#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uew n SER 2 N 0.00 0.00 -4.97 1.61 2.88 -1.26 -5.18 113.62 106.70 1uew n SER 2 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 1uew n SER 2 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1uew n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1uew s SER 3 N 1.27 6.29 -0.18 -3.46 0.15 -1.26 -4.99 113.70 111.51 1uew s SER 3 Ca 0.00 0.10 -0.27 0.00 0.70 0.00 0.00 55.95 56.48 1uew s SER 3 Cb 0.00 -1.84 -0.01 0.00 -1.71 0.00 0.00 66.02 62.47 1uew s SER 3 CO 0.00 -0.12 0.93 -0.83 1.20 0.00 0.00 173.24 174.41 1uew s GLY 4 N -4.00 1.99 0.52 9.45 0.00 -1.26 -5.03 107.32 108.99 1uew s GLY 4 Ca 0.36 0.12 -0.22 0.00 0.00 0.00 0.00 44.72 44.98 1uew s GLY 4 CO 0.30 1.89 1.14 -1.14 0.00 0.00 0.00 173.10 175.29 1uew n SER 5 N 5.62 1.73 -3.48 1.64 3.41 -1.26 -5.05 113.62 116.23 1uew n SER 5 Ca 0.08 0.95 -0.09 0.00 -0.26 0.00 0.00 58.87 59.54 1uew n SER 5 Cb 0.48 -1.46 -0.02 0.00 -0.26 0.00 0.00 64.21 62.95 1uew n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1uew s SER 6 N -0.93 -0.42 0.00 4.04 0.15 -1.26 -5.10 113.70 110.18 1uew s SER 6 Ca 0.70 0.01 0.00 0.00 0.70 0.00 0.00 55.95 57.36 1uew s SER 6 Cb -0.46 0.44 0.00 0.00 -1.71 0.00 0.00 66.02 64.29 1uew s SER 6 CO 0.51 -0.70 0.00 0.61 1.20 0.00 0.00 173.24 174.86 1uew n GLY 7 N -0.25 0.83 0.00 9.45 0.00 -1.26 -5.05 105.19 108.92 1uew n GLY 7 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1uew n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uew n SER 8 N 0.00 0.00 -4.78 1.61 7.64 -1.26 -4.99 113.62 111.84 1uew n SER 8 Ca 0.00 0.06 -0.35 0.00 1.01 0.00 0.00 58.87 59.59 1uew n SER 8 Cb 0.40 -0.08 -0.01 0.00 -1.01 0.00 0.00 64.21 63.51 1uew n SER 8 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1uew s LEU 9 N -1.81 3.87 0.55 -3.43 1.43 -1.26 -4.98 118.68 113.05 1uew s LEU 9 Ca 0.00 2.15 -0.20 0.00 -1.03 0.00 0.00 54.13 55.05 1uew s LEU 9 Cb 0.00 -4.46 -0.06 0.00 0.03 0.00 0.00 46.19 41.70 1uew s LEU 9 CO 0.00 -1.00 1.08 0.00 0.23 0.00 0.00 176.35 176.66 1uew n GLN 10 N -0.93 1.20 -4.10 1.70 1.13 -1.26 -5.04 117.38 110.07 1uew n GLN 10 Ca 0.10 0.45 -0.11 0.00 -1.94 0.00 0.00 57.00 55.50 1uew n GLN 10 Cb 0.50 -2.25 -0.08 0.00 0.11 0.00 0.00 30.24 28.52 1uew n GLN 10 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1uew s THR 11 N -1.41 0.01 0.34 5.09 -4.23 -1.26 -4.80 115.64 109.39 1uew s THR 11 Ca 0.72 -1.72 0.09 0.00 -1.18 0.00 0.00 61.69 59.59 1uew s THR 11 Cb -0.44 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.03 1uew s THR 11 CO 0.50 -0.04 0.06 -0.44 -0.54 0.00 0.00 174.62 174.15 1uew s SER 12 N -3.09 4.37 0.14 3.99 0.01 0.46 -4.72 113.70 114.87 1uew s SER 12 Ca 0.30 -0.90 0.03 0.00 1.31 0.00 0.00 55.95 56.69 1uew s SER 12 Cb 0.04 -0.61 -0.04 0.00 0.21 0.00 0.00 66.02 65.62 1uew s SER 12 CO 0.09 -0.26 0.18 1.51 0.41 0.00 0.00 173.24 175.18 1uew s ASP 13 N -3.76 5.88 0.01 2.44 -4.77 -1.26 -3.21 116.67 111.99 1uew s ASP 13 Ca 0.36 0.03 0.05 0.00 -3.30 0.00 0.00 52.55 49.68 1uew s ASP 13 Cb -0.01 -1.65 -0.01 0.00 -1.09 0.00 0.00 42.92 40.15 1uew s ASP 13 CO 0.21 0.09 -0.15 -0.69 0.70 0.00 0.00 175.17 175.33 1uew s VAL 14 N -1.67 1.15 -0.07 2.11 1.01 -0.85 -4.97 120.40 117.11 1uew s VAL 14 Ca 0.32 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.58 1uew s VAL 14 Cb -0.11 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.28 1uew s VAL 14 CO 0.25 0.22 -0.19 -0.69 0.00 0.00 0.00 175.10 174.69 1uew s VAL 15 N -0.51 1.65 -0.05 2.92 1.01 -1.26 -0.82 120.40 123.33 1uew s VAL 15 Ca 0.04 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.24 1uew s VAL 15 Cb -0.06 -1.43 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1uew s VAL 15 CO 0.00 0.47 -0.10 -0.63 0.00 0.00 0.00 175.10 174.84 1uew s ILE 16 N 0.24 0.93 0.07 2.22 1.01 -0.81 -4.99 121.20 119.88 1uew s ILE 16 Ca -0.11 -0.38 0.08 0.00 0.00 0.00 0.00 60.65 60.25 1uew s ILE 16 Cb -0.15 -0.86 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 1uew s ILE 16 CO 0.05 0.30 -0.21 -1.00 0.00 0.00 0.00 174.94 174.08 1uew s HIS 17 N 0.59 2.48 0.31 3.97 3.76 -1.26 -0.90 115.29 124.23 1uew s HIS 17 Ca -0.11 -0.30 0.04 0.00 -0.15 0.00 0.00 55.06 54.54 1uew s HIS 17 Cb -0.14 -1.39 -0.03 0.00 1.11 0.00 0.00 32.58 32.13 1uew s HIS 17 CO 0.02 0.28 0.29 -0.98 -0.85 0.00 0.00 174.74 173.49 1uew s ARG 18 N -1.66 1.67 0.61 1.40 1.70 -0.26 -4.79 118.95 117.61 1uew s ARG 18 Ca 0.15 -1.89 -0.02 0.00 -0.47 0.00 0.00 55.73 53.50 1uew s ARG 18 Cb -0.10 0.34 0.04 0.00 -0.57 0.00 0.00 34.95 34.65 1uew s ARG 18 CO 0.06 -0.62 0.87 0.15 -1.08 0.00 0.00 175.30 174.68 1uew s LYS 19 N -3.53 2.46 0.28 3.89 3.01 -1.26 -4.84 119.74 119.76 1uew s LYS 19 Ca 0.38 -0.50 0.12 0.00 -1.01 0.00 0.00 55.97 54.97 1uew s LYS 19 Cb 0.03 -2.35 0.35 0.00 -1.01 0.00 0.00 37.83 34.85 1uew s LYS 19 CO 0.23 -0.89 1.59 0.93 0.51 0.00 0.00 175.35 177.72 1uew h GLU 20 N -0.19 0.00 0.66 1.68 4.39 -2.00 -3.33 114.58 115.79 1uew h GLU 20 Ca -0.43 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.23 1uew h GLU 20 Cb 1.30 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.96 1uew h GLU 20 CO 0.56 0.60 -0.32 -0.91 -1.16 0.00 0.00 179.01 177.78 1uew h ASN 21 N 0.00 -0.76 -4.31 1.42 4.21 -2.06 -3.43 115.58 110.65 1uew h ASN 21 Ca -0.01 0.01 -0.48 0.00 1.21 0.00 0.00 56.30 57.03 1uew h ASN 21 Cb 1.15 0.20 0.11 0.00 -1.12 0.00 0.00 38.32 38.65 1uew h ASN 21 CO 0.08 -0.50 0.34 -1.83 -1.29 0.00 0.00 177.43 174.22 1uew s GLU 22 N -5.80 2.03 0.54 0.81 -1.05 -1.25 -5.11 118.70 108.87 1uew s GLU 22 Ca -0.17 0.58 0.09 0.00 -0.15 0.00 0.00 54.97 55.31 1uew s GLU 22 Cb 0.03 -1.92 0.06 0.00 -0.44 0.00 0.00 34.13 31.86 1uew s GLU 22 CO 0.60 -1.64 0.67 0.20 0.95 0.00 0.00 175.26 176.04 1uew s GLY 23 N -3.97 1.89 0.91 -3.83 0.00 -1.26 -4.69 107.32 96.37 1uew s GLY 23 Ca 0.61 -1.92 -0.12 0.00 0.00 0.00 0.00 44.72 43.29 1uew s GLY 23 CO 0.54 -1.70 1.10 -1.36 0.00 0.00 0.00 173.10 171.68 1uew s PHE 24 N -2.63 2.39 -2.95 1.90 0.08 -1.26 -4.77 117.98 110.75 1uew s PHE 24 Ca 0.56 1.08 0.24 0.00 0.12 0.00 0.00 56.93 58.93 1uew s PHE 24 Cb -0.06 -3.23 0.27 0.00 -0.57 0.00 0.00 43.02 39.44 1uew s PHE 24 CO 0.35 -2.42 1.31 0.41 -0.10 0.00 0.00 175.22 174.77 1uew n GLY 25 N -1.52 0.93 3.42 4.36 0.00 -1.26 -4.98 105.19 106.14 1uew n GLY 25 Ca 0.06 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 1uew n GLY 25 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1uew s PHE 26 N -1.99 2.89 -0.15 1.61 -0.71 -1.26 -0.87 117.98 117.50 1uew s PHE 26 Ca 0.29 -0.49 -0.08 0.00 -1.04 0.00 0.00 56.93 55.61 1uew s PHE 26 Cb 0.20 -1.88 -0.04 0.00 -1.21 0.00 0.00 43.02 40.09 1uew s PHE 26 CO 0.30 -0.13 0.12 0.08 -1.34 0.00 0.00 175.22 174.25 1uew s VAL 27 N 0.30 5.30 -0.01 -2.49 1.01 -0.38 -5.01 120.40 119.12 1uew s VAL 27 Ca -0.08 0.14 -0.15 0.00 0.00 0.00 0.00 61.98 61.89 1uew s VAL 27 Cb -0.15 -3.35 -0.06 0.00 0.00 0.00 0.00 36.38 32.82 1uew s VAL 27 CO 0.05 0.53 0.41 -0.63 0.00 0.00 0.00 175.10 175.46 1uew s ILE 28 N -0.33 5.04 0.40 2.22 1.01 -1.26 -0.48 121.20 127.80 1uew s ILE 28 Ca 0.11 0.84 0.05 0.00 0.00 0.00 0.00 60.65 61.65 1uew s ILE 28 Cb -0.12 -3.72 -0.02 0.00 0.01 0.00 0.00 42.46 38.61 1uew s ILE 28 CO 0.01 0.56 0.17 0.27 0.00 0.00 0.00 174.94 175.95 1uew s ILE 29 N -0.91 0.41 -0.11 2.92 -4.36 -0.09 -4.78 121.20 114.27 1uew s ILE 29 Ca 0.24 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.55 1uew s ILE 29 Cb -0.17 -2.33 0.03 0.00 1.25 0.00 0.00 42.46 41.24 1uew s ILE 29 CO 0.13 0.00 0.15 -0.24 0.24 0.00 0.00 174.94 175.22 1uew n SER 30 N -1.46 -1.70 0.00 4.36 2.88 -1.26 -1.10 113.62 115.34 1uew n SER 30 Ca -0.03 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 1uew n SER 30 Cb 0.64 -4.01 0.00 0.00 -0.75 0.00 0.00 64.21 60.09 1uew n SER 30 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uew n SER 31 N 1.22 0.00 -4.01 -3.46 2.88 -1.24 -0.60 113.62 108.41 1uew n SER 31 Ca -0.26 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 56.97 1uew n SER 31 Cb 0.41 0.27 -0.15 0.00 -0.75 0.00 0.00 64.21 63.98 1uew n SER 31 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1uew s LEU 32 N -3.81 3.36 -0.33 2.46 0.20 -1.26 -4.87 118.68 114.43 1uew s LEU 32 Ca 0.00 -1.46 -0.01 0.00 0.69 0.00 0.00 54.13 53.35 1uew s LEU 32 Cb 0.00 -1.43 0.11 0.00 -0.43 0.00 0.00 46.19 44.44 1uew s LEU 32 CO 0.00 -0.24 0.14 0.21 -0.29 0.00 0.00 176.35 176.16 1uew s ASN 33 N 1.17 3.78 0.00 3.68 3.84 -1.26 -5.03 114.94 121.12 1uew s ASN 33 Ca -0.04 -1.79 0.00 0.00 0.21 0.00 0.00 52.86 51.24 1uew s ASN 33 Cb -0.19 -0.75 0.00 0.00 -0.55 0.00 0.00 41.25 39.75 1uew s ASN 33 CO -0.07 -0.39 0.00 0.54 -2.79 0.00 0.00 177.10 174.40 1uew n ARG 34 N 4.63 0.00 0.00 0.43 1.74 -1.26 -4.76 116.66 117.44 1uew n ARG 34 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1uew n ARG 34 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.84 1uew n ARG 34 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1uew n PRO 35 N -1.03 0.86 -3.80 5.56 -0.04 -1.26 -4.72 135.00 130.57 1uew n PRO 35 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 1uew n PRO 35 Cb 0.00 -1.24 -0.16 0.00 -0.04 0.00 0.00 33.50 32.06 1uew n PRO 35 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1uew s GLU 36 N -0.40 0.97 -0.01 0.54 2.12 -1.26 -5.09 118.70 115.58 1uew s GLU 36 Ca 0.00 -0.89 -0.30 0.00 0.36 0.00 0.00 54.97 54.14 1uew s GLU 36 Cb 0.00 -2.25 -0.08 0.00 0.26 0.00 0.00 34.13 32.06 1uew s GLU 36 CO 0.00 -0.78 1.95 -1.54 -0.54 0.00 0.00 175.26 174.36 1uew s SER 37 N 1.60 6.36 0.00 -1.70 1.04 -1.26 -4.34 113.70 115.39 1uew s SER 37 Ca 0.02 2.51 0.00 0.00 0.48 0.00 0.00 55.95 58.96 1uew s SER 37 Cb -0.18 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.41 1uew s SER 37 CO -0.14 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.54 1uew n GLY 38 N 4.64 0.48 3.25 7.32 0.00 -1.26 -5.17 105.19 114.45 1uew n GLY 38 Ca 0.21 -0.46 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 1uew n GLY 38 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uew s SER 39 N 0.00 2.37 0.27 1.61 0.01 -1.26 -5.09 113.70 111.61 1uew s SER 39 Ca 0.00 -0.58 0.08 0.00 1.31 0.00 0.00 55.95 56.76 1uew s SER 39 Cb 0.00 -0.16 -0.05 0.00 0.21 0.00 0.00 66.02 66.01 1uew s SER 39 CO 0.00 0.10 -0.11 -0.89 0.41 0.00 0.00 173.24 172.75 1uew s THR 40 N -0.97 1.87 -1.16 1.44 2.01 -1.26 -4.75 115.64 112.82 1uew s THR 40 Ca 0.06 -2.20 -0.12 0.00 0.31 0.00 0.00 61.69 59.74 1uew s THR 40 Cb -0.09 -2.36 -0.02 0.00 0.01 0.00 0.00 72.50 70.04 1uew s THR 40 CO 0.03 -0.37 0.79 -0.38 -0.69 0.00 0.00 174.62 174.00 1uew n ILE 41 N -0.57 -6.31 -3.93 1.82 -0.00 -1.26 -5.02 119.36 104.09 1uew n ILE 41 Ca -0.06 -0.95 -0.10 0.00 -0.00 0.00 0.00 62.75 61.64 1uew n ILE 41 Cb 0.62 -4.72 -0.10 0.00 -0.00 0.00 0.00 39.64 35.44 1uew n ILE 41 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 1uew s THR 42 N -3.51 0.11 0.14 1.39 -1.32 -1.26 -5.09 115.64 106.10 1uew s THR 42 Ca 0.36 -0.88 0.07 0.00 -1.21 0.00 0.00 61.69 60.02 1uew s THR 42 Cb -0.10 -0.49 -0.04 0.00 -1.51 0.00 0.00 72.50 70.36 1uew s THR 42 CO 0.82 -0.49 -0.15 0.54 -2.21 0.00 0.00 174.62 173.13 1uew s VAL 43 N -1.72 1.50 -0.49 5.08 0.11 -1.26 -5.09 120.40 118.53 1uew s VAL 43 Ca -0.13 -1.82 -0.28 0.00 -2.93 0.00 0.00 61.98 56.82 1uew s VAL 43 Cb -0.07 -1.67 -0.00 0.00 -1.53 0.00 0.00 36.38 33.11 1uew s VAL 43 CO -0.01 -0.41 1.58 -2.16 -3.33 0.00 0.00 175.10 170.78 1uew s PRO 44 N -2.81 3.23 0.00 1.54 0.04 -1.26 -3.59 135.00 132.15 1uew s PRO 44 Ca 0.12 0.79 0.00 0.00 0.04 0.00 0.00 61.00 61.95 1uew s PRO 44 Cb -0.05 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.32 1uew s PRO 44 CO 0.04 -2.00 0.00 0.72 0.04 0.00 0.00 177.00 175.80 1uew n HIS 45 N 10.20 0.00 -4.23 0.56 8.25 0.23 -4.52 115.22 125.70 1uew n HIS 45 Ca 0.17 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.50 1uew n HIS 45 Cb 0.49 -1.83 -0.10 0.00 1.12 0.00 0.00 29.99 29.67 1uew n HIS 45 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1uew s LYS 46 N -1.72 1.03 0.25 -0.41 -2.85 -0.26 -1.47 119.74 114.32 1uew s LYS 46 Ca 0.00 -1.45 -0.30 0.00 -1.00 0.00 0.00 55.97 53.22 1uew s LYS 46 Cb 0.00 -0.45 -0.10 0.00 -2.06 0.00 0.00 37.83 35.22 1uew s LYS 46 CO 0.00 0.00 1.40 0.42 0.10 0.00 0.00 175.35 177.28 1uew s ILE 47 N -3.47 2.76 -0.10 3.79 -1.09 -0.78 -0.91 121.20 121.40 1uew s ILE 47 Ca 0.17 0.65 -0.11 0.00 -2.23 0.00 0.00 60.65 59.14 1uew s ILE 47 Cb 0.04 -3.41 -0.04 0.00 -1.58 0.00 0.00 42.46 37.47 1uew s ILE 47 CO 0.00 0.11 -0.21 0.61 -1.23 0.00 0.00 174.94 174.22 1uew n GLY 48 N 2.08 -0.45 3.21 6.18 0.00 0.37 -3.40 105.19 113.19 1uew n GLY 48 Ca 0.06 -0.20 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 1uew n GLY 48 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uew s ARG 49 N -2.24 0.94 -0.04 1.61 3.52 -1.22 -4.90 118.95 116.63 1uew s ARG 49 Ca -0.17 -1.21 0.02 0.00 -0.13 0.00 0.00 55.73 54.24 1uew s ARG 49 Cb 0.02 -0.72 0.01 0.00 -1.56 0.00 0.00 34.95 32.70 1uew s ARG 49 CO 0.26 0.13 -0.07 0.42 -0.81 0.00 0.00 175.30 175.22 1uew s ILE 50 N -2.31 0.69 -0.19 4.11 1.01 -1.26 -1.25 121.20 122.00 1uew s ILE 50 Ca 0.07 -0.26 -0.32 0.00 0.00 0.00 0.00 60.65 60.15 1uew s ILE 50 Cb -0.04 -0.65 -0.09 0.00 0.01 0.00 0.00 42.46 41.69 1uew s ILE 50 CO 0.02 0.24 2.08 -0.38 0.00 0.00 0.00 174.94 176.90 1uew n ILE 51 N 3.67 0.42 -1.69 2.92 -0.00 -0.04 -4.95 119.36 119.68 1uew n ILE 51 Ca -0.22 -0.26 -0.44 0.00 -0.00 0.00 0.00 62.75 61.83 1uew n ILE 51 Cb 0.53 -2.07 -0.03 0.00 -0.00 0.00 0.00 39.64 38.07 1uew n ILE 51 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 1uew n ASP 52 N 9.19 3.25 0.00 4.38 8.00 -1.26 -2.35 116.55 137.77 1uew n ASP 52 Ca 0.30 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.91 1uew n ASP 52 Cb 0.33 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 39.95 1uew n ASP 52 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1uew n GLY 53 N 2.85 2.13 3.46 0.44 0.00 -1.26 -5.02 105.19 107.79 1uew n GLY 53 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1uew n GLY 53 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uew n SER 54 N 0.00 -1.87 -0.06 1.61 3.41 -0.99 -4.61 113.62 111.11 1uew n SER 54 Ca 0.00 -0.20 0.17 0.00 -0.26 0.00 0.00 58.87 58.58 1uew n SER 54 Cb 0.00 -1.25 0.61 0.00 -0.26 0.00 0.00 64.21 63.31 1uew n SER 54 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1uew h PRO 55 N -2.76 0.18 0.11 4.33 0.13 -1.86 -2.14 132.00 129.99 1uew h PRO 55 Ca -0.63 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.48 1uew h PRO 55 Cb 1.34 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1uew h PRO 55 CO 0.50 0.12 -0.06 0.00 -0.23 0.00 0.00 178.00 178.32 1uew h ALA 56 N 1.71 -1.00 -0.13 -0.56 0.00 -1.90 -2.94 119.26 114.44 1uew h ALA 56 Ca 0.29 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.21 1uew h ALA 56 Cb 0.88 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.71 1uew h ALA 56 CO -0.05 -1.00 -0.33 0.22 0.00 0.00 0.00 179.25 178.10 1uew h ASP 57 N -0.15 -1.03 0.39 0.00 3.58 -1.64 -0.43 116.42 117.15 1uew h ASP 57 Ca -0.02 0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1uew h ASP 57 Cb 0.12 0.43 0.00 0.00 1.72 0.00 0.00 39.33 41.60 1uew h ASP 57 CO 0.02 -0.37 0.00 0.54 -2.88 0.00 0.00 179.24 176.55 1uew n ARG 58 N -5.41 0.11 -0.14 0.28 5.12 -0.85 -0.76 116.66 115.01 1uew n ARG 58 Ca -0.03 0.19 -0.02 0.00 -1.93 0.00 0.00 57.85 56.06 1uew n ARG 58 Cb 0.33 -1.50 0.22 0.00 -1.16 0.00 0.00 32.46 30.35 1uew n ARG 58 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1uew n ALA 60 N -2.45 0.00 0.67 0.00 0.00 0.06 -4.67 120.51 114.12 1uew n ALA 60 Ca 0.05 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.55 1uew n ALA 60 Cb 0.17 0.00 0.35 0.00 0.00 0.00 0.00 19.45 19.97 1uew n ALA 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uew n LYS 61 N -0.69 0.24 -3.51 0.00 4.76 -1.26 -4.55 118.16 113.14 1uew n LYS 61 Ca 0.00 0.13 -0.15 0.00 -2.87 0.00 0.00 58.31 55.42 1uew n LYS 61 Cb 0.00 -1.50 -0.12 0.00 -1.84 0.00 0.00 35.03 31.57 1uew n LYS 61 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1uew s LEU 62 N -2.46 -0.29 0.31 -0.35 0.20 -1.26 -4.91 118.68 109.92 1uew s LEU 62 Ca 0.14 0.13 0.03 0.00 0.69 0.00 0.00 54.13 55.12 1uew s LEU 62 Cb 0.09 0.65 -0.06 0.00 -0.43 0.00 0.00 46.19 46.44 1uew s LEU 62 CO 0.19 -0.29 0.08 -0.54 -0.29 0.00 0.00 176.35 175.50 1uew s LYS 63 N 2.41 1.59 -0.24 1.98 1.02 -1.26 -4.83 119.74 120.41 1uew s LYS 63 Ca 0.06 -1.88 -0.28 0.00 0.02 0.00 0.00 55.97 53.89 1uew s LYS 63 Cb -0.15 -0.61 -0.05 0.00 -0.52 0.00 0.00 37.83 36.50 1uew s LYS 63 CO -0.12 -0.26 2.18 0.08 -0.92 0.00 0.00 175.35 176.32 1uew s VAL 64 N -3.46 3.06 0.00 3.17 1.01 -1.26 -1.49 120.40 121.43 1uew s VAL 64 Ca 0.36 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1uew s VAL 64 Cb 0.08 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1uew s VAL 64 CO 0.15 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1uew n GLY 65 N 5.74 1.33 3.58 4.51 0.00 -1.22 -5.02 105.19 114.11 1uew n GLY 65 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 1uew n GLY 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uew s ASP 66 N -0.82 5.80 0.49 1.61 1.01 -0.56 -4.76 116.67 119.44 1uew s ASP 66 Ca 0.00 0.83 -0.23 0.00 0.71 0.00 0.00 52.55 53.86 1uew s ASP 66 Cb 0.00 -2.53 -0.07 0.00 1.01 0.00 0.00 42.92 41.32 1uew s ASP 66 CO 0.00 -1.86 1.26 0.54 0.21 0.00 0.00 175.17 175.31 1uew n ARG 67 N 8.62 1.71 -4.19 8.23 1.74 -1.26 -1.87 116.66 129.65 1uew n ARG 67 Ca 0.20 0.62 -0.18 0.00 -0.77 0.00 0.00 57.85 57.72 1uew n ARG 67 Cb 0.49 -2.42 -0.12 0.00 -1.02 0.00 0.00 32.46 29.39 1uew n ARG 67 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1uew s ILE 68 N -1.27 1.03 0.00 0.55 1.01 -0.54 -3.49 121.20 118.50 1uew s ILE 68 Ca 0.66 -1.21 0.00 0.00 0.00 0.00 0.00 60.65 60.10 1uew s ILE 68 Cb -0.46 -0.99 0.00 0.00 0.01 0.00 0.00 42.46 41.01 1uew s ILE 68 CO 0.54 -0.20 0.00 0.18 0.00 0.00 0.00 174.94 175.46 1uew n LEU 69 N 1.43 2.44 -3.77 2.97 4.32 -0.23 -4.76 117.00 119.40 1uew n LEU 69 Ca -0.21 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.71 1uew n LEU 69 Cb 0.54 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.32 1uew n LEU 69 CO 0.22 0.40 0.49 0.00 -1.22 0.00 0.00 177.39 177.28 1uew s ALA 70 N -1.94 -1.34 -0.03 -1.18 0.00 -1.18 -3.84 121.76 112.26 1uew s ALA 70 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 51.96 51.85 1uew s ALA 70 Cb 0.00 0.82 0.03 0.00 0.00 0.00 0.00 23.12 23.97 1uew s ALA 70 CO 0.00 -0.99 0.04 0.54 0.00 0.00 0.00 175.76 175.35 1uew s VAL 71 N -3.80 -0.07 -1.61 0.00 0.11 0.76 -1.89 120.40 113.90 1uew s VAL 71 Ca 0.09 0.27 -0.04 0.00 -2.93 0.00 0.00 61.98 59.37 1uew s VAL 71 Cb -0.05 -0.11 0.04 0.00 -1.53 0.00 0.00 36.38 34.74 1uew s VAL 71 CO 0.03 0.11 0.11 0.59 -3.33 0.00 0.00 175.10 172.61 1uew n ASN 72 N 4.47 0.47 -0.23 3.54 3.02 0.82 -0.51 115.26 126.84 1uew n ASN 72 Ca -0.22 -1.27 -0.03 0.00 -0.03 0.00 0.00 54.58 53.03 1uew n ASN 72 Cb 0.50 -1.59 -0.01 0.00 -0.61 0.00 0.00 39.78 38.06 1uew n ASN 72 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uew n GLY 73 N -2.32 0.36 3.81 7.41 0.00 -1.26 -4.98 105.19 108.21 1uew n GLY 73 Ca -0.25 -0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.47 1uew n GLY 73 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uew s GLN 74 N -1.98 2.97 0.56 1.61 -1.52 0.34 -4.78 119.66 116.86 1uew s GLN 74 Ca 0.00 -0.80 -0.21 0.00 -1.95 0.00 0.00 55.36 52.41 1uew s GLN 74 Cb 0.00 -2.71 -0.04 0.00 -0.22 0.00 0.00 33.01 30.04 1uew s GLN 74 CO 0.00 0.51 1.30 -1.54 -0.25 0.00 0.00 175.29 175.30 1uew s SER 75 N -2.98 5.24 0.00 5.90 1.04 -1.26 -0.17 113.70 121.46 1uew s SER 75 Ca 0.31 2.62 0.00 0.00 0.48 0.00 0.00 55.95 59.37 1uew s SER 75 Cb -0.11 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1uew s SER 75 CO 0.24 -1.58 0.06 2.30 0.98 0.00 0.00 173.24 175.24 1uew n ILE 76 N -1.22 0.00 0.02 -1.02 -5.35 -1.25 -4.51 119.36 106.03 1uew n ILE 76 Ca 0.12 -0.21 -0.18 0.00 -0.27 0.00 0.00 62.75 62.20 1uew n ILE 76 Cb 0.47 1.17 -0.14 0.00 -1.74 0.00 0.00 39.64 39.39 1uew n ILE 76 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1uew h ILE 77 N 0.17 1.58 0.00 7.28 1.08 -1.93 -3.38 117.51 122.31 1uew h ILE 77 Ca 0.00 -2.46 -0.26 0.00 -0.39 0.00 0.00 64.86 61.74 1uew h ILE 77 Cb 0.08 3.21 -0.04 0.00 -3.07 0.00 0.00 36.82 37.00 1uew h ILE 77 CO 0.00 0.68 -1.55 0.78 -0.69 0.00 0.00 178.15 177.37 1uew h ASN 78 N -0.51 0.00 -4.14 1.72 4.21 -1.96 -3.47 115.58 111.43 1uew h ASN 78 Ca -0.10 0.00 -0.50 0.00 1.21 0.00 0.00 56.30 56.90 1uew h ASN 78 Cb 1.47 0.00 0.08 0.00 -1.12 0.00 0.00 38.32 38.75 1uew h ASN 78 CO 0.11 0.95 0.40 -0.04 -1.29 0.00 0.00 177.43 177.56 1uew s MET 79 N -2.65 3.18 0.57 0.81 -1.94 -1.26 -5.03 119.30 112.97 1uew s MET 79 Ca -0.03 1.47 -0.17 0.00 -1.71 0.00 0.00 55.69 55.24 1uew s MET 79 Cb 0.08 -1.99 -0.05 0.00 2.01 0.00 0.00 34.83 34.88 1uew s MET 79 CO 0.82 -0.96 1.06 -1.25 -0.01 0.00 0.00 175.02 174.69 1uew s PRO 80 N -3.66 3.39 0.28 2.03 0.04 -1.26 -4.90 135.00 130.92 1uew s PRO 80 Ca 0.69 1.29 -0.03 0.00 0.04 0.00 0.00 61.00 63.00 1uew s PRO 80 Cb -0.21 -2.04 0.37 0.00 0.04 0.00 0.00 34.50 32.67 1uew s PRO 80 CO 0.33 -0.76 1.86 1.25 0.04 0.00 0.00 177.00 179.72 1uew h HIS 81 N 0.73 0.97 0.00 0.56 2.76 -1.96 -2.16 115.15 116.06 1uew h HIS 81 Ca -0.48 -0.05 -0.08 0.00 -2.20 0.00 0.00 60.37 57.56 1uew h HIS 81 Cb 1.23 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.87 1uew h HIS 81 CO 0.57 0.73 -0.40 0.00 -1.30 0.00 0.00 177.93 177.53 1uew h ALA 82 N 1.36 1.15 -0.23 5.26 0.00 -1.98 0.06 119.26 124.88 1uew h ALA 82 Ca 0.23 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1uew h ALA 82 Cb 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1uew h ALA 82 CO -0.02 0.50 -0.12 -0.44 0.00 0.00 0.00 179.25 179.17 1uew h ASP 83 N 0.00 0.51 -0.58 0.00 5.19 -1.78 -0.06 116.42 119.70 1uew h ASP 83 Ca -0.00 -0.42 -0.06 0.00 -0.62 0.00 0.00 57.03 55.93 1uew h ASP 83 Cb 0.80 -0.14 -0.03 0.00 0.18 0.00 0.00 39.33 40.14 1uew h ASP 83 CO 0.05 0.81 0.13 0.40 -3.12 0.00 0.00 179.24 177.51 1uew h ILE 84 N 0.21 1.25 -0.22 0.35 2.04 -1.25 0.14 117.51 120.03 1uew h ILE 84 Ca 0.05 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 1uew h ILE 84 Cb 0.62 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1uew h ILE 84 CO 0.04 0.35 0.12 0.58 0.00 0.00 0.00 178.15 179.23 1uew h VAL 85 N 0.92 1.11 -0.58 1.67 2.07 -0.86 -2.30 116.25 118.28 1uew h VAL 85 Ca 0.19 -0.31 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 1uew h VAL 85 Cb 0.36 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1uew h VAL 85 CO 0.00 0.11 0.16 0.50 0.02 0.00 0.00 177.57 178.37 1uew h LYS 86 N 0.24 0.88 -0.70 1.57 3.11 -0.45 -0.71 116.57 120.51 1uew h LYS 86 Ca 0.08 -0.17 0.08 0.00 -2.81 0.00 0.00 60.65 57.82 1uew h LYS 86 Cb 0.07 -0.14 -0.07 0.00 -1.00 0.00 0.00 32.23 31.10 1uew h LYS 86 CO -0.01 0.78 0.37 -0.07 -2.81 0.00 0.00 179.45 177.70 1uew h LEU 87 N 0.85 0.51 -0.31 5.20 -0.00 -0.85 0.28 115.31 120.99 1uew h LEU 87 Ca 0.19 0.05 -0.09 0.00 -0.00 0.00 0.00 57.88 58.03 1uew h LEU 87 Cb 0.28 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 40.88 1uew h LEU 87 CO -0.01 0.30 -0.17 0.40 -0.00 0.00 0.00 178.44 178.97 1uew h ILE 88 N 0.64 1.29 -0.64 1.22 2.04 -0.78 -0.62 117.51 120.67 1uew h ILE 88 Ca 0.33 -1.28 -0.06 0.00 1.00 0.00 0.00 64.86 64.85 1uew h ILE 88 Cb 0.30 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 1uew h ILE 88 CO -0.24 0.41 0.15 0.50 0.00 0.00 0.00 178.15 178.98 1uew h LYS 89 N 0.42 1.00 -0.01 2.37 3.64 -0.51 -2.43 116.57 121.05 1uew h LYS 89 Ca 0.07 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1uew h LYS 89 Cb 0.70 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 1uew h LYS 89 CO 0.05 0.90 -0.10 -3.47 -2.27 0.00 0.00 179.45 174.55 1uew n ASP 90 N -4.24 0.70 0.14 4.20 2.03 0.94 -4.57 116.55 115.74 1uew n ASP 90 Ca 0.05 -0.84 0.19 0.00 0.52 0.00 0.00 54.79 54.71 1uew n ASP 90 Cb 0.25 -0.02 0.78 0.00 -0.72 0.00 0.00 41.12 41.41 1uew n ASP 90 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1uew h ALA 91 N 3.80 2.00 0.00 -1.67 0.00 -0.58 -3.45 119.26 119.36 1uew h ALA 91 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uew h ALA 91 Cb 0.37 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1uew h ALA 91 CO 0.00 -0.48 0.00 0.41 0.00 0.00 0.00 179.25 179.18 1uew n GLY 92 N -1.46 1.40 4.54 0.00 0.00 -1.26 -4.47 105.19 103.93 1uew n GLY 92 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1uew n GLY 92 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uew n LEU 93 N 0.00 0.00 -4.87 0.99 4.77 -1.26 -4.89 117.00 111.73 1uew n LEU 93 Ca 0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 1uew n LEU 93 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1uew n LEU 93 CO 0.00 0.00 0.14 -0.44 -1.33 0.00 0.00 177.39 175.76 1uew s SER 94 N 0.00 6.63 -0.03 -1.43 0.01 -1.26 -1.10 113.70 116.51 1uew s SER 94 Ca 0.00 0.83 -0.01 0.00 1.31 0.00 0.00 55.95 58.08 1uew s SER 94 Cb 0.00 -2.19 0.03 0.00 0.21 0.00 0.00 66.02 64.07 1uew s SER 94 CO 0.00 0.04 0.05 0.54 0.41 0.00 0.00 173.24 174.28 1uew s VAL 95 N -1.63 -0.08 -0.24 3.43 0.11 -0.08 -4.65 120.40 117.25 1uew s VAL 95 Ca 0.41 0.34 -0.12 0.00 -2.93 0.00 0.00 61.98 59.68 1uew s VAL 95 Cb -0.13 -0.12 -0.05 0.00 -1.53 0.00 0.00 36.38 34.55 1uew s VAL 95 CO 0.21 0.14 0.21 -0.89 -3.33 0.00 0.00 175.10 171.44 1uew s THR 96 N 1.69 5.32 -0.16 5.04 2.01 -1.26 -1.92 115.64 126.35 1uew s THR 96 Ca -0.01 0.27 0.02 0.00 0.31 0.00 0.00 61.69 62.27 1uew s THR 96 Cb -0.12 -3.55 0.02 0.00 0.01 0.00 0.00 72.50 68.86 1uew s THR 96 CO -0.03 0.30 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.23 1uew s LEU 97 N 1.29 2.12 -0.42 4.42 1.43 -0.00 -0.13 118.68 127.39 1uew s LEU 97 Ca 0.09 -0.63 -0.25 0.00 -1.03 0.00 0.00 54.13 52.32 1uew s LEU 97 Cb -0.14 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.63 1uew s LEU 97 CO 0.06 0.04 0.88 -0.60 0.23 0.00 0.00 176.35 176.96 1uew s ARG 98 N 1.07 3.64 0.37 1.70 3.52 -0.79 -2.01 118.95 126.45 1uew s ARG 98 Ca -0.01 0.26 0.08 0.00 -0.13 0.00 0.00 55.73 55.94 1uew s ARG 98 Cb -0.14 -3.87 -0.07 0.00 -1.56 0.00 0.00 34.95 29.31 1uew s ARG 98 CO -0.08 -1.07 -0.02 0.96 -0.81 0.00 0.00 175.30 174.28 1uew s ILE 99 N 3.51 2.23 -0.28 4.11 -5.25 -1.20 -1.06 121.20 123.26 1uew s ILE 99 Ca 0.35 -2.05 -0.11 0.00 -0.99 0.00 0.00 60.65 57.86 1uew s ILE 99 Cb -0.11 -2.83 -0.05 0.00 2.95 0.00 0.00 42.46 42.42 1uew s ILE 99 CO 0.22 -0.11 0.17 -0.63 -1.79 0.00 0.00 174.94 172.80 1uew s ILE 100 N -2.63 5.18 0.49 8.37 1.01 -1.23 -0.40 121.20 131.99 1uew s ILE 100 Ca 0.35 0.12 -0.05 0.00 0.00 0.00 0.00 60.65 61.07 1uew s ILE 100 Cb 0.05 -3.46 0.11 0.00 0.01 0.00 0.00 42.46 39.16 1uew s ILE 100 CO 0.18 0.26 0.67 -0.81 0.00 0.00 0.00 174.94 175.24 1uew n PRO 101 N 5.04 -0.27 -4.14 2.79 -0.04 -1.26 -4.77 135.00 132.35 1uew n PRO 101 Ca -0.14 -1.37 -0.12 0.00 -0.04 0.00 0.00 63.50 61.83 1uew n PRO 101 Cb 0.52 -0.58 -0.08 0.00 -0.04 0.00 0.00 33.50 33.32 1uew n PRO 101 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1uew s GLN 102 N -4.30 1.44 0.00 0.54 0.00 -1.26 -5.00 119.66 111.08 1uew s GLN 102 Ca 0.41 -1.58 0.00 0.00 -0.00 0.00 0.00 55.36 54.19 1uew s GLN 102 Cb -0.02 0.35 0.00 0.00 0.00 0.00 0.00 33.01 33.35 1uew s GLN 102 CO 0.28 -0.54 0.18 -0.85 0.00 0.00 0.00 175.29 174.36 1uew n GLU 103 N -0.37 0.62 0.00 9.60 0.28 -1.26 -4.88 120.64 124.63 1uew n GLU 103 Ca 0.01 -0.18 0.06 0.00 -0.16 0.00 0.00 57.16 56.90 1uew n GLU 103 Cb 0.64 -0.61 -0.03 0.00 1.43 0.00 0.00 31.44 32.87 1uew n GLU 103 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1uew n GLU 104 N -0.14 2.31 -2.10 3.44 0.28 -1.26 -4.99 120.64 118.18 1uew n GLU 104 Ca 0.00 -0.44 -0.40 0.00 -0.16 0.00 0.00 57.16 56.16 1uew n GLU 104 Cb 0.09 -1.13 -0.03 0.00 1.43 0.00 0.00 31.44 31.80 1uew n GLU 104 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1uew s LEU 105 N -2.09 3.34 -0.29 -1.84 2.01 -1.26 -4.89 118.68 113.66 1uew s LEU 105 Ca 0.08 0.47 0.03 0.00 0.01 0.00 0.00 54.13 54.72 1uew s LEU 105 Cb 0.10 -2.78 0.18 0.00 0.01 0.00 0.00 46.19 43.70 1uew s LEU 105 CO 0.39 -2.14 0.51 0.21 1.01 0.00 0.00 176.35 176.32 1uew s ASN 106 N 7.06 -0.74 0.13 2.29 3.84 -1.26 -5.17 114.94 121.09 1uew s ASN 106 Ca 0.66 0.11 -0.20 0.00 0.21 0.00 0.00 52.86 53.64 1uew s ASN 106 Cb -0.14 1.66 0.05 0.00 -0.55 0.00 0.00 41.25 42.27 1uew s ASN 106 CO 0.23 -0.31 0.51 -0.44 -2.79 0.00 0.00 177.10 174.30 1uew s SER 107 N 2.71 -0.41 1.18 -4.21 0.01 -1.26 -5.18 113.70 106.54 1uew s SER 107 Ca 0.12 -0.12 -0.19 0.00 1.31 0.00 0.00 55.95 57.07 1uew s SER 107 Cb -0.12 0.53 0.28 0.00 0.21 0.00 0.00 66.02 66.93 1uew s SER 107 CO -0.26 -0.89 1.16 -2.16 0.41 0.00 0.00 173.24 171.50 1uew s PRO 108 N -3.63 -1.07 -0.30 12.44 0.04 -1.26 -5.02 135.00 136.20 1uew s PRO 108 Ca 0.01 -0.21 0.12 0.00 0.04 0.00 0.00 61.00 60.96 1uew s PRO 108 Cb 0.00 -1.63 0.47 0.00 0.04 0.00 0.00 34.50 33.39 1uew s PRO 108 CO -0.11 -3.58 1.15 0.43 0.04 0.00 0.00 177.00 174.92 1uew n SER 109 N -4.64 3.78 -0.61 6.66 7.64 -1.26 -5.04 113.62 120.15 1uew n SER 109 Ca 0.15 -3.20 0.00 0.00 1.01 0.00 0.00 58.87 56.83 1uew n SER 109 Cb 0.60 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 1uew n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uew n GLY 110 N -0.63 -0.56 3.70 0.23 0.00 -1.26 -4.94 105.19 101.73 1uew n GLY 110 Ca 0.31 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 1uew n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uew n PRO 111 N 0.00 1.90 -3.54 1.61 -0.04 -1.26 -4.97 135.00 128.69 1uew n PRO 111 Ca 0.00 0.68 -0.17 0.00 -0.04 0.00 0.00 63.50 63.97 1uew n PRO 111 Cb 0.00 -2.40 -0.06 0.00 -0.04 0.00 0.00 33.50 30.99 1uew n PRO 111 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1uew s SER 112 N -0.58 -0.66 0.00 3.54 1.04 -1.26 -5.14 113.70 110.64 1uew s SER 112 Ca 0.62 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.88 1uew s SER 112 Cb -0.49 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1uew s SER 112 CO 0.57 -0.55 0.00 -1.20 0.98 0.00 0.00 173.24 173.04 1uew n SER 113 N 1.21 0.00 0.00 7.02 7.64 -1.26 -5.31 113.62 122.92 1uew n SER 113 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 1uew n SER 113 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 1uew n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64