#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5q s SER 2 N 0.00 6.46 0.04 1.61 1.04 -1.26 -4.99 113.70 116.60 1x5q s SER 2 Ca 0.00 1.14 -0.30 0.00 0.48 0.00 0.00 55.95 57.27 1x5q s SER 2 Cb 0.00 -2.33 -0.09 0.00 0.10 0.00 0.00 66.02 63.70 1x5q s SER 2 CO 0.00 -0.48 1.85 -0.44 0.98 0.00 0.00 173.24 175.15 1x5q s SER 3 N -3.41 6.49 0.00 7.02 0.01 -1.26 -4.93 113.70 117.62 1x5q s SER 3 Ca 0.51 2.60 0.00 0.00 1.31 0.00 0.00 55.95 60.37 1x5q s SER 3 Cb -0.10 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.58 1x5q s SER 3 CO 0.36 -1.01 0.37 0.61 0.41 0.00 0.00 173.24 173.98 1x5q n GLY 4 N 4.35 -1.05 3.75 3.44 0.00 -1.26 -4.91 105.19 109.52 1x5q n GLY 4 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 1x5q n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5q s SER 5 N -2.10 5.22 0.43 1.61 0.15 -1.26 -5.13 113.70 112.61 1x5q s SER 5 Ca 0.00 -0.28 0.08 0.00 0.70 0.00 0.00 55.95 56.45 1x5q s SER 5 Cb 0.00 -1.26 0.00 0.00 -1.71 0.00 0.00 66.02 63.05 1x5q s SER 5 CO 0.00 0.05 0.49 -0.94 1.20 0.00 0.00 173.24 174.04 1x5q s SER 6 N -3.26 5.31 0.24 5.45 1.04 -1.26 -5.01 113.70 116.21 1x5q s SER 6 Ca 0.30 -0.62 0.00 0.00 0.48 0.00 0.00 55.95 56.11 1x5q s SER 6 Cb -0.09 -0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.51 1x5q s SER 6 CO 0.22 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.29 1x5q n GLY 7 N -1.73 -1.76 1.43 7.32 0.00 -1.26 -5.17 105.19 104.02 1x5q n GLY 7 Ca 0.06 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.56 1x5q n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x5q n GLU 8 N -3.00 -4.07 -2.43 1.61 1.02 -1.26 -4.82 120.64 107.70 1x5q n GLU 8 Ca 0.00 3.00 -0.43 0.00 -0.02 0.00 0.00 57.16 59.71 1x5q n GLU 8 Cb 0.00 -3.35 -0.02 0.00 -0.02 0.00 0.00 31.44 28.04 1x5q n GLU 8 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1x5q s PRO 9 N -3.56 4.29 -0.08 3.49 0.04 -1.26 -5.02 135.00 132.89 1x5q s PRO 9 Ca 0.00 1.69 0.03 0.00 0.04 0.00 0.00 61.00 62.76 1x5q s PRO 9 Cb 0.00 -3.66 0.01 0.00 0.04 0.00 0.00 34.50 30.88 1x5q s PRO 9 CO 0.00 -0.58 -0.17 0.00 0.04 0.00 0.00 177.00 176.28 1x5q s ALA 10 N 2.87 1.67 0.59 8.56 0.00 -1.26 -5.13 121.76 129.05 1x5q s ALA 10 Ca 0.56 -0.67 -0.07 0.00 0.00 0.00 0.00 51.96 51.78 1x5q s ALA 10 Cb -0.24 -0.69 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 1x5q s ALA 10 CO 0.19 0.16 0.92 1.03 0.00 0.00 0.00 175.76 178.06 1x5q s ARG 11 N 0.58 3.12 -0.04 0.00 0.52 -1.26 -5.09 118.95 116.77 1x5q s ARG 11 Ca -0.15 0.19 0.06 0.00 -0.52 0.00 0.00 55.73 55.31 1x5q s ARG 11 Cb -0.17 -2.23 -0.02 0.00 0.52 0.00 0.00 34.95 33.05 1x5q s ARG 11 CO 0.05 -0.63 -0.24 0.42 0.02 0.00 0.00 175.30 174.92 1x5q s ILE 12 N -3.02 2.21 -0.30 1.52 1.01 -1.26 -5.11 121.20 116.26 1x5q s ILE 12 Ca 0.53 -1.03 -0.25 0.00 0.00 0.00 0.00 60.65 59.90 1x5q s ILE 12 Cb -0.11 -1.79 0.19 0.00 0.01 0.00 0.00 42.46 40.76 1x5q s ILE 12 CO 0.47 0.58 1.42 -1.83 0.00 0.00 0.00 174.94 175.57 1x5q s GLU 13 N -0.43 0.09 0.45 2.79 -1.05 -1.26 -5.15 118.70 114.14 1x5q s GLU 13 Ca 0.05 0.10 -0.17 0.00 -0.15 0.00 0.00 54.97 54.80 1x5q s GLU 13 Cb -0.12 0.04 -0.14 0.00 -0.44 0.00 0.00 34.13 33.48 1x5q s GLU 13 CO 0.01 -0.01 -0.10 0.39 0.95 0.00 0.00 175.26 176.50 1x5q n GLU 14 N 1.64 0.00 -4.57 -4.83 4.71 -1.26 -4.79 120.64 111.54 1x5q n GLU 14 Ca -0.10 0.00 -0.27 0.00 -0.01 0.00 0.00 57.16 56.78 1x5q n GLU 14 Cb 0.57 -0.91 -0.11 0.00 -1.01 0.00 0.00 31.44 29.98 1x5q n GLU 14 CO 0.00 0.00 0.00 -1.83 0.09 0.00 0.00 177.13 175.39 1x5q s GLU 15 N -0.91 1.87 0.14 3.49 -1.05 0.59 -4.81 118.70 118.01 1x5q s GLU 15 Ca 0.52 -2.01 -0.24 0.00 -0.15 0.00 0.00 54.97 53.09 1x5q s GLU 15 Cb -0.46 -1.63 -0.07 0.00 -0.44 0.00 0.00 34.13 31.53 1x5q s GLU 15 CO 0.60 0.04 0.74 -1.21 0.95 0.00 0.00 175.26 176.38 1x5q s GLU 16 N -3.67 4.50 0.05 -4.83 2.02 -1.26 0.07 118.70 115.58 1x5q s GLU 16 Ca 0.34 1.08 0.01 0.00 0.02 0.00 0.00 54.97 56.41 1x5q s GLU 16 Cb 0.06 -3.27 -0.03 0.00 0.10 0.00 0.00 34.13 30.99 1x5q s GLU 16 CO 0.17 0.55 -0.05 -0.51 0.02 0.00 0.00 175.26 175.44 1x5q s LEU 17 N -1.01 2.36 -0.27 1.80 1.43 0.14 -4.92 118.68 118.21 1x5q s LEU 17 Ca 0.35 -0.74 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 1x5q s LEU 17 Cb -0.22 0.01 0.08 0.00 0.03 0.00 0.00 46.19 46.09 1x5q s LEU 17 CO 0.25 -0.38 0.01 -0.89 0.23 0.00 0.00 176.35 175.57 1x5q s THR 18 N -2.48 1.40 0.42 5.49 2.01 -1.26 -0.48 115.64 120.75 1x5q s THR 18 Ca -0.03 -1.41 0.00 0.00 0.31 0.00 0.00 61.69 60.57 1x5q s THR 18 Cb -0.03 -1.85 -0.01 0.00 0.01 0.00 0.00 72.50 70.62 1x5q s THR 18 CO -0.03 -0.35 0.64 -0.22 -0.69 0.00 0.00 174.62 173.96 1x5q s LEU 19 N 1.41 3.76 -0.06 4.42 2.96 0.87 -4.90 118.68 127.13 1x5q s LEU 19 Ca 0.02 0.34 -0.00 0.00 -0.22 0.00 0.00 54.13 54.27 1x5q s LEU 19 Cb -0.18 -3.22 0.03 0.00 0.50 0.00 0.00 46.19 43.31 1x5q s LEU 19 CO -0.12 -0.57 -0.01 -0.89 -1.32 0.00 0.00 176.35 173.44 1x5q s THR 20 N -2.48 0.39 0.14 3.68 2.01 -1.26 -0.71 115.64 117.41 1x5q s THR 20 Ca 0.46 0.05 0.09 0.00 0.31 0.00 0.00 61.69 62.60 1x5q s THR 20 Cb -0.10 -0.51 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 1x5q s THR 20 CO 0.37 0.24 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.75 1x5q s ILE 21 N 1.56 2.94 -0.12 1.82 1.01 0.12 -4.58 121.20 123.95 1x5q s ILE 21 Ca -0.01 -1.58 -0.05 0.00 0.00 0.00 0.00 60.65 59.01 1x5q s ILE 21 Cb -0.13 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 1x5q s ILE 21 CO -0.03 0.02 0.07 -0.76 0.00 0.00 0.00 174.94 174.23 1x5q s LEU 22 N -2.39 3.94 -0.21 2.97 1.43 -1.26 0.19 118.68 123.35 1x5q s LEU 22 Ca 0.20 0.26 -0.22 0.00 -1.03 0.00 0.00 54.13 53.35 1x5q s LEU 22 Cb -0.10 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.16 1x5q s LEU 22 CO 0.12 0.36 0.69 -0.13 0.23 0.00 0.00 176.35 177.62 1x5q s ARG 23 N -0.73 4.21 0.00 1.70 0.52 -0.42 -4.37 118.95 119.85 1x5q s ARG 23 Ca 0.12 0.72 0.00 0.00 -0.52 0.00 0.00 55.73 56.05 1x5q s ARG 23 Cb -0.12 -3.60 0.00 0.00 0.52 0.00 0.00 34.95 31.75 1x5q s ARG 23 CO 0.03 -0.32 0.00 1.04 0.02 0.00 0.00 175.30 176.07 1x5q n GLN 24 N 5.32 0.00 0.00 3.54 6.02 -1.26 -4.94 117.38 126.05 1x5q n GLN 24 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 1x5q n GLN 24 Cb 0.49 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.75 1x5q n GLN 24 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1x5q n THR 25 N 0.00 0.00 0.12 5.09 -2.24 -1.26 -4.75 114.28 111.23 1x5q n THR 25 Ca 0.00 0.23 -0.23 0.00 -2.27 0.00 0.00 64.05 61.78 1x5q n THR 25 Cb 0.00 -1.07 -0.14 0.00 -2.10 0.00 0.00 70.33 67.02 1x5q n THR 25 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1x5q h GLY 26 N 0.00 0.62 -0.67 3.38 0.00 -1.99 -3.50 103.07 100.92 1x5q h GLY 26 Ca 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 47.33 45.88 1x5q h GLY 26 CO 0.00 1.27 0.00 0.61 0.00 0.00 0.00 176.54 178.42 1x5q n GLY 27 N 1.54 -0.51 1.79 4.60 0.00 -1.26 -5.05 105.19 106.29 1x5q n GLY 27 Ca -0.15 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1x5q n GLY 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x5q n LEU 28 N 0.00 -6.08 -3.02 0.99 4.32 -1.26 -4.87 117.00 107.08 1x5q n LEU 28 Ca 0.00 3.05 -0.31 0.00 -0.02 0.00 0.00 56.01 58.73 1x5q n LEU 28 Cb 0.00 -2.90 -0.01 0.00 -1.62 0.00 0.00 43.42 38.89 1x5q n LEU 28 CO 0.00 -0.83 0.53 0.61 -1.22 0.00 0.00 177.39 176.49 1x5q n GLY 29 N 0.74 5.79 3.22 -0.72 0.00 -1.26 -4.91 105.19 108.05 1x5q n GLY 29 Ca 0.00 -2.72 -0.13 0.00 0.00 0.00 0.00 46.02 43.17 1x5q n GLY 29 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1x5q s ILE 30 N -4.67 0.84 0.16 -0.61 -5.25 -1.26 0.72 121.20 111.13 1x5q s ILE 30 Ca 0.47 -1.99 0.11 0.00 -0.99 0.00 0.00 60.65 58.25 1x5q s ILE 30 Cb 0.29 -1.90 -0.04 0.00 2.95 0.00 0.00 42.46 43.76 1x5q s ILE 30 CO -0.16 -0.69 -0.25 -0.44 -1.79 0.00 0.00 174.94 171.61 1x5q s SER 31 N -3.13 3.27 0.21 4.36 0.01 0.44 -4.92 113.70 113.94 1x5q s SER 31 Ca 0.18 -0.81 0.09 0.00 1.31 0.00 0.00 55.95 56.72 1x5q s SER 31 Cb 0.05 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 66.01 1x5q s SER 31 CO 0.00 0.13 -0.09 0.27 0.41 0.00 0.00 173.24 173.96 1x5q s ILE 32 N -1.42 3.15 -0.24 1.44 -4.36 -1.26 0.19 121.20 118.70 1x5q s ILE 32 Ca 0.17 -1.80 -0.09 0.00 -0.26 0.00 0.00 60.65 58.66 1x5q s ILE 32 Cb -0.09 -2.60 0.10 0.00 1.25 0.00 0.00 42.46 41.13 1x5q s ILE 32 CO 0.08 -0.20 0.53 0.00 0.24 0.00 0.00 174.94 175.59 1x5q s ALA 33 N -1.93 -1.57 0.00 2.27 0.00 -0.57 -4.62 121.76 115.35 1x5q s ALA 33 Ca 0.27 1.92 0.00 0.00 0.00 0.00 0.00 51.96 54.14 1x5q s ALA 33 Cb -0.08 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.54 1x5q s ALA 33 CO 0.16 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.55 1x5q n GLY 34 N 5.29 0.47 0.00 0.00 0.00 -1.25 -3.18 105.19 106.51 1x5q n GLY 34 Ca -0.11 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1x5q n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x5q n GLY 35 N 0.00 -1.21 3.52 -0.02 0.00 -1.25 -4.49 105.19 101.75 1x5q n GLY 35 Ca 0.00 -1.29 -0.49 0.00 0.00 0.00 0.00 46.02 44.24 1x5q n GLY 35 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1x5q n LYS 36 N 0.14 0.69 0.00 1.61 4.81 -0.96 -1.48 118.16 122.97 1x5q n LYS 36 Ca 0.00 0.25 0.00 0.00 -0.87 0.00 0.00 58.31 57.69 1x5q n LYS 36 Cb 0.00 -1.58 0.00 0.00 0.02 0.00 0.00 35.03 33.47 1x5q n LYS 36 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x5q n GLY 37 N 1.80 2.52 3.69 3.14 0.00 -1.26 -4.54 105.19 110.54 1x5q n GLY 37 Ca 0.16 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 45.35 1x5q n GLY 37 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5q s SER 38 N 0.00 2.90 0.45 1.61 0.15 -0.55 -4.98 113.70 113.28 1x5q s SER 38 Ca 0.00 1.26 -0.24 0.00 0.70 0.00 0.00 55.95 57.67 1x5q s SER 38 Cb 0.00 -1.92 -0.07 0.00 -1.71 0.00 0.00 66.02 62.31 1x5q s SER 38 CO 0.00 -2.97 1.25 -0.89 1.20 0.00 0.00 173.24 171.83 1x5q s THR 39 N -2.97 2.76 0.41 6.45 2.01 -1.26 -4.68 115.64 118.35 1x5q s THR 39 Ca 0.65 0.61 -0.24 0.00 0.31 0.00 0.00 61.69 63.02 1x5q s THR 39 Cb -0.18 -3.33 -0.09 0.00 0.01 0.00 0.00 72.50 68.91 1x5q s THR 39 CO 0.57 0.03 1.05 -2.16 -0.69 0.00 0.00 174.62 173.43 1x5q s PRO 40 N -2.54 4.12 0.08 4.92 0.04 -1.26 -3.94 135.00 136.42 1x5q s PRO 40 Ca 0.62 1.51 -0.11 0.00 0.04 0.00 0.00 61.00 63.07 1x5q s PRO 40 Cb -0.34 -2.50 -0.24 0.00 0.04 0.00 0.00 34.50 31.45 1x5q s PRO 40 CO 0.42 -0.18 1.16 -0.92 0.04 0.00 0.00 177.00 177.52 1x5q h TYR 41 N 2.41 0.84 -3.17 0.56 3.20 -1.75 -3.44 116.97 115.62 1x5q h TYR 41 Ca -0.48 -0.52 -0.56 0.00 3.14 0.00 0.00 58.73 60.30 1x5q h TYR 41 Cb 1.22 -0.07 -0.36 0.00 1.54 0.00 0.00 36.73 39.06 1x5q h TYR 41 CO 0.58 1.37 -0.82 0.15 -1.64 0.00 0.00 178.16 177.80 1x5q s LYS 42 N -3.00 1.92 0.00 1.82 1.02 -1.26 -5.09 119.74 115.15 1x5q s LYS 42 Ca -0.08 -0.41 0.00 0.00 0.02 0.00 0.00 55.97 55.50 1x5q s LYS 42 Cb 0.07 -1.83 0.00 0.00 -0.52 0.00 0.00 37.83 35.55 1x5q s LYS 42 CO 0.91 -0.23 0.00 0.41 -0.92 0.00 0.00 175.35 175.52 1x5q n GLY 43 N 4.77 0.69 2.78 -3.33 0.00 -1.26 -2.37 105.19 106.46 1x5q n GLY 43 Ca -0.15 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 1x5q n GLY 43 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x5q n ASP 44 N -3.82 4.88 -3.85 1.61 8.00 -1.26 -4.62 116.55 117.49 1x5q n ASP 44 Ca 0.00 -2.99 -0.29 0.00 0.71 0.00 0.00 54.79 52.21 1x5q n ASP 44 Cb 0.00 -1.54 -0.16 0.00 -0.02 0.00 0.00 41.12 39.40 1x5q n ASP 44 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1x5q s ASP 45 N 1.74 3.58 -0.70 -2.24 1.11 -1.00 -5.01 116.67 114.15 1x5q s ASP 45 Ca 0.44 -1.13 -0.07 0.00 0.18 0.00 0.00 52.55 51.96 1x5q s ASP 45 Cb 0.12 -0.97 -0.16 0.00 1.07 0.00 0.00 42.92 42.98 1x5q s ASP 45 CO -0.04 -0.28 3.26 -1.84 1.18 0.00 0.00 175.17 177.45 1x5q n GLU 46 N 4.80 2.79 -4.49 8.23 0.00 -1.26 -4.32 120.64 126.39 1x5q n GLU 46 Ca -0.09 -1.67 -0.24 0.00 0.00 0.00 0.00 57.16 55.16 1x5q n GLU 46 Cb 0.45 -2.34 -0.10 0.00 0.00 0.00 0.00 31.44 29.45 1x5q n GLU 46 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1x5q s GLY 47 N 1.86 1.98 -0.39 -1.84 0.00 -1.26 -3.78 107.32 103.89 1x5q s GLY 47 Ca 0.67 -1.96 -0.21 0.00 0.00 0.00 0.00 44.72 43.22 1x5q s GLY 47 CO -0.04 -1.97 0.69 -0.42 0.00 0.00 0.00 173.10 171.36 1x5q s ILE 48 N -2.65 4.81 0.19 0.90 -1.09 -1.26 -3.77 121.20 118.33 1x5q s ILE 48 Ca 0.30 0.50 0.10 0.00 -2.23 0.00 0.00 60.65 59.33 1x5q s ILE 48 Cb -0.00 -4.17 -0.04 0.00 -1.58 0.00 0.00 42.46 36.66 1x5q s ILE 48 CO 0.15 -0.47 -0.13 -0.36 -1.23 0.00 0.00 174.94 172.91 1x5q s PHE 49 N 2.90 2.55 0.12 3.97 0.40 -1.19 -0.17 117.98 126.55 1x5q s PHE 49 Ca 0.26 -0.26 -0.31 0.00 -0.60 0.00 0.00 56.93 56.02 1x5q s PHE 49 Cb -0.14 -1.23 -0.08 0.00 0.51 0.00 0.00 43.02 42.08 1x5q s PHE 49 CO 0.17 0.53 1.41 0.42 0.70 0.00 0.00 175.22 178.45 1x5q s ILE 50 N -1.78 3.22 -0.18 0.64 -1.09 -0.85 -1.52 121.20 119.65 1x5q s ILE 50 Ca 0.25 0.88 -0.09 0.00 -2.23 0.00 0.00 60.65 59.46 1x5q s ILE 50 Cb -0.08 -3.56 -0.22 0.00 -1.58 0.00 0.00 42.46 37.02 1x5q s ILE 50 CO 0.14 0.07 0.16 -0.24 -1.23 0.00 0.00 174.94 173.84 1x5q n SER 51 N 3.92 2.03 -3.84 3.58 2.88 0.51 -2.12 113.62 120.57 1x5q n SER 51 Ca 0.12 0.21 -0.09 0.00 -1.33 0.00 0.00 58.87 57.77 1x5q n SER 51 Cb 0.42 -0.80 -0.07 0.00 -0.75 0.00 0.00 64.21 63.00 1x5q n SER 51 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1x5q s ARG 52 N -2.50 0.81 -0.29 -1.46 6.06 -1.21 -4.88 118.95 115.48 1x5q s ARG 52 Ca -0.28 -0.84 -0.02 0.00 -2.50 0.00 0.00 55.73 52.09 1x5q s ARG 52 Cb 0.08 0.33 0.10 0.00 0.06 0.00 0.00 34.95 35.52 1x5q s ARG 52 CO 0.67 -0.26 0.11 0.08 -2.50 0.00 0.00 175.30 173.41 1x5q s VAL 53 N -3.45 0.43 0.25 7.11 1.01 -1.26 -0.42 120.40 124.06 1x5q s VAL 53 Ca 0.02 -1.06 -0.28 0.00 0.00 0.00 0.00 61.98 60.65 1x5q s VAL 53 Cb 0.03 -1.32 -0.15 0.00 0.00 0.00 0.00 36.38 34.94 1x5q s VAL 53 CO -0.09 -0.67 0.84 -1.20 0.00 0.00 0.00 175.10 173.98 1x5q n SER 54 N 5.04 0.35 -0.03 3.32 7.64 0.22 -4.89 113.62 125.27 1x5q n SER 54 Ca -0.04 1.16 -0.14 0.00 1.01 0.00 0.00 58.87 60.86 1x5q n SER 54 Cb 0.42 -1.16 -0.10 0.00 -1.01 0.00 0.00 64.21 62.36 1x5q n SER 54 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1x5q h GLU 55 N 1.71 0.11 -2.02 1.43 5.08 -2.00 -3.30 114.58 115.60 1x5q h GLU 55 Ca -0.36 -0.08 -0.77 0.00 -1.00 0.00 0.00 59.36 57.15 1x5q h GLU 55 Cb 1.38 0.02 -0.28 0.00 0.50 0.00 0.00 28.75 30.37 1x5q h GLU 55 CO 0.60 0.73 0.97 -0.85 -1.00 0.00 0.00 179.01 179.46 1x5q n GLU 56 N -4.67 3.19 -4.43 2.33 0.28 -1.26 -4.80 120.64 111.29 1x5q n GLU 56 Ca -0.09 -3.75 -0.29 0.00 -0.16 0.00 0.00 57.16 52.87 1x5q n GLU 56 Cb 0.38 -2.30 -0.06 0.00 1.43 0.00 0.00 31.44 30.88 1x5q n GLU 56 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1x5q s GLY 57 N -1.25 2.69 0.20 -1.84 0.00 -1.24 -5.04 107.32 100.84 1x5q s GLY 57 Ca 0.50 -1.12 0.07 0.00 0.00 0.00 0.00 44.72 44.16 1x5q s GLY 57 CO -0.36 -2.08 1.47 -0.56 0.00 0.00 0.00 173.10 171.57 1x5q h PRO 58 N 1.27 0.09 0.50 2.90 0.13 -1.90 -3.26 132.00 131.73 1x5q h PRO 58 Ca -0.42 -0.08 -0.02 0.00 -0.87 0.00 0.00 66.00 64.60 1x5q h PRO 58 Cb 1.29 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1x5q h PRO 58 CO 0.70 0.81 -0.24 0.00 -0.23 0.00 0.00 178.00 179.05 1x5q h ALA 59 N 1.16 -0.67 -1.00 -0.56 0.00 -1.89 -1.91 119.26 114.38 1x5q h ALA 59 Ca -0.02 -0.19 0.35 0.00 0.00 0.00 0.00 54.91 55.06 1x5q h ALA 59 Cb 1.36 0.26 -0.18 0.00 0.00 0.00 0.00 17.79 19.23 1x5q h ALA 59 CO 0.11 -0.76 0.31 0.00 0.00 0.00 0.00 179.25 178.90 1x5q n ALA 60 N -2.52 0.80 -0.07 0.00 0.00 -1.24 0.18 120.51 117.66 1x5q n ALA 60 Ca -0.11 1.04 -0.11 0.00 0.00 0.00 0.00 53.44 54.26 1x5q n ALA 60 Cb 0.31 -0.91 -0.05 0.00 0.00 0.00 0.00 19.45 18.80 1x5q n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x5q h ARG 61 N 0.00 0.36 -0.87 0.00 3.08 -1.54 -2.80 114.38 112.61 1x5q h ARG 61 Ca 0.74 -0.10 0.15 0.00 0.07 0.00 0.00 59.98 60.84 1x5q h ARG 61 Cb 1.80 -0.04 -0.10 0.00 0.08 0.00 0.00 29.97 31.71 1x5q h ARG 61 CO -0.85 0.51 0.46 0.00 -1.07 0.00 0.00 179.97 179.03 1x5q h ALA 62 N 0.83 1.33 0.00 0.04 0.00 0.28 -3.45 119.26 118.28 1x5q h ALA 62 Ca 0.06 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1x5q h ALA 62 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1x5q h ALA 62 CO 0.01 -0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.58 1x5q n GLY 63 N -1.33 2.00 3.82 0.00 0.00 0.04 -4.83 105.19 104.89 1x5q n GLY 63 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1x5q n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x5q s VAL 64 N -2.00 4.10 -0.02 1.61 0.11 -1.18 -5.03 120.40 117.99 1x5q s VAL 64 Ca 0.00 0.77 -0.02 0.00 -2.93 0.00 0.00 61.98 59.80 1x5q s VAL 64 Cb 0.00 -3.48 0.00 0.00 -1.53 0.00 0.00 36.38 31.38 1x5q s VAL 64 CO 0.00 -0.81 0.05 -0.13 -3.33 0.00 0.00 175.10 170.88 1x5q s ARG 65 N -4.78 0.10 0.43 1.54 3.00 -1.26 -4.77 118.95 113.21 1x5q s ARG 65 Ca 0.59 0.00 -0.26 0.00 0.00 0.00 0.00 55.73 56.07 1x5q s ARG 65 Cb -0.14 0.04 -0.09 0.00 0.00 0.00 0.00 34.95 34.77 1x5q s ARG 65 CO 0.49 -0.01 1.42 0.08 0.00 0.00 0.00 175.30 177.28 1x5q s VAL 66 N -0.14 2.12 0.00 3.52 1.01 -1.26 -2.08 120.40 123.57 1x5q s VAL 66 Ca -0.02 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1x5q s VAL 66 Cb -0.01 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.30 1x5q s VAL 66 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.73 1x5q n GLY 67 N 0.57 3.13 3.68 4.51 0.00 -0.90 -4.95 105.19 111.24 1x5q n GLY 67 Ca 0.04 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.50 1x5q n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x5q n ASP 68 N 0.00 2.41 -4.55 1.61 9.92 -0.88 -4.42 116.55 120.63 1x5q n ASP 68 Ca 0.00 1.01 -0.40 0.00 -0.53 0.00 0.00 54.79 54.87 1x5q n ASP 68 Cb 0.00 -1.16 -0.03 0.00 -0.64 0.00 0.00 41.12 39.29 1x5q n ASP 68 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1x5q s LYS 69 N 3.87 3.28 0.31 -1.24 2.20 -1.17 -2.00 119.74 124.99 1x5q s LYS 69 Ca 1.00 -0.51 -0.30 0.00 -0.36 0.00 0.00 55.97 55.81 1x5q s LYS 69 Cb -1.04 -4.62 -0.12 0.00 -1.51 0.00 0.00 37.83 30.54 1x5q s LYS 69 CO 0.64 -2.23 1.51 -0.11 -0.36 0.00 0.00 175.35 174.80 1x5q n LEU 70 N 9.50 4.20 -0.02 5.43 -0.00 0.75 -0.16 117.00 136.70 1x5q n LEU 70 Ca 0.15 1.17 -0.03 0.00 -0.00 0.00 0.00 56.01 57.30 1x5q n LEU 70 Cb 0.50 -1.57 -0.02 0.00 -0.00 0.00 0.00 43.42 42.33 1x5q n LEU 70 CO 0.69 -0.00 -0.65 0.18 -0.00 0.00 0.00 177.39 177.61 1x5q n LEU 71 N 1.64 2.87 -3.72 -1.96 4.77 0.53 -4.37 117.00 116.75 1x5q n LEU 71 Ca 0.07 -0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.89 1x5q n LEU 71 Cb 0.36 -0.16 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 1x5q n LEU 71 CO 0.64 0.55 0.09 -0.70 -1.33 0.00 0.00 177.39 176.64 1x5q s GLU 72 N -2.09 0.65 -0.14 3.23 -6.30 -0.87 0.34 118.70 113.51 1x5q s GLU 72 Ca -0.06 0.12 -0.02 0.00 -2.50 0.00 0.00 54.97 52.51 1x5q s GLU 72 Cb 0.02 0.30 0.05 0.00 0.00 0.00 0.00 34.13 34.49 1x5q s GLU 72 CO 0.10 -0.16 0.02 0.08 0.02 0.00 0.00 175.26 175.32 1x5q s VAL 73 N -0.78 0.50 0.00 3.70 1.01 0.18 0.12 120.40 125.13 1x5q s VAL 73 Ca -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1x5q s VAL 73 Cb -0.04 -0.85 0.00 0.00 0.00 0.00 0.00 36.38 35.49 1x5q s VAL 73 CO 0.04 0.00 0.00 -3.20 0.00 0.00 0.00 175.10 171.94 1x5q n ASN 74 N 5.08 -1.18 0.00 3.32 4.05 0.19 -2.53 115.26 124.18 1x5q n ASN 74 Ca -0.08 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.95 1x5q n ASN 74 Cb 0.48 -0.50 0.00 0.00 1.23 0.00 0.00 39.78 40.99 1x5q n ASN 74 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1x5q n GLY 75 N -2.18 2.34 3.72 8.20 0.00 -1.26 -4.96 105.19 111.04 1x5q n GLY 75 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1x5q n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x5q s VAL 76 N -2.17 3.90 -0.28 1.61 0.11 -1.05 -4.97 120.40 117.55 1x5q s VAL 76 Ca 0.00 1.42 -0.29 0.00 -2.93 0.00 0.00 61.98 60.18 1x5q s VAL 76 Cb 0.00 -3.91 0.01 0.00 -1.53 0.00 0.00 36.38 30.95 1x5q s VAL 76 CO 0.00 0.14 1.17 0.00 -3.33 0.00 0.00 175.10 173.08 1x5q s ALA 77 N 0.78 3.51 -0.46 1.54 0.00 -1.26 -0.64 121.76 125.23 1x5q s ALA 77 Ca 0.57 0.11 0.03 0.00 0.00 0.00 0.00 51.96 52.67 1x5q s ALA 77 Cb -0.30 -3.68 0.64 0.00 0.00 0.00 0.00 23.12 19.78 1x5q s ALA 77 CO 0.31 -1.46 1.92 1.28 0.00 0.00 0.00 175.76 177.81 1x5q n LEU 78 N 6.98 6.79 -4.58 0.00 4.77 0.15 -4.88 117.00 126.23 1x5q n LEU 78 Ca 0.13 -3.64 -0.42 0.00 -0.03 0.00 0.00 56.01 52.05 1x5q n LEU 78 Cb 0.46 -0.85 -0.03 0.00 -2.33 0.00 0.00 43.42 40.68 1x5q n LEU 78 CO 0.59 1.08 1.41 -1.10 -1.33 0.00 0.00 177.39 178.03 1x5q s GLN 79 N -3.31 3.21 -1.23 3.23 -0.21 -1.23 -3.07 119.66 117.06 1x5q s GLN 79 Ca 0.57 0.85 -0.06 0.00 0.02 0.00 0.00 55.36 56.74 1x5q s GLN 79 Cb 0.48 -4.18 0.01 0.00 1.00 0.00 0.00 33.01 30.31 1x5q s GLN 79 CO 0.10 -2.02 1.06 0.41 -2.12 0.00 0.00 175.29 172.71 1x5q n GLY 80 N 5.37 -0.41 3.92 3.09 0.00 -1.25 -5.00 105.19 110.91 1x5q n GLY 80 Ca 0.18 0.16 -0.31 0.00 0.00 0.00 0.00 46.02 46.05 1x5q n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5q s ALA 81 N -3.31 3.99 0.89 4.61 0.00 -1.17 -4.52 121.76 122.24 1x5q s ALA 81 Ca 0.37 -0.87 -0.11 0.00 0.00 0.00 0.00 51.96 51.35 1x5q s ALA 81 Cb -0.16 -1.81 0.12 0.00 0.00 0.00 0.00 23.12 21.28 1x5q s ALA 81 CO 0.68 0.80 1.10 -1.21 0.00 0.00 0.00 175.76 177.13 1x5q s GLU 82 N -2.57 1.31 0.11 0.00 2.02 -1.26 -2.26 118.70 116.05 1x5q s GLU 82 Ca 0.35 1.05 -0.34 0.00 0.02 0.00 0.00 54.97 56.04 1x5q s GLU 82 Cb -0.13 -1.80 -0.14 0.00 0.10 0.00 0.00 34.13 32.17 1x5q s GLU 82 CO 0.28 -2.27 1.54 1.25 0.02 0.00 0.00 175.26 176.08 1x5q h HIS 83 N -1.58 -1.54 -0.55 1.61 2.76 -1.80 -0.69 115.15 113.36 1x5q h HIS 83 Ca -0.48 0.05 0.10 0.00 -2.20 0.00 0.00 60.37 57.84 1x5q h HIS 83 Cb 1.27 0.67 -0.11 0.00 1.55 0.00 0.00 27.41 30.79 1x5q h HIS 83 CO 0.47 -0.57 -0.32 1.12 -1.30 0.00 0.00 177.93 177.32 1x5q h HIS 84 N -0.69 -0.89 -0.80 5.26 2.07 -1.96 0.33 115.15 118.48 1x5q h HIS 84 Ca 0.01 0.07 0.19 0.00 -2.85 0.00 0.00 60.37 57.78 1x5q h HIS 84 Cb 0.72 0.47 -0.14 0.00 2.57 0.00 0.00 27.41 31.04 1x5q h HIS 84 CO -0.50 -0.38 0.04 0.93 -3.07 0.00 0.00 177.93 174.96 1x5q h GLU 85 N -0.17 0.11 0.65 5.12 5.08 -1.68 0.76 114.58 124.45 1x5q h GLU 85 Ca 0.22 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.55 1x5q h GLU 85 Cb 0.54 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.77 1x5q h GLU 85 CO -0.65 0.07 -0.31 0.00 -1.00 0.00 0.00 179.01 177.12 1x5q h ALA 86 N 1.74 -1.00 -0.65 3.43 0.00 0.94 -2.08 119.26 121.64 1x5q h ALA 86 Ca 0.45 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 55.23 1x5q h ALA 86 Cb 0.82 0.34 -0.10 0.00 0.00 0.00 0.00 17.79 18.85 1x5q h ALA 86 CO -0.69 -0.94 -0.57 0.28 0.00 0.00 0.00 179.25 177.33 1x5q h VAL 87 N -1.07 0.00 -0.80 0.00 2.07 0.47 0.66 116.25 117.58 1x5q h VAL 87 Ca -0.09 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.53 1x5q h VAL 87 Cb 0.67 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.32 1x5q h VAL 87 CO 0.15 0.00 -0.49 -0.08 0.02 0.00 0.00 177.57 177.17 1x5q h GLU 88 N -0.24 -0.11 -0.11 1.57 4.22 0.46 0.14 114.58 120.51 1x5q h GLU 88 Ca 0.11 0.01 0.02 0.00 0.08 0.00 0.00 59.36 59.58 1x5q h GLU 88 Cb 0.52 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 1x5q h GLU 88 CO -0.73 -0.08 -0.45 0.00 -2.18 0.00 0.00 179.01 175.57 1x5q h ALA 89 N 0.69 -0.82 -0.91 2.92 0.00 -0.23 0.50 119.26 121.42 1x5q h ALA 89 Ca 0.20 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 55.20 1x5q h ALA 89 Cb 0.52 0.94 -0.15 0.00 0.00 0.00 0.00 17.79 19.10 1x5q h ALA 89 CO -0.83 -0.98 -0.40 -0.07 0.00 0.00 0.00 179.25 176.97 1x5q h LEU 90 N -0.48 -1.46 -0.76 0.00 3.38 0.75 1.00 115.31 117.74 1x5q h LEU 90 Ca 0.03 0.30 0.15 0.00 0.09 0.00 0.00 57.88 58.44 1x5q h LEU 90 Cb 0.56 0.74 -0.10 0.00 0.09 0.00 0.00 40.66 41.95 1x5q h LEU 90 CO -0.36 -0.29 0.28 0.03 0.09 0.00 0.00 178.44 178.19 1x5q h ARG 91 N -0.04 0.38 -5.80 1.13 3.08 0.50 -3.28 114.38 110.36 1x5q h ARG 91 Ca 0.30 -0.02 -0.62 0.00 0.07 0.00 0.00 59.98 59.71 1x5q h ARG 91 Cb 0.57 -0.09 -0.12 0.00 0.08 0.00 0.00 29.97 30.41 1x5q h ARG 91 CO -0.92 0.25 1.25 0.20 -1.07 0.00 0.00 179.97 179.69 1x5q s GLY 92 N -3.50 1.43 -0.28 0.04 0.00 0.35 -4.89 107.32 100.46 1x5q s GLY 92 Ca -0.12 -2.33 -0.18 0.00 0.00 0.00 0.00 44.72 42.09 1x5q s GLY 92 CO 0.76 2.47 0.89 0.00 0.00 0.00 0.00 173.10 177.23 1x5q s ALA 93 N 4.36 -2.10 1.00 3.20 0.00 -1.24 -4.82 121.76 122.16 1x5q s ALA 93 Ca 0.41 2.21 0.00 0.00 0.00 0.00 0.00 51.96 54.57 1x5q s ALA 93 Cb -0.03 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.53 1x5q s ALA 93 CO -0.07 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.76 1x5q n GLY 94 N 3.59 -1.44 0.00 0.00 0.00 -1.26 -4.95 105.19 101.13 1x5q n GLY 94 Ca -0.18 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1x5q n GLY 94 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x5q n THR 95 N -1.15 0.00 -2.22 2.61 -2.24 -1.26 -3.85 114.28 106.16 1x5q n THR 95 Ca 0.00 0.85 -0.43 0.00 -2.27 0.00 0.00 64.05 62.20 1x5q n THR 95 Cb 0.00 -1.33 -0.02 0.00 -2.10 0.00 0.00 70.33 66.88 1x5q n THR 95 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x5q s ALA 96 N -2.88 2.98 -0.35 6.98 0.00 -1.26 -1.30 121.76 125.93 1x5q s ALA 96 Ca 0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 51.96 51.76 1x5q s ALA 96 Cb 0.00 -3.97 -0.00 0.00 0.00 0.00 0.00 23.12 19.15 1x5q s ALA 96 CO 0.00 -2.49 0.50 0.08 0.00 0.00 0.00 175.76 173.85 1x5q s VAL 97 N 5.97 5.02 -0.08 0.00 1.01 0.51 -4.87 120.40 127.98 1x5q s VAL 97 Ca 0.68 0.29 -0.21 0.00 0.00 0.00 0.00 61.98 62.74 1x5q s VAL 97 Cb -0.17 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1x5q s VAL 97 CO 0.33 -0.22 0.59 -1.58 0.00 0.00 0.00 175.10 174.22 1x5q s GLN 98 N 2.37 4.38 -0.14 2.72 0.74 -1.26 0.13 119.66 128.59 1x5q s GLN 98 Ca 0.18 0.68 -0.01 0.00 0.05 0.00 0.00 55.36 56.26 1x5q s GLN 98 Cb -0.16 -3.43 0.04 0.00 1.10 0.00 0.00 33.01 30.57 1x5q s GLN 98 CO 0.13 0.15 -0.03 -1.64 -0.55 0.00 0.00 175.29 173.35 1x5q s MET 99 N 0.59 1.15 -0.56 1.67 -1.94 0.11 0.53 119.30 120.85 1x5q s MET 99 Ca 0.32 -0.33 -0.23 0.00 -1.71 0.00 0.00 55.69 53.74 1x5q s MET 99 Cb -0.17 -1.74 0.05 0.00 2.01 0.00 0.00 34.83 34.98 1x5q s MET 99 CO 0.15 -0.41 0.88 0.50 -0.01 0.00 0.00 175.02 176.12 1x5q s ARG 100 N 1.75 3.24 0.28 2.03 3.52 0.33 -0.09 118.95 130.02 1x5q s ARG 100 Ca 0.02 -0.51 0.06 0.00 -0.13 0.00 0.00 55.73 55.18 1x5q s ARG 100 Cb -0.14 -4.10 -0.03 0.00 -1.56 0.00 0.00 34.95 29.12 1x5q s ARG 100 CO -0.07 -1.49 0.33 0.14 -0.81 0.00 0.00 175.30 173.40 1x5q s VAL 101 N 3.67 4.44 -0.16 7.11 -7.23 0.37 0.20 120.40 128.81 1x5q s VAL 101 Ca 0.25 -1.16 0.00 0.00 -1.81 0.00 0.00 61.98 59.26 1x5q s VAL 101 Cb -0.15 -3.51 -0.00 0.00 0.56 0.00 0.00 36.38 33.28 1x5q s VAL 101 CO 0.16 -0.26 -0.16 0.86 -0.31 0.00 0.00 175.10 175.39 1x5q s TRP 102 N -2.13 2.78 0.12 2.82 -0.00 0.77 0.25 118.94 123.55 1x5q s TRP 102 Ca 0.38 -1.08 -0.21 0.00 -0.00 0.00 0.00 56.10 55.19 1x5q s TRP 102 Cb -0.08 -1.89 0.05 0.00 -0.00 0.00 0.00 33.47 31.55 1x5q s TRP 102 CO 0.28 -0.50 0.52 1.03 -0.00 0.00 0.00 176.95 178.29 1x5q s ARG 103 N 0.85 1.15 -0.06 5.86 0.52 0.11 -3.05 118.95 124.33 1x5q s ARG 103 Ca -0.05 -0.47 -0.18 0.00 -0.52 0.00 0.00 55.73 54.51 1x5q s ARG 103 Cb -0.15 0.52 -0.05 0.00 0.52 0.00 0.00 34.95 35.79 1x5q s ARG 103 CO -0.01 -0.47 0.50 -2.00 0.02 0.00 0.00 175.30 173.35 1x5q s GLU 104 N -3.40 4.26 0.00 3.54 2.12 -1.26 0.22 118.70 124.18 1x5q s GLU 104 Ca -0.00 0.54 -0.15 0.00 0.36 0.00 0.00 54.97 55.71 1x5q s GLU 104 Cb 0.00 -3.37 -0.06 0.00 0.26 0.00 0.00 34.13 30.97 1x5q s GLU 104 CO -0.09 0.32 0.43 0.45 -0.54 0.00 0.00 175.26 175.83 1x5q s SER 105 N 0.05 6.83 -0.04 -1.70 0.15 -1.26 -4.91 113.70 112.83 1x5q s SER 105 Ca 0.27 0.99 -0.16 0.00 0.70 0.00 0.00 55.95 57.75 1x5q s SER 105 Cb -0.16 -2.27 -0.05 0.00 -1.71 0.00 0.00 66.02 61.83 1x5q s SER 105 CO 0.13 0.30 0.43 -0.83 1.20 0.00 0.00 173.24 174.48 1x5q s GLY 106 N -0.98 2.45 -1.11 9.45 0.00 -1.26 -4.98 107.32 110.89 1x5q s GLY 106 Ca 0.24 -0.21 -0.18 0.00 0.00 0.00 0.00 44.72 44.57 1x5q s GLY 106 CO 0.14 0.39 2.06 -1.55 0.00 0.00 0.00 173.10 174.14 1x5q n PRO 107 N 2.54 2.16 -1.47 2.90 -0.04 -1.26 -4.92 135.00 134.91 1x5q n PRO 107 Ca -0.11 -2.24 -0.58 0.00 -0.04 0.00 0.00 63.50 60.53 1x5q n PRO 107 Cb 0.52 -3.12 -0.08 0.00 -0.04 0.00 0.00 33.50 30.78 1x5q n PRO 107 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x5q n SER 108 N 7.02 -0.05 0.02 3.54 7.64 -1.26 -4.87 113.62 125.65 1x5q n SER 108 Ca 0.51 1.14 -0.02 0.00 1.01 0.00 0.00 58.87 61.50 1x5q n SER 108 Cb 0.40 -0.90 -0.01 0.00 -1.01 0.00 0.00 64.21 62.69 1x5q n SER 108 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x5q n SER 109 N 1.49 1.15 0.00 6.43 2.88 -1.26 -5.33 113.62 118.97 1x5q n SER 109 Ca 0.20 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 1x5q n SER 109 Cb 0.08 -0.39 0.00 0.00 -0.75 0.00 0.00 64.21 63.15 1x5q n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42