#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 1.35 0.46 1.61 0.15 -1.26 -5.15 113.70 110.86 1x5q s SER 2 Ca 0.00 -0.71 -0.18 0.00 0.70 0.00 0.00 55.95 55.75 1x5q s SER 2 Cb 0.00 0.01 -0.09 0.00 -1.71 0.00 0.00 66.02 64.22 1x5q s SER 2 CO 0.00 -0.21 0.95 -0.55 1.20 0.00 0.00 173.24 174.63 1x5q s SER 3 N -2.10 6.78 -0.29 5.45 0.15 -1.26 -5.05 113.70 117.38 1x5q s SER 3 Ca 0.00 1.60 -0.03 0.00 0.70 0.00 0.00 55.95 58.23 1x5q s SER 3 Cb -0.06 -2.51 0.19 0.00 -1.71 0.00 0.00 66.02 61.93 1x5q s SER 3 CO 0.00 -0.45 0.82 -0.83 1.20 0.00 0.00 173.24 173.98 1x5q s GLY 4 N -2.60 -1.06 0.82 9.45 0.00 -1.26 -5.17 107.32 107.50 1x5q s GLY 4 Ca 0.60 1.64 -0.12 0.00 0.00 0.00 0.00 44.72 46.84 1x5q s GLY 4 CO 0.22 3.87 1.16 -0.56 0.00 0.00 0.00 173.10 177.79 1x5q s SER 5 N 2.89 4.43 0.13 1.64 0.01 -1.26 -5.09 113.70 116.45 1x5q s SER 5 Ca 0.18 0.85 -0.24 0.00 1.31 0.00 0.00 55.95 58.05 1x5q s SER 5 Cb -0.07 -1.39 0.08 0.00 0.21 0.00 0.00 66.02 64.85 1x5q s SER 5 CO -0.24 -1.96 0.65 -0.94 0.41 0.00 0.00 173.24 171.16 1x5q s SER 6 N -4.45 -0.54 -0.93 2.44 1.04 -1.26 -5.10 113.70 104.89 1x5q s SER 6 Ca 0.62 0.02 -0.18 0.00 0.48 0.00 0.00 55.95 56.88 1x5q s SER 6 Cb -0.12 0.57 0.13 0.00 0.10 0.00 0.00 66.02 66.70 1x5q s SER 6 CO 0.50 -0.91 1.12 -0.83 0.98 0.00 0.00 173.24 174.11 1x5q s GLY 7 N -2.67 1.96 0.42 7.32 0.00 -1.26 -5.02 107.32 108.08 1x5q s GLY 7 Ca 0.01 -2.80 -0.18 0.00 0.00 0.00 0.00 44.72 41.75 1x5q s GLY 7 CO -0.12 1.99 0.90 -0.54 0.00 0.00 0.00 173.10 175.33 1x5q s GLU 8 N 2.58 4.09 -0.02 2.90 2.02 -1.26 -5.01 118.70 123.99 1x5q s GLU 8 Ca 0.33 0.94 -0.30 0.00 0.02 0.00 0.00 54.97 55.96 1x5q s GLU 8 Cb -0.05 -2.24 -0.04 0.00 0.10 0.00 0.00 34.13 31.90 1x5q s GLU 8 CO -0.09 -0.04 1.21 -1.25 0.02 0.00 0.00 175.26 175.11 1x5q s PRO 9 N -3.37 4.37 -0.39 0.39 0.04 -1.26 -5.00 135.00 129.79 1x5q s PRO 9 Ca 0.59 1.71 0.04 0.00 0.04 0.00 0.00 61.00 63.38 1x5q s PRO 9 Cb -0.10 -3.51 0.11 0.00 0.04 0.00 0.00 34.50 31.04 1x5q s PRO 9 CO 0.19 -0.40 0.11 0.00 0.04 0.00 0.00 177.00 176.93 1x5q s ALA 10 N 1.94 3.01 0.63 8.56 0.00 -1.26 -5.10 121.76 129.54 1x5q s ALA 10 Ca 0.57 -2.74 -0.13 0.00 0.00 0.00 0.00 51.96 49.66 1x5q s ALA 10 Cb -0.26 -2.02 -0.02 0.00 0.00 0.00 0.00 23.12 20.82 1x5q s ALA 10 CO 0.24 -1.78 1.05 1.03 0.00 0.00 0.00 175.76 176.30 1x5q s ARG 11 N 0.58 3.23 -0.05 0.00 1.81 -1.26 -5.06 118.95 118.20 1x5q s ARG 11 Ca 0.13 1.03 0.05 0.00 -1.72 0.00 0.00 55.73 55.22 1x5q s ARG 11 Cb -0.21 -2.03 -0.01 0.00 -0.45 0.00 0.00 34.95 32.26 1x5q s ARG 11 CO -0.06 -0.87 -0.20 0.42 -0.68 0.00 0.00 175.30 173.91 1x5q s ILE 12 N -2.80 1.69 -0.30 1.52 1.01 -1.26 -5.11 121.20 115.95 1x5q s ILE 12 Ca 0.60 -0.86 -0.20 0.00 0.00 0.00 0.00 60.65 60.19 1x5q s ILE 12 Cb -0.14 -1.44 0.19 0.00 0.01 0.00 0.00 42.46 41.08 1x5q s ILE 12 CO 0.46 0.48 1.28 -1.83 0.00 0.00 0.00 174.94 175.33 1x5q s GLU 13 N -0.06 0.12 1.02 2.79 -1.05 -1.26 -5.16 118.70 115.10 1x5q s GLU 13 Ca -0.03 0.18 -0.20 0.00 -0.15 0.00 0.00 54.97 54.76 1x5q s GLU 13 Cb -0.12 0.04 -0.08 0.00 -0.44 0.00 0.00 34.13 33.53 1x5q s GLU 13 CO 0.03 -0.02 -0.68 0.39 0.95 0.00 0.00 175.26 175.93 1x5q n GLU 14 N 2.54 -0.43 -4.50 -4.83 1.02 -1.26 -4.85 120.64 108.33 1x5q n GLU 14 Ca -0.14 -0.11 -0.24 0.00 -0.02 0.00 0.00 57.16 56.64 1x5q n GLU 14 Cb 0.57 -1.31 -0.10 0.00 -0.02 0.00 0.00 31.44 30.58 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 -2.61 1.72 0.19 3.49 -1.05 0.51 -4.82 118.70 116.14 1x5q s GLU 15 Ca 0.45 -1.85 -0.28 0.00 -0.15 0.00 0.00 54.97 53.14 1x5q s GLU 15 Cb -0.07 -1.65 -0.08 0.00 -0.44 0.00 0.00 34.13 31.89 1x5q s GLU 15 CO 0.71 0.20 0.86 -1.21 0.95 0.00 0.00 175.26 176.76 1x5q s GLU 16 N -3.59 4.71 0.08 -4.83 2.02 -1.26 -0.06 118.70 115.77 1x5q s GLU 16 Ca 0.31 1.32 -0.01 0.00 0.02 0.00 0.00 54.97 56.61 1x5q s GLU 16 Cb -0.00 -3.28 -0.04 0.00 0.10 0.00 0.00 34.13 30.91 1x5q s GLU 16 CO 0.15 0.53 -0.00 -0.51 0.02 0.00 0.00 175.26 175.44 1x5q s LEU 17 N -1.08 2.24 -0.08 1.80 1.43 0.17 -4.92 118.68 118.24 1x5q s LEU 17 Ca 0.39 -1.08 -0.01 0.00 -1.03 0.00 0.00 54.13 52.41 1x5q s LEU 17 Cb -0.24 0.20 0.03 0.00 0.03 0.00 0.00 46.19 46.21 1x5q s LEU 17 CO 0.29 -0.63 -0.03 -0.89 0.23 0.00 0.00 176.35 175.32 1x5q s THR 18 N -3.93 0.58 0.11 5.49 2.01 -1.26 -0.85 115.64 117.79 1x5q s THR 18 Ca 0.14 -0.04 0.09 0.00 0.31 0.00 0.00 61.69 62.19 1x5q s THR 18 Cb 0.08 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 1x5q s THR 18 CO -0.05 0.28 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.19 1x5q s LEU 19 N 1.67 2.55 -0.13 4.42 1.43 0.44 -4.95 118.68 124.10 1x5q s LEU 19 Ca 0.01 -0.61 0.01 0.00 -1.03 0.00 0.00 54.13 52.52 1x5q s LEU 19 Cb -0.13 -1.43 0.02 0.00 0.03 0.00 0.00 46.19 44.68 1x5q s LEU 19 CO -0.05 0.19 -0.16 -0.89 0.23 0.00 0.00 176.35 175.67 1x5q s THR 20 N -1.08 1.64 0.13 5.49 2.01 -1.26 0.29 115.64 122.86 1x5q s THR 20 Ca 0.16 -0.70 0.05 0.00 0.31 0.00 0.00 61.69 61.51 1x5q s THR 20 Cb -0.10 -1.50 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 1x5q s THR 20 CO 0.08 0.47 0.08 -0.63 -0.69 0.00 0.00 174.62 173.93 1x5q s ILE 21 N 1.19 4.35 -0.14 1.82 1.01 0.05 -4.61 121.20 124.88 1x5q s ILE 21 Ca -0.01 -1.00 -0.05 0.00 0.00 0.00 0.00 60.65 59.59 1x5q s ILE 21 Cb -0.14 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.14 1x5q s ILE 21 CO -0.06 -0.00 0.04 -0.76 0.00 0.00 0.00 174.94 174.16 1x5q s LEU 22 N -2.74 3.75 0.30 2.97 1.43 -1.26 -0.05 118.68 123.07 1x5q s LEU 22 Ca 0.29 0.13 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1x5q s LEU 22 Cb -0.11 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1x5q s LEU 22 CO 0.22 0.28 0.52 -0.60 0.23 0.00 0.00 176.35 176.99 1x5q s ARG 23 N -0.25 3.54 -0.30 1.70 3.52 0.05 -4.86 118.95 122.35 1x5q s ARG 23 Ca 0.07 -0.23 -0.01 0.00 -0.13 0.00 0.00 55.73 55.43 1x5q s ARG 23 Cb -0.12 -2.69 0.19 0.00 -1.56 0.00 0.00 34.95 30.77 1x5q s ARG 23 CO 0.02 0.22 0.78 -0.65 -0.81 0.00 0.00 175.30 174.86 1x5q s GLN 24 N -3.86 0.40 -1.45 5.12 -0.21 -1.26 -4.86 119.66 113.53 1x5q s GLN 24 Ca 0.41 0.34 -0.06 0.00 0.02 0.00 0.00 55.36 56.07 1x5q s GLN 24 Cb -0.10 0.17 0.06 0.00 1.00 0.00 0.00 33.01 34.14 1x5q s GLN 24 CO 0.33 -0.73 0.16 -2.37 -2.12 0.00 0.00 175.29 170.55 1x5q n THR 25 N 5.21 -0.62 0.00 -0.19 5.66 -1.26 -4.78 114.28 118.30 1x5q n THR 25 Ca 0.07 -0.31 0.00 0.00 -3.05 0.00 0.00 64.05 60.76 1x5q n THR 25 Cb 0.56 -0.75 0.00 0.00 -1.55 0.00 0.00 70.33 68.59 1x5q n THR 25 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1x5q n GLY 26 N -1.99 3.33 0.00 1.09 0.00 -1.26 -5.16 105.19 101.21 1x5q n GLY 26 Ca -0.17 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.95 -3.36 2.98 -0.02 0.00 -1.26 -4.80 105.19 97.78 1x5q n GLY 27 Ca 0.00 -0.90 -0.16 0.00 0.00 0.00 0.00 46.02 44.96 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 -3.08 0.99 4.77 -1.26 -4.61 117.00 113.81 1x5q n LEU 28 Ca 0.00 -2.00 -0.26 0.00 -0.03 0.00 0.00 56.01 53.71 1x5q n LEU 28 Cb 0.00 -0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 40.80 1x5q n LEU 28 CO 0.00 -0.62 0.09 0.61 -1.33 0.00 0.00 177.39 176.14 1x5q n GLY 29 N -0.33 5.17 3.15 -0.72 0.00 -1.26 -4.97 105.19 106.22 1x5q n GLY 29 Ca 0.09 -2.65 -0.10 0.00 0.00 0.00 0.00 46.02 43.35 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 -3.73 0.11 -0.11 -0.61 -4.36 -1.26 -2.60 121.20 108.65 1x5q s ILE 30 Ca 0.46 -0.94 -0.00 0.00 -0.26 0.00 0.00 60.65 59.90 1x5q s ILE 30 Cb 0.25 -0.84 -0.02 0.00 1.25 0.00 0.00 42.46 43.10 1x5q s ILE 30 CO -0.10 -0.52 -0.10 -0.44 0.24 0.00 0.00 174.94 174.02 1x5q s SER 31 N -2.01 4.35 0.25 4.36 0.01 0.14 -4.94 113.70 115.86 1x5q s SER 31 Ca -0.06 -0.19 0.08 0.00 1.31 0.00 0.00 55.95 57.09 1x5q s SER 31 Cb -0.02 -1.44 -0.04 0.00 0.21 0.00 0.00 66.02 64.73 1x5q s SER 31 CO -0.03 0.24 0.08 0.27 0.41 0.00 0.00 173.24 174.20 1x5q s ILE 32 N -0.07 3.89 -0.05 1.44 -4.36 -1.26 0.20 121.20 120.99 1x5q s ILE 32 Ca -0.01 -1.64 -0.29 0.00 -0.26 0.00 0.00 60.65 58.45 1x5q s ILE 32 Cb -0.14 -3.08 0.06 0.00 1.25 0.00 0.00 42.46 40.56 1x5q s ILE 32 CO 0.03 -0.33 0.63 0.00 0.24 0.00 0.00 174.94 175.51 1x5q s ALA 33 N -2.18 -1.64 0.00 2.27 0.00 -0.60 -4.70 121.76 114.92 1x5q s ALA 33 Ca 0.32 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.47 1x5q s ALA 33 Cb -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.05 1x5q s ALA 33 CO 0.22 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.03 1x5q n GLY 34 N 0.98 0.27 0.63 0.00 0.00 -1.23 -1.62 105.19 104.22 1x5q n GLY 34 Ca -0.19 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.45 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 -3.90 3.26 -0.02 0.00 -1.19 -4.39 105.19 98.95 1x5q n GLY 35 Ca 0.00 -0.79 -0.39 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.15 0.01 0.00 1.61 4.81 -1.23 -1.74 118.16 121.48 1x5q n LYS 36 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1x5q n LYS 36 Cb 0.00 -1.02 0.00 0.00 0.02 0.00 0.00 35.03 34.03 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 2.46 1.89 3.61 3.14 0.00 -1.26 -4.35 105.19 110.68 1x5q n GLY 37 Ca 0.09 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 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 1.37 0.18 1.61 0.01 -0.71 -4.97 113.70 111.20 1x5q s SER 38 Ca 0.00 0.79 -0.30 0.00 1.31 0.00 0.00 55.95 57.75 1x5q s SER 38 Cb 0.00 -1.16 -0.08 0.00 0.21 0.00 0.00 66.02 64.99 1x5q s SER 38 CO 0.00 -3.86 1.22 -0.89 0.41 0.00 0.00 173.24 170.12 1x5q s THR 39 N -2.99 3.52 0.20 1.44 2.01 -1.26 -4.76 115.64 113.81 1x5q s THR 39 Ca 0.69 1.27 -0.30 0.00 0.31 0.00 0.00 61.69 63.66 1x5q s THR 39 Cb -0.12 -3.81 -0.08 0.00 0.01 0.00 0.00 72.50 68.50 1x5q s THR 39 CO 0.57 0.20 1.11 -2.16 -0.69 0.00 0.00 174.62 173.64 1x5q s PRO 40 N -0.15 4.60 0.40 4.92 0.04 -1.26 -3.48 135.00 140.06 1x5q s PRO 40 Ca 0.54 1.75 0.11 0.00 0.04 0.00 0.00 61.00 63.44 1x5q s PRO 40 Cb -0.33 -3.25 0.91 0.00 0.04 0.00 0.00 34.50 31.86 1x5q s PRO 40 CO 0.37 0.10 1.96 -0.92 0.04 0.00 0.00 177.00 178.54 1x5q h TYR 41 N 4.80 0.59 -4.32 0.56 5.03 -1.78 -3.43 116.97 118.42 1x5q h TYR 41 Ca -0.45 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 60.80 1x5q h TYR 41 Cb 1.21 -0.19 -0.00 0.00 1.55 0.00 0.00 36.73 39.30 1x5q h TYR 41 CO 0.62 0.28 -0.03 1.63 -1.32 0.00 0.00 178.16 179.34 1x5q n LYS 42 N -4.48 1.18 0.00 1.82 5.02 -1.26 -5.07 118.16 115.37 1x5q n LYS 42 Ca 0.11 -0.48 0.00 0.00 -2.02 0.00 0.00 58.31 55.92 1x5q n LYS 42 Cb 0.34 0.01 0.00 0.00 -0.02 0.00 0.00 35.03 35.36 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 4.01 -0.38 2.63 0.72 0.00 -1.26 -4.15 105.19 106.75 1x5q n GLY 43 Ca 0.01 0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.04 3.51 -4.15 1.61 9.92 -1.26 -4.77 116.55 121.36 1x5q n ASP 44 Ca 0.00 -3.44 -0.37 0.00 -0.53 0.00 0.00 54.79 50.44 1x5q n ASP 44 Cb 0.00 -0.53 -0.11 0.00 -0.64 0.00 0.00 41.12 39.84 1x5q n ASP 44 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1x5q s ASP 45 N -3.27 5.35 -1.08 -2.24 1.11 -1.26 -4.98 116.67 110.30 1x5q s ASP 45 Ca 0.44 -1.91 -0.08 0.00 0.18 0.00 0.00 52.55 51.18 1x5q s ASP 45 Cb 0.36 -1.87 -0.12 0.00 1.07 0.00 0.00 42.92 42.36 1x5q s ASP 45 CO -0.12 -0.55 2.90 -1.84 1.18 0.00 0.00 175.17 176.74 1x5q n GLU 46 N 4.68 2.92 -4.38 8.23 0.00 -1.26 -4.32 120.64 126.51 1x5q n GLU 46 Ca -0.05 -1.73 -0.19 0.00 0.00 0.00 0.00 57.16 55.20 1x5q n GLU 46 Cb 0.41 -2.51 -0.10 0.00 0.00 0.00 0.00 31.44 29.24 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 2.38 1.78 -0.47 -1.84 0.00 -1.26 -4.31 107.32 103.60 1x5q s GLY 47 Ca 0.62 -1.89 -0.21 0.00 0.00 0.00 0.00 44.72 43.24 1x5q s GLY 47 CO -0.04 -1.73 0.68 -0.42 0.00 0.00 0.00 173.10 171.60 1x5q s ILE 48 N -3.37 4.78 0.18 0.90 -1.09 -1.26 -3.16 121.20 118.18 1x5q s ILE 48 Ca 0.32 -0.04 0.08 0.00 -2.23 0.00 0.00 60.65 58.79 1x5q s ILE 48 Cb 0.07 -4.28 -0.04 0.00 -1.58 0.00 0.00 42.46 36.62 1x5q s ILE 48 CO 0.12 -0.73 -0.04 -0.36 -1.23 0.00 0.00 174.94 172.69 1x5q s PHE 49 N 2.93 2.74 0.27 3.97 0.40 -0.64 -0.00 117.98 127.65 1x5q s PHE 49 Ca 0.22 -0.18 -0.29 0.00 -0.60 0.00 0.00 56.93 56.07 1x5q s PHE 49 Cb -0.15 -1.32 -0.10 0.00 0.51 0.00 0.00 43.02 41.96 1x5q s PHE 49 CO 0.17 0.52 1.31 0.42 0.70 0.00 0.00 175.22 178.34 1x5q s ILE 50 N -1.76 2.95 -0.20 0.64 -1.09 -0.33 -1.56 121.20 119.84 1x5q s ILE 50 Ca 0.27 0.87 0.01 0.00 -2.23 0.00 0.00 60.65 59.56 1x5q s ILE 50 Cb -0.09 -3.55 -0.13 0.00 -1.58 0.00 0.00 42.46 37.11 1x5q s ILE 50 CO 0.17 0.17 -0.18 -0.24 -1.23 0.00 0.00 174.94 173.63 1x5q n SER 51 N 1.69 2.41 -3.70 3.58 2.88 0.53 -3.00 113.62 118.01 1x5q n SER 51 Ca 0.03 -0.10 -0.14 0.00 -1.33 0.00 0.00 58.87 57.33 1x5q n SER 51 Cb 0.42 -0.33 -0.09 0.00 -0.75 0.00 0.00 64.21 63.47 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 -2.40 0.65 -0.33 -1.46 3.52 -1.08 -4.93 118.95 112.91 1x5q s ARG 52 Ca -0.27 0.42 0.01 0.00 -0.13 0.00 0.00 55.73 55.76 1x5q s ARG 52 Cb 0.07 0.31 0.10 0.00 -1.56 0.00 0.00 34.95 33.87 1x5q s ARG 52 CO 0.46 -0.13 0.09 0.08 -0.81 0.00 0.00 175.30 175.00 1x5q s VAL 53 N -0.29 1.30 -0.33 7.11 1.01 -1.26 0.26 120.40 128.20 1x5q s VAL 53 Ca -0.04 -1.74 -0.28 0.00 0.00 0.00 0.00 61.98 59.92 1x5q s VAL 53 Cb -0.03 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 1x5q s VAL 53 CO 0.03 -0.67 2.07 -0.44 0.00 0.00 0.00 175.10 176.08 1x5q s SER 54 N 1.33 5.45 0.28 3.32 0.01 -1.07 -4.83 113.70 118.19 1x5q s SER 54 Ca 0.11 1.44 0.01 0.00 1.31 0.00 0.00 55.95 58.81 1x5q s SER 54 Cb -0.18 -2.52 0.67 0.00 0.21 0.00 0.00 66.02 64.20 1x5q s SER 54 CO -0.19 -2.04 1.65 1.05 0.41 0.00 0.00 173.24 174.12 1x5q h GLU 55 N 14.94 0.20 -2.72 12.44 4.11 -1.98 -0.94 114.58 140.62 1x5q h GLU 55 Ca -0.35 -0.01 -0.69 0.00 0.07 0.00 0.00 59.36 58.38 1x5q h GLU 55 Cb 1.21 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.35 1x5q h GLU 55 CO 1.04 0.13 2.81 0.39 0.07 0.00 0.00 179.01 183.45 1x5q n GLU 56 N -5.23 4.13 -4.19 1.06 1.02 -1.26 -4.61 120.64 111.55 1x5q n GLU 56 Ca 0.20 -2.89 -0.17 0.00 -0.02 0.00 0.00 57.16 54.28 1x5q n GLU 56 Cb 0.65 -2.66 -0.06 0.00 -0.02 0.00 0.00 31.44 29.35 1x5q n GLU 56 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1x5q s GLY 57 N 1.08 1.96 0.17 0.62 0.00 -0.36 -5.05 107.32 105.74 1x5q s GLY 57 Ca 0.61 -1.83 0.01 0.00 0.00 0.00 0.00 44.72 43.51 1x5q s GLY 57 CO -0.08 -1.25 1.40 -0.56 0.00 0.00 0.00 173.10 172.61 1x5q h PRO 58 N 2.11 0.27 0.80 2.90 0.13 -1.86 -3.21 132.00 133.14 1x5q h PRO 58 Ca -0.26 -0.26 -0.04 0.00 -0.87 0.00 0.00 66.00 64.56 1x5q h PRO 58 Cb 1.23 0.07 0.01 0.00 0.13 0.00 0.00 31.00 32.44 1x5q h PRO 58 CO 0.37 0.95 -0.39 0.00 -0.23 0.00 0.00 178.00 178.71 1x5q h ALA 59 N 0.96 -1.08 -1.00 -0.56 0.00 -1.87 -1.78 119.26 113.93 1x5q h ALA 59 Ca -0.04 -0.24 0.41 0.00 0.00 0.00 0.00 54.91 55.05 1x5q h ALA 59 Cb 1.42 0.42 -0.18 0.00 0.00 0.00 0.00 17.79 19.44 1x5q h ALA 59 CO 0.13 -1.01 0.53 0.00 0.00 0.00 0.00 179.25 178.90 1x5q h ALA 60 N -1.27 2.14 0.14 0.00 0.00 -1.73 1.09 119.26 119.63 1x5q h ALA 60 Ca -0.11 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1x5q h ALA 60 Cb 0.83 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1x5q h ALA 60 CO 0.18 -0.94 -0.07 0.00 0.00 0.00 0.00 179.25 178.42 1x5q h ARG 61 N 0.01 -0.18 -0.99 0.00 3.08 -1.49 -2.39 114.38 112.42 1x5q h ARG 61 Ca 0.84 0.01 0.29 0.00 0.07 0.00 0.00 59.98 61.19 1x5q h ARG 61 Cb 2.21 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 32.27 1x5q h ARG 61 CO -0.77 0.07 0.73 0.00 -1.07 0.00 0.00 179.97 178.93 1x5q h ALA 62 N 0.40 2.93 0.00 0.04 0.00 0.21 -3.44 119.26 119.39 1x5q h ALA 62 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1x5q h ALA 62 Cb 0.34 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1x5q h ALA 62 CO 0.03 -1.24 0.00 0.41 0.00 0.00 0.00 179.25 178.45 1x5q n GLY 63 N -1.73 1.83 3.76 0.00 0.00 -0.39 -4.75 105.19 103.92 1x5q n GLY 63 Ca 0.21 0.00 -0.35 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 3.02 -0.02 1.61 0.11 -1.12 -5.02 120.40 116.98 1x5q s VAL 64 Ca 0.00 0.57 -0.00 0.00 -2.93 0.00 0.00 61.98 59.62 1x5q s VAL 64 Cb 0.00 -3.17 0.03 0.00 -1.53 0.00 0.00 36.38 31.71 1x5q s VAL 64 CO 0.00 -0.19 0.03 -0.13 -3.33 0.00 0.00 175.10 171.47 1x5q s ARG 65 N -3.58 -0.03 0.50 1.54 0.52 -1.26 -4.74 118.95 111.90 1x5q s ARG 65 Ca 0.72 0.17 -0.21 0.00 -0.52 0.00 0.00 55.73 55.89 1x5q s ARG 65 Cb -0.25 -0.22 -0.09 0.00 0.52 0.00 0.00 34.95 34.91 1x5q s ARG 65 CO 0.34 -0.15 0.77 0.28 0.02 0.00 0.00 175.30 176.56 1x5q n VAL 66 N 4.07 2.52 0.00 3.52 0.31 -1.26 -1.65 118.33 125.84 1x5q n VAL 66 Ca -0.26 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.57 1x5q n VAL 66 Cb 0.51 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.54 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 1.49 2.88 3.61 2.92 0.00 -1.16 -4.94 105.19 109.99 1x5q n GLY 67 Ca 0.11 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.62 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 1.92 -4.38 1.61 2.03 -0.66 -4.46 116.55 112.60 1x5q n ASP 68 Ca 0.00 1.11 -0.46 0.00 0.52 0.00 0.00 54.79 55.96 1x5q n ASP 68 Cb 0.00 -1.22 -0.02 0.00 -0.72 0.00 0.00 41.12 39.15 1x5q n ASP 68 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1x5q s LYS 69 N 0.78 3.58 0.15 -0.67 2.20 -1.15 -1.19 119.74 123.44 1x5q s LYS 69 Ca 0.85 -2.10 -0.34 0.00 -0.36 0.00 0.00 55.97 54.01 1x5q s LYS 69 Cb -0.92 -4.64 -0.16 0.00 -1.51 0.00 0.00 37.83 30.61 1x5q s LYS 69 CO 0.47 -1.51 1.24 -0.11 -0.36 0.00 0.00 175.35 175.07 1x5q n LEU 70 N 5.21 1.71 -0.04 5.43 -0.00 1.00 -1.82 117.00 128.48 1x5q n LEU 70 Ca 0.17 1.13 -0.05 0.00 -0.00 0.00 0.00 56.01 57.27 1x5q n LEU 70 Cb 0.48 -1.23 -0.04 0.00 -0.00 0.00 0.00 43.42 42.63 1x5q n LEU 70 CO 0.42 -1.15 -0.74 0.18 -0.00 0.00 0.00 177.39 176.10 1x5q n LEU 71 N 2.19 1.96 -3.64 -1.96 4.77 0.56 -4.40 117.00 116.48 1x5q n LEU 71 Ca 0.16 -0.03 -0.15 0.00 -0.03 0.00 0.00 56.01 55.96 1x5q n LEU 71 Cb 0.24 -0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.12 1x5q n LEU 71 CO 0.61 0.47 0.24 -0.70 -1.33 0.00 0.00 177.39 176.69 1x5q s GLU 72 N -2.16 0.82 -0.13 3.23 -6.30 -1.09 0.14 118.70 113.21 1x5q s GLU 72 Ca -0.08 0.23 -0.02 0.00 -2.50 0.00 0.00 54.97 52.60 1x5q s GLU 72 Cb 0.02 0.38 0.04 0.00 0.00 0.00 0.00 34.13 34.58 1x5q s GLU 72 CO 0.21 -0.22 0.02 0.08 0.02 0.00 0.00 175.26 175.37 1x5q s VAL 73 N -0.87 0.46 0.00 3.70 1.01 0.35 0.23 120.40 125.28 1x5q s VAL 73 Ca -0.09 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1x5q s VAL 73 Cb -0.03 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.56 1x5q s VAL 73 CO 0.06 0.02 0.00 -3.20 0.00 0.00 0.00 175.10 171.98 1x5q n ASN 74 N 5.10 -1.42 0.00 3.32 2.85 0.24 -2.37 115.26 122.98 1x5q n ASN 74 Ca -0.08 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.39 1x5q n ASN 74 Cb 0.49 -0.72 0.00 0.00 1.24 0.00 0.00 39.78 40.78 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 -2.09 2.37 3.72 8.20 0.00 -1.26 -4.94 105.19 111.19 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 -2.19 3.93 -0.21 1.61 0.11 -1.00 -4.97 120.40 117.69 1x5q s VAL 76 Ca 0.00 1.43 -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 30.93 1x5q s VAL 76 CO 0.00 0.13 1.24 0.00 -3.33 0.00 0.00 175.10 173.14 1x5q s ALA 77 N 0.85 3.59 -0.51 1.54 0.00 -1.26 -0.50 121.76 125.47 1x5q s ALA 77 Ca 0.58 0.33 0.02 0.00 0.00 0.00 0.00 51.96 52.88 1x5q s ALA 77 Cb -0.30 -3.65 0.54 0.00 0.00 0.00 0.00 23.12 19.71 1x5q s ALA 77 CO 0.30 -1.31 1.87 1.28 0.00 0.00 0.00 175.76 177.90 1x5q n LEU 78 N 6.82 6.74 -4.44 0.00 4.77 0.12 -4.72 117.00 126.29 1x5q n LEU 78 Ca 0.14 -4.01 -0.44 0.00 -0.03 0.00 0.00 56.01 51.67 1x5q n LEU 78 Cb 0.45 -0.84 -0.00 0.00 -2.33 0.00 0.00 43.42 40.70 1x5q n LEU 78 CO 0.57 1.33 1.27 -1.58 -1.33 0.00 0.00 177.39 177.65 1x5q s GLN 79 N -3.54 4.09 0.00 3.23 0.74 -1.24 -4.05 119.66 118.90 1x5q s GLN 79 Ca 0.59 -2.67 0.00 0.00 0.05 0.00 0.00 55.36 53.33 1x5q s GLN 79 Cb 0.48 -4.96 0.00 0.00 1.10 0.00 0.00 33.01 29.63 1x5q s GLN 79 CO 0.04 -1.67 0.00 0.41 -0.55 0.00 0.00 175.29 173.52 1x5q n GLY 80 N 3.90 1.34 3.54 2.59 0.00 -1.26 -5.09 105.19 110.20 1x5q n GLY 80 Ca 0.34 -0.34 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.81 -1.18 4.61 0.00 -1.26 -3.63 120.51 118.25 1x5q n ALA 81 Ca 0.00 0.31 -0.30 0.00 0.00 0.00 0.00 53.44 53.45 1x5q n ALA 81 Cb 0.00 -1.92 0.22 0.00 0.00 0.00 0.00 19.45 17.76 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 -1.57 -0.76 0.08 0.00 2.02 -1.26 -3.47 118.70 113.73 1x5q s GLU 82 Ca 0.61 -0.00 -0.27 0.00 0.02 0.00 0.00 54.97 55.33 1x5q s GLU 82 Cb -0.68 -1.64 -0.12 0.00 0.10 0.00 0.00 34.13 31.79 1x5q s GLU 82 CO 0.58 -3.42 1.43 1.25 0.02 0.00 0.00 175.26 175.13 1x5q h HIS 83 N -2.37 -1.18 -0.86 1.61 6.17 -1.78 -1.50 115.15 115.24 1x5q h HIS 83 Ca -0.47 0.03 0.14 0.00 0.71 0.00 0.00 60.37 60.78 1x5q h HIS 83 Cb 1.30 0.50 -0.15 0.00 2.52 0.00 0.00 27.41 31.58 1x5q h HIS 83 CO -1.61 -0.47 -0.36 1.12 0.71 0.00 0.00 177.93 177.32 1x5q h HIS 84 N -0.61 -0.99 -0.81 5.26 2.07 -1.95 0.86 115.15 118.97 1x5q h HIS 84 Ca -0.01 0.09 0.20 0.00 -2.85 0.00 0.00 60.37 57.80 1x5q h HIS 84 Cb 0.60 0.56 -0.13 0.00 2.57 0.00 0.00 27.41 31.01 1x5q h HIS 84 CO -0.39 -0.40 0.14 0.93 -3.07 0.00 0.00 177.93 175.14 1x5q h GLU 85 N -0.05 0.18 0.79 5.12 5.08 -1.71 0.26 114.58 124.25 1x5q h GLU 85 Ca 0.32 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.63 1x5q h GLU 85 Cb 0.59 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.80 1x5q h GLU 85 CO -0.89 0.12 -0.38 0.00 -1.00 0.00 0.00 179.01 176.86 1x5q h ALA 86 N 1.72 -1.22 -0.83 3.43 0.00 0.16 -2.34 119.26 120.19 1x5q h ALA 86 Ca 0.48 -0.23 0.12 0.00 0.00 0.00 0.00 54.91 55.28 1x5q h ALA 86 Cb 0.90 0.41 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 1x5q h ALA 86 CO -0.63 -1.14 -0.42 0.28 0.00 0.00 0.00 179.25 177.34 1x5q h VAL 87 N -1.13 0.05 -0.78 0.00 2.07 0.14 0.59 116.25 117.19 1x5q h VAL 87 Ca -0.11 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.56 1x5q h VAL 87 Cb 0.82 0.05 -0.15 0.00 -1.52 0.00 0.00 31.29 30.49 1x5q h VAL 87 CO 0.18 0.00 -0.25 -0.08 0.02 0.00 0.00 177.57 177.44 1x5q h GLU 88 N -0.08 -0.03 -0.66 1.57 4.22 -0.44 1.57 114.58 120.72 1x5q h GLU 88 Ca 0.26 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.65 1x5q h GLU 88 Cb 0.56 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 1x5q h GLU 88 CO -0.86 -0.02 0.19 0.00 -2.18 0.00 0.00 179.01 176.14 1x5q h ALA 89 N 1.59 1.08 0.22 2.92 0.00 0.47 1.32 119.26 126.87 1x5q h ALA 89 Ca 0.35 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1x5q h ALA 89 Cb 0.58 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1x5q h ALA 89 CO -0.81 0.62 -0.11 -0.07 0.00 0.00 0.00 179.25 178.88 1x5q h LEU 90 N 0.99 -0.25 -1.16 0.00 3.38 0.52 -2.68 115.31 116.10 1x5q h LEU 90 Ca 0.21 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1x5q h LEU 90 Cb 0.30 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1x5q h LEU 90 CO -0.01 -0.05 -0.34 0.08 0.09 0.00 0.00 178.44 178.22 1x5q h ARG 91 N -0.45 0.00 -3.28 1.13 0.11 0.20 -3.31 114.38 108.78 1x5q h ARG 91 Ca -0.03 0.00 -0.75 0.00 0.10 0.00 0.00 59.98 59.29 1x5q h ARG 91 Cb 0.34 0.00 -0.15 0.00 1.11 0.00 0.00 29.97 31.27 1x5q h ARG 91 CO 0.05 0.34 2.09 0.41 0.10 0.00 0.00 179.97 182.95 1x5q n GLY 92 N -0.05 4.88 3.42 0.08 0.00 0.45 -4.88 105.19 109.09 1x5q n GLY 92 Ca -0.01 -2.10 -0.16 0.00 0.00 0.00 0.00 46.02 43.75 1x5q n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5q s ALA 93 N -0.04 -1.42 0.14 4.61 0.00 -1.25 -4.78 121.76 119.02 1x5q s ALA 93 Ca 0.42 0.89 0.00 0.00 0.00 0.00 0.00 51.96 53.27 1x5q s ALA 93 Cb 0.11 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1x5q s ALA 93 CO -0.01 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.77 1x5q n GLY 94 N 0.86 1.54 0.00 0.00 0.00 -1.26 -5.02 105.19 101.31 1x5q n GLY 94 Ca -0.19 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 43.83 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 -0.14 0.00 -2.29 2.61 -2.24 -1.26 -3.97 114.28 106.99 1x5q n THR 95 Ca 0.00 0.87 -0.43 0.00 -2.27 0.00 0.00 64.05 62.23 1x5q n THR 95 Cb 0.00 -1.34 -0.02 0.00 -2.10 0.00 0.00 70.33 66.87 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 -2.77 3.42 -0.26 6.98 0.00 -1.25 -0.77 121.76 127.11 1x5q s ALA 96 Ca 0.00 0.35 -0.04 0.00 0.00 0.00 0.00 51.96 52.28 1x5q s ALA 96 Cb 0.00 -3.77 0.01 0.00 0.00 0.00 0.00 23.12 19.37 1x5q s ALA 96 CO 0.00 -1.68 -0.01 0.08 0.00 0.00 0.00 175.76 174.15 1x5q s VAL 97 N 4.43 3.36 -0.12 0.00 1.01 0.93 -4.92 120.40 125.10 1x5q s VAL 97 Ca 0.62 -0.78 -0.21 0.00 0.00 0.00 0.00 61.98 61.61 1x5q s VAL 97 Cb -0.22 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1x5q s VAL 97 CO 0.24 0.21 0.63 -1.58 0.00 0.00 0.00 175.10 174.60 1x5q s GLN 98 N 1.42 4.34 -0.11 2.72 0.74 -1.26 -0.77 119.66 126.74 1x5q s GLN 98 Ca 0.02 0.70 -0.01 0.00 0.05 0.00 0.00 55.36 56.12 1x5q s GLN 98 Cb -0.16 -3.49 0.03 0.00 1.10 0.00 0.00 33.01 30.49 1x5q s GLN 98 CO -0.02 -0.01 -0.04 -1.64 -0.55 0.00 0.00 175.29 173.03 1x5q s MET 99 N 1.12 1.15 -0.55 1.67 -1.94 0.14 0.80 119.30 121.69 1x5q s MET 99 Ca 0.32 -0.18 -0.23 0.00 -1.71 0.00 0.00 55.69 53.89 1x5q s MET 99 Cb -0.16 -1.48 0.05 0.00 2.01 0.00 0.00 34.83 35.24 1x5q s MET 99 CO 0.14 -0.33 0.87 0.50 -0.01 0.00 0.00 175.02 176.18 1x5q s ARG 100 N 1.80 3.26 0.13 2.03 3.52 0.14 -0.42 118.95 129.40 1x5q s ARG 100 Ca 0.04 -0.47 0.03 0.00 -0.13 0.00 0.00 55.73 55.20 1x5q s ARG 100 Cb -0.13 -4.08 -0.04 0.00 -1.56 0.00 0.00 34.95 29.14 1x5q s ARG 100 CO -0.07 -1.45 0.22 0.14 -0.81 0.00 0.00 175.30 173.33 1x5q s VAL 101 N 3.63 5.08 -0.18 7.11 -7.23 -0.03 0.21 120.40 128.99 1x5q s VAL 101 Ca 0.26 -0.74 -0.03 0.00 -1.81 0.00 0.00 61.98 59.66 1x5q s VAL 101 Cb -0.15 -3.58 -0.01 0.00 0.56 0.00 0.00 36.38 33.20 1x5q s VAL 101 CO 0.17 -0.04 -0.07 0.86 -0.31 0.00 0.00 175.10 175.71 1x5q s TRP 102 N -1.68 2.93 0.09 2.82 -0.00 -0.76 0.43 118.94 122.77 1x5q s TRP 102 Ca 0.33 -0.72 -0.20 0.00 -0.00 0.00 0.00 56.10 55.51 1x5q s TRP 102 Cb -0.11 -2.00 0.05 0.00 -0.00 0.00 0.00 33.47 31.41 1x5q s TRP 102 CO 0.27 -0.35 0.48 1.03 -0.00 0.00 0.00 176.95 178.38 1x5q s ARG 103 N 0.92 1.07 0.19 5.86 0.52 0.91 -2.93 118.95 125.50 1x5q s ARG 103 Ca -0.01 -0.45 -0.21 0.00 -0.52 0.00 0.00 55.73 54.53 1x5q s ARG 103 Cb -0.15 0.48 -0.08 0.00 0.52 0.00 0.00 34.95 35.73 1x5q s ARG 103 CO 0.01 -0.41 0.73 -2.00 0.02 0.00 0.00 175.30 173.64 1x5q s GLU 104 N -3.14 4.35 -0.30 3.54 -6.30 -1.26 0.19 118.70 115.78 1x5q s GLU 104 Ca -0.01 0.95 0.01 0.00 -2.50 0.00 0.00 54.97 53.42 1x5q s GLU 104 Cb 0.00 -3.02 0.19 0.00 0.00 0.00 0.00 34.13 31.30 1x5q s GLU 104 CO -0.07 0.47 0.63 0.45 0.02 0.00 0.00 175.26 176.76 1x5q s SER 105 N -1.45 -1.42 0.64 -1.70 0.15 -1.26 -4.88 113.70 103.78 1x5q s SER 105 Ca 0.40 0.54 -0.06 0.00 0.70 0.00 0.00 55.95 57.53 1x5q s SER 105 Cb -0.19 2.05 0.03 0.00 -1.71 0.00 0.00 66.02 66.21 1x5q s SER 105 CO 0.22 -0.26 0.95 -0.83 1.20 0.00 0.00 173.24 174.52 1x5q s GLY 106 N 2.86 1.66 -0.08 9.45 0.00 -1.26 -4.99 107.32 114.95 1x5q s GLY 106 Ca 0.16 -0.84 -0.22 0.00 0.00 0.00 0.00 44.72 43.81 1x5q s GLY 106 CO -0.23 -0.50 0.84 -0.56 0.00 0.00 0.00 173.10 172.65 1x5q h PRO 107 N -0.36 -0.09 -6.75 2.90 0.13 -2.07 -3.46 132.00 122.29 1x5q h PRO 107 Ca -0.45 0.01 -0.69 0.00 -0.87 0.00 0.00 66.00 64.00 1x5q h PRO 107 Cb 1.29 0.02 -0.22 0.00 0.13 0.00 0.00 31.00 32.22 1x5q h PRO 107 CO 0.60 0.48 -0.83 -1.12 -0.23 0.00 0.00 178.00 176.89 1x5q s SER 108 N -5.74 3.59 0.24 1.44 0.01 -1.26 -4.96 113.70 107.02 1x5q s SER 108 Ca -0.14 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.53 1x5q s SER 108 Cb -0.00 -0.42 0.00 0.00 0.21 0.00 0.00 66.02 65.80 1x5q s SER 108 CO 0.53 0.21 0.00 -1.20 0.41 0.00 0.00 173.24 173.19 1x5q n SER 109 N 1.13 -2.17 0.00 2.44 7.64 -1.26 -5.21 113.62 116.19 1x5q n SER 109 Ca -0.17 0.68 0.00 0.00 1.01 0.00 0.00 58.87 60.40 1x5q n SER 109 Cb 0.53 2.24 0.00 0.00 -1.01 0.00 0.00 64.21 65.96 1x5q n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64