#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5q n SER 2 N 0.00 -9.42 -4.98 1.61 2.88 -1.26 -5.01 113.62 97.44 1x5q n SER 2 Ca 0.00 1.72 -0.20 0.00 -1.33 0.00 0.00 58.87 59.05 1x5q n SER 2 Cb 0.00 -5.22 0.01 0.00 -0.75 0.00 0.00 64.21 58.25 1x5q n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x5q s SER 3 N -0.58 5.67 0.19 -3.46 1.04 -1.26 -5.09 113.70 110.22 1x5q s SER 3 Ca 0.00 -0.04 -0.22 0.00 0.48 0.00 0.00 55.95 56.17 1x5q s SER 3 Cb 0.00 -1.11 -0.08 0.00 0.10 0.00 0.00 66.02 64.93 1x5q s SER 3 CO 0.00 -0.78 0.74 -0.83 0.98 0.00 0.00 173.24 173.35 1x5q s GLY 4 N -4.29 2.74 0.24 7.32 0.00 -1.26 -5.06 107.32 107.00 1x5q s GLY 4 Ca 0.51 0.24 -0.18 0.00 0.00 0.00 0.00 44.72 45.29 1x5q s GLY 4 CO 0.36 0.66 0.60 -0.56 0.00 0.00 0.00 173.10 174.16 1x5q s SER 5 N -1.42 -0.25 0.22 1.64 0.01 -1.26 -5.13 113.70 107.51 1x5q s SER 5 Ca 0.39 -0.60 -0.32 0.00 1.31 0.00 0.00 55.95 56.74 1x5q s SER 5 Cb -0.19 0.65 -0.12 0.00 0.21 0.00 0.00 66.02 66.57 1x5q s SER 5 CO 0.23 -1.19 1.68 -0.44 0.41 0.00 0.00 173.24 173.93 1x5q s SER 6 N -2.92 6.40 0.00 2.44 0.01 -1.26 -4.77 113.70 113.61 1x5q s SER 6 Ca 0.12 2.85 0.00 0.00 1.31 0.00 0.00 55.95 60.24 1x5q s SER 6 Cb -0.03 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.59 1x5q s SER 6 CO 0.03 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.35 1x5q n GLY 7 N 3.63 -1.31 2.88 3.44 0.00 -1.26 -5.11 105.19 107.46 1x5q n GLY 7 Ca 0.14 0.46 -0.08 0.00 0.00 0.00 0.00 46.02 46.54 1x5q n GLY 7 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1x5q n GLU 8 N -0.61 -2.56 -2.53 1.61 4.07 -1.26 -4.95 120.64 114.40 1x5q n GLU 8 Ca 0.00 2.20 -0.36 0.00 -0.06 0.00 0.00 57.16 58.94 1x5q n GLU 8 Cb 0.00 -5.25 -0.04 0.00 -0.06 0.00 0.00 31.44 26.10 1x5q n GLU 8 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 1x5q s PRO 9 N -2.34 4.07 0.12 5.31 0.04 -1.26 -5.06 135.00 135.87 1x5q s PRO 9 Ca 0.20 1.49 -0.04 0.00 0.04 0.00 0.00 61.00 62.68 1x5q s PRO 9 Cb -0.05 -2.43 -0.03 0.00 0.04 0.00 0.00 34.50 32.03 1x5q s PRO 9 CO 0.76 -0.22 0.12 0.00 0.04 0.00 0.00 177.00 177.70 1x5q s ALA 10 N -1.73 0.41 -0.13 8.56 0.00 -1.26 -5.16 121.76 122.46 1x5q s ALA 10 Ca 0.60 -1.15 -0.07 0.00 0.00 0.00 0.00 51.96 51.34 1x5q s ALA 10 Cb -0.21 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 1x5q s ALA 10 CO 0.26 -0.51 0.13 1.03 0.00 0.00 0.00 175.76 176.68 1x5q s ARG 11 N -3.98 3.54 -0.15 0.00 0.52 -1.26 -5.09 118.95 112.53 1x5q s ARG 11 Ca 0.16 -0.15 -0.01 0.00 -0.52 0.00 0.00 55.73 55.21 1x5q s ARG 11 Cb 0.06 -3.21 -0.01 0.00 0.52 0.00 0.00 34.95 32.31 1x5q s ARG 11 CO -0.03 0.71 -0.12 0.42 0.02 0.00 0.00 175.30 176.30 1x5q s ILE 12 N -0.82 3.06 -0.29 1.52 -1.09 -1.26 -5.09 121.20 117.23 1x5q s ILE 12 Ca 0.14 -0.64 -0.21 0.00 -2.23 0.00 0.00 60.65 57.70 1x5q s ILE 12 Cb -0.12 -2.30 0.15 0.00 -1.58 0.00 0.00 42.46 38.61 1x5q s ILE 12 CO 0.03 0.51 1.12 -1.83 -1.23 0.00 0.00 174.94 173.54 1x5q s GLU 13 N 0.59 0.33 0.57 2.79 -1.05 -1.26 -5.15 118.70 115.53 1x5q s GLU 13 Ca -0.07 0.46 -0.16 0.00 -0.15 0.00 0.00 54.97 55.05 1x5q s GLU 13 Cb -0.15 0.13 -0.14 0.00 -0.44 0.00 0.00 34.13 33.53 1x5q s GLU 13 CO 0.03 -0.05 -0.26 0.39 0.95 0.00 0.00 175.26 176.31 1x5q n GLU 14 N 2.64 0.00 -4.44 -4.83 4.71 -1.26 -4.81 120.64 112.65 1x5q n GLU 14 Ca -0.14 0.00 -0.24 0.00 -0.01 0.00 0.00 57.16 56.76 1x5q n GLU 14 Cb 0.57 -0.91 -0.10 0.00 -1.01 0.00 0.00 31.44 29.99 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 -1.14 1.86 0.12 3.49 -1.05 0.57 -4.81 118.70 117.74 1x5q s GLU 15 Ca 0.48 -1.76 -0.27 0.00 -0.15 0.00 0.00 54.97 53.27 1x5q s GLU 15 Cb -0.38 -1.83 -0.07 0.00 -0.44 0.00 0.00 34.13 31.41 1x5q s GLU 15 CO 0.64 0.26 0.85 -1.21 0.95 0.00 0.00 175.26 176.75 1x5q s GLU 16 N -3.59 4.62 0.19 -4.83 2.02 -1.26 0.02 118.70 115.87 1x5q s GLU 16 Ca 0.32 1.25 0.03 0.00 0.02 0.00 0.00 54.97 56.59 1x5q s GLU 16 Cb -0.03 -3.33 -0.05 0.00 0.10 0.00 0.00 34.13 30.83 1x5q s GLU 16 CO 0.17 0.37 -0.03 -0.51 0.02 0.00 0.00 175.26 175.28 1x5q s LEU 17 N -0.47 2.25 -0.25 1.80 1.43 0.16 -4.93 118.68 118.67 1x5q s LEU 17 Ca 0.40 -1.15 -0.02 0.00 -1.03 0.00 0.00 54.13 52.33 1x5q s LEU 17 Cb -0.23 -0.22 0.08 0.00 0.03 0.00 0.00 46.19 45.85 1x5q s LEU 17 CO 0.27 -0.49 0.07 -0.89 0.23 0.00 0.00 176.35 175.54 1x5q s THR 18 N -3.47 0.54 0.29 5.49 2.01 -1.26 -1.39 115.64 117.84 1x5q s THR 18 Ca 0.24 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.41 1x5q s THR 18 Cb 0.05 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 1x5q s THR 18 CO 0.05 -0.44 0.46 -0.22 -0.69 0.00 0.00 174.62 173.78 1x5q s LEU 19 N 1.82 4.15 -0.07 4.42 2.96 0.74 -4.91 118.68 127.79 1x5q s LEU 19 Ca 0.04 0.29 -0.01 0.00 -0.22 0.00 0.00 54.13 54.23 1x5q s LEU 19 Cb -0.17 -3.11 0.03 0.00 0.50 0.00 0.00 46.19 43.43 1x5q s LEU 19 CO -0.18 -0.19 -0.01 -0.89 -1.32 0.00 0.00 176.35 173.76 1x5q s THR 20 N -2.15 0.46 0.12 3.68 2.01 -1.26 -0.05 115.64 118.45 1x5q s THR 20 Ca 0.37 0.05 0.06 0.00 0.31 0.00 0.00 61.69 62.49 1x5q s THR 20 Cb -0.09 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.79 1x5q s THR 20 CO 0.33 0.27 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.86 1x5q s ILE 21 N 1.80 3.70 -0.08 1.82 1.01 0.34 -4.65 121.20 125.13 1x5q s ILE 21 Ca 0.03 -1.23 -0.04 0.00 0.00 0.00 0.00 60.65 59.41 1x5q s ILE 21 Cb -0.13 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 1x5q s ILE 21 CO -0.05 0.04 0.10 -0.76 0.00 0.00 0.00 174.94 174.27 1x5q s LEU 22 N -2.48 4.09 -0.77 2.97 1.43 -1.26 0.20 118.68 122.86 1x5q s LEU 22 Ca 0.25 0.32 -0.25 0.00 -1.03 0.00 0.00 54.13 53.42 1x5q s LEU 22 Cb -0.11 -2.08 0.05 0.00 0.03 0.00 0.00 46.19 44.08 1x5q s LEU 22 CO 0.17 0.37 1.22 -0.60 0.23 0.00 0.00 176.35 177.74 1x5q s ARG 23 N -1.18 3.24 0.43 1.70 3.52 0.73 -4.81 118.95 122.58 1x5q s ARG 23 Ca 0.17 -0.56 0.04 0.00 -0.13 0.00 0.00 55.73 55.25 1x5q s ARG 23 Cb -0.12 -4.38 0.04 0.00 -1.56 0.00 0.00 34.95 28.93 1x5q s ARG 23 CO 0.06 -2.07 0.34 0.00 -0.81 0.00 0.00 175.30 172.83 1x5q n GLN 24 N 8.81 0.84 -1.54 5.12 10.64 -1.22 -4.90 117.38 135.13 1x5q n GLN 24 Ca 0.06 -2.66 -0.35 0.00 -1.83 0.00 0.00 57.00 52.23 1x5q n GLN 24 Cb 0.48 0.25 -0.06 0.00 -0.86 0.00 0.00 30.24 30.05 1x5q n GLN 24 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1x5q n THR 25 N -1.54 -0.06 0.00 -0.39 -2.24 -1.26 -1.38 114.28 107.40 1x5q n THR 25 Ca -0.00 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 1x5q n THR 25 Cb 0.49 -2.21 0.00 0.00 -2.10 0.00 0.00 70.33 66.51 1x5q n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x5q n GLY 26 N 6.17 1.00 7.00 3.38 0.00 -1.26 -5.01 105.19 116.46 1x5q n GLY 26 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 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 2.55 0.00 -0.02 0.00 -0.48 -4.56 105.19 102.68 1x5q n GLY 27 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 -2.82 0.99 4.77 -1.26 -3.46 117.00 115.21 1x5q n LEU 28 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 1x5q n LEU 28 Cb 0.00 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.15 1x5q n LEU 28 CO 0.00 -0.41 0.17 0.61 -1.33 0.00 0.00 177.39 176.43 1x5q n GLY 29 N 5.00 1.65 3.15 -0.72 0.00 -1.26 -4.85 105.19 108.17 1x5q n GLY 29 Ca 0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.95 0.17 0.16 -0.61 -4.36 -1.26 -0.82 121.20 113.53 1x5q s ILE 30 Ca 0.27 -1.39 0.11 0.00 -0.26 0.00 0.00 60.65 59.38 1x5q s ILE 30 Cb 0.36 -1.34 -0.04 0.00 1.25 0.00 0.00 42.46 42.68 1x5q s ILE 30 CO -0.05 -0.77 -0.23 -0.44 0.24 0.00 0.00 174.94 173.69 1x5q s SER 31 N -2.78 3.54 0.31 4.36 0.01 0.15 -4.93 113.70 114.37 1x5q s SER 31 Ca 0.04 -0.75 0.11 0.00 1.31 0.00 0.00 55.95 56.66 1x5q s SER 31 Cb 0.05 -0.33 -0.06 0.00 0.21 0.00 0.00 66.02 65.89 1x5q s SER 31 CO -0.10 0.15 -0.14 0.27 0.41 0.00 0.00 173.24 173.83 1x5q s ILE 32 N -1.36 2.43 -0.28 1.44 -4.36 -1.26 0.11 121.20 117.92 1x5q s ILE 32 Ca 0.18 -2.28 -0.19 0.00 -0.26 0.00 0.00 60.65 58.09 1x5q s ILE 32 Cb -0.09 -2.49 0.09 0.00 1.25 0.00 0.00 42.46 41.22 1x5q s ILE 32 CO 0.09 -0.31 0.79 0.00 0.24 0.00 0.00 174.94 175.75 1x5q s ALA 33 N -2.54 -1.94 0.00 2.27 0.00 0.05 -4.51 121.76 115.09 1x5q s ALA 33 Ca 0.31 2.23 0.00 0.00 0.00 0.00 0.00 51.96 54.50 1x5q s ALA 33 Cb -0.02 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.68 1x5q s ALA 33 CO 0.16 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.98 1x5q n GLY 34 N 3.57 0.68 1.48 0.00 0.00 -1.21 -1.67 105.19 108.03 1x5q n GLY 34 Ca -0.17 -0.82 0.11 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.44 3.72 -0.02 0.00 -1.11 -3.99 105.19 100.35 1x5q n GLY 35 Ca 0.00 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.74 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 -3.72 1.32 0.00 1.61 4.81 -1.17 -2.97 118.16 118.04 1x5q n LYS 36 Ca -0.06 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 57.88 1x5q n LYS 36 Cb 0.59 -2.50 0.00 0.00 0.02 0.00 0.00 35.03 33.15 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 0.91 1.72 3.47 3.14 0.00 -1.26 -4.47 105.19 108.70 1x5q n GLY 37 Ca 0.13 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1x5q n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5q s SER 38 N 0.00 0.76 0.35 1.61 0.01 -1.16 -4.94 113.70 110.33 1x5q s SER 38 Ca 0.00 1.47 -0.27 0.00 1.31 0.00 0.00 55.95 58.46 1x5q s SER 38 Cb 0.00 -2.28 -0.09 0.00 0.21 0.00 0.00 66.02 63.85 1x5q s SER 38 CO 0.00 -4.33 1.18 -0.89 0.41 0.00 0.00 173.24 169.61 1x5q s THR 39 N -2.44 3.16 -0.10 1.44 2.01 -1.26 -4.78 115.64 113.67 1x5q s THR 39 Ca 0.69 1.07 -0.30 0.00 0.31 0.00 0.00 61.69 63.46 1x5q s THR 39 Cb -0.25 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.59 1x5q s THR 39 CO 0.65 0.18 1.25 -2.16 -0.69 0.00 0.00 174.62 173.85 1x5q s PRO 40 N -1.94 4.29 0.48 4.92 0.04 -1.26 -3.34 135.00 138.19 1x5q s PRO 40 Ca 0.51 1.69 0.21 0.00 0.04 0.00 0.00 61.00 63.46 1x5q s PRO 40 Cb -0.33 -3.66 1.24 0.00 0.04 0.00 0.00 34.50 31.79 1x5q s PRO 40 CO 0.42 -0.58 1.95 -0.92 0.04 0.00 0.00 177.00 177.91 1x5q h TYR 41 N 7.86 0.23 0.00 0.56 5.03 -1.80 -3.35 116.97 125.51 1x5q h TYR 41 Ca -0.31 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.01 1x5q h TYR 41 Cb 1.13 -0.07 0.00 0.00 1.55 0.00 0.00 36.73 39.34 1x5q h TYR 41 CO 0.77 0.09 0.00 1.63 -1.32 0.00 0.00 178.16 179.32 1x5q n LYS 42 N -4.42 0.00 0.00 1.82 5.02 -1.26 -5.08 118.16 114.24 1x5q n LYS 42 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1x5q n LYS 42 Cb 0.60 -0.02 0.00 0.00 -0.02 0.00 0.00 35.03 35.59 1x5q n LYS 42 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x5q n GLY 43 N 2.83 0.06 5.00 0.72 0.00 -1.26 -4.99 105.19 107.55 1x5q n GLY 43 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.76 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 0.00 -4.52 1.61 2.03 -1.26 -4.86 116.55 109.55 1x5q n ASP 44 Ca 0.00 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.92 1x5q n ASP 44 Cb 0.00 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.31 1x5q n ASP 44 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1x5q n ASP 45 N 3.13 1.33 -2.84 1.67 8.00 -1.26 -4.75 116.55 121.82 1x5q n ASP 45 Ca 0.00 -0.15 -0.29 0.00 0.71 0.00 0.00 54.79 55.05 1x5q n ASP 45 Cb 0.00 -1.26 -0.08 0.00 -0.02 0.00 0.00 41.12 39.77 1x5q n ASP 45 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1x5q n GLU 46 N 8.74 3.14 -3.73 -1.24 1.02 -1.26 -4.53 120.64 122.78 1x5q n GLU 46 Ca 0.51 -1.90 -0.20 0.00 -0.02 0.00 0.00 57.16 55.55 1x5q n GLU 46 Cb 0.29 -2.49 -0.02 0.00 -0.02 0.00 0.00 31.44 29.20 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 1.89 1.63 -0.45 0.62 0.00 -1.26 -4.07 107.32 105.68 1x5q s GLY 47 Ca 0.67 -1.52 -0.20 0.00 0.00 0.00 0.00 44.72 43.66 1x5q s GLY 47 CO -0.05 -1.47 0.63 -0.42 0.00 0.00 0.00 173.10 171.79 1x5q s ILE 48 N -2.21 4.84 0.22 0.90 -1.09 -1.26 -2.74 121.20 119.86 1x5q s ILE 48 Ca 0.41 -0.00 0.09 0.00 -2.23 0.00 0.00 60.65 58.92 1x5q s ILE 48 Cb -0.08 -4.21 -0.04 0.00 -1.58 0.00 0.00 42.46 36.55 1x5q s ILE 48 CO 0.28 -0.62 -0.07 -0.36 -1.23 0.00 0.00 174.94 172.93 1x5q s PHE 49 N 2.77 2.62 0.03 3.97 0.40 -0.67 0.11 117.98 127.20 1x5q s PHE 49 Ca 0.21 -0.23 -0.30 0.00 -0.60 0.00 0.00 56.93 56.00 1x5q s PHE 49 Cb -0.15 -1.22 -0.06 0.00 0.51 0.00 0.00 43.02 42.09 1x5q s PHE 49 CO 0.18 0.57 1.47 0.42 0.70 0.00 0.00 175.22 178.56 1x5q s ILE 50 N -2.00 3.50 -0.11 0.64 -1.09 -0.38 -0.77 121.20 120.98 1x5q s ILE 50 Ca 0.28 0.92 0.00 0.00 -2.23 0.00 0.00 60.65 59.62 1x5q s ILE 50 Cb -0.08 -3.59 -0.25 0.00 -1.58 0.00 0.00 42.46 36.97 1x5q s ILE 50 CO 0.17 0.00 0.39 -0.24 -1.23 0.00 0.00 174.94 174.03 1x5q n SER 51 N 5.35 1.68 -3.55 3.58 2.88 0.30 -2.07 113.62 121.79 1x5q n SER 51 Ca 0.14 0.23 -0.15 0.00 -1.33 0.00 0.00 58.87 57.75 1x5q n SER 51 Cb 0.43 -0.53 -0.05 0.00 -0.75 0.00 0.00 64.21 63.31 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 -2.56 1.04 -0.31 -1.46 6.06 -1.19 -4.92 118.95 115.62 1x5q s ARG 52 Ca -0.18 -0.05 -0.00 0.00 -2.50 0.00 0.00 55.73 52.99 1x5q s ARG 52 Cb 0.07 0.48 0.10 0.00 0.06 0.00 0.00 34.95 35.66 1x5q s ARG 52 CO 0.77 -0.36 0.09 0.08 -2.50 0.00 0.00 175.30 173.39 1x5q s VAL 53 N -1.99 0.97 -0.36 7.11 1.01 -1.26 0.31 120.40 126.20 1x5q s VAL 53 Ca -0.08 -1.45 -0.37 0.00 0.00 0.00 0.00 61.98 60.08 1x5q s VAL 53 Cb -0.01 -1.73 -0.13 0.00 0.00 0.00 0.00 36.38 34.51 1x5q s VAL 53 CO 0.02 -0.66 2.12 -1.20 0.00 0.00 0.00 175.10 175.38 1x5q n SER 54 N 4.81 1.99 -0.06 3.32 7.64 0.00 -4.81 113.62 126.50 1x5q n SER 54 Ca -0.02 0.55 -0.09 0.00 1.01 0.00 0.00 58.87 60.32 1x5q n SER 54 Cb 0.42 -1.20 -0.03 0.00 -1.01 0.00 0.00 64.21 62.40 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 -0.30 -2.21 1.43 5.08 -1.98 -1.40 114.58 126.37 1x5q h GLU 55 Ca -0.27 0.02 -0.59 0.00 -1.00 0.00 0.00 59.36 57.51 1x5q h GLU 55 Cb 1.33 0.07 -0.16 0.00 0.50 0.00 0.00 28.75 30.49 1x5q h GLU 55 CO 1.02 -0.20 1.09 0.39 -1.00 0.00 0.00 179.01 180.31 1x5q n GLU 56 N -5.41 3.22 -4.00 2.33 1.02 -1.26 -4.65 120.64 111.89 1x5q n GLU 56 Ca -0.01 -2.80 -0.22 0.00 -0.02 0.00 0.00 57.16 54.11 1x5q n GLU 56 Cb 0.33 -2.32 -0.06 0.00 -0.02 0.00 0.00 31.44 29.38 1x5q n GLU 56 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x5q n GLY 57 N 1.10 3.49 0.20 0.62 0.00 -0.53 -5.06 105.19 105.02 1x5q n GLY 57 Ca 0.53 -2.16 -0.18 0.00 0.00 0.00 0.00 46.02 44.21 1x5q n GLY 57 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5q h PRO 58 N 0.00 0.70 0.62 1.61 0.13 -1.87 -3.23 132.00 129.96 1x5q h PRO 58 Ca -0.28 -0.68 -0.02 0.00 -0.87 0.00 0.00 66.00 64.15 1x5q h PRO 58 Cb 0.99 0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1x5q h PRO 58 CO 0.45 1.27 -0.38 0.00 -0.23 0.00 0.00 178.00 179.11 1x5q h ALA 59 N 0.51 -0.97 -1.00 -0.56 0.00 -1.86 -0.22 119.26 115.17 1x5q h ALA 59 Ca -0.10 -0.19 0.38 0.00 0.00 0.00 0.00 54.91 55.00 1x5q h ALA 59 Cb 1.58 0.48 -0.17 0.00 0.00 0.00 0.00 17.79 19.67 1x5q h ALA 59 CO 0.18 -1.06 0.46 0.00 0.00 0.00 0.00 179.25 178.84 1x5q h ALA 60 N -0.65 1.97 -0.10 0.00 0.00 -1.70 1.15 119.26 119.93 1x5q h ALA 60 Ca -0.08 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1x5q h ALA 60 Cb 0.77 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1x5q h ALA 60 CO 0.07 -0.83 -0.04 0.00 0.00 0.00 0.00 179.25 178.46 1x5q h ARG 61 N 0.06 0.21 -1.00 0.00 3.08 -1.35 -2.87 114.38 112.50 1x5q h ARG 61 Ca 0.79 -0.08 0.23 0.00 0.07 0.00 0.00 59.98 60.99 1x5q h ARG 61 Cb 1.98 -0.01 -0.09 0.00 0.08 0.00 0.00 29.97 31.93 1x5q h ARG 61 CO -0.76 0.54 0.64 0.00 -1.07 0.00 0.00 179.97 179.31 1x5q h ALA 62 N 0.66 2.07 0.00 0.04 0.00 0.30 -3.45 119.26 118.90 1x5q h ALA 62 Ca 0.02 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1x5q h ALA 62 Cb 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1x5q h ALA 62 CO 0.01 -0.45 0.00 0.41 0.00 0.00 0.00 179.25 179.22 1x5q n GLY 63 N -1.44 1.75 3.79 0.00 0.00 -0.08 -4.82 105.19 104.39 1x5q n GLY 63 Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 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 3.62 -0.01 1.61 0.11 -1.15 -5.03 120.40 117.55 1x5q s VAL 64 Ca 0.00 0.66 0.00 0.00 -2.93 0.00 0.00 61.98 59.71 1x5q s VAL 64 Cb 0.00 -3.22 0.01 0.00 -1.53 0.00 0.00 36.38 31.63 1x5q s VAL 64 CO 0.00 -0.56 -0.00 -0.13 -3.33 0.00 0.00 175.10 171.08 1x5q s ARG 65 N -4.45 0.08 0.58 1.54 0.52 -1.26 -4.75 118.95 111.22 1x5q s ARG 65 Ca 0.63 0.01 -0.20 0.00 -0.52 0.00 0.00 55.73 55.65 1x5q s ARG 65 Cb -0.17 -0.15 -0.04 0.00 0.52 0.00 0.00 34.95 35.11 1x5q s ARG 65 CO 0.46 -0.02 1.24 0.28 0.02 0.00 0.00 175.30 177.27 1x5q n VAL 66 N 3.34 4.07 0.00 3.52 0.31 -1.26 -2.21 118.33 126.09 1x5q n VAL 66 Ca -0.16 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.67 1x5q n VAL 66 Cb 0.57 -1.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 1x5q n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1x5q n GLY 67 N 0.94 3.15 3.58 2.92 0.00 -0.88 -4.93 105.19 109.97 1x5q n GLY 67 Ca 0.13 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.63 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 0.11 1.41 -4.41 1.61 8.00 -0.94 -4.38 116.55 117.96 1x5q n ASP 68 Ca 0.00 1.13 -0.44 0.00 0.71 0.00 0.00 54.79 56.19 1x5q n ASP 68 Cb 0.00 -1.18 -0.04 0.00 -0.02 0.00 0.00 41.12 39.88 1x5q n ASP 68 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1x5q s LYS 69 N 0.19 3.14 0.20 -1.24 2.20 -1.14 -1.25 119.74 121.84 1x5q s LYS 69 Ca 0.82 -1.22 -0.32 0.00 -0.36 0.00 0.00 55.97 54.88 1x5q s LYS 69 Cb -0.95 -4.33 -0.13 0.00 -1.51 0.00 0.00 37.83 30.92 1x5q s LYS 69 CO 0.49 -1.66 1.66 -0.11 -0.36 0.00 0.00 175.35 175.37 1x5q n LEU 70 N 6.80 3.71 -0.05 5.43 -0.00 0.12 -0.75 117.00 132.26 1x5q n LEU 70 Ca -0.03 1.08 -0.07 0.00 -0.00 0.00 0.00 56.01 56.98 1x5q n LEU 70 Cb 0.44 -1.53 -0.05 0.00 -0.00 0.00 0.00 43.42 42.29 1x5q n LEU 70 CO 0.59 0.01 -0.83 0.18 -0.00 0.00 0.00 177.39 177.34 1x5q n LEU 71 N 3.60 2.95 -3.96 -1.96 4.77 0.56 -4.41 117.00 118.55 1x5q n LEU 71 Ca 0.16 -0.05 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 1x5q n LEU 71 Cb 0.33 -0.35 -0.08 0.00 -2.33 0.00 0.00 43.42 40.98 1x5q n LEU 71 CO 0.64 0.67 -0.20 -1.61 -1.33 0.00 0.00 177.39 175.55 1x5q s GLU 72 N -2.21 0.77 -0.28 3.23 2.02 -0.70 -0.87 118.70 120.66 1x5q s GLU 72 Ca -0.14 -1.09 0.01 0.00 0.02 0.00 0.00 54.97 53.77 1x5q s GLU 72 Cb 0.04 0.29 0.15 0.00 0.10 0.00 0.00 34.13 34.71 1x5q s GLU 72 CO 0.24 -0.21 0.38 0.08 0.02 0.00 0.00 175.26 175.77 1x5q s VAL 73 N -3.90 -0.58 -0.05 2.63 1.01 0.22 -0.14 120.40 119.59 1x5q s VAL 73 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1x5q s VAL 73 Cb 0.06 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.47 1x5q s VAL 73 CO -0.10 -0.30 0.00 -3.20 0.00 0.00 0.00 175.10 171.50 1x5q n ASN 74 N 5.35 -4.00 0.00 3.32 2.85 0.18 -2.13 115.26 120.83 1x5q n ASN 74 Ca -0.00 0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.48 1x5q n ASN 74 Cb 0.49 -1.54 0.00 0.00 1.24 0.00 0.00 39.78 39.97 1x5q n ASN 74 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1x5q n GLY 75 N -1.69 2.47 3.75 8.20 0.00 -1.26 -5.02 105.19 111.65 1x5q n GLY 75 Ca -0.01 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 -2.27 3.09 -0.20 1.61 0.11 -0.90 -4.98 120.40 116.86 1x5q s VAL 76 Ca 0.00 1.01 -0.25 0.00 -2.93 0.00 0.00 61.98 59.81 1x5q s VAL 76 Cb 0.00 -3.64 -0.01 0.00 -1.53 0.00 0.00 36.38 31.19 1x5q s VAL 76 CO 0.00 0.21 0.82 0.00 -3.33 0.00 0.00 175.10 172.80 1x5q s ALA 77 N -0.65 3.57 -0.48 1.54 0.00 -1.26 -0.61 121.76 123.88 1x5q s ALA 77 Ca 0.51 -0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.46 1x5q s ALA 77 Cb -0.37 -3.24 0.44 0.00 0.00 0.00 0.00 23.12 19.95 1x5q s ALA 77 CO 0.44 -0.76 1.48 1.28 0.00 0.00 0.00 175.76 178.21 1x5q n LEU 78 N 5.54 5.88 -3.96 0.00 4.77 -0.04 -4.70 117.00 124.48 1x5q n LEU 78 Ca 0.05 -4.73 -0.40 0.00 -0.03 0.00 0.00 56.01 50.89 1x5q n LEU 78 Cb 0.48 -0.60 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1x5q n LEU 78 CO 0.48 1.94 0.86 1.67 -1.33 0.00 0.00 177.39 181.00 1x5q n GLN 79 N -0.70 3.91 0.00 3.23 7.27 -1.26 -4.25 117.38 125.59 1x5q n GLN 79 Ca 0.49 -4.56 0.00 0.00 0.07 0.00 0.00 57.00 53.00 1x5q n GLN 79 Cb 0.75 -2.47 0.00 0.00 2.41 0.00 0.00 30.24 30.93 1x5q n GLN 79 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1x5q n GLY 80 N 1.49 1.02 3.49 1.69 0.00 -1.26 -5.08 105.19 106.55 1x5q n GLY 80 Ca 0.26 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.84 1x5q n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5q n ALA 81 N 0.00 -1.30 -1.33 4.61 0.00 -1.26 -3.06 120.51 118.16 1x5q n ALA 81 Ca 0.00 0.29 -0.29 0.00 0.00 0.00 0.00 53.44 53.44 1x5q n ALA 81 Cb 0.00 -1.83 0.17 0.00 0.00 0.00 0.00 19.45 17.79 1x5q n ALA 81 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1x5q s GLU 82 N -1.48 0.48 0.15 0.00 2.02 -1.26 -3.55 118.70 115.05 1x5q s GLU 82 Ca 0.62 0.30 -0.27 0.00 0.02 0.00 0.00 54.97 55.64 1x5q s GLU 82 Cb -0.69 -1.76 -0.02 0.00 0.10 0.00 0.00 34.13 31.76 1x5q s GLU 82 CO 0.58 -2.65 1.58 1.25 0.02 0.00 0.00 175.26 176.04 1x5q h HIS 83 N -1.83 -1.18 -0.14 1.61 -0.00 -1.81 -0.04 115.15 111.77 1x5q h HIS 83 Ca -0.52 0.06 0.05 0.00 -0.00 0.00 0.00 60.37 59.96 1x5q h HIS 83 Cb 1.33 0.56 -0.06 0.00 -0.00 0.00 0.00 27.41 29.23 1x5q h HIS 83 CO -0.06 -0.45 -0.26 1.12 -0.00 0.00 0.00 177.93 178.29 1x5q h HIS 84 N -0.38 -0.69 -0.81 5.26 2.07 -1.96 0.10 115.15 118.75 1x5q h HIS 84 Ca 0.12 0.03 0.16 0.00 -2.85 0.00 0.00 60.37 57.83 1x5q h HIS 84 Cb 0.59 0.32 -0.15 0.00 2.57 0.00 0.00 27.41 30.74 1x5q h HIS 84 CO -0.55 -0.34 -0.21 0.93 -3.07 0.00 0.00 177.93 174.69 1x5q h GLU 85 N -0.32 -0.00 0.73 5.12 5.08 -1.57 0.35 114.58 123.98 1x5q h GLU 85 Ca 0.10 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1x5q h GLU 85 Cb 0.47 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.73 1x5q h GLU 85 CO -0.32 -0.00 -0.35 0.00 -1.00 0.00 0.00 179.01 177.33 1x5q h ALA 86 N 1.78 -0.99 -0.87 3.43 0.00 0.09 -2.58 119.26 120.12 1x5q h ALA 86 Ca 0.38 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 55.21 1x5q h ALA 86 Cb 0.59 0.38 -0.15 0.00 0.00 0.00 0.00 17.79 18.61 1x5q h ALA 86 CO -0.83 -1.02 -0.35 0.28 0.00 0.00 0.00 179.25 177.33 1x5q h VAL 87 N -1.06 0.06 -0.67 0.00 2.07 0.10 1.05 116.25 117.80 1x5q h VAL 87 Ca -0.10 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.56 1x5q h VAL 87 Cb 0.77 0.06 -0.12 0.00 -1.52 0.00 0.00 31.29 30.48 1x5q h VAL 87 CO 0.17 0.00 -0.12 -0.08 0.02 0.00 0.00 177.57 177.56 1x5q h GLU 88 N -0.05 0.03 -0.20 1.57 4.22 -0.22 1.20 114.58 121.13 1x5q h GLU 88 Ca 0.33 -0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.72 1x5q h GLU 88 Cb 0.59 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1x5q h GLU 88 CO -0.90 0.02 -0.03 0.00 -2.18 0.00 0.00 179.01 175.92 1x5q h ALA 89 N 1.66 0.28 -0.16 2.92 0.00 0.70 0.46 119.26 125.11 1x5q h ALA 89 Ca 0.34 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1x5q h ALA 89 Cb 0.53 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1x5q h ALA 89 CO -0.66 0.04 -0.18 -0.07 0.00 0.00 0.00 179.25 178.38 1x5q h LEU 90 N 0.11 -0.56 -1.30 0.00 3.38 0.31 0.56 115.31 117.81 1x5q h LEU 90 Ca 0.05 0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1x5q h LEU 90 Cb 0.47 0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1x5q h LEU 90 CO 0.02 -0.23 -0.22 0.08 0.09 0.00 0.00 178.44 178.18 1x5q h ARG 91 N -0.21 0.00 -4.85 1.13 0.11 0.14 -3.38 114.38 107.33 1x5q h ARG 91 Ca 0.11 0.00 -0.70 0.00 0.10 0.00 0.00 59.98 59.49 1x5q h ARG 91 Cb 0.37 0.00 -0.19 0.00 1.11 0.00 0.00 29.97 31.26 1x5q h ARG 91 CO -0.29 0.22 0.61 0.20 0.10 0.00 0.00 179.97 180.82 1x5q s GLY 92 N -4.27 1.97 -0.29 0.08 0.00 0.16 -4.92 107.32 100.04 1x5q s GLY 92 Ca -0.00 -2.70 -0.23 0.00 0.00 0.00 0.00 44.72 41.79 1x5q s GLY 92 CO 0.63 1.85 1.31 0.00 0.00 0.00 0.00 173.10 176.89 1x5q s ALA 93 N 2.44 -2.26 1.00 3.20 0.00 -1.26 -4.74 121.76 120.15 1x5q s ALA 93 Ca 0.27 1.80 0.00 0.00 0.00 0.00 0.00 51.96 54.03 1x5q s ALA 93 Cb -0.09 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.28 1x5q s ALA 93 CO -0.06 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1x5q n GLY 94 N 2.09 -1.14 0.00 0.00 0.00 -1.26 -4.96 105.19 99.92 1x5q n GLY 94 Ca -0.12 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.76 0.00 -2.22 2.61 -2.24 -1.26 -3.99 114.28 106.42 1x5q n THR 95 Ca 0.00 0.91 -0.43 0.00 -2.27 0.00 0.00 64.05 62.27 1x5q n THR 95 Cb 0.00 -1.38 -0.02 0.00 -2.10 0.00 0.00 70.33 66.82 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 -2.83 3.41 -0.27 6.98 0.00 -1.26 -0.19 121.76 127.61 1x5q s ALA 96 Ca 0.00 0.45 -0.06 0.00 0.00 0.00 0.00 51.96 52.35 1x5q s ALA 96 Cb 0.00 -3.78 -0.00 0.00 0.00 0.00 0.00 23.12 19.34 1x5q s ALA 96 CO 0.00 -1.69 0.05 0.08 0.00 0.00 0.00 175.76 174.20 1x5q s VAL 97 N 4.54 3.88 -0.13 0.00 1.01 0.53 -4.92 120.40 125.31 1x5q s VAL 97 Ca 0.65 -0.57 -0.14 0.00 0.00 0.00 0.00 61.98 61.91 1x5q s VAL 97 Cb -0.24 -2.92 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 1x5q s VAL 97 CO 0.25 0.20 0.34 -1.58 0.00 0.00 0.00 175.10 174.30 1x5q s GLN 98 N 1.51 4.20 -0.11 2.72 0.74 -1.26 0.12 119.66 127.59 1x5q s GLN 98 Ca 0.04 0.19 -0.01 0.00 0.05 0.00 0.00 55.36 55.63 1x5q s GLN 98 Cb -0.16 -3.39 0.03 0.00 1.10 0.00 0.00 33.01 30.59 1x5q s GLN 98 CO 0.01 0.30 -0.01 -1.64 -0.55 0.00 0.00 175.29 173.39 1x5q s MET 99 N 0.26 0.88 -0.55 1.67 -1.94 0.92 0.48 119.30 121.03 1x5q s MET 99 Ca 0.19 -0.11 -0.23 0.00 -1.71 0.00 0.00 55.69 53.84 1x5q s MET 99 Cb -0.14 -1.37 0.05 0.00 2.01 0.00 0.00 34.83 35.38 1x5q s MET 99 CO 0.06 -0.36 0.87 0.50 -0.01 0.00 0.00 175.02 176.08 1x5q s ARG 100 N 1.87 3.27 0.37 2.03 3.52 0.80 -0.19 118.95 130.62 1x5q s ARG 100 Ca 0.04 -0.44 0.07 0.00 -0.13 0.00 0.00 55.73 55.27 1x5q s ARG 100 Cb -0.13 -4.07 -0.01 0.00 -1.56 0.00 0.00 34.95 29.18 1x5q s ARG 100 CO -0.07 -1.44 0.47 0.14 -0.81 0.00 0.00 175.30 173.59 1x5q s VAL 101 N 3.65 3.52 -0.13 7.11 -7.23 -0.49 0.21 120.40 127.04 1x5q s VAL 101 Ca 0.26 -1.08 0.03 0.00 -1.81 0.00 0.00 61.98 59.38 1x5q s VAL 101 Cb -0.14 -3.21 0.01 0.00 0.56 0.00 0.00 36.38 33.60 1x5q s VAL 101 CO 0.17 -0.10 -0.22 0.86 -0.31 0.00 0.00 175.10 175.50 1x5q s TRP 102 N -2.28 2.60 0.07 2.82 -0.00 0.07 0.40 118.94 122.63 1x5q s TRP 102 Ca 0.48 -1.25 -0.22 0.00 -0.00 0.00 0.00 56.10 55.10 1x5q s TRP 102 Cb -0.09 -1.77 0.05 0.00 -0.00 0.00 0.00 33.47 31.67 1x5q s TRP 102 CO 0.31 -0.56 0.53 0.50 -0.00 0.00 0.00 176.95 177.73 1x5q s ARG 103 N 0.71 1.09 -0.14 5.86 3.52 0.10 -2.90 118.95 127.19 1x5q s ARG 103 Ca -0.10 -0.29 -0.22 0.00 -0.13 0.00 0.00 55.73 54.99 1x5q s ARG 103 Cb -0.16 0.50 -0.03 0.00 -1.56 0.00 0.00 34.95 33.70 1x5q s ARG 103 CO 0.01 -0.41 0.66 -2.00 -0.81 0.00 0.00 175.30 172.75 1x5q s GLU 104 N -2.73 4.31 -0.36 5.12 2.12 -1.26 0.21 118.70 126.11 1x5q s GLU 104 Ca -0.04 0.74 0.01 0.00 0.36 0.00 0.00 54.97 56.04 1x5q s GLU 104 Cb -0.00 -3.52 0.15 0.00 0.26 0.00 0.00 34.13 31.02 1x5q s GLU 104 CO -0.04 -0.10 0.27 0.45 -0.54 0.00 0.00 175.26 175.30 1x5q s SER 105 N 0.99 2.27 0.56 -1.70 0.15 -1.26 -4.91 113.70 109.81 1x5q s SER 105 Ca 0.33 -2.03 -0.05 0.00 0.70 0.00 0.00 55.95 54.90 1x5q s SER 105 Cb -0.16 -0.06 0.01 0.00 -1.71 0.00 0.00 66.02 64.09 1x5q s SER 105 CO 0.13 -0.28 0.86 -0.83 1.20 0.00 0.00 173.24 174.31 1x5q s GLY 106 N 1.14 1.60 -0.14 9.45 0.00 -1.26 -5.01 107.32 113.09 1x5q s GLY 106 Ca 0.18 -0.76 -0.29 0.00 0.00 0.00 0.00 44.72 43.85 1x5q s GLY 106 CO -0.01 -0.50 1.27 2.56 0.00 0.00 0.00 173.10 176.42 1x5q s PRO 107 N -4.90 4.25 0.09 2.90 0.04 -1.26 -5.01 135.00 131.10 1x5q s PRO 107 Ca 0.53 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 63.13 1x5q s PRO 107 Cb -0.10 -3.74 -0.06 0.00 0.04 0.00 0.00 34.50 30.64 1x5q s PRO 107 CO 0.44 -0.67 0.45 0.45 0.04 0.00 0.00 177.00 177.71 1x5q s SER 108 N 1.94 6.73 -0.01 6.66 0.15 -1.26 -5.07 113.70 122.85 1x5q s SER 108 Ca 0.55 0.92 -0.30 0.00 0.70 0.00 0.00 55.95 57.82 1x5q s SER 108 Cb -0.23 -2.23 0.12 0.00 -1.71 0.00 0.00 66.02 61.97 1x5q s SER 108 CO 0.16 0.17 1.25 -0.94 1.20 0.00 0.00 173.24 175.08 1x5q s SER 109 N -1.64 -0.08 0.00 5.45 1.04 -1.26 -5.34 113.70 111.87 1x5q s SER 109 Ca 0.33 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.61 1x5q s SER 109 Cb -0.15 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.17 1x5q s SER 109 CO 0.18 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.65