#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 1.90 0.13 1.61 0.15 -1.26 -5.15 113.70 111.08 1x5q s SER 2 Ca 0.00 -0.47 0.10 0.00 0.70 0.00 0.00 55.95 56.28 1x5q s SER 2 Cb 0.00 -0.14 -0.04 0.00 -1.71 0.00 0.00 66.02 64.13 1x5q s SER 2 CO 0.00 0.07 -0.20 -0.94 1.20 0.00 0.00 173.24 173.37 1x5q s SER 3 N -1.13 3.73 0.00 5.45 1.04 -1.26 -5.14 113.70 116.40 1x5q s SER 3 Ca 0.03 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.83 1x5q s SER 3 Cb -0.08 -0.45 0.00 0.00 0.10 0.00 0.00 66.02 65.59 1x5q s SER 3 CO 0.01 0.17 0.00 0.61 0.98 0.00 0.00 173.24 175.01 1x5q n GLY 4 N 0.71 1.22 3.61 7.32 0.00 -1.26 -5.14 105.19 111.64 1x5q n GLY 4 Ca -0.15 -1.48 -0.02 0.00 0.00 0.00 0.00 46.02 44.36 1x5q n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5q s SER 5 N -1.00 -0.10 0.88 1.61 1.04 -1.26 -5.16 113.70 109.71 1x5q s SER 5 Ca 0.00 -0.04 -0.15 0.00 0.48 0.00 0.00 55.95 56.24 1x5q s SER 5 Cb 0.00 0.14 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 1x5q s SER 5 CO 0.00 -0.23 0.13 -1.20 0.98 0.00 0.00 173.24 172.91 1x5q n SER 6 N -0.22 -2.85 -1.46 7.02 7.64 -1.26 -5.02 113.62 117.48 1x5q n SER 6 Ca -0.02 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.24 1x5q n SER 6 Cb 0.60 -1.09 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 1x5q n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5q n GLY 7 N 2.06 4.13 3.86 0.23 0.00 -1.26 -5.15 105.19 109.05 1x5q n GLY 7 Ca 0.06 -1.92 -0.32 0.00 0.00 0.00 0.00 46.02 43.84 1x5q n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x5q s GLU 8 N -1.98 3.90 -0.08 1.61 2.02 -1.26 -5.03 118.70 117.89 1x5q s GLU 8 Ca 0.00 0.53 -0.30 0.00 0.02 0.00 0.00 54.97 55.22 1x5q s GLU 8 Cb 0.00 -2.47 -0.03 0.00 0.10 0.00 0.00 34.13 31.73 1x5q s GLU 8 CO 0.00 0.15 1.23 -1.25 0.02 0.00 0.00 175.26 175.42 1x5q s PRO 9 N -3.14 4.32 0.10 0.39 0.04 -1.26 -5.02 135.00 130.42 1x5q s PRO 9 Ca 0.52 1.70 -0.06 0.00 0.04 0.00 0.00 61.00 63.20 1x5q s PRO 9 Cb -0.10 -3.61 -0.05 0.00 0.04 0.00 0.00 34.50 30.77 1x5q s PRO 9 CO 0.21 -0.52 0.34 0.00 0.04 0.00 0.00 177.00 177.07 1x5q s ALA 10 N 2.56 3.81 0.23 8.56 0.00 -1.26 -5.09 121.76 130.57 1x5q s ALA 10 Ca 0.56 -0.55 -0.08 0.00 0.00 0.00 0.00 51.96 51.89 1x5q s ALA 10 Cb -0.24 -2.12 -0.06 0.00 0.00 0.00 0.00 23.12 20.69 1x5q s ALA 10 CO 0.20 0.66 0.52 1.03 0.00 0.00 0.00 175.76 178.17 1x5q s ARG 11 N -2.31 3.73 -0.12 0.00 0.52 -1.26 -5.09 118.95 114.42 1x5q s ARG 11 Ca 0.36 0.15 -0.01 0.00 -0.52 0.00 0.00 55.73 55.71 1x5q s ARG 11 Cb -0.13 -2.68 -0.02 0.00 0.52 0.00 0.00 34.95 32.63 1x5q s ARG 11 CO 0.22 0.32 -0.07 0.42 0.02 0.00 0.00 175.30 176.21 1x5q s ILE 12 N -1.84 3.59 -0.30 1.52 -1.09 -1.26 -5.08 121.20 116.74 1x5q s ILE 12 Ca 0.45 -0.48 -0.19 0.00 -2.23 0.00 0.00 60.65 58.20 1x5q s ILE 12 Cb -0.11 -2.53 0.19 0.00 -1.58 0.00 0.00 42.46 38.43 1x5q s ILE 12 CO 0.24 0.53 1.25 -1.83 -1.23 0.00 0.00 174.94 173.90 1x5q s GLU 13 N 0.04 0.14 0.83 2.79 -1.05 -1.26 -5.16 118.70 115.03 1x5q s GLU 13 Ca -0.02 0.21 -0.16 0.00 -0.15 0.00 0.00 54.97 54.86 1x5q s GLU 13 Cb -0.14 0.04 -0.09 0.00 -0.44 0.00 0.00 34.13 33.51 1x5q s GLU 13 CO 0.03 -0.02 -0.12 0.39 0.95 0.00 0.00 175.26 176.49 1x5q n GLU 14 N 2.68 0.02 -4.05 -4.83 1.02 -1.26 -4.83 120.64 109.39 1x5q n GLU 14 Ca -0.15 0.03 -0.24 0.00 -0.02 0.00 0.00 57.16 56.77 1x5q n GLU 14 Cb 0.57 -1.36 -0.07 0.00 -0.02 0.00 0.00 31.44 30.55 1x5q n GLU 14 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1x5q s GLU 15 N -2.30 2.27 0.21 3.49 -1.05 0.63 -4.80 118.70 117.16 1x5q s GLU 15 Ca 0.53 -1.81 -0.18 0.00 -0.15 0.00 0.00 54.97 53.36 1x5q s GLU 15 Cb -0.29 -2.04 -0.08 0.00 -0.44 0.00 0.00 34.13 31.28 1x5q s GLU 15 CO 0.71 -0.14 0.68 -1.21 0.95 0.00 0.00 175.26 176.25 1x5q s GLU 16 N -3.95 4.17 0.06 -4.83 2.02 -1.26 0.20 118.70 115.12 1x5q s GLU 16 Ca 0.42 0.77 -0.05 0.00 0.02 0.00 0.00 54.97 56.12 1x5q s GLU 16 Cb 0.03 -2.86 -0.02 0.00 0.10 0.00 0.00 34.13 31.38 1x5q s GLU 16 CO 0.23 0.40 0.10 -0.51 0.02 0.00 0.00 175.26 175.49 1x5q s LEU 17 N -2.05 1.86 -0.13 1.80 1.43 0.14 -4.89 118.68 116.84 1x5q s LEU 17 Ca 0.43 -0.74 -0.02 0.00 -1.03 0.00 0.00 54.13 52.77 1x5q s LEU 17 Cb -0.16 0.67 0.04 0.00 0.03 0.00 0.00 46.19 46.77 1x5q s LEU 17 CO 0.20 -0.64 0.02 -0.89 0.23 0.00 0.00 176.35 175.27 1x5q s THR 18 N -3.60 0.43 0.25 5.49 2.01 -1.26 -0.28 115.64 118.68 1x5q s THR 18 Ca 0.03 -0.18 0.06 0.00 0.31 0.00 0.00 61.69 61.91 1x5q s THR 18 Cb 0.05 -0.76 -0.03 0.00 0.01 0.00 0.00 72.50 71.77 1x5q s THR 18 CO -0.09 0.04 0.35 -0.76 -0.69 0.00 0.00 174.62 173.47 1x5q s LEU 19 N 1.93 4.20 -0.07 4.42 2.01 0.69 -4.92 118.68 126.93 1x5q s LEU 19 Ca 0.02 -0.01 -0.01 0.00 0.01 0.00 0.00 54.13 54.14 1x5q s LEU 19 Cb -0.14 -2.76 0.03 0.00 0.01 0.00 0.00 46.19 43.32 1x5q s LEU 19 CO -0.07 -0.11 0.00 -0.89 1.01 0.00 0.00 176.35 176.30 1x5q s THR 20 N -2.03 0.38 0.13 5.49 2.01 -1.26 -0.95 115.64 119.41 1x5q s THR 20 Ca 0.35 0.11 0.05 0.00 0.31 0.00 0.00 61.69 62.51 1x5q s THR 20 Cb -0.09 -0.55 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1x5q s THR 20 CO 0.29 0.25 0.04 -0.63 -0.69 0.00 0.00 174.62 173.88 1x5q s ILE 21 N 1.97 4.12 -0.35 1.82 1.01 0.97 -4.31 121.20 126.44 1x5q s ILE 21 Ca 0.05 -1.09 -0.08 0.00 0.00 0.00 0.00 60.65 59.53 1x5q s ILE 21 Cb -0.12 -3.03 0.04 0.00 0.01 0.00 0.00 42.46 39.36 1x5q s ILE 21 CO -0.05 0.01 0.14 -0.76 0.00 0.00 0.00 174.94 174.27 1x5q s LEU 22 N -2.67 4.46 0.42 2.97 2.01 -1.26 0.36 118.68 124.97 1x5q s LEU 22 Ca 0.28 -1.13 -0.23 0.00 0.01 0.00 0.00 54.13 53.06 1x5q s LEU 22 Cb -0.11 -1.91 -0.08 0.00 0.01 0.00 0.00 46.19 44.10 1x5q s LEU 22 CO 0.20 -0.35 1.08 -0.60 1.01 0.00 0.00 176.35 177.69 1x5q s ARG 23 N 1.44 4.03 0.00 1.70 3.52 0.28 -4.73 118.95 125.18 1x5q s ARG 23 Ca -0.01 1.57 0.00 0.00 -0.13 0.00 0.00 55.73 57.17 1x5q s ARG 23 Cb -0.20 -2.47 0.00 0.00 -1.56 0.00 0.00 34.95 30.72 1x5q s ARG 23 CO 0.04 -0.28 0.00 0.00 -0.81 0.00 0.00 175.30 174.25 1x5q n GLN 24 N -0.25 0.00 -3.80 5.12 10.64 -1.26 -4.75 117.38 123.09 1x5q n GLN 24 Ca 0.06 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 54.88 1x5q n GLN 24 Cb 0.49 0.00 -0.11 0.00 -0.86 0.00 0.00 30.24 29.76 1x5q n GLN 24 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 1x5q s THR 25 N 0.00 3.29 0.00 -0.39 -4.23 -1.26 -5.03 115.64 108.01 1x5q s THR 25 Ca 0.00 -2.66 0.00 0.00 -1.18 0.00 0.00 61.69 57.85 1x5q s THR 25 Cb 0.00 -3.21 0.00 0.00 1.34 0.00 0.00 72.50 70.63 1x5q s THR 25 CO 0.00 -0.78 0.00 0.61 -0.54 0.00 0.00 174.62 173.91 1x5q n GLY 26 N 3.87 -1.12 2.54 3.99 0.00 -1.26 -4.42 105.19 108.79 1x5q n GLY 26 Ca 0.04 -1.24 -0.30 0.00 0.00 0.00 0.00 46.02 44.51 1x5q n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x5q n GLY 27 N 0.00 4.87 6.11 -0.02 0.00 -1.26 -4.98 105.19 109.90 1x5q n GLY 27 Ca 0.00 -2.75 0.02 0.00 0.00 0.00 0.00 46.02 43.28 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 0.96 0.00 -2.93 0.99 4.77 -1.26 -4.72 117.00 114.81 1x5q n LEU 28 Ca 0.29 0.13 -0.13 0.00 -0.03 0.00 0.00 56.01 56.27 1x5q n LEU 28 Cb 0.39 -0.36 0.02 0.00 -2.33 0.00 0.00 43.42 41.15 1x5q n LEU 28 CO 0.46 -0.95 -0.02 0.61 -1.33 0.00 0.00 177.39 176.17 1x5q n GLY 29 N -0.41 2.30 3.10 -0.72 0.00 -1.26 -4.89 105.19 103.31 1x5q n GLY 29 Ca 0.00 -1.10 -0.09 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.77 0.15 -0.03 -0.61 -5.25 -1.26 0.98 121.20 113.41 1x5q s ILE 30 Ca 0.32 -1.23 0.04 0.00 -0.99 0.00 0.00 60.65 58.78 1x5q s ILE 30 Cb 0.37 -0.99 -0.01 0.00 2.95 0.00 0.00 42.46 44.78 1x5q s ILE 30 CO -0.05 -0.68 -0.16 -0.44 -1.79 0.00 0.00 174.94 171.82 1x5q s SER 31 N -2.27 1.95 0.10 4.36 0.01 -0.20 -4.97 113.70 112.68 1x5q s SER 31 Ca -0.03 -0.31 0.02 0.00 1.31 0.00 0.00 55.95 56.94 1x5q s SER 31 Cb 0.00 -0.44 -0.04 0.00 0.21 0.00 0.00 66.02 65.76 1x5q s SER 31 CO -0.06 0.16 0.19 0.27 0.41 0.00 0.00 173.24 174.21 1x5q s ILE 32 N -0.07 5.07 -0.16 1.44 -4.36 -1.26 0.94 121.20 122.80 1x5q s ILE 32 Ca -0.00 -0.64 -0.04 0.00 -0.26 0.00 0.00 60.65 59.70 1x5q s ILE 32 Cb -0.09 -3.52 0.06 0.00 1.25 0.00 0.00 42.46 40.16 1x5q s ILE 32 CO 0.01 0.04 0.10 0.00 0.24 0.00 0.00 174.94 175.34 1x5q s ALA 33 N -1.57 0.31 0.00 2.27 0.00 -0.34 -4.74 121.76 117.69 1x5q s ALA 33 Ca 0.33 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.13 1x5q s ALA 33 Cb -0.12 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 22.00 1x5q s ALA 33 CO 0.26 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.36 1x5q n GLY 34 N 5.29 0.80 0.00 0.00 0.00 -1.26 -3.62 105.19 106.40 1x5q n GLY 34 Ca -0.06 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.92 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 3.81 3.45 -0.02 0.00 -1.25 -4.38 105.19 106.81 1x5q n GLY 35 Ca 0.00 -1.55 -0.52 0.00 0.00 0.00 0.00 46.02 43.95 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 -1.18 0.08 0.00 1.61 4.81 -0.76 -0.40 118.16 122.32 1x5q n LYS 36 Ca 0.00 0.03 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 1x5q n LYS 36 Cb 0.00 -1.24 0.00 0.00 0.02 0.00 0.00 35.03 33.81 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 1.44 3.32 3.14 0.00 -1.26 -4.56 105.19 109.08 1x5q n GLY 37 Ca 0.18 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1x5q n GLY 37 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x5q n SER 38 N 3.29 -2.27 -4.78 1.61 7.64 0.47 -4.93 113.62 114.65 1x5q n SER 38 Ca 0.00 -0.18 -0.36 0.00 1.01 0.00 0.00 58.87 59.33 1x5q n SER 38 Cb 0.00 -1.04 -0.03 0.00 -1.01 0.00 0.00 64.21 62.13 1x5q n SER 38 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x5q s THR 39 N -2.27 3.50 0.60 0.44 2.01 -1.26 -4.63 115.64 114.03 1x5q s THR 39 Ca 0.60 1.13 -0.15 0.00 0.31 0.00 0.00 61.69 63.58 1x5q s THR 39 Cb -0.16 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.74 1x5q s THR 39 CO 0.65 -0.02 1.05 -2.16 -0.69 0.00 0.00 174.62 173.46 1x5q s PRO 40 N -2.62 3.34 -0.22 4.92 0.04 -1.26 -4.04 135.00 135.16 1x5q s PRO 40 Ca 0.61 1.15 0.11 0.00 0.04 0.00 0.00 61.00 62.90 1x5q s PRO 40 Cb -0.24 -2.04 -0.22 0.00 0.04 0.00 0.00 34.50 32.04 1x5q s PRO 40 CO 0.30 -0.79 -0.02 0.98 0.04 0.00 0.00 177.00 177.51 1x5q n TYR 41 N -2.12 0.06 0.00 0.56 4.19 -1.26 -4.78 117.16 113.82 1x5q n TYR 41 Ca 0.08 0.02 0.00 0.00 3.31 0.00 0.00 57.90 61.31 1x5q n TYR 41 Cb 0.53 -1.01 0.00 0.00 0.49 0.00 0.00 39.34 39.35 1x5q n TYR 41 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94 1x5q n LYS 42 N -2.97 0.00 0.00 2.98 4.81 -1.26 -5.08 118.16 116.64 1x5q n LYS 42 Ca -0.37 0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.11 1x5q n LYS 42 Cb 1.09 -0.40 0.00 0.00 0.02 0.00 0.00 35.03 35.74 1x5q n LYS 42 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x5q n GLY 43 N 2.41 0.13 1.06 3.14 0.00 -1.26 -4.97 105.19 105.71 1x5q n GLY 43 Ca 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 1x5q n GLY 43 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x5q n ASP 44 N 0.00 2.55 -4.37 1.61 -0.08 -1.26 -4.65 116.55 110.35 1x5q n ASP 44 Ca 0.00 -3.69 -0.36 0.00 -1.51 0.00 0.00 54.79 49.23 1x5q n ASP 44 Cb 0.00 -0.61 -0.13 0.00 2.34 0.00 0.00 41.12 42.71 1x5q n ASP 44 CO 0.00 0.00 0.00 1.51 0.12 0.00 0.00 177.20 178.83 1x5q s ASP 45 N -2.54 4.80 -0.29 1.67 1.47 -1.26 -4.98 116.67 115.54 1x5q s ASP 45 Ca 0.44 -0.38 -0.02 0.00 1.18 0.00 0.00 52.55 53.76 1x5q s ASP 45 Cb 0.39 -1.84 0.09 0.00 -0.34 0.00 0.00 42.92 41.22 1x5q s ASP 45 CO 0.00 -0.06 2.43 -0.62 0.68 0.00 0.00 175.17 177.60 1x5q n GLU 46 N 4.86 1.92 -3.15 2.11 1.02 -1.26 -4.24 120.64 121.90 1x5q n GLU 46 Ca -0.17 -1.57 -0.19 0.00 -0.02 0.00 0.00 57.16 55.21 1x5q n GLU 46 Cb 0.50 -1.75 0.01 0.00 -0.02 0.00 0.00 31.44 30.18 1x5q n GLU 46 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1x5q s GLY 47 N 0.63 1.72 -0.48 0.62 0.00 -1.26 -3.87 107.32 104.68 1x5q s GLY 47 Ca 0.40 -1.43 -0.18 0.00 0.00 0.00 0.00 44.72 43.51 1x5q s GLY 47 CO -0.07 -1.28 0.55 -0.42 0.00 0.00 0.00 173.10 171.88 1x5q s ILE 48 N -2.36 4.98 0.18 0.90 -1.09 -1.26 -3.75 121.20 118.79 1x5q s ILE 48 Ca 0.50 -0.52 0.08 0.00 -2.23 0.00 0.00 60.65 58.48 1x5q s ILE 48 Cb -0.10 -4.21 -0.04 0.00 -1.58 0.00 0.00 42.46 36.53 1x5q s ILE 48 CO 0.34 -0.67 -0.04 -0.36 -1.23 0.00 0.00 174.94 172.97 1x5q s PHE 49 N 2.37 2.76 0.07 3.97 0.40 -1.24 -0.15 117.98 126.15 1x5q s PHE 49 Ca 0.13 -0.17 -0.31 0.00 -0.60 0.00 0.00 56.93 55.98 1x5q s PHE 49 Cb -0.19 -1.34 -0.06 0.00 0.51 0.00 0.00 43.02 41.94 1x5q s PHE 49 CO 0.12 0.52 1.23 0.42 0.70 0.00 0.00 175.22 178.20 1x5q s ILE 50 N -1.72 3.93 -0.21 0.64 -1.09 0.01 -1.20 121.20 121.56 1x5q s ILE 50 Ca 0.26 1.38 0.14 0.00 -2.23 0.00 0.00 60.65 60.21 1x5q s ILE 50 Cb -0.09 -3.89 -0.22 0.00 -1.58 0.00 0.00 42.46 36.68 1x5q s ILE 50 CO 0.17 0.11 -0.00 -1.54 -1.23 0.00 0.00 174.94 172.45 1x5q n SER 51 N 3.93 0.60 -3.78 3.58 3.41 0.27 -1.42 113.62 120.21 1x5q n SER 51 Ca 0.09 -0.03 -0.13 0.00 -0.26 0.00 0.00 58.87 58.54 1x5q n SER 51 Cb 0.46 0.66 -0.09 0.00 -0.26 0.00 0.00 64.21 64.97 1x5q n SER 51 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1x5q s ARG 52 N -2.48 0.58 -0.20 4.33 6.06 -1.08 -4.88 118.95 121.27 1x5q s ARG 52 Ca -0.15 -0.10 -0.03 0.00 -2.50 0.00 0.00 55.73 52.95 1x5q s ARG 52 Cb 0.07 0.26 0.06 0.00 0.06 0.00 0.00 34.95 35.40 1x5q s ARG 52 CO 0.75 -0.14 0.05 0.08 -2.50 0.00 0.00 175.30 173.54 1x5q s VAL 53 N -1.03 0.46 -0.45 7.11 1.01 -1.26 -1.03 120.40 125.20 1x5q s VAL 53 Ca -0.11 -0.57 -0.38 0.00 0.00 0.00 0.00 61.98 60.92 1x5q s VAL 53 Cb -0.05 -1.02 -0.15 0.00 0.00 0.00 0.00 36.38 35.16 1x5q s VAL 53 CO 0.03 -0.26 2.21 -1.20 0.00 0.00 0.00 175.10 175.88 1x5q n SER 54 N 5.07 1.46 -0.15 3.32 7.64 0.27 -4.79 113.62 126.45 1x5q n SER 54 Ca -0.08 0.48 -0.03 0.00 1.01 0.00 0.00 58.87 60.24 1x5q n SER 54 Cb 0.47 -1.10 0.03 0.00 -1.01 0.00 0.00 64.21 62.60 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 11.18 0.01 -0.87 1.43 5.08 -1.98 -0.20 114.58 129.24 1x5q h GLU 55 Ca -0.19 -0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.64 1x5q h GLU 55 Cb 1.36 -0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.32 1x5q h GLU 55 CO 1.07 0.01 0.46 -1.91 -1.00 0.00 0.00 179.01 177.65 1x5q n GLU 56 N -5.33 2.51 -3.10 2.33 2.13 -1.26 -4.81 120.64 113.11 1x5q n GLU 56 Ca 0.04 -3.28 -0.20 0.00 0.66 0.00 0.00 57.16 54.38 1x5q n GLU 56 Cb 0.25 -2.18 0.06 0.00 0.27 0.00 0.00 31.44 29.84 1x5q n GLU 56 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1x5q s GLY 57 N -1.97 1.78 0.20 8.31 0.00 -0.09 -5.03 107.32 110.53 1x5q s GLY 57 Ca 0.58 -2.08 0.07 0.00 0.00 0.00 0.00 44.72 43.28 1x5q s GLY 57 CO 0.04 -1.70 1.47 -0.56 0.00 0.00 0.00 173.10 172.34 1x5q h PRO 58 N 0.23 0.09 0.88 2.90 0.13 -1.89 -3.28 132.00 131.05 1x5q h PRO 58 Ca -0.30 -0.08 -0.04 0.00 -0.87 0.00 0.00 66.00 64.70 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 0.42 0.81 -0.46 0.00 -0.23 0.00 0.00 178.00 178.54 1x5q h ALA 59 N 1.16 -1.31 -0.98 -0.56 0.00 -1.85 -1.43 119.26 114.28 1x5q h ALA 59 Ca -0.02 -0.26 0.38 0.00 0.00 0.00 0.00 54.91 55.01 1x5q h ALA 59 Cb 1.36 0.53 -0.18 0.00 0.00 0.00 0.00 17.79 19.49 1x5q h ALA 59 CO 0.11 -1.24 0.42 0.00 0.00 0.00 0.00 179.25 178.54 1x5q n ALA 60 N -2.66 0.90 -0.02 0.00 0.00 -1.24 0.19 120.51 117.68 1x5q n ALA 60 Ca -0.15 1.01 -0.11 0.00 0.00 0.00 0.00 53.44 54.18 1x5q n ALA 60 Cb 0.49 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.93 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 0.17 -1.00 0.00 3.08 -1.46 -2.43 114.38 112.74 1x5q h ARG 61 Ca 0.78 -0.03 0.23 0.00 0.07 0.00 0.00 59.98 61.03 1x5q h ARG 61 Cb 1.99 -0.03 -0.10 0.00 0.08 0.00 0.00 29.97 31.92 1x5q h ARG 61 CO -0.79 0.28 0.63 0.00 -1.07 0.00 0.00 179.97 179.01 1x5q h ALA 62 N 0.88 1.95 0.00 0.04 0.00 0.32 -3.45 119.26 119.01 1x5q h ALA 62 Ca 0.04 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1x5q h ALA 62 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1x5q h ALA 62 CO -0.00 -0.34 0.00 0.41 0.00 0.00 0.00 179.25 179.32 1x5q n GLY 63 N -1.40 2.00 3.87 0.00 0.00 -0.54 -4.36 105.19 104.76 1x5q n GLY 63 Ca 0.24 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 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 4.73 0.04 1.61 0.11 -1.19 -5.01 120.40 118.70 1x5q s VAL 64 Ca 0.00 0.77 -0.04 0.00 -2.93 0.00 0.00 61.98 59.78 1x5q s VAL 64 Cb 0.00 -3.84 -0.02 0.00 -1.53 0.00 0.00 36.38 30.99 1x5q s VAL 64 CO 0.00 -0.97 0.05 -0.13 -3.33 0.00 0.00 175.10 170.72 1x5q s ARG 65 N -4.82 0.56 -0.14 1.54 0.52 -1.26 -4.67 118.95 110.67 1x5q s ARG 65 Ca 0.54 -0.84 -0.29 0.00 -0.52 0.00 0.00 55.73 54.61 1x5q s ARG 65 Cb -0.11 0.21 -0.02 0.00 0.52 0.00 0.00 34.95 35.55 1x5q s ARG 65 CO 0.47 -0.13 1.35 0.08 0.02 0.00 0.00 175.30 177.10 1x5q s VAL 66 N -2.76 4.12 0.00 3.52 1.01 -1.26 -2.43 120.40 122.60 1x5q s VAL 66 Ca -0.04 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.30 1x5q s VAL 66 Cb -0.00 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1x5q s VAL 66 CO -0.05 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.54 1x5q n GLY 67 N 3.73 1.08 3.70 4.51 0.00 -0.51 -4.98 105.19 112.72 1x5q n GLY 67 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1x5q n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x5q s ASP 68 N -2.02 6.90 -0.76 1.61 1.11 -1.02 -4.62 116.67 117.87 1x5q s ASP 68 Ca 0.00 2.12 -0.23 0.00 0.18 0.00 0.00 52.55 54.62 1x5q s ASP 68 Cb 0.00 -2.57 0.07 0.00 1.07 0.00 0.00 42.92 41.49 1x5q s ASP 68 CO 0.00 -0.66 1.11 -0.75 1.18 0.00 0.00 175.17 176.05 1x5q s LYS 69 N 1.89 3.26 0.15 8.23 2.20 -1.20 -0.81 119.74 133.46 1x5q s LYS 69 Ca 0.63 -0.88 -0.31 0.00 -0.36 0.00 0.00 55.97 55.04 1x5q s LYS 69 Cb -0.32 -4.45 -0.11 0.00 -1.51 0.00 0.00 37.83 31.45 1x5q s LYS 69 CO 0.27 -1.92 1.77 -1.17 -0.36 0.00 0.00 175.35 173.94 1x5q s LEU 70 N 4.30 4.39 -0.15 5.43 1.98 0.78 -0.89 118.68 134.53 1x5q s LEU 70 Ca 0.29 2.78 0.01 0.00 -2.89 0.00 0.00 54.13 54.32 1x5q s LEU 70 Cb -0.11 -3.58 -0.10 0.00 0.66 0.00 0.00 46.19 43.06 1x5q s LEU 70 CO 0.06 -0.98 -0.13 0.18 -1.89 0.00 0.00 176.35 173.59 1x5q n LEU 71 N 4.99 2.89 -3.86 -0.68 4.77 0.53 -4.44 117.00 121.20 1x5q n LEU 71 Ca 0.17 -0.08 -0.09 0.00 -0.03 0.00 0.00 56.01 55.98 1x5q n LEU 71 Cb 0.37 -0.51 -0.07 0.00 -2.33 0.00 0.00 43.42 40.88 1x5q n LEU 71 CO 0.65 0.74 -0.08 -1.61 -1.33 0.00 0.00 177.39 175.76 1x5q s GLU 72 N -2.30 0.87 -0.24 3.23 2.02 -0.72 -1.87 118.70 119.69 1x5q s GLU 72 Ca -0.20 -0.96 -0.02 0.00 0.02 0.00 0.00 54.97 53.80 1x5q s GLU 72 Cb 0.05 0.35 0.12 0.00 0.10 0.00 0.00 34.13 34.75 1x5q s GLU 72 CO 0.35 -0.28 0.30 0.08 0.02 0.00 0.00 175.26 175.74 1x5q s VAL 73 N -3.87 -0.45 0.00 2.63 1.01 0.74 0.20 120.40 120.67 1x5q s VAL 73 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1x5q s VAL 73 Cb 0.05 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.62 1x5q s VAL 73 CO -0.10 -0.24 0.00 0.59 0.00 0.00 0.00 175.10 175.34 1x5q n ASN 74 N 5.33 -4.88 0.00 3.32 4.13 0.45 -0.98 115.26 122.62 1x5q n ASN 74 Ca -0.04 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.22 1x5q n ASN 74 Cb 0.49 -2.47 0.00 0.00 -1.54 0.00 0.00 39.78 36.26 1x5q n ASN 74 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1x5q n GLY 75 N -0.39 2.53 3.76 7.41 0.00 -1.26 -4.99 105.19 112.25 1x5q n GLY 75 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.31 3.22 -0.26 1.61 0.11 -0.16 -4.98 120.40 117.64 1x5q s VAL 76 Ca 0.00 1.19 -0.24 0.00 -2.93 0.00 0.00 61.98 60.00 1x5q s VAL 76 Cb 0.00 -3.76 -0.00 0.00 -1.53 0.00 0.00 36.38 31.09 1x5q s VAL 76 CO 0.00 0.27 0.80 0.00 -3.33 0.00 0.00 175.10 172.84 1x5q s ALA 77 N -0.99 3.61 -0.46 1.54 0.00 -1.26 -0.18 121.76 124.02 1x5q s ALA 77 Ca 0.47 -0.23 0.04 0.00 0.00 0.00 0.00 51.96 52.24 1x5q s ALA 77 Cb -0.35 -3.27 0.57 0.00 0.00 0.00 0.00 23.12 20.07 1x5q s ALA 77 CO 0.45 -0.99 1.80 1.28 0.00 0.00 0.00 175.76 178.30 1x5q n LEU 78 N 6.04 6.30 -4.57 0.00 4.77 -0.78 -4.82 117.00 123.95 1x5q n LEU 78 Ca 0.05 -3.90 -0.41 0.00 -0.03 0.00 0.00 56.01 51.71 1x5q n LEU 78 Cb 0.48 -0.80 -0.08 0.00 -2.33 0.00 0.00 43.42 40.69 1x5q n LEU 78 CO 0.48 1.28 0.24 -1.58 -1.33 0.00 0.00 177.39 176.47 1x5q s GLN 79 N -3.44 3.68 -1.48 3.23 0.74 -1.26 -4.13 119.66 117.00 1x5q s GLN 79 Ca 0.56 -0.09 -0.04 0.00 0.05 0.00 0.00 55.36 55.84 1x5q s GLN 79 Cb 0.47 -3.79 0.02 0.00 1.10 0.00 0.00 33.01 30.81 1x5q s GLN 79 CO 0.05 -0.61 0.42 0.41 -0.55 0.00 0.00 175.29 175.01 1x5q n GLY 80 N 4.74 -0.51 3.88 2.59 0.00 -1.26 -4.96 105.19 109.68 1x5q n GLY 80 Ca -0.04 0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.05 3.84 0.73 4.61 0.00 -1.26 -4.32 121.76 122.33 1x5q s ALA 81 Ca 0.24 -0.56 -0.14 0.00 0.00 0.00 0.00 51.96 51.50 1x5q s ALA 81 Cb -0.12 -2.07 0.04 0.00 0.00 0.00 0.00 23.12 20.97 1x5q s ALA 81 CO 0.30 0.64 1.18 -1.21 0.00 0.00 0.00 175.76 176.67 1x5q s GLU 82 N -1.71 2.18 0.16 0.00 0.41 -1.26 -1.83 118.70 116.65 1x5q s GLU 82 Ca 0.27 1.64 -0.28 0.00 -0.41 0.00 0.00 54.97 56.18 1x5q s GLU 82 Cb -0.13 -1.85 -0.01 0.00 -1.78 0.00 0.00 34.13 30.35 1x5q s GLU 82 CO 0.15 -1.78 1.55 1.25 -0.49 0.00 0.00 175.26 175.95 1x5q h HIS 83 N -0.41 -1.52 -0.46 1.61 2.76 -1.81 0.15 115.15 115.48 1x5q h HIS 83 Ca -0.47 0.09 0.08 0.00 -2.20 0.00 0.00 60.37 57.88 1x5q h HIS 83 Cb 1.28 0.75 -0.10 0.00 1.55 0.00 0.00 27.41 30.90 1x5q h HIS 83 CO 0.49 -0.43 -0.36 1.12 -1.30 0.00 0.00 177.93 177.46 1x5q h HIS 84 N -0.21 -1.00 -0.63 5.26 2.07 -1.94 1.08 115.15 119.77 1x5q h HIS 84 Ca 0.16 0.06 0.13 0.00 -2.85 0.00 0.00 60.37 57.87 1x5q h HIS 84 Cb 0.54 0.51 -0.12 0.00 2.57 0.00 0.00 27.41 30.91 1x5q h HIS 84 CO -0.80 -0.40 -0.12 0.93 -3.07 0.00 0.00 177.93 174.47 1x5q h GLU 85 N -0.25 0.02 0.53 5.12 5.08 -1.15 1.35 114.58 125.28 1x5q h GLU 85 Ca 0.18 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1x5q h GLU 85 Cb 0.55 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.80 1x5q h GLU 85 CO -0.59 0.01 -0.25 0.00 -1.00 0.00 0.00 179.01 177.18 1x5q h ALA 86 N 1.62 -0.71 -0.30 3.43 0.00 0.14 -0.86 119.26 122.59 1x5q h ALA 86 Ca 0.31 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.08 1x5q h ALA 86 Cb 0.49 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1x5q h ALA 86 CO -0.63 -0.78 -0.44 0.28 0.00 0.00 0.00 179.25 177.68 1x5q h VAL 87 N -0.95 0.11 -0.43 0.00 2.07 0.20 -0.59 116.25 116.66 1x5q h VAL 87 Ca -0.07 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.53 1x5q h VAL 87 Cb 0.62 0.11 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 1x5q h VAL 87 CO 0.12 0.00 -0.28 -0.08 0.02 0.00 0.00 177.57 177.35 1x5q h GLU 88 N -0.40 -0.19 -0.58 1.57 4.22 0.18 -0.25 114.58 119.13 1x5q h GLU 88 Ca 0.11 0.01 0.10 0.00 0.08 0.00 0.00 59.36 59.66 1x5q h GLU 88 Cb 0.61 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.79 1x5q h GLU 88 CO -0.51 -0.12 -0.36 0.00 -2.18 0.00 0.00 179.01 175.84 1x5q h ALA 89 N 0.96 -0.11 -0.30 2.92 0.00 0.27 0.32 119.26 123.31 1x5q h ALA 89 Ca 0.20 0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.32 1x5q h ALA 89 Cb 0.51 0.82 -0.07 0.00 0.00 0.00 0.00 17.79 19.04 1x5q h ALA 89 CO -0.54 -0.71 -0.21 -0.07 0.00 0.00 0.00 179.25 177.72 1x5q h LEU 90 N -0.18 -0.68 -0.71 0.00 3.38 0.32 -0.14 115.31 117.29 1x5q h LEU 90 Ca 0.22 0.14 0.13 0.00 0.09 0.00 0.00 57.88 58.46 1x5q h LEU 90 Cb 0.55 0.34 -0.09 0.00 0.09 0.00 0.00 40.66 41.56 1x5q h LEU 90 CO -0.68 -0.24 0.26 0.03 0.09 0.00 0.00 178.44 177.90 1x5q h ARG 91 N -0.18 0.40 -5.98 1.13 3.08 0.87 -3.27 114.38 110.42 1x5q h ARG 91 Ca 0.16 -0.02 -0.62 0.00 0.07 0.00 0.00 59.98 59.56 1x5q h ARG 91 Cb 0.42 -0.09 -0.09 0.00 0.08 0.00 0.00 29.97 30.29 1x5q h ARG 91 CO -0.41 0.26 1.77 0.20 -1.07 0.00 0.00 179.97 180.72 1x5q s GLY 92 N -3.38 1.37 -0.29 0.04 0.00 0.84 -4.85 107.32 101.06 1x5q s GLY 92 Ca -0.13 -2.51 -0.21 0.00 0.00 0.00 0.00 44.72 41.87 1x5q s GLY 92 CO 0.76 2.74 1.01 0.00 0.00 0.00 0.00 173.10 177.62 1x5q s ALA 93 N 4.91 -2.09 0.95 3.20 0.00 -1.23 -4.87 121.76 122.63 1x5q s ALA 93 Ca 0.50 2.01 0.00 0.00 0.00 0.00 0.00 51.96 54.47 1x5q s ALA 93 Cb 0.01 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.59 1x5q s ALA 93 CO -0.02 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.88 1x5q n GLY 94 N 2.79 0.11 0.00 0.00 0.00 -1.26 -4.99 105.19 101.85 1x5q n GLY 94 Ca -0.15 -1.59 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 2.41 0.00 0.00 0.00 173.32 175.73 1x5q n THR 95 N 0.00 0.00 -2.23 2.61 -1.04 -1.26 -4.11 114.28 108.25 1x5q n THR 95 Ca 0.00 1.43 -0.40 0.00 -2.04 0.00 0.00 64.05 63.04 1x5q n THR 95 Cb 0.00 -2.26 -0.03 0.00 -1.82 0.00 0.00 70.33 66.22 1x5q n THR 95 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1x5q s ALA 96 N -3.20 2.55 -0.26 2.41 0.00 -1.25 0.99 121.76 123.00 1x5q s ALA 96 Ca 0.00 -0.65 -0.13 0.00 0.00 0.00 0.00 51.96 51.18 1x5q s ALA 96 Cb 0.00 -4.19 -0.04 0.00 0.00 0.00 0.00 23.12 18.88 1x5q s ALA 96 CO 0.00 -3.33 0.27 0.08 0.00 0.00 0.00 175.76 172.77 1x5q s VAL 97 N 7.32 5.26 -0.21 0.00 1.01 0.16 -4.89 120.40 129.05 1x5q s VAL 97 Ca 0.59 0.36 -0.11 0.00 0.00 0.00 0.00 61.98 62.82 1x5q s VAL 97 Cb -0.12 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 1x5q s VAL 97 CO 0.23 0.24 0.18 -1.58 0.00 0.00 0.00 175.10 174.17 1x5q s GLN 98 N 1.67 4.15 -0.15 2.72 0.74 -1.26 -0.02 119.66 127.52 1x5q s GLN 98 Ca 0.11 -0.17 -0.01 0.00 0.05 0.00 0.00 55.36 55.34 1x5q s GLN 98 Cb -0.15 -3.47 0.04 0.00 1.10 0.00 0.00 33.01 30.53 1x5q s GLN 98 CO 0.09 0.18 -0.04 -1.64 -0.55 0.00 0.00 175.29 173.33 1x5q s MET 99 N 0.69 1.24 -0.53 1.67 -1.94 -0.12 0.17 119.30 120.47 1x5q s MET 99 Ca 0.10 -0.40 -0.23 0.00 -1.71 0.00 0.00 55.69 53.45 1x5q s MET 99 Cb -0.12 -1.85 0.05 0.00 2.01 0.00 0.00 34.83 34.91 1x5q s MET 99 CO 0.02 -0.43 0.85 0.50 -0.01 0.00 0.00 175.02 175.95 1x5q s ARG 100 N 1.71 3.28 0.41 2.03 3.52 0.13 -0.22 118.95 129.81 1x5q s ARG 100 Ca 0.01 -0.43 0.08 0.00 -0.13 0.00 0.00 55.73 55.26 1x5q s ARG 100 Cb -0.15 -4.06 -0.00 0.00 -1.56 0.00 0.00 34.95 29.18 1x5q s ARG 100 CO -0.07 -1.40 0.50 0.14 -0.81 0.00 0.00 175.30 173.66 1x5q s VAL 101 N 3.56 2.97 -0.11 7.11 -7.23 0.61 0.20 120.40 127.51 1x5q s VAL 101 Ca 0.26 -1.11 0.02 0.00 -1.81 0.00 0.00 61.98 59.34 1x5q s VAL 101 Cb -0.14 -3.03 0.01 0.00 0.56 0.00 0.00 36.38 33.79 1x5q s VAL 101 CO 0.17 -0.01 -0.15 0.86 -0.31 0.00 0.00 175.10 175.66 1x5q s TRP 102 N -2.38 1.99 0.10 2.82 -0.00 -0.07 0.29 118.94 121.69 1x5q s TRP 102 Ca 0.52 -0.94 -0.19 0.00 -0.00 0.00 0.00 56.10 55.49 1x5q s TRP 102 Cb -0.08 -1.43 0.05 0.00 -0.00 0.00 0.00 33.47 32.00 1x5q s TRP 102 CO 0.31 -0.48 0.47 1.03 -0.00 0.00 0.00 176.95 178.28 1x5q s ARG 103 N 0.99 1.08 -0.24 5.86 0.52 0.13 -3.24 118.95 124.05 1x5q s ARG 103 Ca -0.06 -0.49 -0.17 0.00 -0.52 0.00 0.00 55.73 54.49 1x5q s ARG 103 Cb -0.15 0.48 -0.03 0.00 0.52 0.00 0.00 34.95 35.77 1x5q s ARG 103 CO -0.02 -0.42 0.47 -2.00 0.02 0.00 0.00 175.30 173.35 1x5q s GLU 104 N -3.24 4.11 -0.56 3.54 -6.30 -1.26 0.23 118.70 115.22 1x5q s GLU 104 Ca -0.01 0.27 0.05 0.00 -2.50 0.00 0.00 54.97 52.78 1x5q s GLU 104 Cb 0.00 -3.61 0.20 0.00 0.00 0.00 0.00 34.13 30.72 1x5q s GLU 104 CO -0.08 -0.23 0.50 0.45 0.02 0.00 0.00 175.26 175.93 1x5q n SER 105 N 5.11 1.70 -4.44 -1.70 2.88 -1.26 -4.92 113.62 110.99 1x5q n SER 105 Ca -0.06 -2.93 -0.28 0.00 -1.33 0.00 0.00 58.87 54.27 1x5q n SER 105 Cb 0.50 -0.66 0.25 0.00 -0.75 0.00 0.00 64.21 63.55 1x5q n SER 105 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x5q s GLY 106 N -1.18 1.53 0.39 0.46 0.00 -1.26 -4.97 107.32 102.29 1x5q s GLY 106 Ca 0.32 -0.25 -0.24 0.00 0.00 0.00 0.00 44.72 44.54 1x5q s GLY 106 CO -0.14 0.49 1.06 2.56 0.00 0.00 0.00 173.10 177.07 1x5q s PRO 107 N -4.56 4.20 -0.30 2.90 0.04 -1.26 -5.03 135.00 130.99 1x5q s PRO 107 Ca 0.68 1.55 -0.07 0.00 0.04 0.00 0.00 61.00 63.20 1x5q s PRO 107 Cb -0.23 -2.60 0.19 0.00 0.04 0.00 0.00 34.50 31.89 1x5q s PRO 107 CO 0.64 -0.12 0.93 -1.54 0.04 0.00 0.00 177.00 176.95 1x5q s SER 108 N -1.49 -0.71 0.31 6.66 1.04 -1.26 -5.14 113.70 113.11 1x5q s SER 108 Ca 0.57 0.06 -0.30 0.00 0.48 0.00 0.00 55.95 56.76 1x5q s SER 108 Cb -0.23 1.42 -0.11 0.00 0.10 0.00 0.00 66.02 67.19 1x5q s SER 108 CO 0.29 -0.13 1.58 -0.94 0.98 0.00 0.00 173.24 175.02 1x5q s SER 109 N 2.87 6.35 0.00 7.02 1.04 -1.26 -5.30 113.70 124.41 1x5q s SER 109 Ca 0.23 2.99 0.00 0.00 0.48 0.00 0.00 55.95 59.65 1x5q s SER 109 Cb -0.04 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.44 1x5q s SER 109 CO -0.23 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.68