#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 -1.02 0.00 1.61 0.15 -1.26 -5.15 113.70 108.03 1x5q s SER 2 Ca 0.00 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.95 1x5q s SER 2 Cb 0.00 1.82 0.00 0.00 -1.71 0.00 0.00 66.02 66.13 1x5q s SER 2 CO 0.00 -0.30 0.00 -1.20 1.20 0.00 0.00 173.24 172.94 1x5q n SER 3 N 5.41 0.00 0.00 5.45 7.64 -1.26 -5.13 113.62 125.73 1x5q n SER 3 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1x5q n SER 3 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1x5q n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5q n GLY 4 N -0.08 0.12 3.01 0.23 0.00 -1.26 -5.17 105.19 102.05 1x5q n GLY 4 Ca 0.00 0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 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 0.00 1.54 0.21 1.61 0.15 -1.26 -5.11 113.70 110.85 1x5q s SER 5 Ca 0.00 -0.25 -0.31 0.00 0.70 0.00 0.00 55.95 56.09 1x5q s SER 5 Cb 0.00 -0.61 -0.15 0.00 -1.71 0.00 0.00 66.02 63.55 1x5q s SER 5 CO 0.00 0.04 1.09 -0.24 1.20 0.00 0.00 173.24 175.33 1x5q n SER 6 N 3.63 1.24 0.00 5.45 2.88 -1.26 -4.98 113.62 120.58 1x5q n SER 6 Ca -0.22 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1x5q n SER 6 Cb 0.52 -1.23 0.00 0.00 -0.75 0.00 0.00 64.21 62.75 1x5q n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5q n GLY 7 N 1.77 2.43 3.44 0.46 0.00 -1.26 -5.15 105.19 106.89 1x5q n GLY 7 Ca 0.13 -1.51 -0.04 0.00 0.00 0.00 0.00 46.02 44.60 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 4.88 0.46 0.68 1.61 2.02 -1.26 -5.16 118.70 121.92 1x5q s GLU 8 Ca 0.00 1.23 -0.11 0.00 0.02 0.00 0.00 54.97 56.11 1x5q s GLU 8 Cb 0.00 0.59 0.00 0.00 0.10 0.00 0.00 34.13 34.82 1x5q s GLU 8 CO 0.00 -0.24 1.06 -1.25 0.02 0.00 0.00 175.26 174.84 1x5q s PRO 9 N 2.76 3.00 0.02 0.39 0.04 -1.26 -5.08 135.00 134.87 1x5q s PRO 9 Ca -0.03 0.99 0.03 0.00 0.04 0.00 0.00 61.00 62.03 1x5q s PRO 9 Cb -0.12 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.41 1x5q s PRO 9 CO -0.16 -1.05 -0.10 0.00 0.04 0.00 0.00 177.00 175.72 1x5q s ALA 10 N -2.96 0.85 0.49 8.56 0.00 -1.26 -5.14 121.76 122.30 1x5q s ALA 10 Ca 0.59 -0.61 -0.19 0.00 0.00 0.00 0.00 51.96 51.75 1x5q s ALA 10 Cb -0.14 -0.14 -0.08 0.00 0.00 0.00 0.00 23.12 22.76 1x5q s ALA 10 CO 0.52 0.15 1.01 1.03 0.00 0.00 0.00 175.76 178.48 1x5q s ARG 11 N -0.79 3.86 -0.14 0.00 0.52 -1.26 -5.05 118.95 116.09 1x5q s ARG 11 Ca 0.00 1.21 -0.07 0.00 -0.52 0.00 0.00 55.73 56.35 1x5q s ARG 11 Cb -0.06 -2.11 -0.04 0.00 0.52 0.00 0.00 34.95 33.26 1x5q s ARG 11 CO 0.00 -0.36 0.10 0.42 0.02 0.00 0.00 175.30 175.48 1x5q s ILE 12 N -2.22 5.15 -0.29 1.52 1.01 -1.26 -5.07 121.20 120.03 1x5q s ILE 12 Ca 0.64 0.08 -0.22 0.00 0.00 0.00 0.00 60.65 61.15 1x5q s ILE 12 Cb -0.13 -3.26 0.17 0.00 0.01 0.00 0.00 42.46 39.25 1x5q s ILE 12 CO 0.23 0.56 1.25 -1.83 0.00 0.00 0.00 174.94 175.15 1x5q s GLU 13 N -0.56 0.21 0.68 2.79 -1.05 -1.26 -5.15 118.70 114.36 1x5q s GLU 13 Ca 0.12 0.28 -0.16 0.00 -0.15 0.00 0.00 54.97 55.06 1x5q s GLU 13 Cb -0.12 0.09 -0.13 0.00 -0.44 0.00 0.00 34.13 33.52 1x5q s GLU 13 CO 0.02 -0.03 -0.44 0.39 0.95 0.00 0.00 175.26 176.15 1x5q n GLU 14 N 2.27 0.00 -4.55 -4.83 4.71 -1.26 -4.81 120.64 112.17 1x5q n GLU 14 Ca -0.13 0.00 -0.26 0.00 -0.01 0.00 0.00 57.16 56.76 1x5q n GLU 14 Cb 0.57 -0.89 -0.11 0.00 -1.01 0.00 0.00 31.44 30.00 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 -1.37 1.82 -0.03 3.49 -1.05 0.13 -4.81 118.70 116.88 1x5q s GLU 15 Ca 0.43 -2.00 -0.22 0.00 -0.15 0.00 0.00 54.97 53.02 1x5q s GLU 15 Cb -0.29 -1.44 -0.05 0.00 -0.44 0.00 0.00 34.13 31.92 1x5q s GLU 15 CO 0.67 -0.03 0.64 -1.21 0.95 0.00 0.00 175.26 176.28 1x5q s GLU 16 N -3.73 4.39 0.11 -4.83 2.02 -1.26 -0.11 118.70 115.28 1x5q s GLU 16 Ca 0.34 0.80 0.02 0.00 0.02 0.00 0.00 54.97 56.16 1x5q s GLU 16 Cb 0.08 -3.39 -0.04 0.00 0.10 0.00 0.00 34.13 30.87 1x5q s GLU 16 CO 0.17 0.23 -0.06 -0.51 0.02 0.00 0.00 175.26 175.10 1x5q s LEU 17 N 0.27 2.46 0.01 1.80 1.43 0.96 -4.94 118.68 120.66 1x5q s LEU 17 Ca 0.34 -1.03 0.06 0.00 -1.03 0.00 0.00 54.13 52.47 1x5q s LEU 17 Cb -0.18 -0.09 -0.02 0.00 0.03 0.00 0.00 46.19 45.93 1x5q s LEU 17 CO 0.18 -0.47 -0.17 -0.89 0.23 0.00 0.00 176.35 175.22 1x5q s THR 18 N -3.60 1.38 0.15 5.49 2.01 -1.26 -0.26 115.64 119.55 1x5q s THR 18 Ca 0.14 -0.86 0.03 0.00 0.31 0.00 0.00 61.69 61.31 1x5q s THR 18 Cb 0.05 -1.18 -0.04 0.00 0.01 0.00 0.00 72.50 71.34 1x5q s THR 18 CO -0.03 0.30 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.36 1x5q s LEU 19 N -0.65 2.44 -0.02 4.42 1.43 -0.16 -4.94 118.68 121.19 1x5q s LEU 19 Ca 0.06 -1.05 0.01 0.00 -1.03 0.00 0.00 54.13 52.12 1x5q s LEU 19 Cb -0.07 -0.25 0.01 0.00 0.03 0.00 0.00 46.19 45.91 1x5q s LEU 19 CO 0.00 -0.41 -0.05 -0.89 0.23 0.00 0.00 176.35 175.24 1x5q s THR 20 N -3.44 0.47 0.17 5.49 2.01 -1.26 -1.01 115.64 118.07 1x5q s THR 20 Ca 0.18 -0.16 0.10 0.00 0.31 0.00 0.00 61.69 62.12 1x5q s THR 20 Cb 0.04 -0.46 -0.04 0.00 0.01 0.00 0.00 72.50 72.05 1x5q s THR 20 CO 0.01 0.18 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.26 1x5q s ILE 21 N 0.45 2.07 -0.27 1.82 1.01 0.28 -4.32 121.20 122.24 1x5q s ILE 21 Ca -0.05 -1.90 -0.10 0.00 0.00 0.00 0.00 60.65 58.59 1x5q s ILE 21 Cb -0.09 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 1x5q s ILE 21 CO -0.00 -0.16 0.16 -0.76 0.00 0.00 0.00 174.94 174.17 1x5q s LEU 22 N -2.52 3.88 -0.64 2.97 2.01 -1.26 0.03 118.68 123.15 1x5q s LEU 22 Ca 0.16 -0.05 -0.27 0.00 0.01 0.00 0.00 54.13 53.99 1x5q s LEU 22 Cb -0.08 -2.07 0.04 0.00 0.01 0.00 0.00 46.19 44.09 1x5q s LEU 22 CO 0.08 -0.04 1.17 -0.60 1.01 0.00 0.00 176.35 177.96 1x5q s ARG 23 N 1.67 3.34 -0.18 1.70 3.52 0.24 -4.89 118.95 124.35 1x5q s ARG 23 Ca 0.07 -0.10 0.01 0.00 -0.13 0.00 0.00 55.73 55.58 1x5q s ARG 23 Cb -0.16 -4.10 0.04 0.00 -1.56 0.00 0.00 34.95 29.17 1x5q s ARG 23 CO 0.09 -1.83 -0.11 -0.65 -0.81 0.00 0.00 175.30 171.99 1x5q s GLN 24 N 5.00 2.06 -0.00 5.12 -1.52 -1.26 -4.65 119.66 124.40 1x5q s GLN 24 Ca 0.36 -0.75 -0.00 0.00 -1.95 0.00 0.00 55.36 53.03 1x5q s GLN 24 Cb -0.09 -2.31 0.00 0.00 -0.22 0.00 0.00 33.01 30.39 1x5q s GLN 24 CO 0.19 -0.38 0.00 0.25 -0.25 0.00 0.00 175.29 175.11 1x5q n THR 25 N 4.72 -1.92 0.00 -0.19 -2.24 -1.26 -4.60 114.28 108.78 1x5q n THR 25 Ca -0.15 0.44 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 1x5q n THR 25 Cb 0.47 -2.95 0.00 0.00 -2.10 0.00 0.00 70.33 65.75 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 1.45 0.34 0.00 3.38 0.00 -1.26 -5.02 105.19 104.07 1x5q n GLY 26 Ca -0.00 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.45 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 3.43 2.88 -0.02 0.00 -1.26 -5.02 105.19 105.20 1x5q n GLY 27 Ca 0.00 -0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 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 -3.12 0.99 4.77 -1.26 -4.40 117.00 113.98 1x5q n LEU 28 Ca 0.00 -2.23 -0.22 0.00 -0.03 0.00 0.00 56.01 53.53 1x5q n LEU 28 Cb 0.00 0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 1x5q n LEU 28 CO 0.00 -0.48 -0.10 0.61 -1.33 0.00 0.00 177.39 176.09 1x5q n GLY 29 N 0.03 4.24 3.18 -0.72 0.00 -1.26 -4.95 105.19 105.72 1x5q n GLY 29 Ca -0.05 -2.07 -0.09 0.00 0.00 0.00 0.00 46.02 43.81 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 -2.99 0.14 0.02 -0.61 -4.36 -1.26 -0.31 121.20 111.83 1x5q s ILE 30 Ca 0.42 -1.61 0.09 0.00 -0.26 0.00 0.00 60.65 59.29 1x5q s ILE 30 Cb 0.31 -1.69 -0.03 0.00 1.25 0.00 0.00 42.46 42.30 1x5q s ILE 30 CO -0.10 -0.63 -0.26 -0.44 0.24 0.00 0.00 174.94 173.75 1x5q s SER 31 N -2.95 3.14 0.34 4.36 0.01 0.12 -4.92 113.70 113.79 1x5q s SER 31 Ca 0.13 -0.54 0.09 0.00 1.31 0.00 0.00 55.95 56.94 1x5q s SER 31 Cb 0.06 -0.32 -0.05 0.00 0.21 0.00 0.00 66.02 65.93 1x5q s SER 31 CO -0.05 0.28 0.06 0.27 0.41 0.00 0.00 173.24 174.21 1x5q s ILE 32 N -0.74 2.78 -0.28 1.44 -4.36 -1.26 0.19 121.20 118.97 1x5q s ILE 32 Ca 0.11 -1.87 -0.22 0.00 -0.26 0.00 0.00 60.65 58.41 1x5q s ILE 32 Cb -0.10 -2.87 0.11 0.00 1.25 0.00 0.00 42.46 40.86 1x5q s ILE 32 CO 0.01 -0.19 0.94 0.00 0.24 0.00 0.00 174.94 175.93 1x5q s ALA 33 N -2.48 -2.00 0.00 2.27 0.00 -0.43 -4.58 121.76 114.54 1x5q s ALA 33 Ca 0.36 2.03 0.00 0.00 0.00 0.00 0.00 51.96 54.34 1x5q s ALA 33 Cb -0.01 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.66 1x5q s ALA 33 CO 0.21 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.09 1x5q n GLY 34 N 2.81 1.33 7.00 0.00 0.00 -1.25 -1.60 105.19 113.47 1x5q n GLY 34 Ca -0.15 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 1.32 3.08 -0.02 0.00 -0.89 -4.21 105.19 104.47 1x5q n GLY 35 Ca 0.00 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 1x5q n GLY 35 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x5q s LYS 36 N 0.00 1.30 0.00 1.61 2.20 -0.68 -3.75 119.74 120.42 1x5q s LYS 36 Ca 0.00 -0.47 0.00 0.00 -0.36 0.00 0.00 55.97 55.14 1x5q s LYS 36 Cb 0.00 -1.19 0.00 0.00 -1.51 0.00 0.00 37.83 35.13 1x5q s LYS 36 CO 0.00 0.22 0.00 0.41 -0.36 0.00 0.00 175.35 175.62 1x5q n GLY 37 N 3.07 2.11 3.50 5.54 0.00 -1.26 -4.55 105.19 113.59 1x5q n GLY 37 Ca -0.17 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 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 1.04 0.41 1.61 0.15 -1.26 -4.95 113.70 110.71 1x5q s SER 38 Ca 0.00 1.61 -0.25 0.00 0.70 0.00 0.00 55.95 58.02 1x5q s SER 38 Cb 0.00 -2.36 -0.08 0.00 -1.71 0.00 0.00 66.02 61.87 1x5q s SER 38 CO 0.00 -4.18 1.15 -0.89 1.20 0.00 0.00 173.24 170.52 1x5q s THR 39 N -2.45 3.25 0.32 6.45 2.01 -1.26 -4.85 115.64 119.11 1x5q s THR 39 Ca 0.68 1.01 -0.28 0.00 0.31 0.00 0.00 61.69 63.42 1x5q s THR 39 Cb -0.25 -3.55 -0.09 0.00 0.01 0.00 0.00 72.50 68.62 1x5q s THR 39 CO 0.64 0.06 1.07 -2.16 -0.69 0.00 0.00 174.62 173.54 1x5q s PRO 40 N -2.40 4.50 0.45 4.92 0.04 -1.26 -3.90 135.00 137.34 1x5q s PRO 40 Ca 0.58 1.69 0.11 0.00 0.04 0.00 0.00 61.00 63.42 1x5q s PRO 40 Cb -0.29 -2.98 1.02 0.00 0.04 0.00 0.00 34.50 32.29 1x5q s PRO 40 CO 0.36 0.11 2.07 -0.92 0.04 0.00 0.00 177.00 178.66 1x5q h TYR 41 N 3.40 0.25 -1.84 0.56 3.20 -1.80 -3.43 116.97 117.31 1x5q h TYR 41 Ca -0.47 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.44 1x5q h TYR 41 Cb 1.21 -0.08 -0.23 0.00 1.54 0.00 0.00 36.73 39.17 1x5q h TYR 41 CO 0.59 0.20 0.17 -1.59 -1.64 0.00 0.00 178.16 175.88 1x5q s LYS 42 N -5.16 0.61 0.49 1.82 -2.85 -1.26 -5.12 119.74 108.26 1x5q s LYS 42 Ca -0.06 1.00 0.00 0.00 -1.00 0.00 0.00 55.97 55.90 1x5q s LYS 42 Cb 0.17 0.16 0.00 0.00 -2.06 0.00 0.00 37.83 36.10 1x5q s LYS 42 CO 0.71 -0.12 0.00 0.41 0.10 0.00 0.00 175.35 176.45 1x5q n GLY 43 N 3.83 -2.89 3.17 0.59 0.00 -1.26 -4.16 105.19 104.46 1x5q n GLY 43 Ca -0.18 -1.12 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 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 -4.11 3.28 -3.56 1.61 8.00 -1.26 -4.66 116.55 115.85 1x5q n ASP 44 Ca -0.06 -2.75 -0.25 0.00 0.71 0.00 0.00 54.79 52.44 1x5q n ASP 44 Cb 0.61 -1.45 -0.15 0.00 -0.02 0.00 0.00 41.12 40.10 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 4.74 2.39 -0.81 -2.24 1.11 -1.26 -5.03 116.67 115.58 1x5q s ASP 45 Ca 0.57 -0.70 -0.07 0.00 0.18 0.00 0.00 52.55 52.53 1x5q s ASP 45 Cb 0.10 -0.11 -0.12 0.00 1.07 0.00 0.00 42.92 43.86 1x5q s ASP 45 CO 0.07 -0.37 2.67 -0.62 1.18 0.00 0.00 175.17 178.10 1x5q n GLU 46 N 5.28 2.40 -3.76 8.23 -0.58 -1.26 -4.55 120.64 126.40 1x5q n GLU 46 Ca -0.06 -1.44 -0.22 0.00 -0.42 0.00 0.00 57.16 55.01 1x5q n GLU 46 Cb 0.47 -2.36 -0.04 0.00 -0.57 0.00 0.00 31.44 28.95 1x5q n GLU 46 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1x5q s GLY 47 N 2.59 2.22 -0.38 0.62 0.00 -1.25 -3.87 107.32 107.26 1x5q s GLY 47 Ca 0.54 -1.89 -0.16 0.00 0.00 0.00 0.00 44.72 43.20 1x5q s GLY 47 CO -0.03 -1.79 0.40 -0.42 0.00 0.00 0.00 173.10 171.27 1x5q s ILE 48 N -2.54 5.12 0.14 0.90 -1.09 -1.26 -2.09 121.20 120.38 1x5q s ILE 48 Ca 0.45 -0.12 0.10 0.00 -2.23 0.00 0.00 60.65 58.84 1x5q s ILE 48 Cb -0.01 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 1x5q s ILE 48 CO 0.26 -0.25 -0.19 -0.36 -1.23 0.00 0.00 174.94 173.17 1x5q s PHE 49 N 2.09 2.49 0.05 3.97 0.40 -0.63 -0.02 117.98 126.34 1x5q s PHE 49 Ca 0.12 -0.28 -0.31 0.00 -0.60 0.00 0.00 56.93 55.86 1x5q s PHE 49 Cb -0.17 -1.29 -0.07 0.00 0.51 0.00 0.00 43.02 42.00 1x5q s PHE 49 CO 0.13 0.42 1.46 0.42 0.70 0.00 0.00 175.22 178.35 1x5q s ILE 50 N -1.31 3.43 -0.15 0.64 -1.09 0.47 -1.31 121.20 121.87 1x5q s ILE 50 Ca 0.19 0.90 0.05 0.00 -2.23 0.00 0.00 60.65 59.56 1x5q s ILE 50 Cb -0.10 -3.58 -0.23 0.00 -1.58 0.00 0.00 42.46 36.98 1x5q s ILE 50 CO 0.10 0.02 0.24 -0.24 -1.23 0.00 0.00 174.94 173.83 1x5q n SER 51 N 5.02 1.37 -3.64 3.58 2.88 0.49 -1.98 113.62 121.34 1x5q n SER 51 Ca 0.13 0.14 -0.15 0.00 -1.33 0.00 0.00 58.87 57.66 1x5q n SER 51 Cb 0.42 -0.19 -0.07 0.00 -0.75 0.00 0.00 64.21 63.62 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 -2.55 0.89 -0.26 -1.46 6.06 -1.18 -4.91 118.95 115.54 1x5q s ARG 52 Ca -0.19 -0.05 -0.00 0.00 -2.50 0.00 0.00 55.73 52.99 1x5q s ARG 52 Cb 0.07 0.41 0.08 0.00 0.06 0.00 0.00 34.95 35.57 1x5q s ARG 52 CO 0.75 -0.28 0.02 0.08 -2.50 0.00 0.00 175.30 173.38 1x5q s VAL 53 N -1.55 1.21 -0.55 7.11 1.01 -1.26 0.10 120.40 126.46 1x5q s VAL 53 Ca -0.11 -1.26 -0.36 0.00 0.00 0.00 0.00 61.98 60.25 1x5q s VAL 53 Cb -0.02 -1.70 -0.16 0.00 0.00 0.00 0.00 36.38 34.50 1x5q s VAL 53 CO 0.05 -0.35 2.31 -1.20 0.00 0.00 0.00 175.10 175.91 1x5q n SER 54 N 4.75 1.29 -0.33 3.32 7.64 0.58 -4.78 113.62 126.10 1x5q n SER 54 Ca -0.07 0.36 -0.05 0.00 1.01 0.00 0.00 58.87 60.12 1x5q n SER 54 Cb 0.44 -1.10 -0.01 0.00 -1.01 0.00 0.00 64.21 62.53 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 11.87 -0.07 -2.50 1.43 5.08 -1.98 -1.80 114.58 126.60 1x5q h GLU 55 Ca -0.16 0.00 -0.72 0.00 -1.00 0.00 0.00 59.36 57.48 1x5q h GLU 55 Cb 1.35 0.02 -0.34 0.00 0.50 0.00 0.00 28.75 30.28 1x5q h GLU 55 CO 1.14 -0.05 0.26 0.39 -1.00 0.00 0.00 179.01 179.75 1x5q n GLU 56 N -5.41 3.96 -2.89 2.33 1.02 -1.26 -4.76 120.64 113.63 1x5q n GLU 56 Ca 0.06 -4.65 -0.10 0.00 -0.02 0.00 0.00 57.16 52.45 1x5q n GLU 56 Cb 0.36 -2.40 -0.03 0.00 -0.02 0.00 0.00 31.44 29.35 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 0.72 3.81 0.16 0.62 0.00 -0.68 -5.06 105.19 104.76 1x5q n GLY 57 Ca 0.32 -2.02 -0.11 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 0.37 0.60 1.61 0.13 -1.87 -3.23 132.00 129.60 1x5q h PRO 58 Ca -0.12 -0.36 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 1x5q h PRO 58 Cb 0.45 0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.68 1x5q h PRO 58 CO 0.19 1.02 -0.29 0.00 -0.23 0.00 0.00 178.00 178.69 1x5q h ALA 59 N 0.86 -0.81 -0.98 -0.56 0.00 -1.87 -2.15 119.26 113.75 1x5q h ALA 59 Ca -0.05 -0.20 0.36 0.00 0.00 0.00 0.00 54.91 55.01 1x5q h ALA 59 Cb 1.46 0.31 -0.18 0.00 0.00 0.00 0.00 17.79 19.38 1x5q h ALA 59 CO 0.14 -0.86 0.33 0.00 0.00 0.00 0.00 179.25 178.87 1x5q n ALA 60 N -2.56 0.81 -0.03 0.00 0.00 -1.25 0.19 120.51 117.67 1x5q n ALA 60 Ca -0.12 1.02 -0.11 0.00 0.00 0.00 0.00 53.44 54.22 1x5q n ALA 60 Cb 0.35 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 18.83 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 0.18 -0.96 0.00 3.08 -1.51 -2.45 114.38 112.72 1x5q h ARG 61 Ca 0.74 -0.04 0.20 0.00 0.07 0.00 0.00 59.98 60.95 1x5q h ARG 61 Cb 1.82 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 31.76 1x5q h ARG 61 CO -0.82 0.31 0.61 0.00 -1.07 0.00 0.00 179.97 179.00 1x5q h ALA 62 N 0.87 1.99 0.00 0.04 0.00 0.27 -3.45 119.26 118.97 1x5q h ALA 62 Ca 0.04 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1x5q h ALA 62 Cb 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1x5q h ALA 62 CO -0.00 -0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.35 1x5q n GLY 63 N -1.44 1.75 3.83 0.00 0.00 -0.23 -4.68 105.19 104.43 1x5q n GLY 63 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 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 4.50 -0.03 1.61 0.11 -1.18 -5.03 120.40 118.37 1x5q s VAL 64 Ca 0.00 1.28 -0.01 0.00 -2.93 0.00 0.00 61.98 60.32 1x5q s VAL 64 Cb 0.00 -3.64 0.03 0.00 -1.53 0.00 0.00 36.38 31.24 1x5q s VAL 64 CO 0.00 -0.41 0.07 -0.13 -3.33 0.00 0.00 175.10 171.30 1x5q s ARG 65 N -3.42 0.03 0.29 1.54 0.52 -1.26 -4.70 118.95 111.95 1x5q s ARG 65 Ca 0.59 0.21 -0.29 0.00 -0.52 0.00 0.00 55.73 55.73 1x5q s ARG 65 Cb -0.09 -0.15 -0.14 0.00 0.52 0.00 0.00 34.95 35.09 1x5q s ARG 65 CO 0.20 -0.12 1.13 0.28 0.02 0.00 0.00 175.30 176.80 1x5q n VAL 66 N 3.88 1.80 0.00 3.52 0.31 -1.26 -1.88 118.33 124.70 1x5q n VAL 66 Ca -0.23 -0.45 0.00 0.00 -0.01 0.00 0.00 64.34 63.65 1x5q n VAL 66 Cb 0.53 -1.17 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 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 1.27 2.57 3.62 2.92 0.00 -0.84 -4.96 105.19 109.77 1x5q n GLY 67 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 1x5q n GLY 67 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x5q n ASP 68 N 0.00 1.81 -4.25 1.61 -0.08 -0.79 -4.46 116.55 110.39 1x5q n ASP 68 Ca 0.00 1.18 -0.43 0.00 -1.51 0.00 0.00 54.79 54.03 1x5q n ASP 68 Cb 0.00 -1.35 -0.06 0.00 2.34 0.00 0.00 41.12 42.06 1x5q n ASP 68 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1x5q s LYS 69 N -1.49 3.03 0.57 -0.67 2.20 -0.96 -0.39 119.74 122.03 1x5q s LYS 69 Ca 0.59 -2.19 -0.18 0.00 -0.36 0.00 0.00 55.97 53.83 1x5q s LYS 69 Cb -0.67 -4.15 -0.07 0.00 -1.51 0.00 0.00 37.83 31.42 1x5q s LYS 69 CO 0.59 -1.25 0.70 -0.11 -0.36 0.00 0.00 175.35 174.92 1x5q n LEU 70 N 4.31 1.89 0.00 5.43 0.00 0.98 0.43 117.00 130.04 1x5q n LEU 70 Ca 0.03 0.78 0.00 0.00 0.00 0.00 0.00 56.01 56.81 1x5q n LEU 70 Cb 0.42 -1.26 0.00 0.00 0.00 0.00 0.00 43.42 42.59 1x5q n LEU 70 CO 0.39 -2.56 -0.21 0.18 0.00 0.00 0.00 177.39 175.19 1x5q n LEU 71 N 0.05 0.99 -4.09 -1.96 4.77 0.64 -4.44 117.00 112.96 1x5q n LEU 71 Ca 0.12 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.00 1x5q n LEU 71 Cb 0.47 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.45 1x5q n LEU 71 CO 0.51 0.10 -0.38 -1.61 -1.33 0.00 0.00 177.39 174.67 1x5q s GLU 72 N -1.55 0.61 -0.28 3.23 8.01 -0.89 0.10 118.70 127.93 1x5q s GLU 72 Ca 0.00 -0.99 -0.02 0.00 0.01 0.00 0.00 54.97 53.97 1x5q s GLU 72 Cb 0.00 -0.14 0.12 0.00 -4.31 0.00 0.00 34.13 29.80 1x5q s GLU 72 CO 0.00 -0.01 0.23 0.08 0.01 0.00 0.00 175.26 175.58 1x5q s VAL 73 N -2.47 -0.29 0.00 2.63 1.01 -0.07 -0.46 120.40 120.75 1x5q s VAL 73 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1x5q s VAL 73 Cb -0.03 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.41 1x5q s VAL 73 CO -0.03 -0.51 0.00 -3.20 0.00 0.00 0.00 175.10 171.36 1x5q n ASN 74 N 5.29 -2.29 0.00 3.32 2.85 0.24 -2.38 115.26 122.30 1x5q n ASN 74 Ca -0.04 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 1x5q n ASN 74 Cb 0.45 -0.85 0.00 0.00 1.24 0.00 0.00 39.78 40.63 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 -2.16 2.50 3.71 8.20 0.00 -1.26 -4.99 105.19 111.19 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 -2.27 3.96 -0.18 1.61 0.11 -1.00 -4.97 120.40 117.66 1x5q s VAL 76 Ca 0.00 1.39 -0.29 0.00 -2.93 0.00 0.00 61.98 60.15 1x5q s VAL 76 Cb 0.00 -3.89 -0.01 0.00 -1.53 0.00 0.00 36.38 30.95 1x5q s VAL 76 CO 0.00 0.09 1.24 0.00 -3.33 0.00 0.00 175.10 173.10 1x5q s ALA 77 N 1.27 3.66 -0.49 1.54 0.00 -1.26 -0.89 121.76 125.58 1x5q s ALA 77 Ca 0.59 0.42 0.03 0.00 0.00 0.00 0.00 51.96 53.01 1x5q s ALA 77 Cb -0.30 -3.62 0.43 0.00 0.00 0.00 0.00 23.12 19.63 1x5q s ALA 77 CO 0.28 -1.18 1.43 1.28 0.00 0.00 0.00 175.76 177.58 1x5q n LEU 78 N 6.61 5.72 -4.45 0.00 4.77 0.12 -4.90 117.00 124.86 1x5q n LEU 78 Ca 0.14 -4.85 -0.44 0.00 -0.03 0.00 0.00 56.01 50.83 1x5q n LEU 78 Cb 0.45 -0.60 -0.06 0.00 -2.33 0.00 0.00 43.42 40.88 1x5q n LEU 78 CO 0.56 2.00 0.39 -1.58 -1.33 0.00 0.00 177.39 177.42 1x5q s GLN 79 N -3.69 3.14 -1.05 3.23 0.74 -1.25 -4.11 119.66 116.67 1x5q s GLN 79 Ca 0.52 -0.85 -0.03 0.00 0.05 0.00 0.00 55.36 55.05 1x5q s GLN 79 Cb 0.43 -4.11 0.00 0.00 1.10 0.00 0.00 33.01 30.43 1x5q s GLN 79 CO -0.12 -1.28 0.37 0.41 -0.55 0.00 0.00 175.29 174.12 1x5q n GLY 80 N 5.17 -0.13 3.96 2.59 0.00 -1.25 -5.01 105.19 110.52 1x5q n GLY 80 Ca -0.06 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.94 3.71 0.47 4.61 0.00 -1.26 -4.72 121.76 121.63 1x5q s ALA 81 Ca 0.18 -1.13 -0.21 0.00 0.00 0.00 0.00 51.96 50.81 1x5q s ALA 81 Cb -0.08 -2.21 -0.09 0.00 0.00 0.00 0.00 23.12 20.74 1x5q s ALA 81 CO 0.23 -0.69 1.02 -1.21 0.00 0.00 0.00 175.76 175.12 1x5q s GLU 82 N -4.77 3.91 0.38 0.00 0.41 -1.26 -1.68 118.70 115.69 1x5q s GLU 82 Ca 0.54 1.34 0.15 0.00 -0.41 0.00 0.00 54.97 56.59 1x5q s GLU 82 Cb -0.10 -2.15 1.00 0.00 -1.78 0.00 0.00 34.13 31.10 1x5q s GLU 82 CO 0.40 -0.33 1.80 1.25 -0.49 0.00 0.00 175.26 177.89 1x5q h HIS 83 N 1.72 0.72 -0.39 1.61 2.76 -1.84 0.37 115.15 120.09 1x5q h HIS 83 Ca -0.49 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 57.65 1x5q h HIS 83 Cb 1.21 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.94 1x5q h HIS 83 CO 0.58 0.14 0.05 1.12 -1.30 0.00 0.00 177.93 178.52 1x5q h HIS 84 N 0.49 0.69 -0.64 5.26 2.07 -1.96 -0.35 115.15 120.71 1x5q h HIS 84 Ca 0.54 -0.10 0.02 0.00 -2.85 0.00 0.00 60.37 57.99 1x5q h HIS 84 Cb 1.23 -0.19 -0.04 0.00 2.57 0.00 0.00 27.41 30.98 1x5q h HIS 84 CO -0.00 0.69 0.40 0.93 -3.07 0.00 0.00 177.93 176.88 1x5q h GLU 85 N 0.49 0.77 0.53 5.12 5.08 -0.71 0.25 114.58 126.11 1x5q h GLU 85 Ca 0.12 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1x5q h GLU 85 Cb 0.38 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.46 1x5q h GLU 85 CO 0.01 0.51 -0.25 0.00 -1.00 0.00 0.00 179.01 178.27 1x5q h ALA 86 N 1.27 -0.71 -0.12 3.43 0.00 -0.86 0.10 119.26 122.36 1x5q h ALA 86 Ca 0.25 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1x5q h ALA 86 Cb -0.00 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1x5q h ALA 86 CO -0.09 -0.84 -0.38 0.28 0.00 0.00 0.00 179.25 178.22 1x5q h VAL 87 N -0.82 0.20 -0.41 0.00 2.07 -0.80 0.20 116.25 116.69 1x5q h VAL 87 Ca -0.07 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.53 1x5q h VAL 87 Cb 0.59 0.20 -0.09 0.00 -1.52 0.00 0.00 31.29 30.47 1x5q h VAL 87 CO 0.12 0.00 -0.30 -0.08 0.02 0.00 0.00 177.57 177.33 1x5q h GLU 88 N -0.46 -0.21 -0.19 1.57 4.22 -0.43 0.29 114.58 119.38 1x5q h GLU 88 Ca 0.08 0.01 0.05 0.00 0.08 0.00 0.00 59.36 59.59 1x5q h GLU 88 Cb 0.60 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.83 1x5q h GLU 88 CO -0.37 -0.14 -0.27 0.00 -2.18 0.00 0.00 179.01 176.05 1x5q h ALA 89 N 0.87 -0.22 -0.21 2.92 0.00 -0.01 0.94 119.26 123.54 1x5q h ALA 89 Ca 0.18 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.20 1x5q h ALA 89 Cb 0.52 0.53 -0.07 0.00 0.00 0.00 0.00 17.79 18.77 1x5q h ALA 89 CO -0.54 -0.71 -0.32 -0.07 0.00 0.00 0.00 179.25 177.61 1x5q h LEU 90 N -0.30 -1.01 -0.85 0.00 3.38 0.82 0.35 115.31 117.70 1x5q h LEU 90 Ca 0.12 0.16 0.18 0.00 0.09 0.00 0.00 57.88 58.43 1x5q h LEU 90 Cb 0.48 0.44 -0.11 0.00 0.09 0.00 0.00 40.66 41.57 1x5q h LEU 90 CO -0.36 -0.34 0.37 0.03 0.09 0.00 0.00 178.44 178.23 1x5q h ARG 91 N -0.35 0.44 -5.81 1.13 3.08 0.47 -3.27 114.38 110.07 1x5q h ARG 91 Ca 0.12 -0.03 -0.62 0.00 0.07 0.00 0.00 59.98 59.52 1x5q h ARG 91 Cb 0.54 -0.10 -0.12 0.00 0.08 0.00 0.00 29.97 30.37 1x5q h ARG 91 CO -0.41 0.29 1.22 0.20 -1.07 0.00 0.00 179.97 180.21 1x5q s GLY 92 N -3.66 1.41 -0.29 0.04 0.00 0.23 -4.89 107.32 100.17 1x5q s GLY 92 Ca -0.12 -2.28 -0.19 0.00 0.00 0.00 0.00 44.72 42.13 1x5q s GLY 92 CO 0.78 2.47 1.04 0.00 0.00 0.00 0.00 173.10 177.38 1x5q s ALA 93 N 4.40 -2.19 0.93 3.20 0.00 -1.24 -4.85 121.76 122.01 1x5q s ALA 93 Ca 0.40 2.06 0.00 0.00 0.00 0.00 0.00 51.96 54.42 1x5q s ALA 93 Cb -0.03 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.45 1x5q s ALA 93 CO -0.06 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1x5q n GLY 94 N 3.06 -0.61 0.00 0.00 0.00 -1.26 -4.98 105.19 101.40 1x5q n GLY 94 Ca -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.31 0.00 -2.30 2.61 -1.04 -1.26 -3.91 114.28 108.07 1x5q n THR 95 Ca 0.00 1.21 -0.42 0.00 -2.04 0.00 0.00 64.05 62.80 1x5q n THR 95 Cb 0.00 -1.82 -0.03 0.00 -1.82 0.00 0.00 70.33 66.66 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 -3.18 2.79 -0.32 2.41 0.00 -1.25 0.83 121.76 123.05 1x5q s ALA 96 Ca 0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 51.96 51.40 1x5q s ALA 96 Cb 0.00 -4.08 -0.02 0.00 0.00 0.00 0.00 23.12 19.02 1x5q s ALA 96 CO 0.00 -2.89 0.19 0.08 0.00 0.00 0.00 175.76 173.14 1x5q s VAL 97 N 6.37 4.99 -0.08 0.00 1.01 0.10 -4.88 120.40 127.92 1x5q s VAL 97 Ca 0.59 -0.25 -0.14 0.00 0.00 0.00 0.00 61.98 62.19 1x5q s VAL 97 Cb -0.13 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 1x5q s VAL 97 CO 0.27 0.06 0.34 -1.58 0.00 0.00 0.00 175.10 174.19 1x5q s GLN 98 N 1.68 3.99 -0.06 2.72 0.74 -1.26 -0.56 119.66 126.91 1x5q s GLN 98 Ca 0.06 0.23 -0.03 0.00 0.05 0.00 0.00 55.36 55.67 1x5q s GLN 98 Cb -0.17 -3.30 0.04 0.00 1.10 0.00 0.00 33.01 30.68 1x5q s GLN 98 CO 0.09 0.52 0.12 -1.64 -0.55 0.00 0.00 175.29 173.82 1x5q s MET 99 N -0.43 -0.00 -0.51 1.67 -1.94 -0.18 0.83 119.30 118.74 1x5q s MET 99 Ca 0.20 0.46 -0.23 0.00 -1.71 0.00 0.00 55.69 54.41 1x5q s MET 99 Cb -0.15 -0.34 0.04 0.00 2.01 0.00 0.00 34.83 36.39 1x5q s MET 99 CO 0.09 -0.29 0.84 0.50 -0.01 0.00 0.00 175.02 176.15 1x5q s ARG 100 N 2.06 3.32 0.09 2.03 3.52 0.40 -0.99 118.95 129.39 1x5q s ARG 100 Ca 0.02 -0.31 0.01 0.00 -0.13 0.00 0.00 55.73 55.32 1x5q s ARG 100 Cb -0.12 -4.02 -0.04 0.00 -1.56 0.00 0.00 34.95 29.21 1x5q s ARG 100 CO -0.05 -1.33 0.21 0.14 -0.81 0.00 0.00 175.30 173.46 1x5q s VAL 101 N 3.54 5.20 -0.22 7.11 -7.23 0.64 0.23 120.40 129.67 1x5q s VAL 101 Ca 0.28 -0.57 -0.08 0.00 -1.81 0.00 0.00 61.98 59.80 1x5q s VAL 101 Cb -0.13 -3.58 -0.04 0.00 0.56 0.00 0.00 36.38 33.19 1x5q s VAL 101 CO 0.19 0.05 0.08 0.86 -0.31 0.00 0.00 175.10 175.98 1x5q s TRP 102 N -1.58 3.17 -0.05 2.82 -0.00 0.17 -0.03 118.94 123.44 1x5q s TRP 102 Ca 0.34 -0.14 -0.26 0.00 -0.00 0.00 0.00 56.10 56.04 1x5q s TRP 102 Cb -0.12 -2.18 0.06 0.00 -0.00 0.00 0.00 33.47 31.22 1x5q s TRP 102 CO 0.27 -0.11 0.57 0.50 -0.00 0.00 0.00 176.95 178.18 1x5q s ARG 103 N 1.08 0.93 0.01 5.86 3.52 0.84 -2.26 118.95 128.94 1x5q s ARG 103 Ca 0.05 0.17 -0.28 0.00 -0.13 0.00 0.00 55.73 55.53 1x5q s ARG 103 Cb -0.14 0.43 -0.04 0.00 -1.56 0.00 0.00 34.95 33.64 1x5q s ARG 103 CO 0.03 -0.27 0.88 -2.00 -0.81 0.00 0.00 175.30 173.13 1x5q s GLU 104 N -1.14 4.55 -0.25 5.12 -6.30 -1.26 0.18 118.70 119.59 1x5q s GLU 104 Ca -0.11 1.25 -0.02 0.00 -2.50 0.00 0.00 54.97 53.59 1x5q s GLU 104 Cb -0.02 -3.43 0.13 0.00 0.00 0.00 0.00 34.13 30.81 1x5q s GLU 104 CO 0.08 0.08 0.31 0.45 0.02 0.00 0.00 175.26 176.19 1x5q s SER 105 N 0.60 1.07 0.12 -1.70 0.15 -1.26 -4.90 113.70 107.78 1x5q s SER 105 Ca 0.46 -0.29 0.05 0.00 0.70 0.00 0.00 55.95 56.87 1x5q s SER 105 Cb -0.21 0.70 -0.04 0.00 -1.71 0.00 0.00 66.02 64.76 1x5q s SER 105 CO 0.25 -0.34 0.02 -0.83 1.20 0.00 0.00 173.24 173.54 1x5q s GLY 106 N 2.42 1.85 -1.09 9.45 0.00 -1.26 -5.00 107.32 113.69 1x5q s GLY 106 Ca 0.10 -1.18 -0.18 0.00 0.00 0.00 0.00 44.72 43.45 1x5q s GLY 106 CO -0.22 -1.18 2.07 -1.55 0.00 0.00 0.00 173.10 172.23 1x5q n PRO 107 N 0.29 2.14 -3.80 2.90 -0.04 -1.26 -4.79 135.00 130.44 1x5q n PRO 107 Ca -0.10 -2.20 -0.33 0.00 -0.04 0.00 0.00 63.50 60.83 1x5q n PRO 107 Cb 0.53 -3.09 -0.11 0.00 -0.04 0.00 0.00 33.50 30.79 1x5q n PRO 107 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x5q s SER 108 N 4.15 5.07 0.00 3.54 0.01 -1.26 -4.92 113.70 120.29 1x5q s SER 108 Ca 0.53 -3.29 0.00 0.00 1.31 0.00 0.00 55.95 54.49 1x5q s SER 108 Cb 0.14 -1.77 0.00 0.00 0.21 0.00 0.00 66.02 64.61 1x5q s SER 108 CO 0.02 -0.23 0.00 -1.20 0.41 0.00 0.00 173.24 172.24 1x5q n SER 109 N 2.82 0.00 0.00 2.44 7.64 -1.26 -5.27 113.62 119.99 1x5q n SER 109 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1x5q n SER 109 Cb 0.36 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 1x5q n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64