#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e0g s LEU 2 N 0.00 4.72 -0.03 -3.43 2.96 -1.26 -4.94 118.68 116.70 2e0g s LEU 2 Ca 0.00 -2.72 -0.06 0.00 -0.22 0.00 0.00 54.13 51.13 2e0g s LEU 2 Cb 0.00 -1.71 0.01 0.00 0.50 0.00 0.00 46.19 44.99 2e0g s LEU 2 CO 0.00 -0.32 0.14 -0.44 -1.32 0.00 0.00 176.35 174.40 2e0g s SER 3 N 0.38 -0.05 0.11 3.68 0.01 -1.26 -5.07 113.70 111.51 2e0g s SER 3 Ca 0.15 0.03 -0.32 0.00 1.31 0.00 0.00 55.95 57.12 2e0g s SER 3 Cb -0.23 0.25 -0.11 0.00 0.21 0.00 0.00 66.02 66.14 2e0g s SER 3 CO -0.03 -0.21 1.57 0.25 0.41 0.00 0.00 173.24 175.24 2e0g h LEU 4 N 5.10 -1.41 -0.19 2.44 7.12 -1.99 -1.47 115.31 124.91 2e0g h LEU 4 Ca -0.28 0.16 0.03 0.00 0.13 0.00 0.00 57.88 57.92 2e0g h LEU 4 Cb 1.20 0.53 -0.05 0.00 -0.53 0.00 0.00 40.66 41.81 2e0g h LEU 4 CO 0.41 -0.51 -0.37 -0.25 -0.13 0.00 0.00 178.44 177.59 2e0g h TRP 5 N -0.66 -1.13 -0.80 1.25 7.01 -1.98 0.67 115.95 120.30 2e0g h TRP 5 Ca 0.02 0.05 0.13 0.00 2.11 0.00 0.00 58.89 61.20 2e0g h TRP 5 Cb 0.70 0.52 -0.14 0.00 -2.10 0.00 0.00 29.16 28.15 2e0g h TRP 5 CO -0.43 -0.35 -0.37 1.96 -2.79 0.00 0.00 178.44 176.46 2e0g h GLN 6 N -0.33 -0.08 -0.51 2.65 1.08 -1.93 0.23 115.11 116.23 2e0g h GLN 6 Ca 0.04 0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.31 2e0g h GLN 6 Cb 0.43 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.82 2e0g h GLN 6 CO -0.35 -0.05 0.17 1.96 -0.95 0.00 0.00 178.83 179.60 2e0g h GLN 7 N -0.08 0.33 -1.00 1.46 4.20 -0.46 -1.11 115.11 118.45 2e0g h GLN 7 Ca 0.29 -0.02 0.12 0.00 0.06 0.00 0.00 58.65 59.10 2e0g h GLN 7 Cb 0.57 -0.07 -0.08 0.00 0.30 0.00 0.00 27.48 28.19 2e0g h GLN 7 CO -0.84 0.22 0.63 0.00 -0.67 0.00 0.00 178.83 178.17 2e0g h LEU 9 N 0.98 -0.66 -1.32 0.00 3.38 -0.01 -1.58 115.31 116.10 2e0g h LEU 9 Ca 0.49 -0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.60 2e0g h LEU 9 Cb 0.50 0.17 -0.07 0.00 0.09 0.00 0.00 40.66 41.35 2e0g h LEU 9 CO -0.26 -0.28 0.58 0.00 0.09 0.00 0.00 178.44 178.57 2e0g h ALA 10 N -0.97 1.90 -0.48 1.53 0.00 -1.02 0.15 119.26 120.37 2e0g h ALA 10 Ca -0.08 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 2e0g h ALA 10 Cb 0.65 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2e0g h ALA 10 CO 0.13 -0.16 -0.18 -0.09 0.00 0.00 0.00 179.25 178.94 2e0g h ARG 11 N 0.63 0.96 -0.06 0.00 1.12 -0.76 0.26 114.38 116.53 2e0g h ARG 11 Ca 0.46 -0.39 -0.16 0.00 -1.11 0.00 0.00 59.98 58.78 2e0g h ARG 11 Cb 0.83 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 30.73 2e0g h ARG 11 CO -0.21 1.06 -0.66 1.25 -3.11 0.00 0.00 179.97 178.29 2e0g h LEU 12 N 0.84 0.28 0.00 3.80 6.46 0.00 0.36 115.31 127.05 2e0g h LEU 12 Ca 0.12 -0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 57.68 2e0g h LEU 12 Cb 0.75 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 40.59 2e0g h LEU 12 CO 0.06 0.86 -0.42 -0.61 -0.62 0.00 0.00 178.44 177.72 2e0g h GLN 13 N 0.17 0.00 0.05 1.25 5.75 -0.65 -3.16 115.11 118.52 2e0g h GLN 13 Ca -0.01 0.00 -0.35 0.00 -0.15 0.00 0.00 58.65 58.14 2e0g h GLN 13 Cb 1.20 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.70 2e0g h GLN 13 CO 0.10 0.07 -2.07 -0.25 -2.65 0.00 0.00 178.83 174.04 2e0g n ASP 14 N -2.98 1.44 0.04 -0.69 8.00 0.89 -4.22 116.55 119.03 2e0g n ASP 14 Ca 0.02 0.17 -0.01 0.00 0.71 0.00 0.00 54.79 55.68 2e0g n ASP 14 Cb 0.57 -0.28 0.27 0.00 -0.02 0.00 0.00 41.12 41.67 2e0g n ASP 14 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2e0g h GLU 15 N 0.03 0.42 -3.20 -1.24 4.57 -0.39 -3.46 114.58 111.30 2e0g h GLU 15 Ca -0.43 -0.12 -0.02 0.00 -1.18 0.00 0.00 59.36 57.60 2e0g h GLU 15 Cb 2.04 -0.04 -0.11 0.00 -0.16 0.00 0.00 28.75 30.47 2e0g h GLU 15 CO 0.04 0.57 0.08 -0.51 -1.18 0.00 0.00 179.01 178.02 2e0g s LEU 16 N -8.77 -0.09 0.05 1.64 1.02 -1.19 -5.03 118.68 106.31 2e0g s LEU 16 Ca -0.07 -0.31 0.16 0.00 0.02 0.00 0.00 54.13 53.94 2e0g s LEU 16 Cb 0.15 2.28 0.68 0.00 0.02 0.00 0.00 46.19 49.31 2e0g s LEU 16 CO 0.77 -1.01 1.51 -0.81 0.02 0.00 0.00 176.35 176.82 2e0g n PRO 17 N -0.34 0.04 -1.52 1.29 -0.04 -1.26 -4.28 135.00 128.89 2e0g n PRO 17 Ca -0.13 0.29 -0.37 0.00 -0.04 0.00 0.00 63.50 63.25 2e0g n PRO 17 Cb 0.63 -1.58 -0.10 0.00 -0.04 0.00 0.00 33.50 32.41 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 -1.56 0.52 0.60 0.55 0.00 -1.26 -4.72 120.51 114.64 2e0g n ALA 18 Ca 0.03 -0.60 0.11 0.00 0.00 0.00 0.00 53.44 52.99 2e0g n ALA 18 Cb 0.18 -2.68 0.08 0.00 0.00 0.00 0.00 19.45 17.03 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 7.67 0.21 -0.32 0.00 -1.04 -1.26 -4.16 114.28 115.37 2e0g n THR 19 Ca 0.54 -0.23 0.21 0.00 -2.04 0.00 0.00 64.05 62.53 2e0g n THR 19 Cb 0.25 0.12 0.48 0.00 -1.82 0.00 0.00 70.33 69.36 2e0g n THR 19 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 2e0g h GLU 20 N 0.00 0.44 -0.66 -2.82 9.09 -2.00 0.41 114.58 119.04 2e0g h GLU 20 Ca 0.00 -0.03 0.19 0.00 0.05 0.00 0.00 59.36 59.57 2e0g h GLU 20 Cb 0.72 -0.10 -0.03 0.00 -1.65 0.00 0.00 28.75 27.69 2e0g h GLU 20 CO 0.00 0.29 0.47 0.27 0.05 0.00 0.00 179.01 180.09 2e0g h PHE 21 N 0.45 0.03 0.00 2.06 -0.00 -1.95 0.52 116.94 118.05 2e0g h PHE 21 Ca 0.59 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.55 2e0g h PHE 21 Cb 1.39 -0.01 -0.00 0.00 -0.00 0.00 0.00 35.95 37.33 2e0g h PHE 21 CO -0.00 0.01 -0.06 1.03 -0.00 0.00 0.00 178.31 179.29 2e0g h SER 22 N 0.03 0.00 0.41 -0.68 0.87 -0.46 -2.22 113.55 111.49 2e0g h SER 22 Ca 0.32 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.57 2e0g h SER 22 Cb 1.23 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.15 2e0g h SER 22 CO -0.01 0.06 -1.76 0.24 -0.53 0.00 0.00 176.83 174.83 2e0g h MET 23 N 0.00 0.07 -0.82 2.24 2.86 -0.06 -2.49 114.93 116.73 2e0g h MET 23 Ca -0.00 -0.12 -0.26 0.00 -2.06 0.00 0.00 59.70 57.25 2e0g h MET 23 Cb 0.54 0.05 -0.16 0.00 0.06 0.00 0.00 31.60 32.09 2e0g h MET 23 CO 0.01 0.69 0.33 0.91 1.06 0.00 0.00 176.91 179.92 2e0g n TRP 24 N -3.17 2.44 0.00 -0.22 7.02 -0.82 -4.26 117.44 118.43 2e0g n TRP 24 Ca -0.20 -1.26 0.00 0.00 -1.02 0.00 0.00 57.50 55.02 2e0g n TRP 24 Cb 1.05 -0.71 0.00 0.00 -2.42 0.00 0.00 31.31 29.23 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 -0.30 0.00 0.02 -0.99 2.08 -0.86 -4.78 119.36 114.54 2e0g n ILE 25 Ca 0.42 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.62 2e0g n ILE 25 Cb 1.39 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 40.20 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 -0.45 0.00 0.38 2.47 -1.62 -1.11 114.38 114.06 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 0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 2e0g h ARG 26 CO 0.00 -0.30 0.00 -1.00 0.56 0.00 0.00 179.97 179.23 2e0g h PRO 27 N -0.46 0.00 -7.30 0.04 0.13 -1.84 -3.45 132.00 119.13 2e0g h PRO 27 Ca 0.01 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.63 2e0g h PRO 27 Cb 0.51 0.00 0.13 0.00 0.13 0.00 0.00 31.00 31.77 2e0g h PRO 27 CO -0.28 0.00 0.33 -0.51 -0.23 0.00 0.00 178.00 177.31 2e0g s LEU 28 N -5.00 3.09 -0.26 1.56 2.01 -0.42 -4.88 118.68 114.78 2e0g s LEU 28 Ca 0.03 1.85 0.02 0.00 0.01 0.00 0.00 54.13 56.04 2e0g s LEU 28 Cb 0.09 -4.53 0.07 0.00 0.01 0.00 0.00 46.19 41.83 2e0g s LEU 28 CO 0.43 -1.97 -0.05 -1.58 1.01 0.00 0.00 176.35 174.19 2e0g s GLN 29 N -4.77 1.74 0.34 1.70 -0.44 -0.15 -4.88 119.66 113.20 2e0g s GLN 29 Ca 0.62 -1.18 -0.05 0.00 -2.50 0.00 0.00 55.36 52.24 2e0g s GLN 29 Cb -0.18 -2.71 -0.05 0.00 -1.64 0.00 0.00 33.01 28.44 2e0g s GLN 29 CO 0.54 -0.64 0.62 0.00 0.50 0.00 0.00 175.29 176.30 2e0g s ALA 30 N 1.27 3.55 -0.17 1.58 0.00 -1.26 0.13 121.76 126.88 2e0g s ALA 30 Ca -0.04 -0.53 -0.07 0.00 0.00 0.00 0.00 51.96 51.33 2e0g s ALA 30 Cb -0.19 -2.39 0.08 0.00 0.00 0.00 0.00 23.12 20.62 2e0g s ALA 30 CO -0.07 0.10 0.36 -2.00 0.00 0.00 0.00 175.76 174.15 2e0g s GLU 31 N -3.82 0.28 0.11 0.00 2.12 0.24 -4.94 118.70 112.68 2e0g s GLU 31 Ca 0.45 0.89 -0.30 0.00 0.36 0.00 0.00 54.97 56.37 2e0g s GLU 31 Cb -0.10 0.15 -0.06 0.00 0.26 0.00 0.00 34.13 34.37 2e0g s GLU 31 CO 0.32 -0.24 0.97 -0.51 -0.54 0.00 0.00 175.26 175.27 2e0g s LEU 32 N 2.28 4.49 -0.22 2.70 1.43 -1.26 -1.51 118.68 126.59 2e0g s LEU 32 Ca -0.03 1.81 0.12 0.00 -1.03 0.00 0.00 54.13 55.01 2e0g s LEU 32 Cb -0.11 -3.59 0.45 0.00 0.03 0.00 0.00 46.19 42.97 2e0g s LEU 32 CO -0.11 -0.09 1.33 -0.24 0.23 0.00 0.00 176.35 177.47 2e0g n SER 33 N 2.80 2.41 0.00 2.29 2.88 -0.33 -4.92 113.62 118.76 2e0g n SER 33 Ca 0.02 -3.60 0.00 0.00 -1.33 0.00 0.00 58.87 53.97 2e0g n SER 33 Cb 0.49 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 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 -1.09 0.00 0.00 -3.46 -0.08 -1.26 -4.22 116.55 106.43 2e0g n ASP 34 Ca 0.24 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.52 2e0g n ASP 34 Cb 0.85 -0.17 0.00 0.00 2.34 0.00 0.00 41.12 44.13 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 0.00 0.00 -3.38 1.67 4.13 -1.26 -5.05 115.26 111.37 2e0g n ASN 35 Ca 0.00 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.22 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 -0.77 -0.66 3.41 2.01 -1.26 -1.94 115.64 116.43 2e0g s THR 36 Ca 0.00 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.80 2e0g s THR 36 Cb 0.00 -0.86 0.09 0.00 0.01 0.00 0.00 72.50 71.74 2e0g s THR 36 CO 0.00 -0.04 0.87 -0.22 -0.69 0.00 0.00 174.62 174.54 2e0g s LEU 37 N 2.69 4.91 -0.12 4.42 0.20 0.53 -1.18 118.68 130.13 2e0g s LEU 37 Ca 0.11 -1.31 -0.14 0.00 0.69 0.00 0.00 54.13 53.48 2e0g s LEU 37 Cb -0.14 -2.37 -0.05 0.00 -0.43 0.00 0.00 46.19 43.20 2e0g s LEU 37 CO -0.17 -1.26 0.33 0.00 -0.29 0.00 0.00 176.35 174.96 2e0g s ALA 38 N 3.29 3.63 0.17 5.97 0.00 -0.57 -0.03 121.76 134.22 2e0g s ALA 38 Ca 0.19 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 51.85 2e0g s ALA 38 Cb -0.18 -2.38 -0.04 0.00 0.00 0.00 0.00 23.12 20.51 2e0g s ALA 38 CO 0.06 0.22 -0.14 -0.51 0.00 0.00 0.00 175.76 175.39 2e0g s LEU 39 N 0.01 2.82 -0.11 0.00 1.02 0.13 0.79 118.68 123.33 2e0g s LEU 39 Ca 0.19 -0.63 0.02 0.00 0.02 0.00 0.00 54.13 53.72 2e0g s LEU 39 Cb -0.14 -1.54 0.02 0.00 0.02 0.00 0.00 46.19 44.55 2e0g s LEU 39 CO 0.07 0.12 -0.15 -0.31 0.02 0.00 0.00 176.35 176.10 2e0g s TYR 40 N -1.59 2.00 0.31 0.29 1.51 0.12 -0.02 117.35 119.97 2e0g s TYR 40 Ca 0.23 -0.97 0.09 0.00 -1.01 0.00 0.00 57.07 55.41 2e0g s TYR 40 Cb -0.09 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.27 2e0g s TYR 40 CO 0.13 -0.50 0.06 0.00 -1.11 0.00 0.00 175.55 174.13 2e0g s ALA 41 N 1.05 3.30 -1.01 3.71 0.00 -0.03 -0.98 121.76 127.80 2e0g s ALA 41 Ca -0.05 -1.77 0.14 0.00 0.00 0.00 0.00 51.96 50.28 2e0g s ALA 41 Cb -0.15 -0.69 0.61 0.00 0.00 0.00 0.00 23.12 22.90 2e0g s ALA 41 CO -0.03 0.14 1.45 -0.35 0.00 0.00 0.00 175.76 176.98 2e0g n PRO 42 N -1.00 0.00 -3.31 0.00 -0.04 -1.26 0.51 135.00 129.90 2e0g n PRO 42 Ca -0.05 0.25 -0.07 0.00 -0.04 0.00 0.00 63.50 63.59 2e0g n PRO 42 Cb 0.60 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.59 2e0g n PRO 42 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2e0g n ASN 43 N -1.50 -1.90 0.16 3.54 6.94 -1.26 -4.65 115.26 116.59 2e0g n ASN 43 Ca 0.03 -2.30 0.11 0.00 -0.02 0.00 0.00 54.58 52.40 2e0g n ASN 43 Cb 0.17 3.16 0.07 0.00 -2.36 0.00 0.00 39.78 40.82 2e0g n ASN 43 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 2e0g h ARG 44 N 0.00 0.00 -0.04 -3.83 3.08 -1.93 -3.35 114.38 108.32 2e0g h ARG 44 Ca -0.28 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.77 2e0g h ARG 44 Cb 1.03 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.08 2e0g h ARG 44 CO 0.35 0.04 0.02 0.74 -1.07 0.00 0.00 179.97 180.04 2e0g h PHE 45 N 0.00 0.05 -0.73 3.04 -1.00 -1.99 -2.72 116.94 113.60 2e0g h PHE 45 Ca -0.01 -0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.81 2e0g h PHE 45 Cb 1.04 -0.02 -0.05 0.00 3.61 0.00 0.00 35.95 40.54 2e0g h PHE 45 CO 0.00 0.17 0.44 0.28 -1.61 0.00 0.00 178.31 177.59 2e0g h VAL 46 N -0.08 1.05 0.21 -0.55 2.07 -1.99 -2.02 116.25 114.95 2e0g h VAL 46 Ca 0.01 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.26 2e0g h VAL 46 Cb 0.14 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.00 2e0g h VAL 46 CO -0.00 0.15 -0.44 -0.07 0.02 0.00 0.00 177.57 177.23 2e0g h LEU 47 N 0.84 -1.29 -0.50 2.57 3.38 -1.65 0.36 115.31 119.02 2e0g h LEU 47 Ca 0.31 0.13 0.08 0.00 0.09 0.00 0.00 57.88 58.49 2e0g h LEU 47 Cb 0.10 0.47 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 2e0g h LEU 47 CO -0.14 -0.53 0.10 -0.78 0.09 0.00 0.00 178.44 177.18 2e0g h ASP 48 N -0.74 0.01 0.21 -0.43 3.58 -1.28 0.57 116.42 118.34 2e0g h ASP 48 Ca -0.00 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 2e0g h ASP 48 Cb 0.73 0.12 -0.00 0.00 1.72 0.00 0.00 39.33 41.89 2e0g h ASP 48 CO -0.20 0.03 -0.13 -0.25 -2.88 0.00 0.00 179.24 175.81 2e0g h TRP 49 N 0.24 -0.34 -0.28 0.28 2.91 -0.88 -1.72 115.95 116.16 2e0g h TRP 49 Ca 0.25 -0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.31 2e0g h TRP 49 Cb 0.33 0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 29.06 2e0g h TRP 49 CO -0.22 -0.21 -0.01 0.28 -1.03 0.00 0.00 178.44 177.25 2e0g h VAL 50 N -0.33 0.79 0.00 2.65 2.07 0.19 0.91 116.25 122.53 2e0g h VAL 50 Ca -0.02 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2e0g h VAL 50 Cb 0.28 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2e0g h VAL 50 CO 0.02 0.01 0.00 -1.14 0.02 0.00 0.00 177.57 176.48 2e0g n ARG 51 N -5.17 0.15 0.05 1.57 0.63 0.15 -0.10 116.66 113.94 2e0g n ARG 51 Ca -0.01 0.58 -0.09 0.00 -0.92 0.00 0.00 57.85 57.41 2e0g n ARG 51 Cb 0.15 -1.93 -0.06 0.00 0.45 0.00 0.00 32.46 31.07 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 -0.20 0.00 6.15 3.58 0.13 -3.35 116.42 122.73 2e0g h ASP 52 Ca 0.00 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.17 2e0g h ASP 52 Cb 0.10 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.20 2e0g h ASP 52 CO 0.00 0.36 -0.87 2.29 -2.88 0.00 0.00 179.24 178.15 2e0g n LYS 53 N -4.92 0.46 -0.36 0.28 0.00 -1.07 -4.39 118.16 108.17 2e0g n LYS 53 Ca -0.06 0.18 -0.01 0.00 -0.00 0.00 0.00 58.31 58.42 2e0g n LYS 53 Cb 0.23 -1.31 0.04 0.00 -0.00 0.00 0.00 35.03 34.00 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 -4.28 0.04 -0.05 5.58 9.36 0.85 -1.29 117.16 127.39 2e0g n TYR 54 Ca -0.12 1.17 -0.04 0.00 3.32 0.00 0.00 57.90 62.23 2e0g n TYR 54 Cb 0.45 -0.86 -0.03 0.00 -0.63 0.00 0.00 39.34 38.27 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 -0.53 -0.90 2.98 5.85 -1.55 0.34 115.31 121.50 2e0g h LEU 55 Ca 0.34 0.07 0.20 0.00 0.84 0.00 0.00 57.88 59.32 2e0g h LEU 55 Cb 0.57 0.22 -0.17 0.00 0.37 0.00 0.00 40.66 41.65 2e0g h LEU 55 CO -0.94 -0.11 -0.14 0.78 -0.34 0.00 0.00 178.44 177.69 2e0g h ASN 56 N -0.10 -0.69 0.84 1.25 2.35 -1.39 0.27 115.58 118.10 2e0g h ASN 56 Ca 0.02 0.26 -0.04 0.00 -0.55 0.00 0.00 56.30 55.99 2e0g h ASN 56 Cb 0.16 0.51 0.01 0.00 0.05 0.00 0.00 38.32 39.05 2e0g h ASN 56 CO -0.18 -0.29 -0.42 0.78 -1.65 0.00 0.00 177.43 175.67 2e0g h ASN 57 N 0.02 -1.00 -0.19 5.81 2.35 -0.48 -1.61 115.58 120.48 2e0g h ASN 57 Ca 0.47 0.04 0.05 0.00 -0.55 0.00 0.00 56.30 56.30 2e0g h ASN 57 Cb 0.79 0.27 -0.07 0.00 0.05 0.00 0.00 38.32 39.35 2e0g h ASN 57 CO -0.89 -0.70 -0.44 0.40 -1.65 0.00 0.00 177.43 174.15 2e0g h ILE 58 N -1.15 0.12 -0.66 2.81 1.08 0.87 -1.54 117.51 119.04 2e0g h ILE 58 Ca -0.11 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.49 2e0g h ILE 58 Cb 0.88 0.12 -0.13 0.00 -3.07 0.00 0.00 36.82 34.63 2e0g h ILE 58 CO 0.18 0.00 -0.18 0.78 -0.69 0.00 0.00 178.15 178.24 2e0g h ASN 59 N -0.47 -0.65 -0.88 1.72 2.35 -0.52 0.36 115.58 117.50 2e0g h ASN 59 Ca 0.08 0.20 0.14 0.00 -0.55 0.00 0.00 56.30 56.17 2e0g h ASN 59 Cb 0.63 0.42 -0.07 0.00 0.05 0.00 0.00 38.32 39.35 2e0g h ASN 59 CO -0.44 -0.23 0.57 1.23 -1.65 0.00 0.00 177.43 176.91 2e0g h GLY 60 N -0.01 1.18 0.13 2.83 0.00 -0.31 -1.68 103.07 105.21 2e0g h GLY 60 Ca 0.32 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 2e0g h GLY 60 CO -0.69 0.11 -0.03 -2.00 0.00 0.00 0.00 176.54 173.93 2e0g h LEU 61 N 0.70 -0.06 -1.40 3.11 6.46 0.14 -0.34 115.31 123.92 2e0g h LEU 61 Ca 0.44 -0.51 0.35 0.00 -0.12 0.00 0.00 57.88 58.04 2e0g h LEU 61 Cb 0.67 0.02 -0.11 0.00 -0.73 0.00 0.00 40.66 40.51 2e0g h LEU 61 CO -0.20 0.65 0.76 -0.07 -0.62 0.00 0.00 178.44 178.96 2e0g h LEU 62 N -0.95 0.33 0.11 2.25 4.07 -0.23 0.55 115.31 121.45 2e0g h LEU 62 Ca -0.01 0.11 -0.33 0.00 0.08 0.00 0.00 57.88 57.72 2e0g h LEU 62 Cb 0.56 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.36 2e0g h LEU 62 CO 0.01 -0.05 -1.78 0.74 -1.08 0.00 0.00 178.44 176.28 2e0g h THR 63 N 0.23 0.86 0.00 0.22 2.02 -1.39 -3.28 112.91 111.57 2e0g h THR 63 Ca 0.70 -2.55 0.00 0.00 0.77 0.00 0.00 66.41 65.33 2e0g h THR 63 Cb 2.04 2.60 0.00 0.00 -1.74 0.00 0.00 68.15 71.06 2e0g h THR 63 CO -0.35 0.80 0.00 0.28 0.37 0.00 0.00 175.52 176.63 2e0g h SER 64 N 0.07 0.00 0.00 4.18 0.02 0.12 -1.46 113.55 116.48 2e0g h SER 64 Ca -0.34 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2e0g h SER 64 Cb 2.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.58 2e0g h SER 64 CO 0.12 0.00 -0.00 0.15 -1.14 0.00 0.00 176.83 175.96 2e0g h PHE 65 N 0.00 -0.00 0.00 3.45 3.04 -0.17 -3.46 116.94 119.80 2e0g h PHE 65 Ca 0.00 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 2e0g h PHE 65 Cb 0.37 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.88 2e0g h PHE 65 CO 0.00 0.95 -0.12 0.00 -2.02 0.00 0.00 178.31 177.12 2e0g n GLY 67 N 1.69 2.31 0.00 0.00 0.00 -0.56 -4.61 105.19 104.02 2e0g n GLY 67 Ca 0.00 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.71 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 2.21 -0.14 4.61 0.00 -1.26 -2.94 120.51 122.99 2e0g n ALA 68 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2e0g n ALA 68 Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.06 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 -1.29 0.31 -4.35 0.00 -0.08 -1.26 -5.04 116.55 104.84 2e0g n ASP 69 Ca 0.11 -0.64 -0.55 0.00 -1.51 0.00 0.00 54.79 52.21 2e0g n ASP 69 Cb 0.19 0.38 -0.10 0.00 2.34 0.00 0.00 41.12 43.94 2e0g n ASP 69 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2e0g n ALA 70 N -0.38 0.59 -1.00 -1.67 0.00 -1.15 -4.91 120.51 111.98 2e0g n ALA 70 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2e0g n ALA 70 Cb 0.03 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.18 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 7.88 -0.32 -4.54 0.00 -0.04 -1.26 -4.94 135.00 131.77 2e0g n PRO 71 Ca 0.50 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.70 2e0g n PRO 71 Cb 0.09 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.44 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 -1.95 1.81 -0.00 0.54 -0.21 -0.82 -4.97 119.66 114.05 2e0g s GLN 72 Ca 0.00 -1.97 0.05 0.00 0.02 0.00 0.00 55.36 53.46 2e0g s GLN 72 Cb 0.00 -1.50 -0.03 0.00 1.00 0.00 0.00 33.01 32.48 2e0g s GLN 72 CO 0.00 0.02 -0.15 -1.17 -2.12 0.00 0.00 175.29 171.87 2e0g s LEU 73 N -3.61 2.73 0.14 2.90 2.96 -1.26 -0.35 118.68 122.20 2e0g s LEU 73 Ca 0.33 -0.29 0.06 0.00 -0.22 0.00 0.00 54.13 54.01 2e0g s LEU 73 Cb 0.06 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 2e0g s LEU 73 CO 0.16 0.30 -0.13 -0.13 -1.32 0.00 0.00 176.35 175.22 2e0g s ARG 74 N -1.14 1.08 0.01 1.98 0.52 0.96 -4.89 118.95 117.46 2e0g s ARG 74 Ca 0.14 -1.33 0.00 0.00 -0.52 0.00 0.00 55.73 54.02 2e0g s ARG 74 Cb -0.11 -0.89 -0.01 0.00 0.52 0.00 0.00 34.95 34.47 2e0g s ARG 74 CO 0.04 0.16 -0.02 -0.06 0.02 0.00 0.00 175.30 175.44 2e0g s PHE 75 N -2.48 0.15 0.00 -0.53 0.08 -1.26 0.19 117.98 114.12 2e0g s PHE 75 Ca 0.12 -0.27 -0.05 0.00 0.12 0.00 0.00 56.93 56.85 2e0g s PHE 75 Cb -0.03 -0.11 -0.00 0.00 -0.57 0.00 0.00 43.02 42.31 2e0g s PHE 75 CO 0.03 -0.09 0.09 -2.00 -0.10 0.00 0.00 175.22 173.15 2e0g s GLU 76 N -0.74 0.40 -0.44 0.44 2.12 0.98 -4.89 118.70 116.58 2e0g s GLU 76 Ca -0.08 -0.39 -0.15 0.00 0.36 0.00 0.00 54.97 54.71 2e0g s GLU 76 Cb -0.05 0.16 0.05 0.00 0.26 0.00 0.00 34.13 34.55 2e0g s GLU 76 CO -0.00 -0.09 0.33 0.54 -0.54 0.00 0.00 175.26 175.50 2e0g s VAL 77 N -1.25 5.13 0.00 3.70 0.11 -1.26 -0.85 120.40 125.98 2e0g s VAL 77 Ca -0.13 -0.90 0.00 0.00 -2.93 0.00 0.00 61.98 58.01 2e0g s VAL 77 Cb -0.07 -3.97 0.00 0.00 -1.53 0.00 0.00 36.38 30.81 2e0g s VAL 77 CO 0.01 -0.44 0.00 0.61 -3.33 0.00 0.00 175.10 171.95 2e0g n GLY 78 N 5.15 2.61 3.75 6.54 0.00 0.18 -4.62 105.19 118.80 2e0g n GLY 78 Ca -0.12 0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 2e0g n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2e0g s THR 79 N 0.00 2.10 -0.73 2.61 2.01 -1.26 -4.88 115.64 115.49 2e0g s THR 79 Ca 0.00 -1.72 -0.04 0.00 0.31 0.00 0.00 61.69 60.24 2e0g s THR 79 Cb 0.00 -2.82 0.19 0.00 0.01 0.00 0.00 72.50 69.88 2e0g s THR 79 CO 0.00 0.00 0.58 -0.54 -0.69 0.00 0.00 174.62 173.97 2e0g s LYS 80 N -3.93 2.90 1.00 4.92 1.02 -1.26 -5.08 119.74 119.31 2e0g s LYS 80 Ca 0.36 -2.72 -0.12 0.00 0.02 0.00 0.00 55.97 53.51 2e0g s LYS 80 Cb 0.03 -3.89 0.19 0.00 -0.52 0.00 0.00 37.83 33.64 2e0g s LYS 80 CO 0.20 -1.21 1.09 -1.25 -0.92 0.00 0.00 175.35 173.26 2e0g s PRO 81 N -0.38 0.44 0.06 -1.68 0.04 -1.26 -5.08 135.00 127.13 2e0g s PRO 81 Ca 0.20 0.53 0.04 0.00 0.04 0.00 0.00 61.00 61.81 2e0g s PRO 81 Cb -0.16 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2e0g s PRO 81 CO -0.06 -2.73 -0.12 0.08 0.04 0.00 0.00 177.00 174.21 2e0g s VAL 82 N -2.96 0.94 -0.00 -0.36 1.01 -1.26 -5.15 120.40 112.61 2e0g s VAL 82 Ca 0.65 -1.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.19 2e0g s VAL 82 Cb -0.19 -0.91 0.10 0.00 0.00 0.00 0.00 36.38 35.38 2e0g s VAL 82 CO 0.58 -0.21 1.03 0.28 0.00 0.00 0.00 175.10 176.78 2e0g s THR 83 N -1.18 0.00 -0.12 3.92 -1.32 -1.26 -5.19 115.64 110.49 2e0g s THR 83 Ca -0.03 -0.21 -0.31 0.00 -1.21 0.00 0.00 61.69 59.93 2e0g s THR 83 Cb -0.09 -1.42 0.13 0.00 -1.51 0.00 0.00 72.50 69.60 2e0g s THR 83 CO 0.02 0.00 1.02 0.00 -2.21 0.00 0.00 174.62 173.45 2e0g s GLN 84 N -2.91 0.58 0.00 7.08 -2.07 -1.26 -5.12 119.66 115.96 2e0g s GLN 84 Ca 0.09 -0.06 0.00 0.00 -1.82 0.00 0.00 55.36 53.57 2e0g s GLN 84 Cb -0.00 0.27 0.00 0.00 -1.09 0.00 0.00 33.01 32.19 2e0g s GLN 84 CO -0.04 -0.22 0.00 -2.37 -1.32 0.00 0.00 175.29 171.33 2e0g n THR 85 N 0.24 0.00 -0.97 3.63 5.66 -1.26 -5.18 114.28 116.40 2e0g n THR 85 Ca -0.07 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.67 2e0g n THR 85 Cb 0.59 0.00 0.22 0.00 -1.55 0.00 0.00 70.33 69.59 2e0g n THR 85 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2e0g n PRO 86 N 0.00 -2.86 -3.61 1.09 -0.04 -1.26 -5.09 135.00 123.22 2e0g n PRO 86 Ca 0.00 -1.51 0.03 0.00 -0.04 0.00 0.00 63.50 61.98 2e0g n PRO 86 Cb 0.00 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 2e0g n PRO 86 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2e0g s GLN 87 N -5.14 0.10 -0.20 0.54 0.74 -1.26 -5.19 119.66 109.25 2e0g s GLN 87 Ca 0.61 -0.06 -0.36 0.00 0.05 0.00 0.00 55.36 55.61 2e0g s GLN 87 Cb -0.06 0.03 0.14 0.00 1.10 0.00 0.00 33.01 34.23 2e0g s GLN 87 CO 0.47 -0.05 1.31 0.00 -0.55 0.00 0.00 175.29 176.47 2e0g s ALA 88 N -2.09 -2.19 -0.30 1.58 0.00 -1.26 -5.18 121.76 112.32 2e0g s ALA 88 Ca 0.17 1.54 -0.25 0.00 0.00 0.00 0.00 51.96 53.42 2e0g s ALA 88 Cb 0.06 -0.13 0.19 0.00 0.00 0.00 0.00 23.12 23.24 2e0g s ALA 88 CO -0.06 -0.68 1.41 0.00 0.00 0.00 0.00 175.76 176.43 2e0g s ALA 89 N -2.23 -2.22 -0.01 0.00 0.00 -1.26 -5.18 121.76 110.86 2e0g s ALA 89 Ca 0.11 1.70 -0.10 0.00 0.00 0.00 0.00 51.96 53.67 2e0g s ALA 89 Cb 0.01 -1.77 0.01 0.00 0.00 0.00 0.00 23.12 21.37 2e0g s ALA 89 CO -0.04 -0.11 0.21 0.54 0.00 0.00 0.00 175.76 176.36 2e0g s VAL 90 N 0.06 0.07 -0.29 0.00 0.11 -1.26 -5.16 120.40 113.93 2e0g s VAL 90 Ca 0.07 -0.59 -0.25 0.00 -2.93 0.00 0.00 61.98 58.27 2e0g s VAL 90 Cb -0.05 -0.51 0.17 0.00 -1.53 0.00 0.00 36.38 34.46 2e0g s VAL 90 CO -0.15 -0.32 1.32 0.28 -3.33 0.00 0.00 175.10 172.90 2e0g s THR 91 N -1.34 0.00 -0.25 5.04 -1.32 -1.26 -5.19 115.64 111.32 2e0g s THR 91 Ca -0.14 0.00 -0.33 0.00 -1.21 0.00 0.00 61.69 60.01 2e0g s THR 91 Cb -0.07 -1.00 0.16 0.00 -1.51 0.00 0.00 72.50 70.09 2e0g s THR 91 CO 0.03 0.00 1.30 -0.55 -2.21 0.00 0.00 174.62 173.19 2e0g s SER 92 N -0.00 -0.08 -0.30 8.08 0.15 -1.26 -5.17 113.70 115.12 2e0g s SER 92 Ca 0.06 0.04 -0.19 0.00 0.70 0.00 0.00 55.95 56.57 2e0g s SER 92 Cb -0.05 0.08 0.18 0.00 -1.71 0.00 0.00 66.02 64.52 2e0g s SER 92 CO -0.12 -0.11 1.27 0.54 1.20 0.00 0.00 173.24 176.02 2e0g s ASN 93 N -1.60 -0.06 -0.02 5.45 4.22 -1.26 -5.18 114.94 116.49 2e0g s ASN 93 Ca 0.09 0.06 -0.09 0.00 -2.14 0.00 0.00 52.86 50.79 2e0g s ASN 93 Cb -0.01 1.06 0.01 0.00 1.28 0.00 0.00 41.25 43.59 2e0g s ASN 93 CO -0.05 -0.01 0.18 -0.69 -2.04 0.00 0.00 177.10 174.49 2e0g s VAL 94 N 2.48 0.06 -0.29 3.54 1.01 -1.26 -5.16 120.40 120.79 2e0g s VAL 94 Ca -0.04 -0.52 -0.21 0.00 0.00 0.00 0.00 61.98 61.21 2e0g s VAL 94 Cb -0.04 -0.44 0.15 0.00 0.00 0.00 0.00 36.38 36.05 2e0g s VAL 94 CO -0.12 -0.28 1.10 0.00 0.00 0.00 0.00 175.10 175.79 2e0g s ALA 95 N -1.08 -2.20 -0.32 5.51 0.00 -1.26 -5.11 121.76 117.30 2e0g s ALA 95 Ca -0.12 1.98 -0.05 0.00 0.00 0.00 0.00 51.96 53.78 2e0g s ALA 95 Cb -0.06 -1.65 0.25 0.00 0.00 0.00 0.00 23.12 21.66 2e0g s ALA 95 CO 0.02 -0.26 1.21 0.00 0.00 0.00 0.00 175.76 176.72 2e0g n ALA 96 N 2.77 -3.80 -1.03 0.00 0.00 -1.26 -5.17 120.51 112.01 2e0g n ALA 96 Ca -0.15 -0.08 -0.11 0.00 0.00 0.00 0.00 53.44 53.10 2e0g n ALA 96 Cb 0.57 -3.39 0.14 0.00 0.00 0.00 0.00 19.45 16.77 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 1.92 -2.22 -1.92 0.00 -0.04 -1.26 -5.09 135.00 126.39 2e0g n PRO 97 Ca 0.05 -0.98 -0.00 0.00 -0.04 0.00 0.00 63.50 62.53 2e0g n PRO 97 Cb 0.69 -0.92 0.00 0.00 -0.04 0.00 0.00 33.50 33.24 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 -4.05 -0.48 -3.80 0.55 0.00 -1.26 -5.19 120.51 106.27 2e0g n ALA 98 Ca -0.12 -0.16 -0.06 0.00 0.00 0.00 0.00 53.44 53.10 2e0g n ALA 98 Cb 0.33 0.08 -0.02 0.00 0.00 0.00 0.00 19.45 19.84 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 -2.01 1.61 -0.26 0.00 -2.07 -1.26 -5.19 119.66 110.49 2e0g s GLN 99 Ca 0.04 -0.87 -0.28 0.00 -1.82 0.00 0.00 55.36 52.42 2e0g s GLN 99 Cb -0.00 0.56 0.17 0.00 -1.09 0.00 0.00 33.01 32.65 2e0g s GLN 99 CO 0.01 -0.73 1.26 0.54 -1.32 0.00 0.00 175.29 175.04 2e0g s VAL 100 N -3.75 0.00 -0.18 3.63 0.11 -1.26 -5.19 120.40 113.76 2e0g s VAL 100 Ca 0.11 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.86 2e0g s VAL 100 Cb -0.05 -1.00 0.14 0.00 -1.53 0.00 0.00 36.38 33.94 2e0g s VAL 100 CO 0.04 0.00 1.05 0.00 -3.33 0.00 0.00 175.10 172.87 2e0g s ALA 101 N -0.80 -1.96 -0.19 1.54 0.00 -1.26 -5.19 121.76 113.90 2e0g s ALA 101 Ca 0.06 1.64 -0.36 0.00 0.00 0.00 0.00 51.96 53.30 2e0g s ALA 101 Cb -0.02 -0.87 0.15 0.00 0.00 0.00 0.00 23.12 22.38 2e0g s ALA 101 CO -0.07 -0.29 1.39 -0.65 0.00 0.00 0.00 175.76 176.14 2e0g s GLN 102 N -1.01 0.07 -0.09 0.00 -0.21 -1.26 -5.19 119.66 111.96 2e0g s GLN 102 Ca -0.00 -0.03 -0.32 0.00 0.02 0.00 0.00 55.36 55.03 2e0g s GLN 102 Cb -0.01 0.03 0.13 0.00 1.00 0.00 0.00 33.01 34.15 2e0g s GLN 102 CO -0.00 -0.03 1.20 -0.08 -2.12 0.00 0.00 175.29 174.25 2e0g s THR 103 N -2.08 0.00 0.18 -0.19 -1.32 -1.26 -5.19 115.64 105.78 2e0g s THR 103 Ca 0.13 -0.12 0.06 0.00 -1.21 0.00 0.00 61.69 60.55 2e0g s THR 103 Cb 0.03 -1.40 -0.05 0.00 -1.51 0.00 0.00 72.50 69.57 2e0g s THR 103 CO -0.04 0.00 -0.11 -1.10 -2.21 0.00 0.00 174.62 171.16 2e0g s GLN 104 N -2.53 1.19 1.24 7.08 -0.21 -1.26 -5.16 119.66 120.00 2e0g s GLN 104 Ca 0.11 -1.52 -0.20 0.00 0.02 0.00 0.00 55.36 53.76 2e0g s GLN 104 Cb 0.01 -0.81 0.30 0.00 1.00 0.00 0.00 33.01 33.51 2e0g s GLN 104 CO -0.04 0.10 1.11 -1.25 -2.12 0.00 0.00 175.29 173.09 2e0g s PRO 105 N -3.72 -1.49 -0.06 2.91 0.04 -1.26 -5.09 135.00 126.33 2e0g s PRO 105 Ca 0.20 -0.16 -0.03 0.00 0.04 0.00 0.00 61.00 61.04 2e0g s PRO 105 Cb 0.02 -1.57 0.03 0.00 0.04 0.00 0.00 34.50 33.01 2e0g s PRO 105 CO 0.04 -3.87 0.14 -1.14 0.04 0.00 0.00 177.00 172.21 2e0g s GLN 106 N -5.48 0.11 0.00 4.56 0.74 -1.26 -5.37 119.66 112.97 2e0g s GLN 106 Ca 0.72 0.31 0.15 0.00 0.05 0.00 0.00 55.36 56.59 2e0g s GLN 106 Cb -0.08 -0.09 0.12 0.00 1.10 0.00 0.00 33.01 34.06 2e0g s GLN 106 CO 0.56 -0.12 0.98 -2.13 -0.55 0.00 0.00 175.29 174.03