#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 0.25 -4.45 -3.43 4.77 -1.26 -5.08 117.00 107.81 2e0g n LEU 2 Ca 0.00 0.07 -0.32 0.00 -0.03 0.00 0.00 56.01 55.73 2e0g n LEU 2 Cb 0.00 -0.05 -0.13 0.00 -2.33 0.00 0.00 43.42 40.91 2e0g n LEU 2 CO 0.00 -0.31 -0.48 -0.44 -1.33 0.00 0.00 177.39 174.83 2e0g s SER 3 N -5.23 3.81 0.11 -1.43 0.01 -1.26 -5.05 113.70 104.65 2e0g s SER 3 Ca 0.00 -0.32 -0.33 0.00 1.31 0.00 0.00 55.95 56.61 2e0g s SER 3 Cb 0.00 -0.69 -0.13 0.00 0.21 0.00 0.00 66.02 65.42 2e0g s SER 3 CO 0.00 0.31 1.57 0.25 0.41 0.00 0.00 173.24 175.78 2e0g h LEU 4 N 5.05 -1.46 -0.03 2.44 6.46 -1.99 -1.25 115.31 124.53 2e0g h LEU 4 Ca -0.46 0.16 0.02 0.00 -0.12 0.00 0.00 57.88 57.47 2e0g h LEU 4 Cb 1.15 0.54 -0.04 0.00 -0.73 0.00 0.00 40.66 41.58 2e0g h LEU 4 CO 0.49 -0.53 -0.39 -0.25 -0.62 0.00 0.00 178.44 177.13 2e0g h TRP 5 N -0.72 -1.15 -0.89 1.25 7.01 -1.97 0.07 115.95 119.56 2e0g h TRP 5 Ca 0.01 0.04 0.13 0.00 2.11 0.00 0.00 58.89 61.18 2e0g h TRP 5 Cb 0.73 0.51 -0.14 0.00 -2.10 0.00 0.00 29.16 28.16 2e0g h TRP 5 CO -0.42 -0.41 -0.41 1.96 -2.79 0.00 0.00 178.44 176.37 2e0g h GLN 6 N -0.47 -0.05 -0.24 2.65 1.08 -1.95 0.18 115.11 116.31 2e0g h GLN 6 Ca 0.01 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.27 2e0g h GLN 6 Cb 0.52 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.91 2e0g h GLN 6 CO -0.28 -0.03 -0.08 0.37 -0.95 0.00 0.00 178.83 177.87 2e0g h GLN 7 N -0.05 -0.02 -0.84 1.46 4.15 -0.68 -1.20 115.11 117.93 2e0g h GLN 7 Ca 0.29 0.00 0.16 0.00 0.77 0.00 0.00 58.65 59.87 2e0g h GLN 7 Cb 0.57 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 28.16 2e0g h GLN 7 CO -0.90 -0.02 0.40 0.00 -1.93 0.00 0.00 178.83 176.38 2e0g h LEU 9 N 0.54 -0.72 -1.46 0.00 3.38 -0.26 -1.72 115.31 115.07 2e0g h LEU 9 Ca 0.47 -0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.54 2e0g h LEU 9 Cb 0.73 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 2e0g h LEU 9 CO -0.40 -0.38 0.50 0.00 0.09 0.00 0.00 178.44 178.24 2e0g h ALA 10 N -0.89 1.91 -0.61 1.53 0.00 -0.77 -0.31 119.26 120.12 2e0g h ALA 10 Ca -0.09 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2e0g h ALA 10 Cb 0.70 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2e0g h ALA 10 CO 0.14 -0.09 0.04 -0.09 0.00 0.00 0.00 179.25 179.26 2e0g h ARG 11 N 0.58 1.05 -0.13 0.00 9.65 -0.17 0.34 114.38 125.70 2e0g h ARG 11 Ca 0.36 -0.31 -0.15 0.00 -1.10 0.00 0.00 59.98 58.77 2e0g h ARG 11 Cb 0.60 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.06 2e0g h ARG 11 CO -0.13 1.01 -0.58 1.25 2.80 0.00 0.00 179.97 184.32 2e0g h LEU 12 N 0.95 0.47 0.00 3.80 6.46 -0.24 0.24 115.31 126.99 2e0g h LEU 12 Ca 0.18 -0.26 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 2e0g h LEU 12 Cb 0.51 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.30 2e0g h LEU 12 CO 0.02 0.94 -0.25 -0.61 -0.62 0.00 0.00 178.44 177.92 2e0g h GLN 13 N 0.31 0.00 0.12 1.25 5.75 -0.91 -3.23 115.11 118.40 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 1.10 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.63 2e0g h GLN 13 CO 0.10 0.00 -1.89 0.22 -2.65 0.00 0.00 178.83 174.61 2e0g h ASP 14 N 0.00 0.38 -0.56 -0.69 3.58 -0.15 -3.37 116.42 115.61 2e0g h ASP 14 Ca 0.00 -0.90 0.00 0.00 0.42 0.00 0.00 57.03 56.55 2e0g h ASP 14 Cb 0.87 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.77 2e0g h ASP 14 CO 0.00 1.81 0.36 -0.08 -2.88 0.00 0.00 179.24 178.45 2e0g h GLU 15 N -0.06 0.76 -1.38 0.28 4.57 -1.05 -3.46 114.58 114.25 2e0g h GLU 15 Ca -0.41 -0.06 0.22 0.00 -1.18 0.00 0.00 59.36 57.94 2e0g h GLU 15 Cb 1.95 -0.17 -0.22 0.00 -0.16 0.00 0.00 28.75 30.16 2e0g h GLU 15 CO 0.06 0.52 0.80 -0.51 -1.18 0.00 0.00 179.01 178.71 2e0g s LEU 16 N -9.63 -0.15 -0.51 1.64 1.43 -1.22 -5.11 118.68 105.13 2e0g s LEU 16 Ca -0.10 0.08 -0.27 0.00 -1.03 0.00 0.00 54.13 52.81 2e0g s LEU 16 Cb 0.17 1.38 -0.02 0.00 0.03 0.00 0.00 46.19 47.76 2e0g s LEU 16 CO 0.76 -0.20 1.80 -2.16 0.23 0.00 0.00 176.35 176.78 2e0g s PRO 17 N -1.81 2.93 -0.42 1.29 0.04 -1.26 -4.27 135.00 131.49 2e0g s PRO 17 Ca 0.07 0.88 0.04 0.00 0.04 0.00 0.00 61.00 62.04 2e0g s PRO 17 Cb -0.01 -4.30 0.17 0.00 0.04 0.00 0.00 34.50 30.40 2e0g s PRO 17 CO -0.05 -2.36 0.43 0.00 0.04 0.00 0.00 177.00 175.06 2e0g s ALA 18 N 8.07 0.19 -0.18 8.56 0.00 -1.26 -4.97 121.76 132.18 2e0g s ALA 18 Ca 0.70 -1.66 0.22 0.00 0.00 0.00 0.00 51.96 51.22 2e0g s ALA 18 Cb -0.16 -1.94 1.19 0.00 0.00 0.00 0.00 23.12 22.21 2e0g s ALA 18 CO 0.26 -2.08 1.66 2.41 0.00 0.00 0.00 175.76 178.01 2e0g n THR 19 N 3.22 1.01 -0.11 0.00 -1.04 -1.26 -3.00 114.28 113.09 2e0g n THR 19 Ca 0.22 0.75 -0.14 0.00 -2.04 0.00 0.00 64.05 62.84 2e0g n THR 19 Cb 0.49 -1.75 -0.10 0.00 -1.82 0.00 0.00 70.33 67.15 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 0.00 -0.41 -0.71 -2.82 4.39 -2.00 0.27 114.58 113.30 2e0g h GLU 20 Ca 0.00 0.03 0.17 0.00 0.34 0.00 0.00 59.36 59.90 2e0g h GLU 20 Cb 0.02 0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 2e0g h GLU 20 CO 0.00 -0.28 0.49 0.27 -1.16 0.00 0.00 179.01 178.33 2e0g h PHE 21 N -0.43 0.26 0.00 4.33 -5.15 -1.90 0.56 116.94 114.60 2e0g h PHE 21 Ca 0.06 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.84 2e0g h PHE 21 Cb 0.60 -0.08 0.00 0.00 0.22 0.00 0.00 35.95 36.69 2e0g h PHE 21 CO -0.70 0.09 0.00 0.43 -2.00 0.00 0.00 178.31 176.13 2e0g n SER 22 N -4.42 0.66 -0.06 -0.68 7.64 0.92 -1.94 113.62 115.75 2e0g n SER 22 Ca 0.14 0.69 -0.03 0.00 1.01 0.00 0.00 58.87 60.68 2e0g n SER 22 Cb 0.63 -0.82 -0.12 0.00 -1.01 0.00 0.00 64.21 62.89 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 -2.26 1.31 -1.19 1.43 2.81 0.18 -3.73 117.12 115.67 2e0g n MET 23 Ca 0.01 -0.04 -0.22 0.00 -1.81 0.00 0.00 57.70 55.64 2e0g n MET 23 Cb 0.18 -1.38 0.16 0.00 -0.71 0.00 0.00 33.22 31.48 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 -2.42 2.69 0.00 2.03 7.02 -0.35 -4.37 117.44 122.04 2e0g n TRP 24 Ca -0.19 -2.02 0.00 0.00 -1.02 0.00 0.00 57.50 54.27 2e0g n TRP 24 Cb 0.84 -0.92 0.00 0.00 -2.42 0.00 0.00 31.31 28.80 2e0g n TRP 24 CO 0.00 0.00 0.00 1.51 -2.02 0.00 0.00 177.69 177.18 2e0g n ILE 25 N -1.09 0.00 0.15 -0.99 0.13 -0.82 -4.82 119.36 111.93 2e0g n ILE 25 Ca 0.55 0.00 -0.15 0.00 -1.10 0.00 0.00 62.75 62.04 2e0g n ILE 25 Cb 1.35 0.00 -0.08 0.00 -0.84 0.00 0.00 39.64 40.06 2e0g n ILE 25 CO 0.00 0.00 0.00 0.03 2.80 0.00 0.00 176.55 179.38 2e0g h ARG 26 N 0.00 -0.71 0.00 9.51 3.08 -1.73 -0.82 114.38 123.71 2e0g h ARG 26 Ca 0.00 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2e0g h ARG 26 Cb 0.00 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2e0g h ARG 26 CO 0.00 -0.47 0.00 -0.35 -1.07 0.00 0.00 179.97 178.08 2e0g n PRO 27 N -5.49 0.09 -2.98 0.04 -0.04 -1.26 -4.76 135.00 120.61 2e0g n PRO 27 Ca -0.08 0.21 -0.26 0.00 -0.04 0.00 0.00 63.50 63.33 2e0g n PRO 27 Cb 0.40 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.35 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 -2.81 3.81 -0.25 1.53 1.43 -0.31 -4.83 118.68 117.25 2e0g s LEU 28 Ca 0.10 0.72 0.01 0.00 -1.03 0.00 0.00 54.13 53.93 2e0g s LEU 28 Cb 0.10 -3.63 0.07 0.00 0.03 0.00 0.00 46.19 42.75 2e0g s LEU 28 CO 0.24 -0.44 -0.04 -1.58 0.23 0.00 0.00 176.35 174.76 2e0g s GLN 29 N -4.52 1.58 0.33 1.70 -0.44 0.83 -4.92 119.66 114.22 2e0g s GLN 29 Ca 0.44 -1.08 -0.16 0.00 -2.50 0.00 0.00 55.36 52.06 2e0g s GLN 29 Cb -0.10 -2.61 -0.09 0.00 -1.64 0.00 0.00 33.01 28.57 2e0g s GLN 29 CO 0.41 -0.65 0.76 0.00 0.50 0.00 0.00 175.29 176.31 2e0g s ALA 30 N 1.36 3.30 -0.05 1.58 0.00 -1.26 0.28 121.76 126.97 2e0g s ALA 30 Ca -0.04 0.09 0.01 0.00 0.00 0.00 0.00 51.96 52.02 2e0g s ALA 30 Cb -0.19 -2.81 0.02 0.00 0.00 0.00 0.00 23.12 20.14 2e0g s ALA 30 CO -0.07 0.31 -0.05 -2.00 0.00 0.00 0.00 175.76 173.95 2e0g s GLU 31 N -2.93 0.94 0.00 0.00 2.12 -0.24 -4.94 118.70 113.66 2e0g s GLU 31 Ca 0.54 -0.13 -0.21 0.00 0.36 0.00 0.00 54.97 55.54 2e0g s GLU 31 Cb -0.11 -0.96 -0.05 0.00 0.26 0.00 0.00 34.13 33.27 2e0g s GLU 31 CO 0.17 -0.10 0.60 -0.51 -0.54 0.00 0.00 175.26 174.88 2e0g s LEU 32 N 1.05 4.43 -0.21 2.70 1.43 -1.26 -0.33 118.68 126.49 2e0g s LEU 32 Ca -0.09 1.18 0.14 0.00 -1.03 0.00 0.00 54.13 54.34 2e0g s LEU 32 Cb -0.14 -2.94 0.48 0.00 0.03 0.00 0.00 46.19 43.62 2e0g s LEU 32 CO -0.01 0.11 1.38 -1.20 0.23 0.00 0.00 176.35 176.86 2e0g n SER 33 N 2.67 3.06 0.00 2.29 7.64 0.10 -4.92 113.62 124.46 2e0g n SER 33 Ca -0.07 -3.32 0.00 0.00 1.01 0.00 0.00 58.87 56.49 2e0g n SER 33 Cb 0.51 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 2e0g n SER 33 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2e0g n ASP 34 N -0.90 0.00 -0.23 6.43 2.03 -1.26 -4.37 116.55 118.26 2e0g n ASP 34 Ca 0.24 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.55 2e0g n ASP 34 Cb 0.89 -0.06 0.00 0.00 -0.72 0.00 0.00 41.12 41.23 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 -3.63 1.67 4.13 -1.26 -5.01 115.26 111.16 2e0g n ASN 35 Ca 0.00 -0.59 -0.04 0.00 1.68 0.00 0.00 54.58 55.63 2e0g n ASN 35 Cb 0.00 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.18 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 -0.38 -0.56 3.41 2.01 -1.26 -1.74 115.64 117.11 2e0g s THR 36 Ca 0.00 0.00 -0.12 0.00 0.31 0.00 0.00 61.69 61.88 2e0g s THR 36 Cb 0.00 -1.00 0.14 0.00 0.01 0.00 0.00 72.50 71.65 2e0g s THR 36 CO 0.00 0.00 0.48 -0.22 -0.69 0.00 0.00 174.62 174.19 2e0g s LEU 37 N 2.10 6.04 0.75 4.42 2.96 0.13 0.01 118.68 135.09 2e0g s LEU 37 Ca -0.08 -2.04 -0.12 0.00 -0.22 0.00 0.00 54.13 51.67 2e0g s LEU 37 Cb -0.07 -2.11 0.04 0.00 0.50 0.00 0.00 46.19 44.54 2e0g s LEU 37 CO -0.19 -0.72 1.12 0.00 -1.32 0.00 0.00 176.35 175.24 2e0g s ALA 38 N 1.18 2.75 -0.07 5.97 0.00 0.55 -1.42 121.76 130.71 2e0g s ALA 38 Ca 0.07 -0.43 0.01 0.00 0.00 0.00 0.00 51.96 51.61 2e0g s ALA 38 Cb -0.25 -3.01 0.02 0.00 0.00 0.00 0.00 23.12 19.88 2e0g s ALA 38 CO -0.01 -1.37 -0.08 -1.17 0.00 0.00 0.00 175.76 173.13 2e0g s LEU 39 N -5.47 1.39 -0.22 0.00 1.98 0.20 -1.08 118.68 115.48 2e0g s LEU 39 Ca 0.60 -0.24 -0.05 0.00 -2.89 0.00 0.00 54.13 51.54 2e0g s LEU 39 Cb -0.11 -0.70 -0.02 0.00 0.66 0.00 0.00 46.19 46.01 2e0g s LEU 39 CO 0.51 -0.04 0.01 -0.31 -1.89 0.00 0.00 176.35 174.63 2e0g s TYR 40 N 1.05 3.04 0.23 5.38 1.51 0.14 -0.51 117.35 128.20 2e0g s TYR 40 Ca -0.08 -0.53 0.05 0.00 -1.01 0.00 0.00 57.07 55.50 2e0g s TYR 40 Cb -0.14 -2.13 -0.05 0.00 -0.11 0.00 0.00 41.96 39.52 2e0g s TYR 40 CO -0.01 -0.33 -0.06 0.00 -1.11 0.00 0.00 175.55 174.05 2e0g s ALA 41 N 1.25 1.98 -0.31 3.71 0.00 -0.48 -0.12 121.76 127.80 2e0g s ALA 41 Ca 0.04 -1.76 0.26 0.00 0.00 0.00 0.00 51.96 50.50 2e0g s ALA 41 Cb -0.15 0.23 1.10 0.00 0.00 0.00 0.00 23.12 24.31 2e0g s ALA 41 CO 0.01 -0.12 1.79 -1.00 0.00 0.00 0.00 175.76 176.45 2e0g h PRO 42 N 2.46 0.00 0.00 0.00 0.13 -1.88 0.51 132.00 133.22 2e0g h PRO 42 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2e0g h PRO 42 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2e0g h PRO 42 CO 0.65 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.69 2e0g n ASN 43 N -2.47 0.00 -0.08 1.44 2.04 -1.26 -4.85 115.26 110.08 2e0g n ASN 43 Ca 0.02 -0.64 -0.08 0.00 -0.44 0.00 0.00 54.58 53.44 2e0g n ASN 43 Cb 0.24 0.00 -0.13 0.00 -2.53 0.00 0.00 39.78 37.37 2e0g n ASN 43 CO 0.00 0.00 0.00 -1.14 -0.44 0.00 0.00 177.26 175.68 2e0g n ARG 44 N 0.00 1.41 -0.07 -3.83 0.63 -1.26 -4.37 116.66 109.17 2e0g n ARG 44 Ca 0.00 -0.01 -0.13 0.00 -0.92 0.00 0.00 57.85 56.79 2e0g n ARG 44 Cb 0.00 -1.41 -0.08 0.00 0.45 0.00 0.00 32.46 31.43 2e0g n ARG 44 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 2e0g h PHE 45 N 0.00 -1.45 -0.48 -0.14 3.04 -2.00 -1.56 116.94 114.35 2e0g h PHE 45 Ca -0.43 0.07 0.10 0.00 3.98 0.00 0.00 57.97 61.68 2e0g h PHE 45 Cb 1.97 0.67 -0.10 0.00 2.56 0.00 0.00 35.95 41.06 2e0g h PHE 45 CO 0.00 -0.49 -0.17 -0.24 -2.02 0.00 0.00 178.31 175.39 2e0g h VAL 46 N -0.45 0.44 -0.52 1.41 3.04 -2.00 -2.00 116.25 116.16 2e0g h VAL 46 Ca 0.08 0.00 0.07 0.00 -1.01 0.00 0.00 66.70 65.84 2e0g h VAL 46 Cb 0.63 0.44 -0.10 0.00 -2.01 0.00 0.00 31.29 30.25 2e0g h VAL 46 CO -0.51 0.00 -0.48 -0.07 -1.01 0.00 0.00 177.57 175.50 2e0g h LEU 47 N -0.06 -1.64 -0.56 3.16 3.38 -1.53 0.41 115.31 118.47 2e0g h LEU 47 Ca 0.23 0.25 0.10 0.00 0.09 0.00 0.00 57.88 58.55 2e0g h LEU 47 Cb 0.41 0.71 -0.08 0.00 0.09 0.00 0.00 40.66 41.79 2e0g h LEU 47 CO -0.52 -0.36 0.10 -0.78 0.09 0.00 0.00 178.44 176.97 2e0g h ASP 48 N -0.29 -0.04 0.65 -0.43 3.58 -0.84 0.26 116.42 119.31 2e0g h ASP 48 Ca 0.14 0.11 -0.03 0.00 0.42 0.00 0.00 57.03 57.67 2e0g h ASP 48 Cb 0.57 0.16 0.01 0.00 1.72 0.00 0.00 39.33 41.79 2e0g h ASP 48 CO -0.66 -0.00 -0.31 -0.25 -2.88 0.00 0.00 179.24 175.14 2e0g h TRP 49 N 0.23 -0.81 -0.52 0.28 2.91 -0.37 -1.77 115.95 115.89 2e0g h TRP 49 Ca 0.29 -0.02 0.08 0.00 1.13 0.00 0.00 58.89 60.37 2e0g h TRP 49 Cb 0.42 0.27 -0.06 0.00 -0.51 0.00 0.00 29.16 29.28 2e0g h TRP 49 CO -0.26 -0.50 0.17 0.28 -1.03 0.00 0.00 178.44 177.10 2e0g h VAL 50 N -0.88 0.79 0.00 2.65 2.07 0.15 0.23 116.25 121.26 2e0g h VAL 50 Ca -0.09 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2e0g h VAL 50 Cb 0.67 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 2e0g h VAL 50 CO 0.15 0.06 0.00 -1.14 0.02 0.00 0.00 177.57 176.66 2e0g n ARG 51 N -5.03 0.11 -0.05 1.57 0.00 0.87 0.22 116.66 114.35 2e0g n ARG 51 Ca 0.06 0.50 -0.15 0.00 -0.00 0.00 0.00 57.85 58.26 2e0g n ARG 51 Cb 0.23 -1.79 -0.13 0.00 0.00 0.00 0.00 32.46 30.76 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 0.09 0.00 6.15 3.58 0.37 -3.35 116.42 123.26 2e0g h ASP 52 Ca 0.00 -0.97 0.00 0.00 0.42 0.00 0.00 57.03 56.48 2e0g h ASP 52 Cb 0.14 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.16 2e0g h ASP 52 CO 0.00 1.05 -0.73 2.29 -2.88 0.00 0.00 179.24 178.97 2e0g n LYS 53 N -4.53 0.39 -0.33 0.28 0.00 -1.01 -4.37 118.16 108.59 2e0g n LYS 53 Ca -0.11 0.15 -0.04 0.00 -0.00 0.00 0.00 58.31 58.32 2e0g n LYS 53 Cb 0.53 -1.17 0.00 0.00 -0.00 0.00 0.00 35.03 34.40 2e0g n LYS 53 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 2e0g h TYR 54 N -0.73 -1.20 -0.23 5.58 3.20 -0.47 -1.55 116.97 121.56 2e0g h TYR 54 Ca 0.00 0.10 0.02 0.00 3.14 0.00 0.00 58.73 61.99 2e0g h TYR 54 Cb 0.73 0.65 -0.04 0.00 1.54 0.00 0.00 36.73 39.61 2e0g h TYR 54 CO -0.31 -0.40 -0.23 1.25 -1.64 0.00 0.00 178.16 176.82 2e0g h LEU 55 N -0.06 -0.80 -0.93 2.82 5.85 -1.58 0.99 115.31 121.58 2e0g h LEU 55 Ca 0.28 0.11 0.16 0.00 0.84 0.00 0.00 57.88 59.26 2e0g h LEU 55 Cb 0.56 0.34 -0.16 0.00 0.37 0.00 0.00 40.66 41.77 2e0g h LEU 55 CO -0.88 -0.15 -0.34 0.78 -0.34 0.00 0.00 178.44 177.51 2e0g h ASN 56 N -0.12 -1.26 0.50 1.25 -0.26 -1.50 0.33 115.58 114.52 2e0g h ASN 56 Ca 0.04 0.29 -0.01 0.00 -0.56 0.00 0.00 56.30 56.06 2e0g h ASN 56 Cb 0.22 0.69 -0.02 0.00 -1.06 0.00 0.00 38.32 38.15 2e0g h ASN 56 CO -0.28 -0.30 -0.50 0.78 -1.06 0.00 0.00 177.43 176.07 2e0g h ASN 57 N -0.02 -1.36 -0.36 5.81 4.21 -0.65 -2.00 115.58 121.22 2e0g h ASN 57 Ca 0.36 0.11 0.08 0.00 1.21 0.00 0.00 56.30 58.06 2e0g h ASN 57 Cb 0.62 0.45 -0.08 0.00 -1.12 0.00 0.00 38.32 38.19 2e0g h ASN 57 CO -0.95 -0.66 -0.19 0.40 -1.29 0.00 0.00 177.43 174.75 2e0g h ILE 58 N -0.99 0.45 -0.46 2.81 1.08 0.76 -2.18 117.51 118.98 2e0g h ILE 58 Ca -0.06 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.49 2e0g h ILE 58 Cb 0.86 0.45 -0.10 0.00 -3.07 0.00 0.00 36.82 34.97 2e0g h ILE 58 CO -0.06 0.00 -0.42 0.78 -0.69 0.00 0.00 178.15 177.76 2e0g h ASN 59 N -0.13 -1.42 -0.93 1.72 -0.26 -0.20 0.33 115.58 114.70 2e0g h ASN 59 Ca 0.18 0.22 0.17 0.00 -0.56 0.00 0.00 56.30 56.32 2e0g h ASN 59 Cb 0.41 0.63 -0.08 0.00 -1.06 0.00 0.00 38.32 38.22 2e0g h ASN 59 CO -0.44 -0.35 0.60 1.23 -1.06 0.00 0.00 177.43 177.40 2e0g h GLY 60 N -0.29 1.28 0.50 2.83 0.00 -0.76 -1.64 103.07 104.99 2e0g h GLY 60 Ca 0.16 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 2e0g h GLY 60 CO -0.61 0.03 -0.08 -2.00 0.00 0.00 0.00 176.54 173.87 2e0g h LEU 61 N 0.64 0.13 -0.40 3.11 6.46 -0.24 -1.95 115.31 123.06 2e0g h LEU 61 Ca 0.49 -0.59 0.08 0.00 -0.12 0.00 0.00 57.88 57.74 2e0g h LEU 61 Cb 0.90 -0.04 -0.08 0.00 -0.73 0.00 0.00 40.66 40.70 2e0g h LEU 61 CO -0.24 0.70 -0.17 -0.07 -0.62 0.00 0.00 178.44 178.03 2e0g h LEU 62 N -0.43 -0.60 -0.38 2.25 3.38 0.29 0.59 115.31 120.41 2e0g h LEU 62 Ca -0.00 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2e0g h LEU 62 Cb 0.68 0.33 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2e0g h LEU 62 CO 0.02 -0.21 0.11 0.74 0.09 0.00 0.00 178.44 179.19 2e0g h THR 63 N -0.10 1.22 0.00 0.22 2.02 -1.40 -1.46 112.91 113.41 2e0g h THR 63 Ca 0.20 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 2e0g h THR 63 Cb 0.40 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2e0g h THR 63 CO -0.46 0.25 -0.05 -1.28 0.37 0.00 0.00 175.52 174.35 2e0g h SER 64 N 0.47 0.00 0.13 4.18 0.87 -0.51 0.33 113.55 119.02 2e0g h SER 64 Ca 0.12 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.49 2e0g h SER 64 Cb 0.28 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.25 2e0g h SER 64 CO -0.00 0.05 -0.85 0.15 -0.53 0.00 0.00 176.83 175.65 2e0g h PHE 65 N 0.00 0.51 0.00 2.24 3.57 0.70 -3.45 116.94 120.50 2e0g h PHE 65 Ca -0.00 -0.37 0.00 0.00 3.53 0.00 0.00 57.97 61.13 2e0g h PHE 65 Cb 0.34 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.06 2e0g h PHE 65 CO 0.00 1.33 -0.31 0.00 -2.23 0.00 0.00 178.31 177.10 2e0g n GLY 67 N 1.96 -1.14 3.47 0.00 0.00 0.11 -4.62 105.19 104.97 2e0g n GLY 67 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 0.21 0.00 0.02 4.61 0.00 -1.26 -4.69 120.51 119.40 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 -0.33 -0.04 0.00 0.00 0.00 0.00 19.45 19.08 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 3.34 -4.70 0.00 2.03 -1.26 -5.04 116.55 110.92 2e0g n ASP 69 Ca 0.00 -0.06 -0.30 0.00 0.52 0.00 0.00 54.79 54.95 2e0g n ASP 69 Cb 0.00 1.24 0.14 0.00 -0.72 0.00 0.00 41.12 41.78 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 -2.33 1.55 1.23 -1.67 0.00 -1.26 -5.01 121.76 114.27 2e0g s ALA 70 Ca -0.02 0.16 -0.19 0.00 0.00 0.00 0.00 51.96 51.91 2e0g s ALA 70 Cb 0.04 -3.27 0.29 0.00 0.00 0.00 0.00 23.12 20.17 2e0g s ALA 70 CO 0.24 -2.40 1.02 -0.35 0.00 0.00 0.00 175.76 174.27 2e0g n PRO 71 N -3.95 -3.02 -4.76 0.00 -0.04 -1.26 -5.01 135.00 116.97 2e0g n PRO 71 Ca 0.08 -1.63 -0.33 0.00 -0.04 0.00 0.00 63.50 61.58 2e0g n PRO 71 Cb 0.54 -1.53 -0.07 0.00 -0.04 0.00 0.00 33.50 32.40 2e0g n PRO 71 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2e0g s GLN 72 N -5.31 2.22 0.07 0.54 -0.21 -0.71 -4.92 119.66 111.34 2e0g s GLN 72 Ca 0.66 -2.42 0.09 0.00 0.02 0.00 0.00 55.36 53.70 2e0g s GLN 72 Cb -0.07 -1.53 -0.03 0.00 1.00 0.00 0.00 33.01 32.38 2e0g s GLN 72 CO 0.51 -0.40 -0.21 -0.51 -2.12 0.00 0.00 175.29 172.56 2e0g s LEU 73 N -3.90 2.48 0.15 2.90 2.01 -1.26 0.19 118.68 121.25 2e0g s LEU 73 Ca 0.03 -0.55 0.05 0.00 0.01 0.00 0.00 54.13 53.67 2e0g s LEU 73 Cb 0.01 -1.42 -0.04 0.00 0.01 0.00 0.00 46.19 44.74 2e0g s LEU 73 CO 0.02 0.23 -0.11 -0.13 1.01 0.00 0.00 176.35 177.37 2e0g s ARG 74 N -1.66 1.07 0.01 1.70 0.52 -0.51 -4.88 118.95 115.19 2e0g s ARG 74 Ca 0.15 -1.45 -0.01 0.00 -0.52 0.00 0.00 55.73 53.90 2e0g s ARG 74 Cb -0.10 -0.66 -0.01 0.00 0.52 0.00 0.00 34.95 34.70 2e0g s ARG 74 CO 0.06 0.08 0.01 -0.06 0.02 0.00 0.00 175.30 175.41 2e0g s PHE 75 N -3.24 0.13 -0.09 -0.53 0.40 -1.26 0.62 117.98 114.00 2e0g s PHE 75 Ca 0.16 -0.27 -0.32 0.00 -0.60 0.00 0.00 56.93 55.91 2e0g s PHE 75 Cb 0.02 -0.10 0.12 0.00 0.51 0.00 0.00 43.02 43.57 2e0g s PHE 75 CO 0.01 -0.14 1.10 -2.00 0.70 0.00 0.00 175.22 174.89 2e0g s GLU 76 N -0.92 0.53 -0.47 0.44 2.56 0.33 -4.84 118.70 116.32 2e0g s GLU 76 Ca -0.10 -0.22 -0.18 0.00 0.00 0.00 0.00 54.97 54.47 2e0g s GLU 76 Cb -0.06 0.23 0.05 0.00 2.00 0.00 0.00 34.13 36.35 2e0g s GLU 76 CO -0.00 -0.23 0.53 0.08 -0.56 0.00 0.00 175.26 175.07 2e0g s VAL 77 N -2.69 5.01 -0.80 3.70 1.01 -1.26 -1.38 120.40 123.99 2e0g s VAL 77 Ca 0.09 -0.56 -0.25 0.00 0.00 0.00 0.00 61.98 61.25 2e0g s VAL 77 Cb -0.00 -4.19 -0.09 0.00 0.00 0.00 0.00 36.38 32.10 2e0g s VAL 77 CO -0.06 -0.65 2.18 -0.83 0.00 0.00 0.00 175.10 175.74 2e0g s GLY 78 N 2.42 -0.31 0.30 4.51 0.00 0.18 -4.83 107.32 109.59 2e0g s GLY 78 Ca 0.12 -1.01 -0.19 0.00 0.00 0.00 0.00 44.72 43.64 2e0g s GLY 78 CO 0.11 3.86 0.79 -0.51 0.00 0.00 0.00 173.10 177.36 2e0g s THR 79 N 12.26 0.00 0.80 0.90 -4.23 -1.26 -4.70 115.64 119.41 2e0g s THR 79 Ca 0.82 -0.94 -0.11 0.00 -1.18 0.00 0.00 61.69 60.28 2e0g s THR 79 Cb -0.11 -2.41 0.08 0.00 1.34 0.00 0.00 72.50 71.40 2e0g s THR 79 CO 0.07 0.00 1.12 -0.54 -0.54 0.00 0.00 174.62 174.73 2e0g s LYS 80 N -3.09 1.92 0.99 3.99 3.01 -1.26 -5.02 119.74 120.28 2e0g s LYS 80 Ca 0.14 1.37 -0.12 0.00 -1.01 0.00 0.00 55.97 56.34 2e0g s LYS 80 Cb -0.05 -1.84 0.18 0.00 -1.01 0.00 0.00 37.83 35.11 2e0g s LYS 80 CO 0.08 -1.93 1.09 -1.25 0.51 0.00 0.00 175.35 173.86 2e0g s PRO 81 N -4.64 0.52 0.08 -1.68 0.04 -1.26 -5.08 135.00 122.97 2e0g s PRO 81 Ca 0.65 0.56 0.05 0.00 0.04 0.00 0.00 61.00 62.30 2e0g s PRO 81 Cb -0.20 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 2e0g s PRO 81 CO 0.54 -2.68 -0.15 0.08 0.04 0.00 0.00 177.00 174.83 2e0g s VAL 82 N -2.96 1.18 0.07 -0.36 1.01 -1.26 -5.16 120.40 112.93 2e0g s VAL 82 Ca 0.65 -1.35 0.01 0.00 0.00 0.00 0.00 61.98 61.29 2e0g s VAL 82 Cb -0.19 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 2e0g s VAL 82 CO 0.58 -0.22 0.07 0.35 0.00 0.00 0.00 175.10 175.87 2e0g n THR 83 N 1.21 0.00 -2.42 3.92 -2.24 -1.26 -5.07 114.28 108.43 2e0g n THR 83 Ca -0.21 -0.52 -0.05 0.00 -2.27 0.00 0.00 64.05 61.01 2e0g n THR 83 Cb 0.54 0.26 -0.04 0.00 -2.10 0.00 0.00 70.33 69.00 2e0g n THR 83 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2e0g n GLN 84 N -0.14 -3.82 -3.14 -0.78 7.27 -1.26 -5.03 117.38 110.47 2e0g n GLN 84 Ca 0.02 2.96 -0.21 0.00 0.07 0.00 0.00 57.00 59.84 2e0g n GLN 84 Cb 0.13 -4.44 -0.05 0.00 2.41 0.00 0.00 30.24 28.28 2e0g n GLN 84 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 2e0g n THR 85 N 1.37 -0.68 -1.33 1.69 -2.24 -1.26 -5.14 114.28 106.70 2e0g n THR 85 Ca -0.34 -3.21 -0.31 0.00 -2.27 0.00 0.00 64.05 57.92 2e0g n THR 85 Cb 0.52 -1.10 0.09 0.00 -2.10 0.00 0.00 70.33 67.74 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 -0.37 2.32 -0.29 -0.78 0.04 -1.26 -5.07 135.00 129.59 2e0g s PRO 86 Ca 0.34 1.20 -0.29 0.00 0.04 0.00 0.00 61.00 62.29 2e0g s PRO 86 Cb 0.13 -1.90 0.19 0.00 0.04 0.00 0.00 34.50 32.96 2e0g s PRO 86 CO -0.15 -1.60 1.38 -1.14 0.04 0.00 0.00 177.00 175.53 2e0g s GLN 87 N -4.79 0.05 -0.30 4.56 2.00 -1.26 -5.18 119.66 114.75 2e0g s GLN 87 Ca 0.62 0.02 -0.17 0.00 -2.00 0.00 0.00 55.36 53.83 2e0g s GLN 87 Cb -0.18 0.02 0.20 0.00 0.80 0.00 0.00 33.01 33.85 2e0g s GLN 87 CO 0.54 -0.01 1.23 0.00 -0.50 0.00 0.00 175.29 176.54 2e0g s ALA 88 N -0.88 -2.58 -0.30 1.58 0.00 -1.26 -5.18 121.76 113.14 2e0g s ALA 88 Ca 0.09 1.99 -0.25 0.00 0.00 0.00 0.00 51.96 53.79 2e0g s ALA 88 Cb -0.01 -1.93 0.18 0.00 0.00 0.00 0.00 23.12 21.36 2e0g s ALA 88 CO -0.09 -0.31 1.40 0.00 0.00 0.00 0.00 175.76 176.77 2e0g s ALA 89 N 1.02 -2.20 -0.05 0.00 0.00 -1.26 -5.17 121.76 114.10 2e0g s ALA 89 Ca -0.07 1.70 -0.02 0.00 0.00 0.00 0.00 51.96 53.57 2e0g s ALA 89 Cb -0.03 -1.74 0.03 0.00 0.00 0.00 0.00 23.12 21.38 2e0g s ALA 89 CO -0.11 -0.12 0.10 0.54 0.00 0.00 0.00 175.76 176.18 2e0g s VAL 90 N -0.00 -0.04 -0.09 0.00 0.11 -1.26 -5.15 120.40 113.97 2e0g s VAL 90 Ca 0.07 0.14 -0.30 0.00 -2.93 0.00 0.00 61.98 58.96 2e0g s VAL 90 Cb -0.05 -0.17 0.08 0.00 -1.53 0.00 0.00 36.38 34.71 2e0g s VAL 90 CO -0.15 0.06 0.73 -0.89 -3.33 0.00 0.00 175.10 171.53 2e0g s THR 91 N 0.86 0.00 -0.03 5.04 2.01 -1.26 -5.18 115.64 117.08 2e0g s THR 91 Ca -0.07 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.64 2e0g s THR 91 Cb -0.09 -1.00 0.10 0.00 0.01 0.00 0.00 72.50 71.52 2e0g s THR 91 CO -0.04 0.00 0.84 -0.94 -0.69 0.00 0.00 174.62 173.79 2e0g s SER 92 N -1.01 -0.45 -0.30 3.53 1.04 -1.26 -5.18 113.70 110.08 2e0g s SER 92 Ca -0.08 0.26 -0.20 0.00 0.48 0.00 0.00 55.95 56.40 2e0g s SER 92 Cb -0.01 0.42 0.19 0.00 0.10 0.00 0.00 66.02 66.73 2e0g s SER 92 CO 0.08 -0.59 1.30 0.21 0.98 0.00 0.00 173.24 175.22 2e0g s ASN 93 N -1.87 -0.11 0.01 7.02 2.47 -1.26 -5.18 114.94 116.02 2e0g s ASN 93 Ca -0.01 0.19 0.00 0.00 0.42 0.00 0.00 52.86 53.46 2e0g s ASN 93 Cb -0.01 0.68 -0.01 0.00 -1.45 0.00 0.00 41.25 40.46 2e0g s ASN 93 CO -0.03 -0.03 -0.02 0.54 -3.72 0.00 0.00 177.10 173.84 2e0g s VAL 94 N 0.64 0.11 -0.30 -5.21 0.11 -1.26 -5.15 120.40 109.34 2e0g s VAL 94 Ca -0.02 -0.44 -0.20 0.00 -2.93 0.00 0.00 61.98 58.39 2e0g s VAL 94 Cb -0.03 -0.17 0.20 0.00 -1.53 0.00 0.00 36.38 34.84 2e0g s VAL 94 CO -0.12 -0.21 1.32 0.00 -3.33 0.00 0.00 175.10 172.76 2e0g s ALA 95 N -0.67 -2.46 -0.32 1.54 0.00 -1.26 -5.12 121.76 113.48 2e0g s ALA 95 Ca -0.07 1.86 -0.05 0.00 0.00 0.00 0.00 51.96 53.70 2e0g s ALA 95 Cb -0.05 -1.88 0.25 0.00 0.00 0.00 0.00 23.12 21.44 2e0g s ALA 95 CO -0.00 -0.23 1.22 0.00 0.00 0.00 0.00 175.76 176.75 2e0g n ALA 96 N 2.48 -3.85 -1.01 0.00 0.00 -1.26 -5.17 120.51 111.68 2e0g n ALA 96 Ca -0.14 -0.06 -0.05 0.00 0.00 0.00 0.00 53.44 53.19 2e0g n ALA 96 Cb 0.57 -3.44 0.07 0.00 0.00 0.00 0.00 19.45 16.65 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 1.90 -1.61 -3.89 0.00 -0.04 -1.26 -5.10 135.00 125.01 2e0g n PRO 97 Ca 0.05 -0.48 0.03 0.00 -0.04 0.00 0.00 63.50 63.06 2e0g n PRO 97 Cb 0.69 -0.45 0.01 0.00 -0.04 0.00 0.00 33.50 33.71 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 -2.98 -2.56 -0.02 0.55 0.00 -1.26 -5.20 121.76 110.29 2e0g s ALA 98 Ca 0.19 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.17 2e0g s ALA 98 Cb -0.02 0.74 0.11 0.00 0.00 0.00 0.00 23.12 23.95 2e0g s ALA 98 CO 0.15 -1.14 1.29 -1.14 0.00 0.00 0.00 175.76 174.93 2e0g s GLN 99 N -2.06 0.38 -0.13 0.00 0.74 -1.26 -5.19 119.66 112.13 2e0g s GLN 99 Ca 0.26 -0.23 -0.30 0.00 0.05 0.00 0.00 55.36 55.14 2e0g s GLN 99 Cb 0.02 0.11 0.10 0.00 1.10 0.00 0.00 33.01 34.34 2e0g s GLN 99 CO -0.03 -0.17 0.87 0.54 -0.55 0.00 0.00 175.29 175.94 2e0g s VAL 100 N -2.18 0.00 -0.02 1.34 0.11 -1.26 -5.18 120.40 113.21 2e0g s VAL 100 Ca 0.22 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.99 2e0g s VAL 100 Cb 0.02 -1.00 0.10 0.00 -1.53 0.00 0.00 36.38 33.97 2e0g s VAL 100 CO -0.02 0.00 0.83 0.00 -3.33 0.00 0.00 175.10 172.58 2e0g s ALA 101 N -0.96 -1.80 -0.02 1.54 0.00 -1.26 -5.19 121.76 114.07 2e0g s ALA 101 Ca -0.05 1.09 -0.29 0.00 0.00 0.00 0.00 51.96 52.72 2e0g s ALA 101 Cb -0.01 0.20 0.10 0.00 0.00 0.00 0.00 23.12 23.41 2e0g s ALA 101 CO 0.04 -0.58 0.86 1.14 0.00 0.00 0.00 175.76 177.22 2e0g s GLN 102 N -2.53 0.85 -0.30 0.00 1.03 -1.26 -5.17 119.66 112.28 2e0g s GLN 102 Ca 0.01 -0.16 -0.18 0.00 0.04 0.00 0.00 55.36 55.06 2e0g s GLN 102 Cb -0.01 0.39 0.19 0.00 0.03 0.00 0.00 33.01 33.62 2e0g s GLN 102 CO -0.05 -0.34 1.24 0.95 -2.54 0.00 0.00 175.29 174.55 2e0g s THR 103 N -2.55 -0.09 -0.36 3.63 -4.23 -1.26 -5.11 115.64 105.67 2e0g s THR 103 Ca 0.01 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.50 2e0g s THR 103 Cb -0.01 -1.00 0.25 0.00 1.34 0.00 0.00 72.50 73.08 2e0g s THR 103 CO -0.05 0.00 1.14 1.67 -0.54 0.00 0.00 174.62 176.84 2e0g n GLN 104 N 4.28 0.20 -1.25 3.99 -0.06 -1.26 -5.17 117.38 118.12 2e0g n GLN 104 Ca -0.09 -0.88 -0.31 0.00 -2.00 0.00 0.00 57.00 53.72 2e0g n GLN 104 Cb 0.55 -0.30 0.10 0.00 -4.06 0.00 0.00 30.24 26.53 2e0g n GLN 104 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2e0g s PRO 105 N 0.46 2.15 0.02 3.69 0.04 -1.26 -5.06 135.00 135.03 2e0g s PRO 105 Ca 0.26 1.14 0.04 0.00 0.04 0.00 0.00 61.00 62.48 2e0g s PRO 105 Cb 0.18 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.80 2e0g s PRO 105 CO -0.10 -1.71 -0.09 -1.14 0.04 0.00 0.00 177.00 173.99 2e0g s GLN 106 N -4.90 2.43 0.00 4.56 0.74 -1.26 -5.37 119.66 115.86 2e0g s GLN 106 Ca 0.61 -0.79 0.09 0.00 0.05 0.00 0.00 55.36 55.32 2e0g s GLN 106 Cb -0.17 -2.43 0.07 0.00 1.10 0.00 0.00 33.01 31.58 2e0g s GLN 106 CO 0.56 0.58 0.79 0.54 -0.55 0.00 0.00 175.29 177.22