0.19 -1.02 118.68 116.73 2e0g s LEU 39 Ca 0.53 -0.41 -0.09 0.00 0.01 0.00 0.00 54.13 54.16 2e0g s LEU 39 Cb -0.10 -1.05 -0.04 0.00 0.01 0.00 0.00 46.19 45.01 2e0g s LEU 39 CO 0.40 -0.05 0.13 -0.31 1.01 0.00 0.00 176.35 177.53 2e0g s TYR 40 N 1.38 3.18 0.27 0.29 1.51 0.27 -0.07 117.35 124.18 2e0g s TYR 40 Ca 0.01 -0.08 0.10 0.00 -1.01 0.00 0.00 57.07 56.09 2e0g s TYR 40 Cb -0.13 -2.29 -0.05 0.00 -0.11 0.00 0.00 41.96 39.38 2e0g s TYR 40 CO -0.07 -0.19 -0.16 0.00 -1.11 0.00 0.00 175.55 174.02 2e0g s ALA 41 N 1.51 2.59 -0.85 3.71 0.00 0.18 -1.22 121.76 127.68 2e0g s ALA 41 Ca 0.06 -1.87 0.17 0.00 0.00 0.00 0.00 51.96 50.32 2e0g s ALA 41 Cb -0.15 -0.16 0.71 0.00 0.00 0.00 0.00 23.12 23.52 2e0g s ALA 41 CO 0.07 0.18 1.52 -0.35 0.00 0.00 0.00 175.76 177.18 2e0g n PRO 42 N -0.59 0.05 -3.85 0.00 -0.04 -1.26 0.49 135.00 129.80 2e0g n PRO 42 Ca -0.06 0.30 -0.04 0.00 -0.04 0.00 0.00 63.50 63.66 2e0g n PRO 42 Cb 0.61 -1.60 0.01 0.00 -0.04 0.00 0.00 33.50 32.48 2e0g n PRO 42 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2e0g s ASN 43 N -3.34 -0.03 0.17 3.54 6.03 -1.26 -4.84 114.94 115.21 2e0g s ASN 43 Ca 0.06 -0.71 -0.04 0.00 -1.03 0.00 0.00 52.86 51.14 2e0g s ASN 43 Cb 0.09 0.56 0.04 0.00 -3.03 0.00 0.00 41.25 38.92 2e0g s ASN 43 CO 0.29 -1.11 1.44 -0.09 -2.03 0.00 0.00 177.10 175.61 2e0g h ARG 44 N 2.00 0.53 -0.68 3.55 1.12 -1.94 -3.28 114.38 115.68 2e0g h ARG 44 Ca -0.28 -0.39 0.11 0.00 -1.11 0.00 0.00 59.98 58.31 2e0g h ARG 44 Cb 1.23 0.07 -0.12 0.00 -0.01 0.00 0.00 29.97 31.13 2e0g h ARG 44 CO 0.35 1.02 -0.38 0.74 -3.11 0.00 0.00 179.97 178.59 2e0g h PHE 45 N 0.38 -1.07 -0.30 2.20 0.04 -1.99 0.16 116.94 116.36 2e0g h PHE 45 Ca -0.02 0.08 0.05 0.00 2.80 0.00 0.00 57.97 60.89 2e0g h PHE 45 Cb 1.24 0.57 -0.05 0.00 2.20 0.00 0.00 35.95 39.91 2e0g h PHE 45 CO 0.05 -0.40 0.00 0.28 -0.60 0.00 0.00 178.31 177.64 2e0g h VAL 46 N -0.14 0.79 -0.23 -0.55 2.07 -1.99 -1.92 116.25 114.27 2e0g h VAL 46 Ca 0.24 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.78 2e0g h VAL 46 Cb 0.56 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 2e0g h VAL 46 CO -0.75 0.02 -0.44 -0.07 0.02 0.00 0.00 177.57 176.34 2e0g h LEU 47 N 0.09 -1.42 -0.28 2.57 3.38 -1.08 0.37 115.31 118.93 2e0g h LEU 47 Ca 0.14 0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.37 2e0g h LEU 47 Cb 0.19 0.59 -0.07 0.00 0.09 0.00 0.00 40.66 41.46 2e0g h LEU 47 CO -0.24 -0.41 -0.15 -0.78 0.09 0.00 0.00 178.44 176.94 2e0g h ASP 48 N -0.44 -0.51 0.45 -0.43 3.58 -1.00 0.27 116.42 118.33 2e0g h ASP 48 Ca 0.09 0.12 -0.01 0.00 0.42 0.00 0.00 57.03 57.65 2e0g h ASP 48 Cb 0.62 0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.93 2e0g h ASP 48 CO -0.47 -0.19 -0.38 -0.25 -2.88 0.00 0.00 179.24 175.07 2e0g h TRP 49 N -0.12 -1.03 -0.65 0.28 2.91 -0.55 -1.34 115.95 115.46 2e0g h TRP 49 Ca 0.15 0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.27 2e0g h TRP 49 Cb 0.35 0.39 -0.07 0.00 -0.51 0.00 0.00 29.16 29.31 2e0g h TRP 49 CO -0.34 -0.54 0.26 0.28 -1.03 0.00 0.00 178.44 177.07 2e0g h VAL 50 N -0.83 0.78 0.00 2.65 2.07 0.02 0.33 116.25 121.27 2e0g h VAL 50 Ca -0.04 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2e0g h VAL 50 Cb 0.72 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2e0g h VAL 50 CO -0.02 0.08 0.00 -1.14 0.02 0.00 0.00 177.57 176.51 2e0g n ARG 51 N -4.97 0.09 -0.06 1.57 0.63 0.91 -0.44 116.66 114.39 2e0g n ARG 51 Ca 0.10 0.44 -0.10 0.00 -0.92 0.00 0.00 57.85 57.37 2e0g n ARG 51 Cb 0.29 -1.71 -0.09 0.00 0.45 0.00 0.00 32.46 31.40 2e0g n ARG 51 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 2e0g h ASP 52 N 0.00 -0.01 0.00 6.15 1.82 0.83 -3.37 116.42 121.84 2e0g h ASP 52 Ca 0.00 -0.67 0.00 0.00 -0.39 0.00 0.00 57.03 55.97 2e0g h ASP 52 Cb 0.18 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.19 2e0g h ASP 52 CO 0.00 0.82 -0.57 2.29 -1.61 0.00 0.00 179.24 180.17 2e0g n LYS 53 N -4.68 0.30 -0.37 0.28 0.00 -1.08 -4.36 118.16 108.25 2e0g n LYS 53 Ca -0.07 0.12 -0.04 0.00 -0.00 0.00 0.00 58.31 58.32 2e0g n LYS 53 Cb 0.32 -1.01 -0.00 0.00 -0.00 0.00 0.00 35.03 34.34 2e0g n LYS 53 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 2e0g n TYR 54 N -3.64 -0.11 -0.08 5.58 9.36 0.42 -1.31 117.16 127.39 2e0g n TYR 54 Ca -0.08 1.17 -0.04 0.00 3.32 0.00 0.00 57.90 62.27 2e0g n TYR 54 Cb 0.29 -0.77 -0.03 0.00 -0.63 0.00 0.00 39.34 38.20 2e0g n TYR 54 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 2e0g h LEU 55 N 0.00 -0.63 -0.99 2.98 6.46 -1.50 0.33 115.31 121.97 2e0g h LEU 55 Ca 0.27 0.09 0.25 0.00 -0.12 0.00 0.00 57.88 58.37 2e0g h LEU 55 Cb 0.51 0.27 -0.18 0.00 -0.73 0.00 0.00 40.66 40.52 2e0g h LEU 55 CO -0.92 -0.11 -0.05 0.78 -0.62 0.00 0.00 178.44 177.52 2e0g h ASN 56 N -0.08 -0.61 0.59 1.25 -0.26 -1.40 0.35 115.58 115.42 2e0g h ASN 56 Ca 0.03 0.29 -0.03 0.00 -0.56 0.00 0.00 56.30 56.03 2e0g h ASN 56 Cb 0.17 0.52 0.01 0.00 -1.06 0.00 0.00 38.32 37.96 2e0g h ASN 56 CO -0.23 -0.35 -0.28 0.78 -1.06 0.00 0.00 177.43 176.29 2e0g h ASN 57 N 0.01 -0.67 0.05 5.81 2.35 -0.47 -1.64 115.58 121.01 2e0g h ASN 57 Ca 0.56 -0.03 0.03 0.00 -0.55 0.00 0.00 56.30 56.31 2e0g h ASN 57 Cb 1.09 0.17 -0.05 0.00 0.05 0.00 0.00 38.32 39.58 2e0g h ASN 57 CO -0.95 -0.38 -0.42 0.40 -1.65 0.00 0.00 177.43 174.43 2e0g h ILE 58 N -0.95 0.15 -0.19 2.81 1.08 0.19 -1.20 117.51 119.41 2e0g h ILE 58 Ca -0.08 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.43 2e0g h ILE 58 Cb 0.66 0.15 -0.07 0.00 -3.07 0.00 0.00 36.82 34.49 2e0g h ILE 58 CO 0.13 0.00 -0.46 0.78 -0.69 0.00 0.00 178.15 177.91 2e0g h ASN 59 N -0.61 -1.47 -1.01 1.72 -0.26 -0.48 0.29 115.58 113.76 2e0g h ASN 59 Ca 0.03 0.19 0.23 0.00 -0.56 0.00 0.00 56.30 56.19 2e0g h ASN 59 Cb 0.66 0.60 -0.11 0.00 -1.06 0.00 0.00 38.32 38.42 2e0g h ASN 59 CO -0.28 -0.43 0.62 1.23 -1.06 0.00 0.00 177.43 177.50 2e0g h GLY 60 N -0.49 1.65 0.49 2.83 0.00 -1.00 -1.28 103.07 105.28 2e0g h GLY 60 Ca 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 2e0g h GLY 60 CO -0.45 -0.14 -0.06 -2.00 0.00 0.00 0.00 176.54 173.89 2e0g h LEU 61 N 0.60 0.10 -0.51 3.11 6.46 0.16 -2.04 115.31 123.19 2e0g h LEU 61 Ca 0.60 -0.58 0.10 0.00 -0.12 0.00 0.00 57.88 57.88 2e0g h LEU 61 Cb 1.16 -0.03 -0.10 0.00 -0.73 0.00 0.00 40.66 40.96 2e0g h LEU 61 CO -0.38 0.66 -0.17 -0.07 -0.62 0.00 0.00 178.44 177.85 2e0g h LEU 62 N -0.46 -0.62 -0.24 2.25 4.07 0.58 0.69 115.31 121.58 2e0g h LEU 62 Ca 0.00 0.17 -0.03 0.00 0.08 0.00 0.00 57.88 58.10 2e0g h LEU 62 Cb 0.65 0.37 -0.01 0.00 1.08 0.00 0.00 40.66 42.75 2e0g h LEU 62 CO 0.01 -0.21 0.05 0.74 -1.08 0.00 0.00 178.44 177.95 2e0g h THR 63 N -0.05 1.22 0.00 0.22 2.02 -1.38 -1.60 112.91 113.34 2e0g h THR 63 Ca 0.24 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 2e0g h THR 63 Cb 0.43 1.23 -0.00 0.00 -1.74 0.00 0.00 68.15 68.07 2e0g h THR 63 CO -0.56 0.23 -0.01 -1.28 0.37 0.00 0.00 175.52 174.28 2e0g h SER 64 N 0.21 0.00 0.13 4.18 0.87 -0.53 0.28 113.55 118.69 2e0g h SER 64 Ca 0.08 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.44 2e0g h SER 64 Cb 0.30 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2e0g h SER 64 CO 0.00 0.01 -0.91 0.15 -0.53 0.00 0.00 176.83 175.55 2e0g h PHE 65 N 0.00 0.48 0.00 2.24 3.57 0.84 -3.45 116.94 120.62 2e0g h PHE 65 Ca -0.00 -0.35 0.00 0.00 3.53 0.00 0.00 57.97 61.15 2e0g h PHE 65 Cb 0.27 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.99 2e0g h PHE 65 CO 0.00 1.35 -0.25 0.00 -2.23 0.00 0.00 178.31 177.18 2e0g n GLY 67 N 1.88 -1.67 3.37 0.00 0.00 0.95 -4.61 105.19 105.11 2e0g n GLY 67 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2e0g n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e0g n ALA 68 N 0.27 0.00 0.00 4.61 0.00 -1.26 -4.68 120.51 119.45 2e0g n ALA 68 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2e0g n ALA 68 Cb 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 19.45 19.23 2e0g n ALA 68 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2e0g n ASP 69 N 0.00 3.74 -4.63 0.00 2.03 -1.26 -5.04 116.55 111.38 2e0g n ASP 69 Ca 0.00 -0.01 -0.29 0.00 0.52 0.00 0.00 54.79 55.01 2e0g n ASP 69 Cb 0.00 1.24 0.18 0.00 -0.72 0.00 0.00 41.12 41.83 2e0g n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2e0g s ALA 70 N -2.36 0.83 1.00 -1.67 0.00 -1.26 -5.02 121.76 113.28 2e0g s ALA 70 Ca -0.02 0.06 -0.00 0.00 0.00 0.00 0.00 51.96 52.00 2e0g s ALA 70 Cb 0.03 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.89 2e0g s ALA 70 CO 0.22 -2.97 0.00 -0.35 0.00 0.00 0.00 175.76 172.67 2e0g n PRO 71 N -4.32 -1.03 -4.24 0.00 -0.04 -1.26 -5.01 135.00 119.10 2e0g n PRO 71 Ca 0.07 -0.01 -0.20 0.00 -0.04 0.00 0.00 63.50 63.32 2e0g n PRO 71 Cb 0.54 -0.01 -0.12 0.00 -0.04 0.00 0.00 33.50 33.87 2e0g n PRO 71 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2e0g s GLN 72 N -3.01 0.94 -0.15 0.54 -2.07 -0.63 -4.97 119.66 110.31 2e0g s GLN 72 Ca 0.00 -0.99 -0.16 0.00 -1.82 0.00 0.00 55.36 52.39 2e0g s GLN 72 Cb -0.00 -1.02 -0.04 0.00 -1.09 0.00 0.00 33.01 30.85 2e0g s GLN 72 CO 0.00 0.24 0.40 -1.17 -1.32 0.00 0.00 175.29 173.44 2e0g s LEU 73 N -1.71 4.24 0.31 2.60 2.96 -1.26 0.29 118.68 126.11 2e0g s LEU 73 Ca 0.01 0.65 0.10 0.00 -0.22 0.00 0.00 54.13 54.67 2e0g s LEU 73 Cb -0.10 -2.55 -0.06 0.00 0.50 0.00 0.00 46.19 43.99 2e0g s LEU 73 CO 0.03 0.02 -0.10 -0.60 -1.32 0.00 0.00 176.35 174.37 2e0g s ARG 74 N 0.73 1.88 0.04 1.98 3.52 0.93 -4.94 118.95 123.08 2e0g s ARG 74 Ca 0.21 -1.78 0.00 0.00 -0.13 0.00 0.00 55.73 54.03 2e0g s ARG 74 Cb -0.14 -1.82 -0.03 0.00 -1.56 0.00 0.00 34.95 31.40 2e0g s ARG 74 CO 0.08 0.23 -0.04 -0.06 -0.81 0.00 0.00 175.30 174.70 2e0g s PHE 75 N -2.53 0.42 -0.20 5.12 0.40 -1.26 0.57 117.98 120.50 2e0g s PHE 75 Ca 0.32 -0.71 -0.33 0.00 -0.60 0.00 0.00 56.93 55.61 2e0g s PHE 75 Cb -0.02 -0.29 0.15 0.00 0.51 0.00 0.00 43.02 43.37 2e0g s PHE 75 CO 0.17 -0.23 1.19 -1.21 0.70 0.00 0.00 175.22 175.84 2e0g s GLU 76 N -2.34 0.32 -0.47 0.44 2.02 0.90 -4.79 118.70 114.77 2e0g s GLU 76 Ca -0.07 -0.05 -0.18 0.00 0.02 0.00 0.00 54.97 54.69 2e0g s GLU 76 Cb -0.04 0.15 0.05 0.00 0.10 0.00 0.00 34.13 34.39 2e0g s GLU 76 CO -0.04 -0.13 0.52 0.08 0.02 0.00 0.00 175.26 175.72 2e0g s VAL 77 N -1.91 5.01 0.00 2.63 1.01 -1.26 -0.64 120.40 125.24 2e0g s VAL 77 Ca 0.07 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2e0g s VAL 77 Cb -0.01 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.18 2e0g s VAL 77 CO -0.05 -0.65 0.00 0.61 0.00 0.00 0.00 175.10 175.02 2e0g n GLY 78 N 5.16 0.87 3.63 4.51 0.00 0.18 -4.67 105.19 114.87 2e0g n GLY 78 Ca -0.08 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 2e0g n GLY 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2e0g s THR 79 N 0.00 4.00 0.23 2.61 -4.23 -1.26 -4.83 115.64 112.16 2e0g s THR 79 Ca 0.00 -0.40 0.09 0.00 -1.18 0.00 0.00 61.69 60.20 2e0g s THR 79 Cb 0.00 -2.67 -0.04 0.00 1.34 0.00 0.00 72.50 71.13 2e0g s THR 79 CO 0.00 0.58 -0.04 -1.59 -0.54 0.00 0.00 174.62 173.03 2e0g s LYS 80 N -0.93 2.22 0.99 3.99 0.00 -1.26 -5.13 119.74 119.61 2e0g s LYS 80 Ca 0.14 -1.34 -0.12 0.00 0.00 0.00 0.00 55.97 54.64 2e0g s LYS 80 Cb -0.11 -2.17 0.18 0.00 0.00 0.00 0.00 37.83 35.73 2e0g s LYS 80 CO 0.03 0.40 1.09 -1.25 0.00 0.00 0.00 175.35 175.62 2e0g s PRO 81 N -3.32 0.50 0.16 1.78 0.04 -1.26 -5.04 135.00 127.86 2e0g s PRO 81 Ca 0.29 0.55 -0.10 0.00 0.04 0.00 0.00 61.00 61.78 2e0g s PRO 81 Cb -0.07 -1.74 -0.07 0.00 0.04 0.00 0.00 34.50 32.66 2e0g s PRO 81 CO 0.18 -2.69 0.49 0.54 0.04 0.00 0.00 177.00 175.56 2e0g s VAL 82 N -2.96 4.98 0.40 -0.36 0.11 -1.26 -5.10 120.40 116.21 2e0g s VAL 82 Ca 0.65 0.52 0.08 0.00 -2.93 0.00 0.00 61.98 60.30 2e0g s VAL 82 Cb -0.19 -3.66 -0.04 0.00 -1.53 0.00 0.00 36.38 30.97 2e0g s VAL 82 CO 0.58 0.12 0.27 0.28 -3.33 0.00 0.00 175.10 173.01 2e0g s THR 83 N -1.59 2.62 -0.30 5.04 -1.32 -1.26 -5.12 115.64 113.71 2e0g s THR 83 Ca 0.40 -1.53 -0.13 0.00 -1.21 0.00 0.00 61.69 59.22 2e0g s THR 83 Cb -0.13 -3.01 0.18 0.00 -1.51 0.00 0.00 72.50 68.03 2e0g s THR 83 CO 0.20 -0.04 1.09 -1.58 -2.21 0.00 0.00 174.62 172.09 2e0g s GLN 84 N -4.00 0.13 -0.41 7.08 0.74 -1.26 -5.10 119.66 116.84 2e0g s GLN 84 Ca 0.44 0.17 0.07 0.00 0.05 0.00 0.00 55.36 56.09 2e0g s GLN 84 Cb -0.01 0.09 0.24 0.00 1.10 0.00 0.00 33.01 34.43 2e0g s GLN 84 CO 0.25 -0.19 0.51 0.25 -0.55 0.00 0.00 175.29 175.56 2e0g n THR 85 N 5.29 -0.60 -2.26 -0.34 -2.24 -1.26 -5.12 114.28 107.75 2e0g n THR 85 Ca 0.01 -4.00 -0.38 0.00 -2.27 0.00 0.00 64.05 57.41 2e0g n THR 85 Cb 0.56 -1.93 -0.02 0.00 -2.10 0.00 0.00 70.33 66.85 2e0g n THR 85 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2e0g s PRO 86 N -1.08 4.05 -0.12 -0.78 0.04 -1.26 -5.04 135.00 130.81 2e0g s PRO 86 Ca 0.35 1.89 -0.30 0.00 0.04 0.00 0.00 61.00 62.98 2e0g s PRO 86 Cb 0.15 -2.70 0.11 0.00 0.04 0.00 0.00 34.50 32.10 2e0g s PRO 86 CO -0.12 -0.34 0.92 -1.14 0.04 0.00 0.00 177.00 176.36 2e0g s GLN 87 N -2.27 0.72 0.09 4.56 0.74 -1.26 -5.19 119.66 117.06 2e0g s GLN 87 Ca 0.57 0.14 -0.26 0.00 0.05 0.00 0.00 55.36 55.86 2e0g s GLN 87 Cb -0.32 0.34 0.09 0.00 1.10 0.00 0.00 33.01 34.22 2e0g s GLN 87 CO 0.40 -0.23 1.13 0.00 -0.55 0.00 0.00 175.29 176.04 2e0g s ALA 88 N -1.28 -1.93 0.09 1.58 0.00 -1.26 -5.19 121.76 113.77 2e0g s ALA 88 Ca -0.03 0.06 -0.26 0.00 0.00 0.00 0.00 51.96 51.72 2e0g s ALA 88 Cb -0.00 0.68 0.08 0.00 0.00 0.00 0.00 23.12 23.87 2e0g s ALA 88 CO 0.03 -1.08 0.84 0.00 0.00 0.00 0.00 175.76 175.55 2e0g s ALA 89 N -2.41 -1.69 0.00 0.00 0.00 -1.26 -5.18 121.76 111.22 2e0g s ALA 89 Ca 0.20 0.59 -0.06 0.00 0.00 0.00 0.00 51.96 52.68 2e0g s ALA 89 Cb -0.00 0.60 -0.00 0.00 0.00 0.00 0.00 23.12 23.72 2e0g s ALA 89 CO 0.01 -0.82 0.12 0.54 0.00 0.00 0.00 175.76 175.61 2e0g s VAL 90 N -3.35 0.08 0.06 0.00 0.11 -1.26 -5.17 120.40 110.88 2e0g s VAL 90 Ca 0.06 -0.69 -0.16 0.00 -2.93 0.00 0.00 61.98 58.27 2e0g s VAL 90 Cb -0.01 -0.41 0.03 0.00 -1.53 0.00 0.00 36.38 34.46 2e0g s VAL 90 CO -0.06 -0.38 0.37 0.42 -3.33 0.00 0.00 175.10 172.12 2e0g s THR 91 N -1.34 0.07 0.07 5.04 -4.23 -1.26 -5.18 115.64 108.82 2e0g s THR 91 Ca -0.14 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 2e0g s THR 91 Cb -0.08 -1.01 -0.04 0.00 1.34 0.00 0.00 72.50 72.71 2e0g s THR 91 CO 0.01 -0.32 -0.04 -0.44 -0.54 0.00 0.00 174.62 173.29 2e0g s SER 92 N -2.23 0.74 -0.29 3.99 0.01 -1.26 -5.16 113.70 109.50 2e0g s SER 92 Ca -0.03 -1.01 -0.25 0.00 1.31 0.00 0.00 55.95 55.97 2e0g s SER 92 Cb 0.00 0.16 0.17 0.00 0.21 0.00 0.00 66.02 66.57 2e0g s SER 92 CO -0.05 -0.55 1.33 0.21 0.41 0.00 0.00 173.24 174.59 2e0g s ASN 93 N -2.97 -0.16 0.04 2.44 3.84 -1.26 -5.18 114.94 111.69 2e0g s ASN 93 Ca 0.10 0.30 0.03 0.00 0.21 0.00 0.00 52.86 53.50 2e0g s ASN 93 Cb 0.07 0.33 -0.02 0.00 -0.55 0.00 0.00 41.25 41.07 2e0g s ASN 93 CO -0.08 -0.05 -0.10 0.54 -2.79 0.00 0.00 177.10 174.63 2e0g s VAL 94 N 0.10 0.72 -0.28 -5.21 0.11 -1.26 -5.15 120.40 109.43 2e0g s VAL 94 Ca 0.06 -0.99 -0.20 0.00 -2.93 0.00 0.00 61.98 57.92 2e0g s VAL 94 Cb -0.05 -0.72 0.11 0.00 -1.53 0.00 0.00 36.38 34.19 2e0g s VAL 94 CO -0.13 -0.22 0.89 0.00 -3.33 0.00 0.00 175.10 172.31 2e0g s ALA 95 N -1.10 -2.02 -0.39 1.54 0.00 -1.26 -5.11 121.76 113.43 2e0g s ALA 95 Ca -0.05 2.13 -0.01 0.00 0.00 0.00 0.00 51.96 54.03 2e0g s ALA 95 Cb -0.09 -1.49 0.24 0.00 0.00 0.00 0.00 23.12 21.79 2e0g s ALA 95 CO 0.01 -0.32 1.08 0.00 0.00 0.00 0.00 175.76 176.53 2e0g n ALA 96 N 3.23 -2.99 -1.04 0.00 0.00 -1.26 -5.17 120.51 113.29 2e0g n ALA 96 Ca -0.16 -0.53 -0.12 0.00 0.00 0.00 0.00 53.44 52.63 2e0g n ALA 96 Cb 0.57 -2.66 0.15 0.00 0.00 0.00 0.00 19.45 17.51 2e0g n ALA 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2e0g n PRO 97 N 1.94 -2.33 -3.77 0.00 -0.04 -1.26 -5.10 135.00 124.44 2e0g n PRO 97 Ca 0.07 -1.07 -0.10 0.00 -0.04 0.00 0.00 63.50 62.36 2e0g n PRO 97 Cb 0.66 -1.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.07 2e0g n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e0g s ALA 98 N -3.00 -0.72 -0.29 0.55 0.00 -1.26 -5.18 121.76 111.86 2e0g s ALA 98 Ca 0.43 -0.35 -0.23 0.00 0.00 0.00 0.00 51.96 51.81 2e0g s ALA 98 Cb -0.04 0.82 0.17 0.00 0.00 0.00 0.00 23.12 24.08 2e0g s ALA 98 CO 0.33 -0.74 1.29 -1.14 0.00 0.00 0.00 175.76 175.50 2e0g s GLN 99 N -3.88 0.18 -0.11 0.00 -0.44 -1.26 -5.18 119.66 108.97 2e0g s GLN 99 Ca 0.10 0.24 -0.30 0.00 -2.50 0.00 0.00 55.36 52.89 2e0g s GLN 99 Cb 0.00 0.08 0.11 0.00 -1.64 0.00 0.00 33.01 31.57 2e0g s GLN 99 CO -0.04 -0.02 0.91 0.54 0.50 0.00 0.00 175.29 177.17 2e0g s VAL 100 N 0.29 0.00 -0.01 1.34 0.11 -1.26 -5.18 120.40 115.68 2e0g s VAL 100 Ca 0.03 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.80 2e0g s VAL 100 Cb -0.05 -1.00 0.09 0.00 -1.53 0.00 0.00 36.38 33.89 2e0g s VAL 100 CO -0.13 0.00 0.78 0.00 -3.33 0.00 0.00 175.10 172.42 2e0g s ALA 101 N -1.43 -1.78 0.03 1.54 0.00 -1.26 -5.18 121.76 113.68 2e0g s ALA 101 Ca -0.03 1.11 0.06 0.00 0.00 0.00 0.00 51.96 53.10 2e0g s ALA 101 Cb -0.00 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 2e0g s ALA 101 CO 0.02 -0.53 -0.18 -0.65 0.00 0.00 0.00 175.76 174.43 2e0g s GLN 102 N -2.23 1.24 -0.15 0.00 -0.21 -1.26 -5.14 119.66 111.91 2e0g s GLN 102 Ca -0.02 -0.81 -0.13 0.00 0.02 0.00 0.00 55.36 54.42 2e0g s GLN 102 Cb -0.01 -1.29 0.04 0.00 1.00 0.00 0.00 33.01 32.76 2e0g s GLN 102 CO -0.02 0.33 0.39 0.95 -2.12 0.00 0.00 175.29 174.83 2e0g s THR 103 N -0.73 -0.01 0.05 -0.19 -4.23 -1.26 -5.17 115.64 104.10 2e0g s THR 103 Ca 0.05 0.02 -0.01 0.00 -1.18 0.00 0.00 61.69 60.58 2e0g s THR 103 Cb -0.08 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.17 2e0g s THR 103 CO 0.01 0.01 -0.03 0.00 -0.54 0.00 0.00 174.62 174.07 2e0g s GLN 104 N 0.44 0.55 1.22 3.99 -2.07 -1.26 -5.17 119.66 117.37 2e0g s GLN 104 Ca -0.02 -1.08 -0.20 0.00 -1.82 0.00 0.00 55.36 52.24 2e0g s GLN 104 Cb -0.04 0.16 0.30 0.00 -1.09 0.00 0.00 33.01 32.34 2e0g s GLN 104 CO -0.02 -0.09 1.11 -1.25 -1.32 0.00 0.00 175.29 173.72 2e0g s PRO 105 N -3.31 -1.41 0.05 9.60 0.04 -1.26 -5.10 135.00 133.62 2e0g s PRO 105 Ca 0.02 -0.13 -0.10 0.00 0.04 0.00 0.00 61.00 60.83 2e0g s PRO 105 Cb 0.03 -1.58 0.01 0.00 0.04 0.00 0.00 34.50 33.00 2e0g s PRO 105 CO -0.07 -3.82 0.21 -1.14 0.04 0.00 0.00 177.00 172.21 2e0g s GLN 106 N -5.46 0.73 0.00 4.56 0.74 -1.26 -5.35 119.66 113.62 2e0g s GLN 106 Ca 0.71 -0.66 0.00 0.00 0.05 0.00 0.00 55.36 55.47 2e0g s GLN 106 Cb -0.09 0.30 0.00 0.00 1.10 0.00 0.00 33.01 34.33 2e0g s GLN 106 CO 0.56 -0.22 0.00 -2.13 -0.55 0.00 0.00 175.29 172.95