#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 -1.02 -4.32 2.46 7.94 -1.26 -5.10 117.00 115.70 2e0g n LEU 2 Ca 0.00 -2.31 -0.31 0.00 -1.11 0.00 0.00 56.01 52.28 2e0g n LEU 2 Cb 0.00 0.18 -0.16 0.00 0.53 0.00 0.00 43.42 43.97 2e0g n LEU 2 CO 0.00 1.46 -0.57 -0.44 -1.11 0.00 0.00 177.39 176.73 2e0g s SER 3 N -0.85 3.08 0.11 1.96 0.01 -1.26 -5.05 113.70 111.69 2e0g s SER 3 Ca 0.04 -0.50 -0.33 0.00 1.31 0.00 0.00 55.95 56.47 2e0g s SER 3 Cb 0.22 -0.33 -0.12 0.00 0.21 0.00 0.00 66.02 66.01 2e0g s SER 3 CO -0.06 0.30 1.57 0.25 0.41 0.00 0.00 173.24 175.71 2e0g h LEU 4 N 5.30 -1.50 -0.14 2.44 6.46 -2.00 -1.44 115.31 124.43 2e0g h LEU 4 Ca -0.44 0.17 0.03 0.00 -0.12 0.00 0.00 57.88 57.52 2e0g h LEU 4 Cb 1.13 0.57 -0.06 0.00 -0.73 0.00 0.00 40.66 41.56 2e0g h LEU 4 CO 0.46 -0.52 -0.48 -0.25 -0.62 0.00 0.00 178.44 177.03 2e0g h TRP 5 N -0.68 -1.43 -0.84 1.25 7.01 -1.98 0.50 115.95 119.76 2e0g h TRP 5 Ca 0.02 0.06 0.16 0.00 2.11 0.00 0.00 58.89 61.23 2e0g h TRP 5 Cb 0.72 0.64 -0.15 0.00 -2.10 0.00 0.00 29.16 28.27 2e0g h TRP 5 CO -0.46 -0.48 -0.27 1.96 -2.79 0.00 0.00 178.44 176.41 2e0g h GLN 6 N -0.50 -0.03 -0.51 2.65 1.08 -1.93 0.31 115.11 116.19 2e0g h GLN 6 Ca 0.03 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.25 2e0g h GLN 6 Cb 0.59 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.99 2e0g h GLN 6 CO -0.40 -0.02 0.31 0.37 -0.95 0.00 0.00 178.83 178.15 2e0g h GLN 7 N -0.03 0.61 -0.97 1.46 4.15 -0.33 -1.35 115.11 118.66 2e0g h GLN 7 Ca 0.37 -0.04 0.10 0.00 0.77 0.00 0.00 58.65 59.85 2e0g h GLN 7 Cb 0.61 -0.14 -0.08 0.00 0.21 0.00 0.00 27.48 28.08 2e0g h GLN 7 CO -0.87 0.40 0.60 0.00 -1.93 0.00 0.00 178.83 177.04 2e0g h LEU 9 N 1.01 -0.34 -0.89 0.00 3.38 -0.53 -1.68 115.31 116.26 2e0g h LEU 9 Ca 0.46 -0.19 0.09 0.00 0.09 0.00 0.00 57.88 58.32 2e0g h LEU 9 Cb 0.37 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.14 2e0g h LEU 9 CO -0.24 0.06 0.54 0.00 0.09 0.00 0.00 178.44 178.90 2e0g h ALA 10 N -0.29 1.28 -0.46 1.53 0.00 -0.96 0.34 119.26 120.70 2e0g h ALA 10 Ca -0.04 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2e0g h ALA 10 Cb 0.51 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2e0g h ALA 10 CO 0.07 0.21 0.16 -0.09 0.00 0.00 0.00 179.25 179.59 2e0g h ARG 11 N 0.92 0.70 0.00 0.00 1.12 -0.62 0.31 114.38 116.81 2e0g h ARG 11 Ca 0.42 -0.14 -0.06 0.00 -1.11 0.00 0.00 59.98 59.09 2e0g h ARG 11 Cb 0.33 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 30.17 2e0g h ARG 11 CO -0.23 0.66 -0.30 1.25 -3.11 0.00 0.00 179.97 178.24 2e0g h LEU 12 N 0.60 0.00 0.00 3.80 6.46 -0.50 -1.18 115.31 124.48 2e0g h LEU 12 Ca 0.15 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.91 2e0g h LEU 12 Cb 0.24 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.17 2e0g h LEU 12 CO -0.01 0.30 -0.71 -0.61 -0.62 0.00 0.00 178.44 176.79 2e0g h GLN 13 N 0.00 0.00 0.11 1.25 5.75 0.07 -3.31 115.11 118.98 2e0g h GLN 13 Ca -0.00 0.00 -0.35 0.00 -0.15 0.00 0.00 58.65 58.15 2e0g h GLN 13 Cb 0.88 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.41 2e0g h GLN 13 CO 0.04 0.00 -1.93 -0.25 -2.65 0.00 0.00 178.83 174.04 2e0g n ASP 14 N -2.69 1.91 0.19 -0.69 9.92 0.10 -4.07 116.55 121.23 2e0g n ASP 14 Ca 0.01 0.26 0.06 0.00 -0.53 0.00 0.00 54.79 54.59 2e0g n ASP 14 Cb 0.53 -0.73 0.55 0.00 -0.64 0.00 0.00 41.12 40.82 2e0g n ASP 14 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 2e0g h GLU 15 N 0.06 0.12 -2.07 -1.24 4.81 -1.36 -3.45 114.58 111.46 2e0g h GLU 15 Ca -0.40 -0.01 0.12 0.00 -0.13 0.00 0.00 59.36 58.94 2e0g h GLU 15 Cb 2.03 -0.02 -0.17 0.00 0.63 0.00 0.00 28.75 31.22 2e0g h GLU 15 CO 0.09 0.14 0.54 -0.51 -0.73 0.00 0.00 179.01 178.54 2e0g s LEU 16 N -9.03 -0.34 0.00 1.64 1.43 -1.24 -5.02 118.68 106.12 2e0g s LEU 16 Ca -0.05 0.07 0.15 0.00 -1.03 0.00 0.00 54.13 53.26 2e0g s LEU 16 Cb 0.17 1.93 0.72 0.00 0.03 0.00 0.00 46.19 49.03 2e0g s LEU 16 CO 0.69 -0.53 1.41 -0.81 0.23 0.00 0.00 176.35 177.35 2e0g n PRO 17 N -0.06 0.17 -1.48 1.29 -0.04 -1.26 -4.33 135.00 129.29 2e0g n PRO 17 Ca -0.08 0.17 -0.43 0.00 -0.04 0.00 0.00 63.50 63.12 2e0g n PRO 17 Cb 0.61 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.33 0.44 1.02 0.55 0.00 -1.26 -4.74 120.51 115.20 2e0g n ALA 18 Ca 0.06 -0.33 0.14 0.00 0.00 0.00 0.00 53.44 53.31 2e0g n ALA 18 Cb 0.13 -2.45 0.61 0.00 0.00 0.00 0.00 19.45 17.74 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 7.46 0.00 -0.23 0.00 -1.04 -1.26 -4.01 114.28 115.20 2e0g n THR 19 Ca 0.57 -0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.54 2e0g n THR 19 Cb 0.14 -0.47 0.01 0.00 -1.82 0.00 0.00 70.33 68.19 2e0g n THR 19 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 2e0g h GLU 20 N 0.00 -0.13 -0.81 -2.82 4.22 -1.99 0.60 114.58 113.65 2e0g h GLU 20 Ca 0.00 0.01 0.18 0.00 0.08 0.00 0.00 59.36 59.63 2e0g h GLU 20 Cb 0.49 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 2e0g h GLU 20 CO 0.00 -0.09 0.55 0.27 -2.18 0.00 0.00 179.01 177.56 2e0g h PHE 21 N -0.13 0.41 0.00 0.92 -5.15 -1.95 0.74 116.94 111.77 2e0g h PHE 21 Ca 0.25 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 58.03 2e0g h PHE 21 Cb 0.56 -0.13 0.00 0.00 0.22 0.00 0.00 35.95 36.60 2e0g h PHE 21 CO -0.66 0.13 0.00 0.43 -2.00 0.00 0.00 178.31 176.21 2e0g n SER 22 N -4.46 0.69 -0.04 -0.68 7.64 0.20 -2.41 113.62 114.56 2e0g n SER 22 Ca 0.16 0.61 -0.04 0.00 1.01 0.00 0.00 58.87 60.62 2e0g n SER 22 Cb 0.66 -0.78 -0.14 0.00 -1.01 0.00 0.00 64.21 62.94 2e0g n SER 22 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2e0g n MET 23 N -2.20 0.66 -1.05 1.43 2.81 0.24 -3.14 117.12 115.87 2e0g n MET 23 Ca 0.04 0.07 -0.14 0.00 -1.81 0.00 0.00 57.70 55.86 2e0g n MET 23 Cb 0.32 -1.64 0.18 0.00 -0.71 0.00 0.00 33.22 31.37 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 -2.77 2.01 0.00 2.03 7.02 -0.35 -4.53 117.44 120.85 2e0g n TRP 24 Ca -0.20 -1.83 0.00 0.00 -1.02 0.00 0.00 57.50 54.45 2e0g n TRP 24 Cb 0.98 -0.72 0.00 0.00 -2.42 0.00 0.00 31.31 29.15 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 -1.10 0.00 -0.03 -0.99 2.08 -1.01 -4.83 119.36 113.47 2e0g n ILE 25 Ca 0.45 0.00 -0.14 0.00 0.56 0.00 0.00 62.75 63.62 2e0g n ILE 25 Cb 1.24 -0.02 -0.09 0.00 -0.75 0.00 0.00 39.64 40.01 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 -1.74 0.17 114.38 115.16 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 0.10 -2.65 0.04 -0.04 -1.26 -4.76 135.00 121.00 2e0g n PRO 27 Ca -0.05 0.20 -0.26 0.00 -0.04 0.00 0.00 63.50 63.35 2e0g n PRO 27 Cb 0.37 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.79 3.53 -0.26 1.53 1.43 0.61 -4.86 118.68 117.87 2e0g s LEU 28 Ca 0.10 0.74 0.03 0.00 -1.03 0.00 0.00 54.13 53.97 2e0g s LEU 28 Cb 0.10 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.74 2e0g s LEU 28 CO 0.24 -0.73 -0.10 -1.58 0.23 0.00 0.00 176.35 174.41 2e0g s GLN 29 N -4.77 2.17 0.37 1.70 -0.44 -0.38 -4.88 119.66 113.43 2e0g s GLN 29 Ca 0.49 -1.35 -0.12 0.00 -2.50 0.00 0.00 55.36 51.88 2e0g s GLN 29 Cb -0.10 -2.88 -0.07 0.00 -1.64 0.00 0.00 33.01 28.31 2e0g s GLN 29 CO 0.43 -0.59 0.76 0.00 0.50 0.00 0.00 175.29 176.40 2e0g s ALA 30 N 1.11 3.33 -0.10 1.58 0.00 -1.26 0.08 121.76 126.51 2e0g s ALA 30 Ca -0.08 -0.10 -0.04 0.00 0.00 0.00 0.00 51.96 51.74 2e0g s ALA 30 Cb -0.20 -2.74 0.05 0.00 0.00 0.00 0.00 23.12 20.24 2e0g s ALA 30 CO -0.05 0.13 0.20 -2.00 0.00 0.00 0.00 175.76 174.04 2e0g s GLU 31 N -3.50 0.10 0.11 0.00 2.12 0.10 -4.95 118.70 112.68 2e0g s GLU 31 Ca 0.53 0.60 -0.28 0.00 0.36 0.00 0.00 54.97 56.18 2e0g s GLU 31 Cb -0.10 -0.16 -0.06 0.00 0.26 0.00 0.00 34.13 34.06 2e0g s GLU 31 CO 0.26 -0.27 0.87 -0.51 -0.54 0.00 0.00 175.26 175.06 2e0g s LEU 32 N 2.11 4.51 -0.19 2.70 1.43 -1.26 -1.08 118.68 126.90 2e0g s LEU 32 Ca -0.00 1.68 0.14 0.00 -1.03 0.00 0.00 54.13 54.92 2e0g s LEU 32 Cb -0.12 -3.43 0.39 0.00 0.03 0.00 0.00 46.19 43.06 2e0g s LEU 32 CO -0.07 0.03 1.24 -0.24 0.23 0.00 0.00 176.35 177.53 2e0g n SER 33 N 2.48 2.20 0.00 2.29 2.88 -0.40 -4.93 113.62 118.14 2e0g n SER 33 Ca -0.01 -3.51 0.00 0.00 -1.33 0.00 0.00 58.87 54.02 2e0g n SER 33 Cb 0.49 -0.50 0.00 0.00 -0.75 0.00 0.00 64.21 63.45 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 -1.20 0.00 -0.01 -3.46 2.03 -1.26 -4.22 116.55 108.43 2e0g n ASP 34 Ca 0.20 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.51 2e0g n ASP 34 Cb 0.73 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.83 2e0g n ASP 34 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2e0g n ASN 35 N 0.00 0.00 -3.38 1.67 4.13 -1.26 -5.06 115.26 111.36 2e0g n ASN 35 Ca 0.00 -0.03 -0.08 0.00 1.68 0.00 0.00 54.58 56.16 2e0g n ASN 35 Cb 0.00 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.17 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 -0.65 -0.72 3.41 2.01 -1.26 -1.86 115.64 116.56 2e0g s THR 36 Ca 0.00 -0.02 -0.20 0.00 0.31 0.00 0.00 61.69 61.78 2e0g s THR 36 Cb 0.00 -0.81 0.10 0.00 0.01 0.00 0.00 72.50 71.80 2e0g s THR 36 CO 0.00 -0.08 0.93 -0.22 -0.69 0.00 0.00 174.62 174.56 2e0g s LEU 37 N 2.59 4.95 0.54 4.42 0.20 0.12 -1.28 118.68 130.22 2e0g s LEU 37 Ca 0.11 -1.48 -0.07 0.00 0.69 0.00 0.00 54.13 53.38 2e0g s LEU 37 Cb -0.15 -2.37 -0.03 0.00 -0.43 0.00 0.00 46.19 43.21 2e0g s LEU 37 CO -0.16 -1.21 0.87 0.00 -0.29 0.00 0.00 176.35 175.56 2e0g s ALA 38 N 3.13 3.30 -0.01 5.97 0.00 -0.24 0.11 121.76 134.03 2e0g s ALA 38 Ca 0.22 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2e0g s ALA 38 Cb -0.15 -2.71 0.01 0.00 0.00 0.00 0.00 23.12 20.27 2e0g s ALA 38 CO 0.03 -0.53 0.03 -0.51 0.00 0.00 0.00 175.76 174.77 2e0g s LEU 39 N -4.90 1.64 -0.24 0.00 2.01 0.20 -0.72 118.68 116.67 2e0g s LEU 39 Ca 0.51 0.05 -0.05 0.00 0.01 0.00 0.00 54.13 54.65 2e0g s LEU 39 Cb -0.10 0.05 -0.01 0.00 0.01 0.00 0.00 46.19 46.14 2e0g s LEU 39 CO 0.47 -0.05 0.00 -0.31 1.01 0.00 0.00 176.35 177.47 2e0g s TYR 40 N 0.35 3.03 0.31 0.29 2.02 0.11 -0.95 117.35 122.51 2e0g s TYR 40 Ca -0.03 -0.90 0.10 0.00 -0.37 0.00 0.00 57.07 55.87 2e0g s TYR 40 Cb -0.04 -2.15 -0.05 0.00 -0.40 0.00 0.00 41.96 39.31 2e0g s TYR 40 CO -0.01 -0.53 -0.02 0.00 -1.57 0.00 0.00 175.55 173.42 2e0g s ALA 41 N 1.50 3.14 -0.61 3.71 0.00 0.27 -1.25 121.76 128.52 2e0g s ALA 41 Ca 0.05 -1.86 0.21 0.00 0.00 0.00 0.00 51.96 50.36 2e0g s ALA 41 Cb -0.15 -0.49 0.89 0.00 0.00 0.00 0.00 23.12 23.37 2e0g s ALA 41 CO -0.01 0.15 1.65 -0.35 0.00 0.00 0.00 175.76 177.20 2e0g n PRO 42 N -0.90 0.15 -3.85 0.00 -0.04 -1.26 0.45 135.00 129.54 2e0g n PRO 42 Ca -0.05 0.38 -0.10 0.00 -0.04 0.00 0.00 63.50 63.69 2e0g n PRO 42 Cb 0.61 -1.78 0.02 0.00 -0.04 0.00 0.00 33.50 32.31 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 -3.93 0.23 0.14 3.54 4.22 -1.26 -4.64 114.94 113.25 2e0g s ASN 43 Ca 0.05 -1.28 0.11 0.00 -2.14 0.00 0.00 52.86 49.59 2e0g s ASN 43 Cb 0.09 0.84 -0.13 0.00 1.28 0.00 0.00 41.25 43.33 2e0g s ASN 43 CO 0.36 -1.67 1.23 -0.09 -2.04 0.00 0.00 177.10 174.89 2e0g h ARG 44 N 2.01 0.00 -0.35 3.55 2.43 -1.93 -3.34 114.38 116.75 2e0g h ARG 44 Ca -0.33 0.00 0.08 0.00 -0.81 0.00 0.00 59.98 58.92 2e0g h ARG 44 Cb 1.25 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.72 2e0g h ARG 44 CO 0.42 0.75 -0.16 0.74 -1.51 0.00 0.00 179.97 180.22 2e0g h PHE 45 N 0.00 -0.39 -0.64 2.20 -1.00 -1.99 -1.43 116.94 113.69 2e0g h PHE 45 Ca -0.05 0.04 0.03 0.00 2.81 0.00 0.00 57.97 60.80 2e0g h PHE 45 Cb 1.67 0.23 -0.04 0.00 3.61 0.00 0.00 35.95 41.42 2e0g h PHE 45 CO 0.00 -0.24 0.40 0.28 -1.61 0.00 0.00 178.31 177.14 2e0g h VAL 46 N -0.10 1.09 -0.01 -0.55 2.07 -1.99 -1.92 116.25 114.84 2e0g h VAL 46 Ca 0.18 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.45 2e0g h VAL 46 Cb 0.37 0.24 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 2e0g h VAL 46 CO -0.41 0.14 -0.49 -0.07 0.02 0.00 0.00 177.57 176.76 2e0g h LEU 47 N 0.78 -1.51 -0.72 2.57 3.38 -1.40 0.25 115.31 118.67 2e0g h LEU 47 Ca 0.25 0.18 0.07 0.00 0.09 0.00 0.00 57.88 58.47 2e0g h LEU 47 Cb 0.01 0.58 -0.06 0.00 0.09 0.00 0.00 40.66 41.28 2e0g h LEU 47 CO -0.10 -0.50 0.40 -0.78 0.09 0.00 0.00 178.44 177.55 2e0g h ASP 48 N -0.63 0.58 0.21 -0.43 1.82 -1.26 -1.32 116.42 115.39 2e0g h ASP 48 Ca 0.03 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.71 2e0g h ASP 48 Cb 0.70 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.62 2e0g h ASP 48 CO -0.35 0.36 -0.18 -0.25 -1.61 0.00 0.00 179.24 177.21 2e0g h TRP 49 N 0.71 -0.48 -0.53 0.28 2.91 -0.51 -1.85 115.95 116.49 2e0g h TRP 49 Ca 0.33 0.00 0.07 0.00 1.13 0.00 0.00 58.89 60.42 2e0g h TRP 49 Cb 0.24 0.18 -0.06 0.00 -0.51 0.00 0.00 29.16 29.02 2e0g h TRP 49 CO -0.08 -0.28 0.21 0.28 -1.03 0.00 0.00 178.44 177.54 2e0g h VAL 50 N -0.41 0.85 0.00 2.65 2.07 -0.15 0.15 116.25 121.41 2e0g h VAL 50 Ca -0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2e0g h VAL 50 Cb 0.38 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2e0g h VAL 50 CO -0.03 0.07 0.00 -1.14 0.02 0.00 0.00 177.57 176.49 2e0g n ARG 51 N -4.97 0.15 0.08 1.57 0.00 -0.53 -1.22 116.66 111.73 2e0g n ARG 51 Ca 0.06 0.54 -0.04 0.00 -0.00 0.00 0.00 57.85 58.41 2e0g n ARG 51 Cb 0.20 -1.89 -0.02 0.00 0.00 0.00 0.00 32.46 30.75 2e0g n ARG 51 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2e0g h ASP 52 N 0.00 -0.22 0.00 6.15 1.82 0.15 -3.37 116.42 120.95 2e0g h ASP 52 Ca 0.00 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 2e0g h ASP 52 Cb 0.14 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.21 2e0g h ASP 52 CO 0.00 0.09 -0.35 2.29 -1.61 0.00 0.00 179.24 179.66 2e0g n LYS 53 N -4.07 0.21 -0.26 0.28 0.00 -1.15 -4.32 118.16 108.84 2e0g n LYS 53 Ca -0.03 0.17 0.02 0.00 -0.00 0.00 0.00 58.31 58.46 2e0g n LYS 53 Cb 0.10 -0.95 0.06 0.00 -0.00 0.00 0.00 35.03 34.24 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 -3.28 0.13 -0.03 5.58 9.36 -0.36 -0.57 117.16 127.99 2e0g n TYR 54 Ca -0.05 0.85 -0.03 0.00 3.32 0.00 0.00 57.90 61.99 2e0g n TYR 54 Cb 0.18 -0.83 -0.02 0.00 -0.63 0.00 0.00 39.34 38.04 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 -0.44 -0.82 2.98 5.85 -1.42 0.27 115.31 121.74 2e0g h LEU 55 Ca 0.28 0.06 0.16 0.00 0.84 0.00 0.00 57.88 59.22 2e0g h LEU 55 Cb 0.46 0.18 -0.15 0.00 0.37 0.00 0.00 40.66 41.51 2e0g h LEU 55 CO -0.70 -0.09 -0.25 0.78 -0.34 0.00 0.00 178.44 177.84 2e0g h ASN 56 N -0.09 -0.90 0.51 1.25 4.21 -1.03 0.18 115.58 119.71 2e0g h ASN 56 Ca 0.02 0.25 -0.01 0.00 1.21 0.00 0.00 56.30 57.77 2e0g h ASN 56 Cb 0.14 0.55 -0.02 0.00 -1.12 0.00 0.00 38.32 37.87 2e0g h ASN 56 CO -0.14 -0.28 -0.48 0.78 -1.29 0.00 0.00 177.43 176.02 2e0g h ASN 57 N -0.02 -1.31 -0.17 5.81 2.35 -0.72 -1.87 115.58 119.66 2e0g h ASN 57 Ca 0.37 0.10 0.05 0.00 -0.55 0.00 0.00 56.30 56.28 2e0g h ASN 57 Cb 0.60 0.43 -0.07 0.00 0.05 0.00 0.00 38.32 39.33 2e0g h ASN 57 CO -0.85 -0.65 -0.33 0.40 -1.65 0.00 0.00 177.43 174.34 2e0g h ILE 58 N -0.99 0.26 -0.61 2.81 1.08 0.84 -1.92 117.51 118.98 2e0g h ILE 58 Ca -0.06 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.50 2e0g h ILE 58 Cb 0.86 0.26 -0.11 0.00 -3.07 0.00 0.00 36.82 34.76 2e0g h ILE 58 CO -0.05 0.00 -0.42 0.78 -0.69 0.00 0.00 178.15 177.77 2e0g h ASN 59 N -0.39 -1.47 -0.84 1.72 -0.26 -0.55 0.49 115.58 114.28 2e0g h ASN 59 Ca 0.10 0.25 0.14 0.00 -0.56 0.00 0.00 56.30 56.23 2e0g h ASN 59 Cb 0.55 0.68 -0.06 0.00 -1.06 0.00 0.00 38.32 38.43 2e0g h ASN 59 CO -0.38 -0.33 0.55 1.23 -1.06 0.00 0.00 177.43 177.44 2e0g h GLY 60 N -0.20 1.04 0.34 2.83 0.00 -0.79 -2.06 103.07 104.23 2e0g h GLY 60 Ca 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 2e0g h GLY 60 CO -0.71 0.09 -0.06 -2.00 0.00 0.00 0.00 176.54 173.86 2e0g h LEU 61 N 0.62 -0.14 -0.83 3.11 6.46 0.31 -1.65 115.31 123.19 2e0g h LEU 61 Ca 0.42 -0.42 0.21 0.00 -0.12 0.00 0.00 57.88 57.96 2e0g h LEU 61 Cb 0.73 0.04 -0.14 0.00 -0.73 0.00 0.00 40.66 40.56 2e0g h LEU 61 CO -0.17 0.45 0.11 -0.07 -0.62 0.00 0.00 178.44 178.13 2e0g h LEU 62 N -0.83 -0.20 -0.11 2.25 4.07 0.15 1.03 115.31 121.68 2e0g h LEU 62 Ca -0.02 0.20 -0.06 0.00 0.08 0.00 0.00 57.88 58.08 2e0g h LEU 62 Cb 0.55 0.32 -0.00 0.00 1.08 0.00 0.00 40.66 42.61 2e0g h LEU 62 CO 0.03 -0.18 -0.18 0.74 -1.08 0.00 0.00 178.44 177.77 2e0g h THR 63 N 0.15 1.38 0.00 0.22 2.02 -1.45 -2.62 112.91 112.60 2e0g h THR 63 Ca 0.49 -1.43 0.00 0.00 0.77 0.00 0.00 66.41 66.24 2e0g h THR 63 Cb 0.93 2.05 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 2e0g h THR 63 CO -0.68 0.41 0.00 0.28 0.37 0.00 0.00 175.52 175.90 2e0g h SER 64 N -0.11 0.00 0.08 4.18 0.02 -0.04 0.39 113.55 118.07 2e0g h SER 64 Ca 0.01 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.84 2e0g h SER 64 Cb 0.75 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.30 2e0g h SER 64 CO 0.04 0.00 -0.54 0.15 -1.14 0.00 0.00 176.83 175.34 2e0g h PHE 65 N 0.00 0.32 0.00 3.45 3.57 0.12 -3.46 116.94 120.94 2e0g h PHE 65 Ca 0.00 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.27 2e0g h PHE 65 Cb 0.29 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.01 2e0g h PHE 65 CO 0.00 1.21 -0.18 0.00 -2.23 0.00 0.00 178.31 177.10 2e0g n GLY 67 N 1.84 1.05 0.00 0.00 0.00 0.10 -4.63 105.19 103.56 2e0g n GLY 67 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 0.00 1.71 0.06 4.61 0.00 -1.26 -4.10 120.51 121.53 2e0g n ALA 68 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2e0g n ALA 68 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.21 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 -1.44 0.25 -3.16 0.00 2.03 -1.26 -5.10 116.55 107.87 2e0g n ASP 69 Ca 0.04 0.19 -0.11 0.00 0.52 0.00 0.00 54.79 55.44 2e0g n ASP 69 Cb 0.16 0.03 0.01 0.00 -0.72 0.00 0.00 41.12 40.60 2e0g n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2e0g n ALA 70 N -3.18 -2.03 -1.00 -1.67 0.00 -1.26 -4.96 120.51 106.42 2e0g n ALA 70 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2e0g n ALA 70 Cb 0.10 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.61 2e0g n ALA 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2e0g n PRO 71 N 0.85 -0.12 -4.58 0.00 -0.04 -1.26 -4.98 135.00 124.88 2e0g n PRO 71 Ca -0.02 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.16 2e0g n PRO 71 Cb 0.53 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.91 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 -1.65 2.03 0.20 0.54 -2.07 -0.78 -4.99 119.66 112.95 2e0g s GLN 72 Ca 0.00 -2.27 0.10 0.00 -1.82 0.00 0.00 55.36 51.37 2e0g s GLN 72 Cb 0.00 -0.79 -0.04 0.00 -1.09 0.00 0.00 33.01 31.09 2e0g s GLN 72 CO 0.00 -0.49 -0.19 -0.51 -1.32 0.00 0.00 175.29 172.77 2e0g s LEU 73 N -3.69 2.49 0.10 2.60 1.43 -1.26 0.11 118.68 120.46 2e0g s LEU 73 Ca 0.18 -0.92 0.04 0.00 -1.03 0.00 0.00 54.13 52.40 2e0g s LEU 73 Cb 0.01 -0.95 -0.03 0.00 0.03 0.00 0.00 46.19 45.25 2e0g s LEU 73 CO 0.12 -0.00 -0.12 -0.13 0.23 0.00 0.00 176.35 176.45 2e0g s ARG 74 N -3.04 0.88 -0.02 1.70 0.52 0.12 -4.82 118.95 114.28 2e0g s ARG 74 Ca 0.21 -1.13 -0.03 0.00 -0.52 0.00 0.00 55.73 54.26 2e0g s ARG 74 Cb -0.05 -0.67 0.00 0.00 0.52 0.00 0.00 34.95 34.75 2e0g s ARG 74 CO 0.09 0.12 0.07 -0.06 0.02 0.00 0.00 175.30 175.54 2e0g s PHE 75 N -2.14 -0.04 0.10 -0.53 0.08 -1.26 0.62 117.98 114.80 2e0g s PHE 75 Ca 0.05 0.11 -0.26 0.00 0.12 0.00 0.00 56.93 56.95 2e0g s PHE 75 Cb -0.05 0.01 0.08 0.00 -0.57 0.00 0.00 43.02 42.49 2e0g s PHE 75 CO 0.01 -0.06 0.78 -2.00 -0.10 0.00 0.00 175.22 173.85 2e0g s GLU 76 N -0.17 1.11 -0.52 0.44 2.56 -0.13 -4.90 118.70 117.10 2e0g s GLU 76 Ca -0.02 -0.46 -0.22 0.00 0.00 0.00 0.00 54.97 54.27 2e0g s GLU 76 Cb -0.02 0.48 0.04 0.00 2.00 0.00 0.00 34.13 36.63 2e0g s GLU 76 CO 0.00 -0.49 0.81 0.08 -0.56 0.00 0.00 175.26 175.10 2e0g s VAL 77 N -3.43 4.59 0.49 3.70 1.01 -1.26 -0.57 120.40 124.93 2e0g s VAL 77 Ca 0.05 0.07 0.25 0.00 0.00 0.00 0.00 61.98 62.35 2e0g s VAL 77 Cb -0.01 -4.42 0.43 0.00 0.00 0.00 0.00 36.38 32.38 2e0g s VAL 77 CO -0.08 -0.94 1.89 1.23 0.00 0.00 0.00 175.10 177.20 2e0g h GLY 78 N 10.41 0.38 -5.17 4.51 0.00 -0.28 -3.41 103.07 109.51 2e0g h GLY 78 Ca -0.26 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 2e0g h GLY 78 CO 1.02 -0.01 -0.06 -0.51 0.00 0.00 0.00 176.54 176.99 2e0g s THR 79 N -5.17 -0.01 0.23 4.70 -4.23 -1.25 -5.04 115.64 104.86 2e0g s THR 79 Ca -0.06 0.02 0.09 0.00 -1.18 0.00 0.00 61.69 60.56 2e0g s THR 79 Cb 0.22 -0.87 -0.04 0.00 1.34 0.00 0.00 72.50 73.14 2e0g s THR 79 CO 0.77 0.01 -0.04 -1.59 -0.54 0.00 0.00 174.62 173.23 2e0g s LYS 80 N 1.25 2.19 1.00 3.99 -2.85 -1.26 -4.50 119.74 119.56 2e0g s LYS 80 Ca -0.07 -1.35 -0.12 0.00 -1.00 0.00 0.00 55.97 53.42 2e0g s LYS 80 Cb -0.06 -2.16 0.19 0.00 -2.06 0.00 0.00 37.83 33.74 2e0g s LYS 80 CO -0.13 0.40 1.09 -1.25 0.10 0.00 0.00 175.35 175.56 2e0g s PRO 81 N -3.31 0.42 0.04 1.78 0.04 -1.26 -5.08 135.00 127.63 2e0g s PRO 81 Ca 0.29 0.53 0.02 0.00 0.04 0.00 0.00 61.00 61.88 2e0g s PRO 81 Cb -0.07 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.71 2e0g s PRO 81 CO 0.18 -2.74 -0.08 0.08 0.04 0.00 0.00 177.00 174.48 2e0g s VAL 82 N -2.96 0.58 -0.03 -0.36 1.01 -1.26 -5.16 120.40 112.23 2e0g s VAL 82 Ca 0.65 -1.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.32 2e0g s VAL 82 Cb -0.19 -0.63 0.11 0.00 0.00 0.00 0.00 36.38 35.67 2e0g s VAL 82 CO 0.58 -0.32 1.05 0.28 0.00 0.00 0.00 175.10 176.69 2e0g s THR 83 N -1.25 0.00 -0.30 3.92 -1.32 -1.26 -5.18 115.64 110.25 2e0g s THR 83 Ca -0.08 -0.16 -0.24 0.00 -1.21 0.00 0.00 61.69 60.00 2e0g s THR 83 Cb -0.09 -1.34 0.20 0.00 -1.51 0.00 0.00 72.50 69.76 2e0g s THR 83 CO 0.01 0.00 1.45 -1.58 -2.21 0.00 0.00 174.62 172.29 2e0g s GLN 84 N -2.86 0.03 -0.43 7.08 0.74 -1.26 -5.11 119.66 117.85 2e0g s GLN 84 Ca 0.09 0.03 0.06 0.00 0.05 0.00 0.00 55.36 55.60 2e0g s GLN 84 Cb -0.00 0.01 0.22 0.00 1.10 0.00 0.00 33.01 34.34 2e0g s GLN 84 CO -0.05 -0.00 0.56 0.25 -0.55 0.00 0.00 175.29 175.49 2e0g n THR 85 N 1.70 -0.65 -1.09 -0.34 -2.24 -1.26 -5.14 114.28 105.26 2e0g n THR 85 Ca -0.11 -3.02 -0.30 0.00 -2.27 0.00 0.00 64.05 58.35 2e0g n THR 85 Cb 0.57 -0.90 0.24 0.00 -2.10 0.00 0.00 70.33 68.14 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 -0.23 -1.17 0.04 -0.78 0.04 -1.26 -5.09 135.00 126.55 2e0g s PRO 86 Ca 0.33 -0.05 -0.02 0.00 0.04 0.00 0.00 61.00 61.30 2e0g s PRO 86 Cb 0.12 -1.60 0.01 0.00 0.04 0.00 0.00 34.50 33.07 2e0g s PRO 86 CO -0.15 -3.68 0.10 0.00 0.04 0.00 0.00 177.00 173.31 2e0g n GLN 87 N -4.74 0.12 -3.93 4.56 10.64 -1.26 -5.20 117.38 117.57 2e0g n GLN 87 Ca 0.13 -0.24 0.04 0.00 -1.83 0.00 0.00 57.00 55.10 2e0g n GLN 87 Cb 0.59 0.30 0.01 0.00 -0.86 0.00 0.00 30.24 30.28 2e0g n GLN 87 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2e0g s ALA 88 N -1.13 -2.60 -0.21 2.61 0.00 -1.26 -5.19 121.76 113.99 2e0g s ALA 88 Ca 0.02 0.24 -0.31 0.00 0.00 0.00 0.00 51.96 51.91 2e0g s ALA 88 Cb -0.01 0.81 0.15 0.00 0.00 0.00 0.00 23.12 24.07 2e0g s ALA 88 CO 0.01 -1.15 1.19 0.00 0.00 0.00 0.00 175.76 175.81 2e0g s ALA 89 N -2.04 -2.04 0.00 0.00 0.00 -1.26 -5.18 121.76 111.24 2e0g s ALA 89 Ca 0.28 1.67 -0.08 0.00 0.00 0.00 0.00 51.96 53.83 2e0g s ALA 89 Cb 0.01 -0.75 0.00 0.00 0.00 0.00 0.00 23.12 22.39 2e0g s ALA 89 CO -0.03 -0.39 0.15 0.08 0.00 0.00 0.00 175.76 175.57 2e0g s VAL 90 N -1.59 0.08 0.07 0.00 1.01 -1.26 -5.17 120.40 113.54 2e0g s VAL 90 Ca 0.06 -0.66 -0.27 0.00 0.00 0.00 0.00 61.98 61.11 2e0g s VAL 90 Cb -0.01 -0.44 0.08 0.00 0.00 0.00 0.00 36.38 36.01 2e0g s VAL 90 CO -0.04 -0.37 0.87 0.42 0.00 0.00 0.00 175.10 175.99 2e0g s THR 91 N -1.36 0.00 -0.08 3.92 -4.23 -1.26 -5.19 115.64 107.44 2e0g s THR 91 Ca -0.14 -0.25 -0.32 0.00 -1.18 0.00 0.00 61.69 59.80 2e0g s THR 91 Cb -0.07 -1.35 0.13 0.00 1.34 0.00 0.00 72.50 72.54 2e0g s THR 91 CO 0.02 0.00 1.39 -0.94 -0.54 0.00 0.00 174.62 174.55 2e0g s SER 92 N -2.67 -0.01 -0.28 3.99 1.04 -1.26 -5.19 113.70 109.32 2e0g s SER 92 Ca 0.07 -0.04 -0.29 0.00 0.48 0.00 0.00 55.95 56.17 2e0g s SER 92 Cb -0.01 0.03 0.19 0.00 0.10 0.00 0.00 66.02 66.33 2e0g s SER 92 CO -0.05 -0.07 1.35 0.21 0.98 0.00 0.00 173.24 175.66 2e0g s ASN 93 N -3.35 -0.05 0.02 7.02 2.47 -1.26 -5.18 114.94 114.61 2e0g s ASN 93 Ca 0.21 0.05 0.00 0.00 0.42 0.00 0.00 52.86 53.55 2e0g s ASN 93 Cb 0.05 0.04 -0.02 0.00 -1.45 0.00 0.00 41.25 39.87 2e0g s ASN 93 CO -0.05 -0.04 -0.03 0.54 -3.72 0.00 0.00 177.10 173.79 2e0g s VAL 94 N -0.99 0.16 -0.27 -5.21 0.11 -1.26 -5.16 120.40 107.78 2e0g s VAL 94 Ca 0.08 -0.85 -0.32 0.00 -2.93 0.00 0.00 61.98 57.97 2e0g s VAL 94 Cb -0.01 -0.28 0.18 0.00 -1.53 0.00 0.00 36.38 34.73 2e0g s VAL 94 CO -0.08 -0.44 1.33 0.00 -3.33 0.00 0.00 175.10 172.58 2e0g s ALA 95 N -1.32 -2.12 0.12 1.54 0.00 -1.26 -5.19 121.76 113.53 2e0g s ALA 95 Ca -0.14 1.85 -0.14 0.00 0.00 0.00 0.00 51.96 53.53 2e0g s ALA 95 Cb -0.09 -1.13 0.03 0.00 0.00 0.00 0.00 23.12 21.93 2e0g s ALA 95 CO -0.01 -0.34 0.36 0.00 0.00 0.00 0.00 175.76 175.78 2e0g s ALA 96 N -1.35 -0.77 1.03 0.00 0.00 -1.26 -5.18 121.76 114.23 2e0g s ALA 96 Ca 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 2e0g s ALA 96 Cb -0.01 0.67 0.04 0.00 0.00 0.00 0.00 23.12 23.81 2e0g s ALA 96 CO -0.06 -0.63 0.13 -0.35 0.00 0.00 0.00 175.76 174.86 2e0g n PRO 97 N -0.20 -1.29 -1.97 0.00 -0.04 -1.26 -5.10 135.00 125.14 2e0g n PRO 97 Ca -0.15 -0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 2e0g n PRO 97 Cb 0.63 -0.20 0.00 0.00 -0.04 0.00 0.00 33.50 33.89 2e0g n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e0g n ALA 98 N -3.23 0.00 -2.47 0.55 0.00 -1.26 -5.18 120.51 108.92 2e0g n ALA 98 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.33 2e0g n ALA 98 Cb 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.44 2e0g n ALA 98 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2e0g s GLN 99 N -1.95 0.83 -0.23 0.00 -2.07 -1.26 -5.17 119.66 109.80 2e0g s GLN 99 Ca 0.00 -1.04 -0.31 0.00 -1.82 0.00 0.00 55.36 52.20 2e0g s GLN 99 Cb 0.00 0.32 0.16 0.00 -1.09 0.00 0.00 33.01 32.40 2e0g s GLN 99 CO 0.00 -0.25 1.23 0.54 -1.32 0.00 0.00 175.29 175.49 2e0g s VAL 100 N -3.89 0.00 0.21 3.63 0.11 -1.26 -5.19 120.40 114.01 2e0g s VAL 100 Ca 0.07 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 58.90 2e0g s VAL 100 Cb 0.05 -1.00 0.07 0.00 -1.53 0.00 0.00 36.38 33.97 2e0g s VAL 100 CO -0.10 0.00 0.97 0.00 -3.33 0.00 0.00 175.10 172.65 2e0g s ALA 101 N -1.29 -1.48 0.02 1.54 0.00 -1.26 -5.19 121.76 114.10 2e0g s ALA 101 Ca 0.06 -0.25 -0.03 0.00 0.00 0.00 0.00 51.96 51.74 2e0g s ALA 101 Cb -0.01 0.71 0.01 0.00 0.00 0.00 0.00 23.12 23.83 2e0g s ALA 101 CO -0.05 -1.05 0.14 0.00 0.00 0.00 0.00 175.76 174.81 2e0g n GLN 102 N -0.60 0.08 -3.75 0.00 10.64 -1.26 -5.20 117.38 117.29 2e0g n GLN 102 Ca -0.05 -0.19 0.01 0.00 -1.83 0.00 0.00 57.00 54.94 2e0g n GLN 102 Cb 0.60 0.26 0.00 0.00 -0.86 0.00 0.00 30.24 30.25 2e0g n GLN 102 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 2e0g s THR 103 N -2.48 0.00 0.10 -0.39 -1.32 -1.26 -5.19 115.64 105.11 2e0g s THR 103 Ca 0.03 -0.28 -0.10 0.00 -1.21 0.00 0.00 61.69 60.14 2e0g s THR 103 Cb -0.00 -2.34 0.00 0.00 -1.51 0.00 0.00 72.50 68.64 2e0g s THR 103 CO 0.01 0.00 0.23 -1.10 -2.21 0.00 0.00 174.62 171.55 2e0g s GLN 104 N -2.36 0.91 0.12 7.08 1.11 -1.26 -5.18 119.66 120.09 2e0g s GLN 104 Ca 0.19 -0.95 -0.02 0.00 0.01 0.00 0.00 55.36 54.59 2e0g s GLN 104 Cb 0.02 0.36 0.03 0.00 -1.01 0.00 0.00 33.01 32.42 2e0g s GLN 104 CO -0.02 -0.31 0.11 -0.35 0.01 0.00 0.00 175.29 174.73 2e0g n PRO 105 N -0.10 -1.23 -2.02 2.91 -0.04 -1.26 -5.10 135.00 128.16 2e0g n PRO 105 Ca -0.14 -0.17 -0.00 0.00 -0.04 0.00 0.00 63.50 63.15 2e0g n PRO 105 Cb 0.63 -0.16 -0.00 0.00 -0.04 0.00 0.00 33.50 33.93 2e0g n PRO 105 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e0g n GLN 106 N -1.83 1.81 0.00 0.54 10.64 -1.26 -5.36 117.38 121.91 2e0g n GLN 106 Ca 0.01 -0.03 0.00 0.00 -1.83 0.00 0.00 57.00 55.16 2e0g n GLN 106 Cb 0.06 0.01 0.00 0.00 -0.86 0.00 0.00 30.24 29.45 2e0g n GLN 106 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10