#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5z s SER 2 N 0.00 -0.47 0.14 1.61 0.15 -1.26 -5.06 113.70 108.82 1x5z s SER 2 Ca 0.00 0.35 -0.20 0.00 0.70 0.00 0.00 55.95 56.80 1x5z s SER 2 Cb 0.00 0.47 0.02 0.00 -1.71 0.00 0.00 66.02 64.80 1x5z s SER 2 CO 0.00 -0.62 1.67 0.77 1.20 0.00 0.00 173.24 176.25 1x5z h SER 3 N 3.08 -0.45 0.00 5.45 4.64 -2.10 -3.47 113.55 120.71 1x5z h SER 3 Ca -0.29 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1x5z h SER 3 Cb 1.18 0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 1x5z h SER 3 CO 0.40 -0.17 0.00 0.61 -0.87 0.00 0.00 176.83 176.80 1x5z n GLY 4 N -1.30 2.50 3.32 -0.77 0.00 -1.26 -4.20 105.19 103.49 1x5z n GLY 4 Ca -0.01 -0.44 -0.47 0.00 0.00 0.00 0.00 46.02 45.11 1x5z n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5z s SER 5 N -4.00 6.57 -0.00 1.61 1.04 -1.26 -4.92 113.70 112.74 1x5z s SER 5 Ca 0.00 -2.39 -0.23 0.00 0.48 0.00 0.00 55.95 53.81 1x5z s SER 5 Cb 0.00 -2.21 -0.14 0.00 0.10 0.00 0.00 66.02 63.76 1x5z s SER 5 CO 0.00 -0.67 1.04 0.77 0.98 0.00 0.00 173.24 175.36 1x5z h SER 6 N 8.16 -0.51 -3.06 7.02 4.64 -1.99 -3.49 113.55 124.31 1x5z h SER 6 Ca -0.03 -0.09 0.17 0.00 -0.47 0.00 0.00 61.79 61.38 1x5z h SER 6 Cb 1.06 0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 63.24 1x5z h SER 6 CO 0.85 -0.11 -0.23 0.61 -0.87 0.00 0.00 176.83 177.08 1x5z n GLY 7 N -0.21 -1.81 3.56 -0.77 0.00 -1.26 -4.54 105.19 100.17 1x5z n GLY 7 Ca -0.10 -1.25 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 1x5z n GLY 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x5z s ASP 8 N -4.91 5.55 -0.13 1.61 2.15 -1.26 -4.97 116.67 114.71 1x5z s ASP 8 Ca 0.00 0.49 -0.01 0.00 0.43 0.00 0.00 52.55 53.46 1x5z s ASP 8 Cb 0.00 -2.53 -0.02 0.00 -0.30 0.00 0.00 42.92 40.07 1x5z s ASP 8 CO 0.00 -2.13 -0.10 -0.63 -0.17 0.00 0.00 175.17 172.14 1x5z s ILE 9 N 8.08 3.29 -0.55 4.11 -1.09 -1.26 -5.07 121.20 128.71 1x5z s ILE 9 Ca 0.66 -0.58 0.04 0.00 -2.23 0.00 0.00 60.65 58.54 1x5z s ILE 9 Cb -0.14 -2.40 0.15 0.00 -1.58 0.00 0.00 42.46 38.49 1x5z s ILE 9 CO 0.24 0.52 0.34 -1.10 -1.23 0.00 0.00 174.94 173.70 1x5z s GLN 10 N 0.31 1.87 0.09 2.79 -0.21 -1.26 -5.10 119.66 118.15 1x5z s GLN 10 Ca -0.08 -2.66 -0.11 0.00 0.02 0.00 0.00 55.36 52.53 1x5z s GLN 10 Cb -0.15 -2.94 -0.06 0.00 1.00 0.00 0.00 33.01 30.85 1x5z s GLN 10 CO 0.05 -1.20 0.43 0.14 -2.12 0.00 0.00 175.29 172.59 1x5z s VAL 11 N -0.48 5.04 0.00 1.09 -7.23 -1.26 -5.05 120.40 112.52 1x5z s VAL 11 Ca 0.21 0.54 0.00 0.00 -1.81 0.00 0.00 61.98 60.92 1x5z s VAL 11 Cb -0.16 -3.66 0.00 0.00 0.56 0.00 0.00 36.38 33.11 1x5z s VAL 11 CO -0.07 0.28 0.21 -0.38 -0.31 0.00 0.00 175.10 174.84 1x5z n ILE 12 N 0.90 0.00 -4.44 -0.62 5.41 -1.26 -5.00 119.36 114.36 1x5z n ILE 12 Ca -0.08 0.64 -0.21 0.00 1.00 0.00 0.00 62.75 64.10 1x5z n ILE 12 Cb 0.52 -1.49 -0.11 0.00 -0.71 0.00 0.00 39.64 37.86 1x5z n ILE 12 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1x5z s THR 13 N -1.23 1.31 0.08 1.39 -4.23 -1.26 -5.06 115.64 106.63 1x5z s THR 13 Ca 0.00 -2.03 -0.23 0.00 -1.18 0.00 0.00 61.69 58.25 1x5z s THR 13 Cb 0.00 -2.68 -0.16 0.00 1.34 0.00 0.00 72.50 71.00 1x5z s THR 13 CO 0.00 -0.10 1.68 1.56 -0.54 0.00 0.00 174.62 177.22 1x5z h GLN 14 N 2.17 -0.01 -6.76 3.99 4.20 -2.06 -3.43 115.11 113.20 1x5z h GLN 14 Ca -0.40 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 57.73 1x5z h GLN 14 Cb 1.24 0.00 0.16 0.00 0.30 0.00 0.00 27.48 29.18 1x5z h GLN 14 CO 0.69 0.05 0.07 -2.37 -0.67 0.00 0.00 178.83 176.60 1x5z n THR 15 N -5.07 3.32 0.00 -0.54 5.66 -1.26 -4.96 114.28 111.43 1x5z n THR 15 Ca -0.07 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.43 1x5z n THR 15 Cb 0.06 -1.10 0.00 0.00 -1.55 0.00 0.00 70.33 67.74 1x5z n THR 15 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1x5z n GLY 16 N 1.33 -0.01 3.21 1.09 0.00 -1.26 -5.02 105.19 104.52 1x5z n GLY 16 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 1x5z n GLY 16 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1x5z s VAL 17 N -0.23 1.51 0.80 1.61 -7.23 -1.26 -4.36 120.40 111.24 1x5z s VAL 17 Ca 0.00 -1.06 -0.11 0.00 -1.81 0.00 0.00 61.98 59.01 1x5z s VAL 17 Cb 0.00 -1.30 0.07 0.00 0.56 0.00 0.00 36.38 35.71 1x5z s VAL 17 CO 0.00 0.22 1.09 -2.16 -0.31 0.00 0.00 175.10 173.94 1x5z s PRO 18 N -0.99 2.04 0.04 4.82 0.04 -1.26 -4.96 135.00 134.74 1x5z s PRO 18 Ca 0.06 1.10 -0.13 0.00 0.04 0.00 0.00 61.00 62.07 1x5z s PRO 18 Cb -0.08 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 1x5z s PRO 18 CO 0.01 -1.77 0.42 0.20 0.04 0.00 0.00 177.00 175.90 1x5z s GLY 19 N -3.39 2.43 0.34 0.56 0.00 -1.26 -4.13 107.32 101.87 1x5z s GLY 19 Ca 0.62 -0.26 -0.25 0.00 0.00 0.00 0.00 44.72 44.82 1x5z s GLY 19 CO 0.56 0.04 0.62 0.61 0.00 0.00 0.00 173.10 174.94 1x5z n GLN 20 N 1.39 0.59 -1.20 2.90 10.64 -1.26 -4.74 117.38 125.70 1x5z n GLN 20 Ca -0.11 0.21 -0.30 0.00 -1.83 0.00 0.00 57.00 54.98 1x5z n GLN 20 Cb 0.52 -1.44 0.14 0.00 -0.86 0.00 0.00 30.24 28.61 1x5z n GLN 20 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 1x5z s PRO 21 N -1.40 1.15 0.41 2.61 0.04 -1.26 -4.86 135.00 131.69 1x5z s PRO 21 Ca 0.62 0.78 0.07 0.00 0.04 0.00 0.00 61.00 62.51 1x5z s PRO 21 Cb -0.70 -1.80 -0.06 0.00 0.04 0.00 0.00 34.50 31.98 1x5z s PRO 21 CO 0.58 -2.30 0.14 -0.51 0.04 0.00 0.00 177.00 174.95 1x5z s LEU 22 N -6.25 3.07 -1.43 -3.56 1.43 -0.97 -4.71 118.68 106.25 1x5z s LEU 22 Ca 0.64 -1.12 -0.09 0.00 -1.03 0.00 0.00 54.13 52.52 1x5z s LEU 22 Cb -0.18 -1.35 0.05 0.00 0.03 0.00 0.00 46.19 44.74 1x5z s LEU 22 CO 0.57 -0.51 0.97 0.59 0.23 0.00 0.00 176.35 178.21 1x5z n ASN 23 N -1.18 -4.29 -4.61 2.29 3.02 -1.26 0.05 115.26 109.29 1x5z n ASN 23 Ca -0.02 -0.73 -0.43 0.00 -0.03 0.00 0.00 54.58 53.38 1x5z n ASN 23 Cb 0.65 -4.23 -0.04 0.00 -0.61 0.00 0.00 39.78 35.55 1x5z n ASN 23 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1x5z s PHE 24 N -3.38 3.10 -0.02 3.10 5.36 -1.25 -3.73 117.98 121.16 1x5z s PHE 24 Ca 0.48 0.79 -0.10 0.00 -0.96 0.00 0.00 56.93 57.14 1x5z s PHE 24 Cb -0.23 -3.60 0.01 0.00 -0.34 0.00 0.00 43.02 38.86 1x5z s PHE 24 CO 0.80 -0.79 0.22 -1.59 -1.46 0.00 0.00 175.22 172.39 1x5z s LYS 25 N 3.42 0.52 -0.11 10.12 -2.85 -0.78 -5.03 119.74 125.03 1x5z s LYS 25 Ca 0.38 -0.21 -0.01 0.00 -1.00 0.00 0.00 55.97 55.12 1x5z s LYS 25 Cb -0.12 0.23 -0.03 0.00 -2.06 0.00 0.00 37.83 35.85 1x5z s LYS 25 CO 0.18 -0.13 -0.05 0.00 0.10 0.00 0.00 175.35 175.45 1x5z s ALA 26 N -1.14 3.03 -0.04 0.59 0.00 -1.26 -1.85 121.76 121.08 1x5z s ALA 26 Ca -0.12 -0.85 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 1x5z s ALA 26 Cb -0.06 -1.40 0.03 0.00 0.00 0.00 0.00 23.12 21.69 1x5z s ALA 26 CO 0.02 0.42 0.04 -1.21 0.00 0.00 0.00 175.76 175.03 1x5z s GLU 27 N -0.32 0.11 -0.39 0.00 2.02 -0.57 -4.89 118.70 114.67 1x5z s GLU 27 Ca 0.05 0.27 -0.28 0.00 0.02 0.00 0.00 54.97 55.03 1x5z s GLU 27 Cb -0.12 -0.58 -0.01 0.00 0.10 0.00 0.00 34.13 33.51 1x5z s GLU 27 CO 0.02 -0.29 1.72 -1.25 0.02 0.00 0.00 175.26 175.49 1x5z s PRO 28 N 1.90 3.29 0.31 0.39 0.04 -1.26 -1.16 135.00 138.49 1x5z s PRO 28 Ca 0.02 1.20 0.21 0.00 0.04 0.00 0.00 61.00 62.47 1x5z s PRO 28 Cb -0.12 -4.19 0.15 0.00 0.04 0.00 0.00 34.50 30.37 1x5z s PRO 28 CO -0.03 -1.92 1.33 1.05 0.04 0.00 0.00 177.00 177.47 1x5z h GLU 29 N 12.69 0.00 -3.19 4.56 4.11 -1.87 -3.47 114.58 127.41 1x5z h GLU 29 Ca -0.31 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.06 1x5z h GLU 29 Cb 1.15 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 1x5z h GLU 29 CO 1.07 0.10 0.19 0.45 0.07 0.00 0.00 179.01 180.89 1x5z s SER 30 N -5.94 0.14 0.21 3.06 0.15 -0.65 -4.97 113.70 105.70 1x5z s SER 30 Ca 0.03 -1.17 0.07 0.00 0.70 0.00 0.00 55.95 55.59 1x5z s SER 30 Cb 0.07 0.81 0.14 0.00 -1.71 0.00 0.00 66.02 65.33 1x5z s SER 30 CO 0.73 -1.60 1.48 1.05 1.20 0.00 0.00 173.24 176.10 1x5z h GLU 31 N 2.02 0.07 -0.12 5.44 9.09 -1.93 -3.26 114.58 125.89 1x5z h GLU 31 Ca -0.31 -0.06 0.00 0.00 0.05 0.00 0.00 59.36 59.04 1x5z h GLU 31 Cb 1.25 0.02 0.00 0.00 -1.65 0.00 0.00 28.75 28.36 1x5z h GLU 31 CO 0.39 0.79 0.00 0.25 0.05 0.00 0.00 179.01 180.49 1x5z n THR 32 N -3.67 0.91 -4.07 -1.06 -2.24 -1.26 -3.64 114.28 99.24 1x5z n THR 32 Ca -0.02 -0.95 -0.10 0.00 -2.27 0.00 0.00 64.05 60.72 1x5z n THR 32 Cb 0.73 0.56 -0.11 0.00 -2.10 0.00 0.00 70.33 69.41 1x5z n THR 32 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1x5z s SER 33 N -0.94 0.62 -0.05 3.42 0.01 -1.23 -1.27 113.70 114.26 1x5z s SER 33 Ca 0.08 -0.76 -0.07 0.00 1.31 0.00 0.00 55.95 56.50 1x5z s SER 33 Cb 0.04 0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.40 1x5z s SER 33 CO 0.06 -0.40 0.19 -0.63 0.41 0.00 0.00 173.24 172.87 1x5z s ILE 34 N -2.62 0.02 -0.04 1.44 1.01 0.08 -1.64 121.20 119.45 1x5z s ILE 34 Ca -0.02 -0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.48 1x5z s ILE 34 Cb -0.02 -0.34 -0.03 0.00 0.01 0.00 0.00 42.46 42.09 1x5z s ILE 34 CO -0.04 -0.10 -0.13 -0.22 0.00 0.00 0.00 174.94 174.45 1x5z s LEU 35 N -0.31 2.84 0.03 2.97 2.96 -0.31 -0.99 118.68 125.86 1x5z s LEU 35 Ca -0.04 -0.18 0.07 0.00 -0.22 0.00 0.00 54.13 53.76 1x5z s LEU 35 Cb -0.03 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.03 1x5z s LEU 35 CO 0.01 0.33 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.44 1x5z s LEU 36 N -0.88 2.62 -0.18 -0.68 1.43 -0.92 -1.51 118.68 118.57 1x5z s LEU 36 Ca 0.12 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1x5z s LEU 36 Cb -0.11 -1.53 0.04 0.00 0.03 0.00 0.00 46.19 44.62 1x5z s LEU 36 CO 0.02 0.27 -0.10 -0.44 0.23 0.00 0.00 176.35 176.33 1x5z s SER 37 N -1.32 3.06 0.05 2.29 0.01 -0.77 -3.51 113.70 113.51 1x5z s SER 37 Ca 0.14 -0.72 -0.03 0.00 1.31 0.00 0.00 55.95 56.65 1x5z s SER 37 Cb -0.11 -1.14 -0.03 0.00 0.21 0.00 0.00 66.02 64.95 1x5z s SER 37 CO 0.05 -0.13 0.03 -1.66 0.41 0.00 0.00 173.24 171.93 1x5z s TRP 38 N 1.48 0.39 -0.21 2.43 -2.14 -1.11 -1.86 118.94 117.91 1x5z s TRP 38 Ca 0.01 -0.86 -0.03 0.00 2.66 0.00 0.00 56.10 57.87 1x5z s TRP 38 Cb -0.15 -0.28 -0.01 0.00 -3.10 0.00 0.00 33.47 29.93 1x5z s TRP 38 CO -0.09 -0.39 -0.06 0.99 -2.66 0.00 0.00 176.95 174.75 1x5z s THR 39 N -3.53 3.29 0.11 0.66 2.01 0.11 -4.60 115.64 113.68 1x5z s THR 39 Ca 0.03 -0.52 -0.31 0.00 0.31 0.00 0.00 61.69 61.20 1x5z s THR 39 Cb 0.05 -2.49 -0.08 0.00 0.01 0.00 0.00 72.50 69.99 1x5z s THR 39 CO -0.09 0.44 1.36 -2.16 -0.69 0.00 0.00 174.62 173.48 1x5z s PRO 40 N 1.40 4.33 1.18 4.92 0.04 -1.26 -2.30 135.00 143.32 1x5z s PRO 40 Ca 0.05 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 62.94 1x5z s PRO 40 Cb -0.14 -3.26 0.28 0.00 0.04 0.00 0.00 34.50 31.41 1x5z s PRO 40 CO -0.03 -0.41 1.11 -1.25 0.04 0.00 0.00 177.00 176.45 1x5z s PRO 41 N 1.11 -1.04 0.27 0.56 0.04 -1.26 -4.91 135.00 129.77 1x5z s PRO 41 Ca 0.64 0.00 0.00 0.00 0.04 0.00 0.00 61.00 61.68 1x5z s PRO 41 Cb -0.36 -1.61 0.62 0.00 0.04 0.00 0.00 34.50 33.20 1x5z s PRO 41 CO 0.30 -3.61 1.68 0.07 0.04 0.00 0.00 177.00 175.49 1x5z h ARG 42 N -2.51 0.31 -5.15 4.56 0.11 -1.95 -3.39 114.38 106.37 1x5z h ARG 42 Ca -0.46 -0.02 -0.44 0.00 0.10 0.00 0.00 59.98 59.16 1x5z h ARG 42 Cb 1.30 -0.07 -0.07 0.00 1.11 0.00 0.00 29.97 32.24 1x5z h ARG 42 CO 0.37 0.21 1.68 0.43 0.10 0.00 0.00 179.97 182.76 1x5z n SER 43 N -5.12 0.52 -0.03 0.08 7.64 -1.26 -4.75 113.62 110.70 1x5z n SER 43 Ca 0.19 -0.18 -0.16 0.00 1.01 0.00 0.00 58.87 59.73 1x5z n SER 43 Cb 0.58 -1.04 -0.08 0.00 -1.01 0.00 0.00 64.21 62.66 1x5z n SER 43 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1x5z h ASP 44 N 13.49 0.67 -1.58 6.43 5.19 -1.99 -3.41 116.42 135.22 1x5z h ASP 44 Ca -0.07 -0.63 -0.43 0.00 -0.62 0.00 0.00 57.03 55.28 1x5z h ASP 44 Cb 1.26 -0.20 -0.03 0.00 0.18 0.00 0.00 39.33 40.53 1x5z h ASP 44 CO 1.36 1.18 1.18 0.42 -3.12 0.00 0.00 179.24 180.26 1x5z s THR 45 N -3.74 3.35 -0.06 0.35 -4.23 -1.26 -4.93 115.64 105.12 1x5z s THR 45 Ca -0.12 0.03 0.01 0.00 -1.18 0.00 0.00 61.69 60.42 1x5z s THR 45 Cb 0.06 -3.87 0.02 0.00 1.34 0.00 0.00 72.50 70.05 1x5z s THR 45 CO 0.84 -0.84 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.40 1x5z s ILE 46 N 9.70 0.62 -0.08 2.99 1.01 -1.26 -4.90 121.20 129.27 1x5z s ILE 46 Ca 0.71 -0.13 -0.27 0.00 0.00 0.00 0.00 60.65 60.95 1x5z s ILE 46 Cb -0.11 -0.66 -0.23 0.00 0.01 0.00 0.00 42.46 41.47 1x5z s ILE 46 CO 0.15 0.26 0.99 0.00 0.00 0.00 0.00 174.94 176.34 1x5z h ALA 47 N 7.48 -0.01 -2.02 9.38 0.00 -1.73 -3.43 119.26 128.93 1x5z h ALA 47 Ca -0.33 -0.37 0.31 0.00 0.00 0.00 0.00 54.91 54.53 1x5z h ALA 47 Cb 1.15 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.87 1x5z h ALA 47 CO 0.42 -0.13 0.83 0.54 0.00 0.00 0.00 179.25 180.92 1x5z s ASN 48 N -5.94 -0.01 -0.07 0.00 2.20 -1.10 -4.04 114.94 105.98 1x5z s ASN 48 Ca -0.17 -0.26 0.02 0.00 -0.94 0.00 0.00 52.86 51.51 1x5z s ASN 48 Cb -0.01 0.20 -0.03 0.00 -2.00 0.00 0.00 41.25 39.42 1x5z s ASN 48 CO 0.67 -0.40 -0.12 -0.31 -2.94 0.00 0.00 177.10 174.00 1x5z s TYR 49 N -2.16 2.79 -0.18 1.54 1.51 -1.10 -0.04 117.35 119.71 1x5z s TYR 49 Ca 0.24 -0.17 -0.20 0.00 -1.01 0.00 0.00 57.07 55.94 1x5z s TYR 49 Cb 0.00 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 40.14 1x5z s TYR 49 CO -0.01 0.17 0.57 -2.00 -1.11 0.00 0.00 175.55 173.17 1x5z s GLU 50 N -0.59 4.23 -0.68 -0.62 2.56 -0.82 -3.38 118.70 119.40 1x5z s GLU 50 Ca 0.08 0.52 0.01 0.00 0.00 0.00 0.00 54.97 55.58 1x5z s GLU 50 Cb -0.11 -3.54 0.17 0.00 2.00 0.00 0.00 34.13 32.64 1x5z s GLU 50 CO 0.01 -0.13 0.49 -1.17 -0.56 0.00 0.00 175.26 173.90 1x5z s LEU 51 N 1.56 5.02 -1.08 2.70 2.96 -1.25 -2.36 118.68 126.24 1x5z s LEU 51 Ca 0.27 -3.30 -0.22 0.00 -0.22 0.00 0.00 54.13 50.65 1x5z s LEU 51 Cb -0.16 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 44.76 1x5z s LEU 51 CO 0.10 -0.23 1.74 -0.69 -1.32 0.00 0.00 176.35 175.95 1x5z s VAL 52 N -0.71 3.76 -0.13 1.68 1.01 -0.78 -3.36 120.40 121.87 1x5z s VAL 52 Ca 0.21 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 1x5z s VAL 52 Cb -0.15 -4.70 -0.04 0.00 0.00 0.00 0.00 36.38 31.49 1x5z s VAL 52 CO -0.07 -1.50 0.13 -0.72 0.00 0.00 0.00 175.10 172.94 1x5z s TYR 53 N 7.43 3.56 0.02 5.22 -0.85 -0.12 -3.46 117.35 129.15 1x5z s TYR 53 Ca 0.59 0.49 -0.08 0.00 -0.52 0.00 0.00 57.07 57.55 1x5z s TYR 53 Cb -0.01 -1.96 0.00 0.00 0.38 0.00 0.00 41.96 40.36 1x5z s TYR 53 CO 0.01 0.67 0.16 -1.59 -1.52 0.00 0.00 175.55 173.28 1x5z s LYS 54 N -0.84 0.57 -0.58 -3.49 -2.85 -1.23 -1.61 119.74 109.71 1x5z s LYS 54 Ca 0.14 -0.51 -0.26 0.00 -1.00 0.00 0.00 55.97 54.34 1x5z s LYS 54 Cb -0.12 0.24 0.04 0.00 -2.06 0.00 0.00 37.83 35.92 1x5z s LYS 54 CO 0.03 -0.15 1.07 0.34 0.10 0.00 0.00 175.35 176.75 1x5z s ASP 55 N -1.69 6.37 0.00 0.03 2.15 -1.26 -2.44 116.67 119.83 1x5z s ASP 55 Ca -0.11 -0.17 0.00 0.00 0.43 0.00 0.00 52.55 52.70 1x5z s ASP 55 Cb -0.05 -2.49 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1x5z s ASP 55 CO -0.01 -1.38 0.00 0.61 -0.17 0.00 0.00 175.17 174.22 1x5z n GLY 56 N 5.11 -2.04 0.17 2.66 0.00 -1.25 -2.71 105.19 107.13 1x5z n GLY 56 Ca 0.05 -1.47 -0.22 0.00 0.00 0.00 0.00 46.02 44.37 1x5z n GLY 56 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1x5z h GLU 57 N 0.00 0.60 -0.90 1.61 4.81 -1.96 -3.25 114.58 115.49 1x5z h GLU 57 Ca 0.00 -0.82 -0.24 0.00 -0.13 0.00 0.00 59.36 58.16 1x5z h GLU 57 Cb 0.00 0.28 -0.15 0.00 0.63 0.00 0.00 28.75 29.51 1x5z h GLU 57 CO 0.00 1.38 0.31 0.72 -0.73 0.00 0.00 179.01 180.69 1x5z n HIS 58 N -3.82 1.97 -1.46 0.92 8.25 -1.26 -4.96 115.22 114.86 1x5z n HIS 58 Ca -0.14 -1.14 -0.30 0.00 -0.26 0.00 0.00 57.72 55.88 1x5z n HIS 58 Cb 0.98 -0.63 0.21 0.00 1.12 0.00 0.00 29.99 31.67 1x5z n HIS 58 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1x5z s GLY 59 N -0.62 1.66 -0.17 -1.41 0.00 -1.10 -4.99 107.32 100.69 1x5z s GLY 59 Ca 0.40 -0.99 -0.14 0.00 0.00 0.00 0.00 44.72 43.99 1x5z s GLY 59 CO 0.09 -0.19 0.29 1.85 0.00 0.00 0.00 173.10 175.14 1x5z s GLU 60 N -5.58 4.23 -0.09 2.90 2.12 -1.26 -4.82 118.70 116.21 1x5z s GLU 60 Ca 0.71 0.07 -0.29 0.00 0.36 0.00 0.00 54.97 55.82 1x5z s GLU 60 Cb -0.08 -3.45 -0.06 0.00 0.26 0.00 0.00 34.13 30.80 1x5z s GLU 60 CO 0.55 0.19 1.92 -1.21 -0.54 0.00 0.00 175.26 176.17 1x5z s GLU 61 N 0.62 3.82 -0.18 4.30 2.02 -1.26 -4.19 118.70 123.83 1x5z s GLU 61 Ca 0.16 2.22 0.01 0.00 0.02 0.00 0.00 54.97 57.37 1x5z s GLU 61 Cb -0.13 -4.17 0.03 0.00 0.10 0.00 0.00 34.13 29.96 1x5z s GLU 61 CO 0.04 -1.30 -0.15 -0.65 0.02 0.00 0.00 175.26 173.21 1x5z s GLN 62 N 4.93 2.52 -0.13 1.61 -0.21 -0.63 -4.95 119.66 122.80 1x5z s GLN 62 Ca 0.86 -0.78 -0.13 0.00 0.02 0.00 0.00 55.36 55.33 1x5z s GLN 62 Cb -0.35 -2.41 -0.05 0.00 1.00 0.00 0.00 33.01 31.20 1x5z s GLN 62 CO 0.36 -0.29 0.28 1.03 -2.12 0.00 0.00 175.29 174.54 1x5z s ARG 63 N 1.36 4.05 -0.02 2.91 3.00 -1.26 -0.94 118.95 128.06 1x5z s ARG 63 Ca 0.03 0.09 0.04 0.00 0.00 0.00 0.00 55.73 55.89 1x5z s ARG 63 Cb -0.14 -3.35 -0.03 0.00 0.00 0.00 0.00 34.95 31.43 1x5z s ARG 63 CO -0.11 0.42 -0.12 0.42 0.00 0.00 0.00 175.30 175.91 1x5z s ILE 64 N -0.07 3.24 -0.95 1.52 1.01 -1.21 -4.93 121.20 119.80 1x5z s ILE 64 Ca 0.17 -0.81 -0.24 0.00 0.00 0.00 0.00 60.65 59.77 1x5z s ILE 64 Cb -0.13 -2.34 0.04 0.00 0.01 0.00 0.00 42.46 40.05 1x5z s ILE 64 CO 0.05 0.48 1.41 -0.89 0.00 0.00 0.00 174.94 176.00 1x5z s THR 65 N -0.86 3.87 0.07 2.92 2.01 -1.26 -3.93 115.64 118.46 1x5z s THR 65 Ca 0.14 -0.48 -0.09 0.00 0.31 0.00 0.00 61.69 61.57 1x5z s THR 65 Cb -0.11 -5.02 -0.06 0.00 0.01 0.00 0.00 72.50 67.33 1x5z s THR 65 CO 0.04 -1.91 0.38 -0.63 -0.69 0.00 0.00 174.62 171.80 1x5z s ILE 66 N 5.20 5.14 0.36 1.82 1.01 -1.22 -5.01 121.20 128.50 1x5z s ILE 66 Ca 0.44 0.36 -0.27 0.00 0.00 0.00 0.00 60.65 61.18 1x5z s ILE 66 Cb -0.02 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.73 1x5z s ILE 66 CO -0.04 0.27 1.13 -1.61 0.00 0.00 0.00 174.94 174.70 1x5z s GLU 67 N -1.97 4.28 -1.19 2.79 2.02 -1.26 -2.71 118.70 120.67 1x5z s GLU 67 Ca 0.33 1.79 -0.23 0.00 0.02 0.00 0.00 54.97 56.88 1x5z s GLU 67 Cb -0.14 -2.84 -0.09 0.00 0.10 0.00 0.00 34.13 31.17 1x5z s GLU 67 CO 0.18 -0.11 1.93 -1.25 0.02 0.00 0.00 175.26 176.04 1x5z s PRO 68 N -2.04 2.50 0.00 0.39 0.04 -1.26 -4.57 135.00 130.07 1x5z s PRO 68 Ca 0.53 -1.19 0.00 0.00 0.04 0.00 0.00 61.00 60.38 1x5z s PRO 68 Cb -0.30 -5.25 0.00 0.00 0.04 0.00 0.00 34.50 28.99 1x5z s PRO 68 CO 0.38 -4.00 0.00 0.41 0.04 0.00 0.00 177.00 173.84 1x5z n GLY 69 N 5.78 3.43 0.00 0.56 0.00 -1.26 -5.01 105.19 108.69 1x5z n GLY 69 Ca 0.45 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1x5z n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x5z n THR 70 N 0.00 0.00 -4.12 2.61 -2.24 -1.26 -4.64 114.28 104.63 1x5z n THR 70 Ca 0.00 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1x5z n THR 70 Cb 0.00 -0.54 -0.10 0.00 -2.10 0.00 0.00 70.33 67.59 1x5z n THR 70 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1x5z s SER 71 N -2.75 0.47 0.07 3.42 1.04 -1.26 -2.75 113.70 111.93 1x5z s SER 71 Ca 0.00 -1.09 -0.12 0.00 0.48 0.00 0.00 55.95 55.22 1x5z s SER 71 Cb 0.00 0.23 0.01 0.00 0.10 0.00 0.00 66.02 66.37 1x5z s SER 71 CO 0.00 -0.65 0.28 -0.47 0.98 0.00 0.00 173.24 173.38 1x5z s TYR 72 N -3.95 -0.03 -0.21 5.02 6.14 -1.23 -4.98 117.35 118.10 1x5z s TYR 72 Ca 0.15 -0.23 0.01 0.00 0.64 0.00 0.00 57.07 57.64 1x5z s TYR 72 Cb 0.08 0.07 0.04 0.00 0.42 0.00 0.00 41.96 42.56 1x5z s TYR 72 CO -0.05 -0.54 -0.12 0.50 0.64 0.00 0.00 175.55 175.99 1x5z s ARG 73 N -3.13 2.23 -0.21 4.97 3.52 -1.26 -2.16 118.95 122.91 1x5z s ARG 73 Ca -0.01 -0.96 -0.13 0.00 -0.13 0.00 0.00 55.73 54.50 1x5z s ARG 73 Cb 0.01 -2.56 -0.05 0.00 -1.56 0.00 0.00 34.95 30.80 1x5z s ARG 73 CO -0.07 -0.43 0.26 -1.17 -0.81 0.00 0.00 175.30 173.08 1x5z s LEU 74 N 1.31 4.15 0.31 -0.88 2.96 -0.17 -4.95 118.68 121.41 1x5z s LEU 74 Ca -0.02 0.31 0.10 0.00 -0.22 0.00 0.00 54.13 54.30 1x5z s LEU 74 Cb -0.17 -2.28 -0.05 0.00 0.50 0.00 0.00 46.19 44.19 1x5z s LEU 74 CO -0.08 0.02 -0.10 -1.10 -1.32 0.00 0.00 176.35 173.77 1x5z s GLN 75 N 1.04 1.88 0.00 1.98 -0.21 -1.26 -0.75 119.66 122.34 1x5z s GLN 75 Ca 0.13 -1.77 0.00 0.00 0.02 0.00 0.00 55.36 53.74 1x5z s GLN 75 Cb -0.14 -1.83 0.00 0.00 1.00 0.00 0.00 33.01 32.04 1x5z s GLN 75 CO 0.05 0.24 0.00 0.41 -2.12 0.00 0.00 175.29 173.87 1x5z n GLY 76 N -0.78 0.46 2.67 3.09 0.00 -0.40 -4.99 105.19 105.24 1x5z n GLY 76 Ca -0.05 -0.45 -0.18 0.00 0.00 0.00 0.00 46.02 45.34 1x5z n GLY 76 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x5z n LEU 77 N -0.72 0.00 -4.68 0.99 4.77 -1.07 -5.04 117.00 111.26 1x5z n LEU 77 Ca 0.00 -2.56 -0.34 0.00 -0.03 0.00 0.00 56.01 53.08 1x5z n LEU 77 Cb 0.30 1.12 -0.09 0.00 -2.33 0.00 0.00 43.42 42.42 1x5z n LEU 77 CO 0.00 -0.41 -0.32 -0.54 -1.33 0.00 0.00 177.39 174.79 1x5z s LYS 78 N -3.18 2.89 0.58 3.23 1.02 -1.26 -4.66 119.74 118.37 1x5z s LYS 78 Ca 0.25 -0.50 -0.18 0.00 0.02 0.00 0.00 55.97 55.56 1x5z s LYS 78 Cb 0.01 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.55 1x5z s LYS 78 CO 0.18 0.67 1.12 -1.25 -0.92 0.00 0.00 175.35 175.15 1x5z s PRO 79 N -1.18 3.17 -1.43 -1.68 0.04 -1.24 -3.67 135.00 129.01 1x5z s PRO 79 Ca 0.16 1.53 -0.07 0.00 0.04 0.00 0.00 61.00 62.67 1x5z s PRO 79 Cb -0.11 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.45 1x5z s PRO 79 CO 0.06 -0.98 0.28 -1.71 0.04 0.00 0.00 177.00 174.69 1x5z n ASN 80 N -1.68 -0.61 -3.85 6.66 2.85 0.05 -4.95 115.26 113.73 1x5z n ASN 80 Ca 0.11 -1.18 -0.13 0.00 -0.11 0.00 0.00 54.58 53.27 1x5z n ASN 80 Cb 0.51 -2.16 -0.14 0.00 1.24 0.00 0.00 39.78 39.23 1x5z n ASN 80 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1x5z s SER 81 N -4.19 0.04 0.17 1.20 0.01 -1.24 -4.97 113.70 104.71 1x5z s SER 81 Ca 0.11 0.00 -0.30 0.00 1.31 0.00 0.00 55.95 57.07 1x5z s SER 81 Cb -0.05 -0.02 -0.07 0.00 0.21 0.00 0.00 66.02 66.09 1x5z s SER 81 CO 0.95 -0.02 0.95 -0.22 0.41 0.00 0.00 173.24 175.31 1x5z s LEU 82 N 0.20 4.57 -0.12 2.44 2.96 -1.26 -3.54 118.68 123.92 1x5z s LEU 82 Ca -0.02 1.85 -0.04 0.00 -0.22 0.00 0.00 54.13 55.71 1x5z s LEU 82 Cb -0.03 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.13 1x5z s LEU 82 CO -0.01 0.04 0.14 -0.31 -1.32 0.00 0.00 176.35 174.89 1x5z s TYR 83 N -0.54 -0.07 0.75 5.38 2.02 -1.21 -3.87 117.35 119.81 1x5z s TYR 83 Ca 0.44 0.24 -0.12 0.00 -0.37 0.00 0.00 57.07 57.26 1x5z s TYR 83 Cb -0.24 -0.43 0.05 0.00 -0.40 0.00 0.00 41.96 40.94 1x5z s TYR 83 CO 0.31 -0.39 1.10 0.71 -1.57 0.00 0.00 175.55 175.71 1x5z s TYR 84 N 2.24 2.51 -0.09 2.71 1.51 -1.02 -2.93 117.35 122.28 1x5z s TYR 84 Ca 0.04 1.57 -0.14 0.00 -1.01 0.00 0.00 57.07 57.53 1x5z s TYR 84 Cb -0.14 -3.11 0.03 0.00 -0.11 0.00 0.00 41.96 38.63 1x5z s TYR 84 CO -0.07 -1.86 0.35 -0.06 -1.11 0.00 0.00 175.55 172.80 1x5z s PHE 85 N -2.72 -0.33 -0.15 2.71 0.08 0.11 -3.57 117.98 114.12 1x5z s PHE 85 Ca 0.63 0.74 -0.06 0.00 0.12 0.00 0.00 56.93 58.36 1x5z s PHE 85 Cb -0.19 0.13 0.07 0.00 -0.57 0.00 0.00 43.02 42.46 1x5z s PHE 85 CO 0.52 -0.26 0.33 1.03 -0.10 0.00 0.00 175.22 176.73 1x5z s ARG 86 N -0.34 0.23 -0.01 0.44 1.81 -1.23 -2.47 118.95 117.39 1x5z s ARG 86 Ca -0.05 0.84 -0.03 0.00 -1.72 0.00 0.00 55.73 54.77 1x5z s ARG 86 Cb -0.03 0.09 -0.04 0.00 -0.45 0.00 0.00 34.95 34.52 1x5z s ARG 86 CO 0.02 -0.25 0.17 -1.17 -0.68 0.00 0.00 175.30 173.39 1x5z s LEU 87 N 2.33 4.34 -0.30 2.53 2.96 -1.25 -1.87 118.68 127.42 1x5z s LEU 87 Ca -0.01 0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 54.22 1x5z s LEU 87 Cb -0.12 -2.58 0.19 0.00 0.50 0.00 0.00 46.19 44.19 1x5z s LEU 87 CO -0.10 0.27 0.66 0.00 -1.32 0.00 0.00 176.35 175.85 1x5z s ALA 88 N -1.31 -2.47 0.22 5.97 0.00 -0.99 -0.49 121.76 122.69 1x5z s ALA 88 Ca 0.27 1.61 -0.29 0.00 0.00 0.00 0.00 51.96 53.55 1x5z s ALA 88 Cb -0.13 -2.31 -0.16 0.00 0.00 0.00 0.00 23.12 20.53 1x5z s ALA 88 CO 0.18 -1.48 0.80 0.00 0.00 0.00 0.00 175.76 175.26 1x5z n ALA 89 N 5.42 -1.66 -4.09 0.00 0.00 -1.26 -1.95 120.51 116.98 1x5z n ALA 89 Ca 0.00 0.43 -0.32 0.00 0.00 0.00 0.00 53.44 53.55 1x5z n ALA 89 Cb 0.52 -1.82 -0.16 0.00 0.00 0.00 0.00 19.45 17.99 1x5z n ALA 89 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1x5z s ARG 90 N -1.11 2.75 0.15 0.00 3.52 0.94 -3.14 118.95 122.06 1x5z s ARG 90 Ca 0.64 -0.75 0.06 0.00 -0.13 0.00 0.00 55.73 55.55 1x5z s ARG 90 Cb -0.85 -2.43 -0.04 0.00 -1.56 0.00 0.00 34.95 30.07 1x5z s ARG 90 CO 0.57 -0.23 0.03 -1.54 -0.81 0.00 0.00 175.30 173.32 1x5z s SER 91 N 1.35 4.99 0.00 -2.12 1.04 -0.98 -1.85 113.70 116.12 1x5z s SER 91 Ca 0.05 -0.28 0.15 0.00 0.48 0.00 0.00 55.95 56.35 1x5z s SER 91 Cb -0.13 -1.15 0.86 0.00 0.10 0.00 0.00 66.02 65.70 1x5z s SER 91 CO -0.12 0.11 1.37 -0.81 0.98 0.00 0.00 173.24 174.77 1x5z n PRO 92 N 0.05 0.38 -0.03 4.02 -0.04 -1.26 -2.26 135.00 135.85 1x5z n PRO 92 Ca -0.10 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1x5z n PRO 92 Cb 0.54 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.39 1x5z n PRO 92 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1x5z n GLN 93 N -1.11 1.13 0.00 0.54 1.13 -1.26 -5.09 117.38 112.71 1x5z n GLN 93 Ca 0.10 -0.07 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 1x5z n GLN 93 Cb 0.08 -1.34 0.00 0.00 0.11 0.00 0.00 30.24 29.09 1x5z n GLN 93 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1x5z n GLY 94 N 1.94 0.32 3.86 1.08 0.00 -0.96 -5.00 105.19 106.43 1x5z n GLY 94 Ca -0.12 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.58 1x5z n GLY 94 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x5z s LEU 95 N 0.00 4.27 0.00 0.99 2.96 -1.26 -2.32 118.68 123.32 1x5z s LEU 95 Ca 0.00 1.01 0.00 0.00 -0.22 0.00 0.00 54.13 54.92 1x5z s LEU 95 Cb 0.00 -3.43 0.00 0.00 0.50 0.00 0.00 46.19 43.26 1x5z s LEU 95 CO 0.00 0.03 0.00 0.61 -1.32 0.00 0.00 176.35 175.67 1x5z n GLY 96 N 0.43 0.97 3.46 7.98 0.00 -1.19 -4.82 105.19 112.02 1x5z n GLY 96 Ca -0.03 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 1x5z n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5z s ALA 97 N -3.25 2.59 -0.16 4.61 0.00 -1.26 -5.01 121.76 119.28 1x5z s ALA 97 Ca 0.00 -1.29 -0.15 0.00 0.00 0.00 0.00 51.96 50.51 1x5z s ALA 97 Cb 0.00 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 1x5z s ALA 97 CO 0.00 0.58 0.36 -1.12 0.00 0.00 0.00 175.76 175.57 1x5z s SER 98 N -1.79 6.49 1.45 0.00 0.01 -1.26 -4.26 113.70 114.35 1x5z s SER 98 Ca 0.16 0.58 -0.23 0.00 1.31 0.00 0.00 55.95 57.77 1x5z s SER 98 Cb -0.10 -2.22 0.38 0.00 0.21 0.00 0.00 66.02 64.29 1x5z s SER 98 CO 0.07 0.04 0.90 0.42 0.41 0.00 0.00 173.24 175.08 1x5z s THR 99 N 0.67 1.15 0.76 1.44 -4.23 0.36 -4.94 115.64 110.86 1x5z s THR 99 Ca 0.19 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.56 1x5z s THR 99 Cb -0.14 -2.01 0.06 0.00 1.34 0.00 0.00 72.50 71.75 1x5z s THR 99 CO 0.06 0.00 1.23 0.00 -0.54 0.00 0.00 174.62 175.37 1x5z n ALA 100 N -5.76 0.31 -2.44 3.99 0.00 -1.26 -4.74 120.51 110.61 1x5z n ALA 100 Ca 0.12 -0.23 -0.40 0.00 0.00 0.00 0.00 53.44 52.92 1x5z n ALA 100 Cb 0.60 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 17.75 1x5z n ALA 100 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1x5z s GLU 101 N -3.89 3.08 0.28 0.00 2.12 -1.26 -4.77 118.70 114.26 1x5z s GLU 101 Ca 0.76 -0.09 0.08 0.00 0.36 0.00 0.00 54.97 56.08 1x5z s GLU 101 Cb -0.32 -4.27 -0.04 0.00 0.26 0.00 0.00 34.13 29.77 1x5z s GLU 101 CO 0.48 -2.29 0.18 0.96 -0.54 0.00 0.00 175.26 174.05 1x5z s ILE 102 N 6.46 3.90 0.11 -3.70 -4.36 -1.03 -4.96 121.20 117.61 1x5z s ILE 102 Ca 0.42 -1.51 -0.03 0.00 -0.26 0.00 0.00 60.65 59.27 1x5z s ILE 102 Cb -0.09 -3.21 -0.03 0.00 1.25 0.00 0.00 42.46 40.38 1x5z s ILE 102 CO 0.15 -0.29 0.08 -0.94 0.24 0.00 0.00 174.94 174.18 1x5z s SER 103 N -3.85 0.30 -0.04 4.36 1.04 -1.26 0.07 113.70 114.31 1x5z s SER 103 Ca 0.35 -1.02 -0.03 0.00 0.48 0.00 0.00 55.95 55.73 1x5z s SER 103 Cb -0.07 0.29 0.01 0.00 0.10 0.00 0.00 66.02 66.36 1x5z s SER 103 CO 0.24 -0.72 0.09 0.00 0.98 0.00 0.00 173.24 173.84 1x5z s ALA 104 N -3.97 -0.22 -0.25 5.32 0.00 -1.15 -4.81 121.76 116.68 1x5z s ALA 104 Ca 0.15 0.28 -0.11 0.00 0.00 0.00 0.00 51.96 52.28 1x5z s ALA 104 Cb 0.07 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 1x5z s ALA 104 CO -0.04 -0.05 0.18 0.50 0.00 0.00 0.00 175.76 176.36 1x5z s ARG 105 N 0.11 4.03 0.84 0.00 3.52 -1.26 -3.32 118.95 122.87 1x5z s ARG 105 Ca -0.00 -0.26 -0.11 0.00 -0.13 0.00 0.00 55.73 55.22 1x5z s ARG 105 Cb -0.01 -3.58 0.09 0.00 -1.56 0.00 0.00 34.95 29.89 1x5z s ARG 105 CO -0.00 -0.03 1.10 0.95 -0.81 0.00 0.00 175.30 176.50 1x5z s THR 106 N 1.32 2.94 1.28 4.11 -4.23 -1.23 -4.69 115.64 115.14 1x5z s THR 106 Ca 0.08 0.31 -0.19 0.00 -1.18 0.00 0.00 61.69 60.71 1x5z s THR 106 Cb -0.14 -2.73 0.32 0.00 1.34 0.00 0.00 72.50 71.29 1x5z s THR 106 CO 0.07 -0.40 1.01 -0.04 -0.54 0.00 0.00 174.62 174.71 1x5z s MET 107 N -4.87 -1.80 -0.50 3.99 1.00 -1.24 -3.68 119.30 112.20 1x5z s MET 107 Ca 0.63 0.29 -0.08 0.00 0.00 0.00 0.00 55.69 56.53 1x5z s MET 107 Cb -0.18 -1.50 0.13 0.00 0.00 0.00 0.00 34.83 33.28 1x5z s MET 107 CO 0.57 -4.17 0.36 -1.14 0.00 0.00 0.00 175.02 170.63 1x5z s GLN 108 N -4.97 2.48 -0.41 2.03 0.74 -1.26 -0.77 119.66 117.49 1x5z s GLN 108 Ca 0.69 -1.90 -0.33 0.00 0.05 0.00 0.00 55.36 53.87 1x5z s GLN 108 Cb -0.16 -3.88 -0.11 0.00 1.10 0.00 0.00 33.01 29.96 1x5z s GLN 108 CO 0.59 -1.18 2.26 0.45 -0.55 0.00 0.00 175.29 176.86 1x5z n SER 109 N 4.65 2.09 -4.64 6.67 2.88 -1.26 -4.92 113.62 119.09 1x5z n SER 109 Ca -0.04 0.26 -0.35 0.00 -1.33 0.00 0.00 58.87 57.41 1x5z n SER 109 Cb 0.41 -1.30 -0.10 0.00 -0.75 0.00 0.00 64.21 62.48 1x5z n SER 109 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x5z s SER 110 N 8.13 5.73 0.00 -3.46 0.15 -1.26 -5.04 113.70 117.95 1x5z s SER 110 Ca 1.10 0.09 0.00 0.00 0.70 0.00 0.00 55.95 57.84 1x5z s SER 110 Cb -0.77 -1.99 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 1x5z s SER 110 CO 0.45 0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.66 1x5z n GLY 111 N 3.65 4.07 0.00 9.45 0.00 -1.26 -4.95 105.19 116.14 1x5z n GLY 111 Ca -0.16 -0.67 0.07 0.00 0.00 0.00 0.00 46.02 45.26 1x5z n GLY 111 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5z n PRO 112 N -1.33 0.21 -3.47 1.61 -0.04 -1.26 -4.36 135.00 126.36 1x5z n PRO 112 Ca 0.00 0.14 -0.43 0.00 -0.04 0.00 0.00 63.50 63.17 1x5z n PRO 112 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 1x5z n PRO 112 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5z s SER 113 N -2.56 6.04 -0.42 3.54 0.15 -1.26 -5.04 113.70 114.15 1x5z s SER 113 Ca 0.14 -2.34 -0.29 0.00 0.70 0.00 0.00 55.95 54.16 1x5z s SER 113 Cb 0.10 -2.08 0.02 0.00 -1.71 0.00 0.00 66.02 62.35 1x5z s SER 113 CO 0.22 -0.62 1.18 -0.55 1.20 0.00 0.00 173.24 174.68 1x5z s SER 114 N 2.27 6.65 0.00 5.45 0.15 -1.26 -5.08 113.70 121.89 1x5z s SER 114 Ca 0.11 0.72 0.00 0.00 0.70 0.00 0.00 55.95 57.48 1x5z s SER 114 Cb -0.20 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 1x5z s SER 114 CO -0.03 -1.19 0.00 0.61 1.20 0.00 0.00 173.24 173.83