#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uew s SER 2 N 0.00 5.90 -0.77 1.61 0.15 -1.26 -4.94 113.70 114.39 1uew s SER 2 Ca 0.00 1.78 -0.26 0.00 0.70 0.00 0.00 55.95 58.17 1uew s SER 2 Cb 0.00 -2.52 0.04 0.00 -1.71 0.00 0.00 66.02 61.83 1uew s SER 2 CO 0.00 -1.62 1.26 -0.44 1.20 0.00 0.00 173.24 173.64 1uew s SER 3 N 6.33 6.21 0.00 5.45 0.01 -1.26 -4.87 113.70 125.57 1uew s SER 3 Ca 0.87 -0.68 0.00 0.00 1.31 0.00 0.00 55.95 57.46 1uew s SER 3 Cb -0.30 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.39 1uew s SER 3 CO 0.34 -1.73 0.00 0.61 0.41 0.00 0.00 173.24 172.87 1uew n GLY 4 N 5.57 4.69 0.00 3.44 0.00 -1.26 -5.10 105.19 112.53 1uew n GLY 4 Ca 0.06 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1uew n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uew n SER 5 N 0.00 0.00 -4.39 1.61 7.64 -1.26 -5.13 113.62 112.09 1uew n SER 5 Ca 0.00 -0.44 -0.20 0.00 1.01 0.00 0.00 58.87 59.24 1uew n SER 5 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 1uew n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1uew s SER 6 N 0.00 2.85 0.00 6.43 1.04 -1.26 -5.05 113.70 117.71 1uew s SER 6 Ca 0.00 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1uew s SER 6 Cb 0.00 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 65.94 1uew s SER 6 CO 0.00 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.67 1uew n GLY 7 N -0.48 -0.44 0.20 7.32 0.00 -1.26 -5.07 105.19 105.46 1uew n GLY 7 Ca -0.07 0.09 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 1uew n GLY 7 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1uew h SER 8 N 0.00 -0.37 -2.88 1.61 0.87 -2.02 -3.43 113.55 107.34 1uew h SER 8 Ca 0.00 -0.08 -0.67 0.00 -1.23 0.00 0.00 61.79 59.81 1uew h SER 8 Cb 0.00 0.10 -0.09 0.00 -0.44 0.00 0.00 62.40 61.96 1uew h SER 8 CO 0.00 -0.14 -0.53 -0.76 -0.53 0.00 0.00 176.83 174.87 1uew s LEU 9 N -9.86 4.12 0.00 2.23 1.02 -1.26 -5.05 118.68 109.88 1uew s LEU 9 Ca -0.15 0.35 0.00 0.00 0.02 0.00 0.00 54.13 54.35 1uew s LEU 9 Cb 0.04 -2.04 0.00 0.00 0.02 0.00 0.00 46.19 44.21 1uew s LEU 9 CO 0.61 0.38 0.00 1.67 0.02 0.00 0.00 176.35 179.03 1uew n GLN 10 N 1.92 0.00 -4.26 1.70 7.27 -1.26 -5.20 117.38 117.55 1uew n GLN 10 Ca -0.19 0.00 -0.14 0.00 0.07 0.00 0.00 57.00 56.74 1uew n GLN 10 Cb 0.54 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 33.09 1uew n GLN 10 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1uew s THR 11 N 1.51 0.38 0.16 1.69 -4.23 -1.26 -4.70 115.64 109.18 1uew s THR 11 Ca 0.00 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 1uew s THR 11 Cb 0.00 -2.51 -0.05 0.00 1.34 0.00 0.00 72.50 71.28 1uew s THR 11 CO 0.00 -0.07 -0.00 -0.44 -0.54 0.00 0.00 174.62 173.56 1uew s SER 12 N -3.24 1.16 -0.35 3.99 0.01 -0.53 -4.97 113.70 109.77 1uew s SER 12 Ca 0.36 -1.15 -0.00 0.00 1.31 0.00 0.00 55.95 56.47 1uew s SER 12 Cb 0.07 0.12 0.12 0.00 0.21 0.00 0.00 66.02 66.55 1uew s SER 12 CO 0.12 -0.56 0.17 1.51 0.41 0.00 0.00 173.24 174.88 1uew s ASP 13 N -3.15 3.60 -0.42 2.44 -4.77 -1.26 -1.13 116.67 111.98 1uew s ASP 13 Ca 0.22 -1.99 -0.17 0.00 -3.30 0.00 0.00 52.55 47.31 1uew s ASP 13 Cb 0.06 -0.72 0.02 0.00 -1.09 0.00 0.00 42.92 41.19 1uew s ASP 13 CO 0.03 -0.35 0.44 -0.69 0.70 0.00 0.00 175.17 175.29 1uew s VAL 14 N 1.21 5.09 0.20 2.11 1.01 -0.20 -4.88 120.40 124.95 1uew s VAL 14 Ca 0.14 -0.39 -0.24 0.00 0.00 0.00 0.00 61.98 61.49 1uew s VAL 14 Cb -0.20 -4.05 -0.08 0.00 0.00 0.00 0.00 36.38 32.05 1uew s VAL 14 CO -0.14 -0.44 0.78 -0.69 0.00 0.00 0.00 175.10 174.62 1uew s VAL 15 N 2.12 4.41 0.03 2.92 1.01 -1.26 -0.81 120.40 128.81 1uew s VAL 15 Ca 0.12 1.59 0.01 0.00 0.00 0.00 0.00 61.98 63.69 1uew s VAL 15 Cb -0.17 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.15 1uew s VAL 15 CO 0.13 0.38 -0.05 -0.63 0.00 0.00 0.00 175.10 174.93 1uew s ILE 16 N -1.32 0.30 0.12 2.22 1.01 -0.12 -4.99 121.20 118.42 1uew s ILE 16 Ca 0.40 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 60.13 1uew s ILE 16 Cb -0.21 -0.41 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 1uew s ILE 16 CO 0.24 -0.44 -0.12 -1.00 0.00 0.00 0.00 174.94 173.63 1uew s HIS 17 N -1.40 1.28 0.24 3.97 3.76 -1.26 -0.86 115.29 121.03 1uew s HIS 17 Ca -0.13 -0.63 0.03 0.00 -0.15 0.00 0.00 55.06 54.18 1uew s HIS 17 Cb -0.10 -0.67 -0.01 0.00 1.11 0.00 0.00 32.58 32.91 1uew s HIS 17 CO -0.00 0.10 0.25 2.89 -0.85 0.00 0.00 174.74 177.13 1uew n ARG 18 N 0.32 0.37 -3.84 1.40 1.85 -0.56 -4.76 116.66 111.43 1uew n ARG 18 Ca -0.14 -2.22 -0.21 0.00 -1.00 0.00 0.00 57.85 54.28 1uew n ARG 18 Cb 0.58 1.93 -0.03 0.00 -1.05 0.00 0.00 32.46 33.89 1uew n ARG 18 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1uew s LYS 19 N -2.82 2.91 0.51 2.89 3.01 -1.26 -4.84 119.74 120.15 1uew s LYS 19 Ca 0.25 -1.13 0.32 0.00 -1.01 0.00 0.00 55.97 54.40 1uew s LYS 19 Cb 0.01 -2.60 1.29 0.00 -1.01 0.00 0.00 37.83 35.52 1uew s LYS 19 CO 0.18 0.20 1.94 0.93 0.51 0.00 0.00 175.35 179.11 1uew h GLU 20 N 1.24 0.00 -0.22 1.68 5.08 -2.00 -2.71 114.58 117.65 1uew h GLU 20 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1uew h GLU 20 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1uew h GLU 20 CO 0.58 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.68 1uew n ASN 21 N -2.98 1.83 -3.56 1.42 3.02 -1.26 -4.96 115.26 108.76 1uew n ASN 21 Ca 0.01 -1.78 -0.17 0.00 -0.03 0.00 0.00 54.58 52.61 1uew n ASN 21 Cb 0.30 -0.14 -0.08 0.00 -0.61 0.00 0.00 39.78 39.25 1uew n ASN 21 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1uew s GLU 22 N -1.71 1.63 0.43 3.52 -1.05 -1.02 -5.17 118.70 115.32 1uew s GLU 22 Ca 0.31 -1.89 0.07 0.00 -0.15 0.00 0.00 54.97 53.32 1uew s GLU 22 Cb 0.17 0.33 -0.03 0.00 -0.44 0.00 0.00 34.13 34.16 1uew s GLU 22 CO 0.25 -0.60 0.32 0.20 0.95 0.00 0.00 175.26 176.37 1uew s GLY 23 N -3.30 2.23 1.01 -3.83 0.00 -1.26 -4.71 107.32 97.45 1uew s GLY 23 Ca 0.39 -1.91 -0.13 0.00 0.00 0.00 0.00 44.72 43.06 1uew s GLY 23 CO 0.23 -1.79 1.11 -1.36 0.00 0.00 0.00 173.10 171.29 1uew s PHE 24 N -2.54 1.99 -0.45 1.90 0.08 -1.26 -4.77 117.98 112.93 1uew s PHE 24 Ca 0.45 0.86 0.09 0.00 0.12 0.00 0.00 56.93 58.44 1uew s PHE 24 Cb -0.01 -3.35 0.39 0.00 -0.57 0.00 0.00 43.02 39.48 1uew s PHE 24 CO 0.26 -2.90 0.95 0.41 -0.10 0.00 0.00 175.22 173.83 1uew n GLY 25 N -1.44 4.55 3.24 4.36 0.00 -1.26 -4.99 105.19 109.65 1uew n GLY 25 Ca 0.07 -2.28 -0.15 0.00 0.00 0.00 0.00 46.02 43.66 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 -3.20 1.26 -0.04 1.61 -0.71 -1.26 -0.69 117.98 114.95 1uew s PHE 26 Ca 0.43 -0.71 0.00 0.00 -1.04 0.00 0.00 56.93 55.61 1uew s PHE 26 Cb 0.36 -0.65 0.03 0.00 -1.21 0.00 0.00 43.02 41.55 1uew s PHE 26 CO -0.11 0.09 -0.01 0.08 -1.34 0.00 0.00 175.22 173.93 1uew s VAL 27 N -3.03 0.26 0.24 -2.49 1.01 0.25 -4.94 120.40 111.70 1uew s VAL 27 Ca 0.14 0.07 -0.16 0.00 0.00 0.00 0.00 61.98 62.03 1uew s VAL 27 Cb 0.01 -0.36 -0.08 0.00 0.00 0.00 0.00 36.38 35.95 1uew s VAL 27 CO 0.01 0.18 0.68 -0.63 0.00 0.00 0.00 175.10 175.34 1uew s ILE 28 N 1.20 4.69 0.28 2.22 1.09 -1.26 -0.16 121.20 129.26 1uew s ILE 28 Ca -0.07 1.02 0.02 0.00 -1.10 0.00 0.00 60.65 60.51 1uew s ILE 28 Cb -0.13 -3.74 -0.05 0.00 -1.06 0.00 0.00 42.46 37.48 1uew s ILE 28 CO -0.02 0.07 0.10 0.27 -0.10 0.00 0.00 174.94 175.26 1uew s ILE 29 N -1.68 0.61 0.28 2.92 -4.36 0.15 -4.67 121.20 114.45 1uew s ILE 29 Ca 0.46 -2.00 0.05 0.00 -0.26 0.00 0.00 60.65 58.90 1uew s ILE 29 Cb -0.14 -2.63 -0.02 0.00 1.25 0.00 0.00 42.46 40.92 1uew s ILE 29 CO 0.20 0.00 0.19 -0.24 0.24 0.00 0.00 174.94 175.33 1uew n SER 30 N -0.57 -0.08 -3.32 4.36 2.88 -1.26 -1.27 113.62 114.36 1uew n SER 30 Ca -0.00 -2.74 -0.10 0.00 -1.33 0.00 0.00 58.87 54.69 1uew n SER 30 Cb 0.66 1.19 -0.06 0.00 -0.75 0.00 0.00 64.21 65.24 1uew n SER 30 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1uew s SER 31 N -2.89 0.58 -0.29 -3.46 0.15 -1.26 -5.04 113.70 101.48 1uew s SER 31 Ca 0.27 -0.51 -0.00 0.00 0.70 0.00 0.00 55.95 56.41 1uew s SER 31 Cb 0.01 1.01 0.19 0.00 -1.71 0.00 0.00 66.02 65.52 1uew s SER 31 CO 0.19 -0.35 0.72 -0.22 1.20 0.00 0.00 173.24 174.78 1uew s LEU 32 N 2.45 -1.25 0.01 3.45 2.96 -1.26 -4.87 118.68 120.16 1uew s LEU 32 Ca 0.10 0.34 -0.07 0.00 -0.22 0.00 0.00 54.13 54.27 1uew s LEU 32 Cb -0.13 1.87 -0.04 0.00 0.50 0.00 0.00 46.19 48.40 1uew s LEU 32 CO -0.29 -0.23 0.87 0.78 -1.32 0.00 0.00 176.35 176.16 1uew h ASN 33 N 7.87 -0.22 -5.01 3.68 2.35 -2.04 -3.49 115.58 118.71 1uew h ASN 33 Ca -0.09 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 1uew h ASN 33 Cb 1.18 0.06 -0.14 0.00 0.05 0.00 0.00 38.32 39.46 1uew h ASN 33 CO 0.11 -0.13 0.15 0.00 -1.65 0.00 0.00 177.43 175.91 1uew s ARG 34 N -3.12 1.17 1.18 0.81 1.70 -1.26 -5.17 118.95 114.26 1uew s ARG 34 Ca -0.04 -0.31 -0.18 0.00 -0.47 0.00 0.00 55.73 54.74 1uew s ARG 34 Cb 0.00 0.54 0.28 0.00 -0.57 0.00 0.00 34.95 35.20 1uew s ARG 34 CO 0.12 -0.47 1.08 -1.25 -1.08 0.00 0.00 175.30 173.70 1uew s PRO 35 N -3.01 -1.07 0.00 3.89 0.04 -1.26 -5.04 135.00 128.54 1uew s PRO 35 Ca -0.02 0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.14 1uew s PRO 35 Cb -0.00 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 32.94 1uew s PRO 35 CO -0.06 -3.65 0.00 -1.91 0.04 0.00 0.00 177.00 171.41 1uew n GLU 36 N -4.75 0.00 -2.89 4.56 0.00 -1.26 -5.04 120.64 111.26 1uew n GLU 36 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.83 1uew n GLU 36 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 31.99 1uew n GLU 36 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1uew s SER 37 N -0.06 6.17 0.54 4.31 0.01 -1.26 -4.96 113.70 118.46 1uew s SER 37 Ca 0.00 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.21 1uew s SER 37 Cb 0.00 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.83 1uew s SER 37 CO 0.00 -1.40 0.00 0.61 0.41 0.00 0.00 173.24 172.86 1uew n GLY 38 N 5.32 1.91 2.91 3.44 0.00 -1.26 -3.53 105.19 113.98 1uew n GLY 38 Ca -0.05 0.50 -0.30 0.00 0.00 0.00 0.00 46.02 46.17 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 -4.00 4.31 0.60 1.61 0.01 -1.26 -4.94 113.70 110.03 1uew s SER 39 Ca 0.00 -1.73 -0.16 0.00 1.31 0.00 0.00 55.95 55.37 1uew s SER 39 Cb 0.00 -1.28 -0.03 0.00 0.21 0.00 0.00 66.02 64.92 1uew s SER 39 CO 0.00 -0.35 1.07 0.42 0.41 0.00 0.00 173.24 174.79 1uew s THR 40 N 1.25 3.71 -0.28 1.44 -4.23 -1.23 -4.98 115.64 111.32 1uew s THR 40 Ca 0.06 0.82 -0.29 0.00 -1.18 0.00 0.00 61.69 61.10 1uew s THR 40 Cb -0.18 -3.34 -0.02 0.00 1.34 0.00 0.00 72.50 70.29 1uew s THR 40 CO -0.13 -0.47 1.71 -0.63 -0.54 0.00 0.00 174.62 174.56 1uew s ILE 41 N -2.41 3.57 0.33 2.99 1.01 -1.26 -4.93 121.20 120.49 1uew s ILE 41 Ca 0.64 0.61 -0.15 0.00 0.00 0.00 0.00 60.65 61.75 1uew s ILE 41 Cb -0.17 -3.68 0.03 0.00 0.01 0.00 0.00 42.46 38.65 1uew s ILE 41 CO 0.37 -0.37 0.68 0.28 0.00 0.00 0.00 174.94 175.90 1uew s THR 42 N 6.09 0.00 -0.01 2.92 -1.32 -1.26 -5.17 115.64 116.89 1uew s THR 42 Ca 0.76 -1.15 0.05 0.00 -1.21 0.00 0.00 61.69 60.15 1uew s THR 42 Cb -0.24 -2.49 -0.01 0.00 -1.51 0.00 0.00 72.50 68.25 1uew s THR 42 CO 0.32 0.00 -0.17 0.54 -2.21 0.00 0.00 174.62 173.10 1uew s VAL 43 N -3.14 1.34 0.00 5.08 0.11 -1.26 -5.09 120.40 117.44 1uew s VAL 43 Ca 0.17 -0.74 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1uew s VAL 43 Cb -0.04 -1.12 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 1uew s VAL 43 CO 0.11 0.37 0.08 -0.81 -3.33 0.00 0.00 175.10 171.52 1uew n PRO 44 N 2.63 0.00 -1.91 1.54 -0.04 -1.26 -4.61 135.00 131.36 1uew n PRO 44 Ca -0.15 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.89 1uew n PRO 44 Cb 0.54 -0.57 -0.03 0.00 -0.04 0.00 0.00 33.50 33.41 1uew n PRO 44 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1uew s HIS 45 N -0.17 1.73 0.06 0.54 3.76 -1.26 -4.10 115.29 115.85 1uew s HIS 45 Ca 0.00 0.24 0.02 0.00 -0.15 0.00 0.00 55.06 55.17 1uew s HIS 45 Cb 0.00 -4.02 -0.03 0.00 1.11 0.00 0.00 32.58 29.64 1uew s HIS 45 CO 0.00 -3.92 -0.08 -1.59 -0.85 0.00 0.00 174.74 168.30 1uew s LYS 46 N 4.77 0.61 -0.07 1.40 -2.85 -0.40 -1.47 119.74 121.74 1uew s LYS 46 Ca 0.81 -0.88 -0.29 0.00 -1.00 0.00 0.00 55.97 54.60 1uew s LYS 46 Cb -0.32 -0.33 -0.07 0.00 -2.06 0.00 0.00 37.83 35.05 1uew s LYS 46 CO 0.33 0.05 2.08 0.42 0.10 0.00 0.00 175.35 178.33 1uew s ILE 47 N -1.78 3.01 -0.12 3.79 -1.09 -0.11 -0.68 121.20 124.22 1uew s ILE 47 Ca -0.05 0.01 -0.06 0.00 -2.23 0.00 0.00 60.65 58.32 1uew s ILE 47 Cb -0.07 -3.01 -0.26 0.00 -1.58 0.00 0.00 42.46 37.54 1uew s ILE 47 CO -0.00 -0.00 0.38 0.61 -1.23 0.00 0.00 174.94 174.69 1uew n GLY 48 N 5.05 -0.58 3.28 6.18 0.00 0.78 -3.31 105.19 116.59 1uew n GLY 48 Ca 0.24 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.56 0.99 -0.02 1.61 3.52 -1.17 -4.93 118.95 116.39 1uew s ARG 49 Ca -0.22 -0.95 0.03 0.00 -0.13 0.00 0.00 55.73 54.46 1uew s ARG 49 Cb 0.07 0.39 0.00 0.00 -1.56 0.00 0.00 34.95 33.84 1uew s ARG 49 CO 0.77 -0.35 -0.10 0.42 -0.81 0.00 0.00 175.30 175.23 1uew s ILE 50 N -3.87 0.81 0.06 4.11 1.01 -1.26 -0.58 121.20 121.48 1uew s ILE 50 Ca 0.08 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.04 1uew s ILE 50 Cb 0.04 -0.71 -0.05 0.00 0.01 0.00 0.00 42.46 41.75 1uew s ILE 50 CO -0.08 0.25 0.98 -0.63 0.00 0.00 0.00 174.94 175.45 1uew s ILE 51 N 0.09 4.64 0.22 2.92 1.09 0.14 -4.97 121.20 125.34 1uew s ILE 51 Ca -0.02 2.05 -0.32 0.00 -1.10 0.00 0.00 60.65 61.26 1uew s ILE 51 Cb -0.08 -4.31 -0.13 0.00 -1.06 0.00 0.00 42.46 36.88 1uew s ILE 51 CO 0.00 0.24 1.50 0.47 -0.10 0.00 0.00 174.94 177.06 1uew n ASP 52 N 3.28 3.07 0.00 3.58 8.00 -1.26 -2.81 116.55 130.42 1uew n ASP 52 Ca 0.04 1.12 0.00 0.00 0.71 0.00 0.00 54.79 56.66 1uew n ASP 52 Cb 0.50 -1.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 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 2.59 1.78 3.73 0.44 0.00 -1.26 -5.02 105.19 107.45 1uew n GLY 53 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1uew n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uew s SER 54 N -3.24 3.34 0.29 1.61 1.04 -1.12 -4.80 113.70 110.83 1uew s SER 54 Ca 0.00 1.29 0.03 0.00 0.48 0.00 0.00 55.95 57.75 1uew s SER 54 Cb 0.00 -1.96 0.60 0.00 0.10 0.00 0.00 66.02 64.76 1uew s SER 54 CO 0.00 -2.69 1.83 1.55 0.98 0.00 0.00 173.24 174.91 1uew h PRO 55 N -1.59 0.91 0.56 4.02 0.13 -1.86 -0.68 132.00 133.49 1uew h PRO 55 Ca -0.51 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 64.54 1uew h PRO 55 Cb 1.30 -0.21 0.01 0.00 0.13 0.00 0.00 31.00 32.23 1uew h PRO 55 CO 0.57 0.61 -0.27 0.00 -0.23 0.00 0.00 178.00 178.68 1uew h ALA 56 N 1.56 -0.75 -0.34 -0.56 0.00 -1.88 -0.28 119.26 117.02 1uew h ALA 56 Ca 0.51 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.32 1uew h ALA 56 Cb 0.56 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1uew h ALA 56 CO -0.28 -0.89 0.24 0.22 0.00 0.00 0.00 179.25 178.54 1uew h ASP 57 N -0.80 0.08 0.86 0.00 3.58 -1.72 -1.96 116.42 116.46 1uew h ASP 57 Ca -0.08 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.15 1uew h ASP 57 Cb 0.60 -0.02 -0.04 0.00 1.72 0.00 0.00 39.33 41.60 1uew h ASP 57 CO 0.13 0.05 -1.21 0.03 -2.88 0.00 0.00 179.24 175.35 1uew h ARG 58 N 0.09 0.00 0.00 0.28 3.08 -0.91 -3.34 114.38 113.58 1uew h ARG 58 Ca 0.16 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.13 1uew h ARG 58 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1uew h ARG 58 CO -0.02 0.74 -0.36 0.00 -1.07 0.00 0.00 179.97 179.26 1uew n ALA 60 N -2.37 0.00 -0.78 0.00 0.00 -1.12 -4.87 120.51 111.38 1uew n ALA 60 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1uew n ALA 60 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.06 -1.02 -3.45 0.00 5.02 -1.26 -4.90 118.16 112.49 1uew n LYS 61 Ca 0.00 0.25 -0.16 0.00 -2.02 0.00 0.00 58.31 56.38 1uew n LYS 61 Cb 0.00 -4.68 -0.11 0.00 -0.02 0.00 0.00 35.03 30.22 1uew n LYS 61 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1uew s LEU 62 N 0.00 -0.22 0.28 -0.35 2.96 -1.26 -4.84 118.68 115.25 1uew s LEU 62 Ca 0.00 -0.22 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 1uew s LEU 62 Cb 0.00 0.54 -0.05 0.00 0.50 0.00 0.00 46.19 47.18 1uew s LEU 62 CO 0.00 -0.33 0.11 -0.54 -1.32 0.00 0.00 176.35 174.26 1uew s LYS 63 N 2.37 1.49 -0.66 1.98 1.02 -1.26 -4.87 119.74 119.80 1uew s LYS 63 Ca 0.08 -1.82 -0.27 0.00 0.02 0.00 0.00 55.97 53.98 1uew s LYS 63 Cb -0.15 -0.30 0.01 0.00 -0.52 0.00 0.00 37.83 36.87 1uew s LYS 63 CO -0.16 -0.32 1.46 0.08 -0.92 0.00 0.00 175.35 175.49 1uew s VAL 64 N -3.67 3.64 0.00 3.17 1.01 -1.26 -1.67 120.40 121.62 1uew s VAL 64 Ca 0.37 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.77 1uew s VAL 64 Cb 0.07 -4.55 0.00 0.00 0.00 0.00 0.00 36.38 31.90 1uew s VAL 64 CO 0.15 -1.44 0.00 0.61 0.00 0.00 0.00 175.10 174.41 1uew n GLY 65 N 5.43 0.66 3.60 4.51 0.00 -1.21 -5.05 105.19 113.14 1uew n GLY 65 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.04 6.35 0.89 1.61 1.01 -0.67 -4.82 116.67 121.00 1uew s ASP 66 Ca 0.00 0.91 -0.11 0.00 0.71 0.00 0.00 52.55 54.06 1uew s ASP 66 Cb 0.00 -2.54 0.13 0.00 1.01 0.00 0.00 42.92 41.52 1uew s ASP 66 CO 0.00 -1.40 1.16 0.54 0.21 0.00 0.00 175.17 175.68 1uew n ARG 67 N 8.00 -0.26 -4.40 8.23 5.12 -1.26 -0.93 116.66 131.15 1uew n ARG 67 Ca 0.17 -0.00 -0.22 0.00 -1.93 0.00 0.00 57.85 55.87 1uew n ARG 67 Cb 0.48 -2.39 -0.16 0.00 -1.16 0.00 0.00 32.46 29.22 1uew n ARG 67 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1uew s ILE 68 N -2.47 0.84 -0.16 0.55 1.01 -0.54 -3.81 121.20 116.61 1uew s ILE 68 Ca 0.69 -0.34 -0.23 0.00 0.00 0.00 0.00 60.65 60.77 1uew s ILE 68 Cb -0.25 -0.78 -0.20 0.00 0.01 0.00 0.00 42.46 41.24 1uew s ILE 68 CO 0.56 0.28 0.44 -0.07 0.00 0.00 0.00 174.94 176.15 1uew h LEU 69 N 6.80 0.00 -8.17 2.97 3.38 -1.32 -3.42 115.31 115.55 1uew h LEU 69 Ca -0.34 -0.68 -0.06 0.00 0.09 0.00 0.00 57.88 56.89 1uew h LEU 69 Cb 1.17 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 1uew h LEU 69 CO 0.48 1.15 -0.13 0.00 0.09 0.00 0.00 178.44 180.03 1uew s ALA 70 N -2.33 -0.28 -0.13 1.53 0.00 -1.24 -4.07 121.76 115.24 1uew s ALA 70 Ca -0.21 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 1uew s ALA 70 Cb 0.01 1.03 0.03 0.00 0.00 0.00 0.00 23.12 24.19 1uew s ALA 70 CO 0.58 -0.83 -0.06 0.08 0.00 0.00 0.00 175.76 175.54 1uew s VAL 71 N -4.00 0.96 -1.06 0.00 1.01 0.31 -3.61 120.40 114.01 1uew s VAL 71 Ca 0.21 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.59 1uew s VAL 71 Cb -0.00 -1.06 0.03 0.00 0.00 0.00 0.00 36.38 35.35 1uew s VAL 71 CO 0.07 0.26 0.63 0.59 0.00 0.00 0.00 175.10 176.65 1uew n ASN 72 N 4.95 -4.16 0.00 3.32 3.02 -0.99 -0.75 115.26 120.65 1uew n ASN 72 Ca -0.12 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.26 1uew n ASN 72 Cb 0.49 -1.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.13 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 -1.93 0.43 3.64 7.41 0.00 -1.26 -4.97 105.19 108.50 1uew n GLY 73 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.63 2.31 0.39 1.61 -1.52 0.07 -5.08 119.66 116.80 1uew s GLN 74 Ca 0.00 -1.13 -0.26 0.00 -1.95 0.00 0.00 55.36 52.02 1uew s GLN 74 Cb 0.00 -2.31 -0.09 0.00 -0.22 0.00 0.00 33.01 30.39 1uew s GLN 74 CO 0.00 0.46 1.30 -1.54 -0.25 0.00 0.00 175.29 175.26 1uew s SER 75 N -2.83 6.38 0.00 5.90 1.04 -1.26 -0.53 113.70 122.39 1uew s SER 75 Ca 0.26 2.66 0.00 0.00 0.48 0.00 0.00 55.95 59.35 1uew s SER 75 Cb -0.09 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1uew s SER 75 CO 0.17 -0.80 0.11 2.30 0.98 0.00 0.00 173.24 176.00 1uew n ILE 76 N 0.22 0.00 0.22 -1.02 -5.35 -1.26 -4.38 119.36 107.80 1uew n ILE 76 Ca 0.03 -0.25 0.11 0.00 -0.27 0.00 0.00 62.75 62.37 1uew n ILE 76 Cb 0.43 1.21 0.41 0.00 -1.74 0.00 0.00 39.64 39.95 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 0.21 0.38 0.00 7.28 2.04 -1.92 -3.40 117.51 122.10 1uew h ILE 77 Ca 0.00 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1uew h ILE 77 Cb 0.10 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 1uew h ILE 77 CO 0.00 0.17 -0.76 0.59 0.00 0.00 0.00 178.15 178.15 1uew n ASN 78 N -3.26 2.19 -4.66 1.72 3.02 -1.26 -5.02 115.26 107.99 1uew n ASN 78 Ca 0.01 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.19 1uew n ASN 78 Cb 0.46 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.70 1uew n ASN 78 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1uew n MET 79 N -2.43 0.82 -2.24 3.52 2.81 -1.26 -4.98 117.12 113.36 1uew n MET 79 Ca 0.00 0.33 -0.36 0.00 -1.81 0.00 0.00 57.70 55.87 1uew n MET 79 Cb 0.38 -2.32 0.00 0.00 -0.71 0.00 0.00 33.22 30.58 1uew n MET 79 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1uew s PRO 80 N -3.19 3.43 0.25 0.03 0.04 -1.26 -4.88 135.00 129.42 1uew s PRO 80 Ca 0.78 1.67 -0.03 0.00 0.04 0.00 0.00 61.00 63.46 1uew s PRO 80 Cb -0.38 -2.10 0.42 0.00 0.04 0.00 0.00 34.50 32.48 1uew s PRO 80 CO 0.45 -0.80 1.83 1.25 0.04 0.00 0.00 177.00 179.78 1uew h HIS 81 N 1.40 0.98 -0.00 0.56 2.76 -1.94 -0.26 115.15 118.64 1uew h HIS 81 Ca -0.50 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 57.68 1uew h HIS 81 Cb 1.26 -0.31 -0.00 0.00 1.55 0.00 0.00 27.41 29.91 1uew h HIS 81 CO 0.51 0.43 -0.09 0.00 -1.30 0.00 0.00 177.93 177.48 1uew h ALA 82 N 1.46 1.84 0.05 5.26 0.00 -1.99 -0.04 119.26 125.84 1uew h ALA 82 Ca 0.42 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1uew h ALA 82 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1uew h ALA 82 CO -0.23 0.12 -0.02 0.22 0.00 0.00 0.00 179.25 179.34 1uew h ASP 83 N 0.00 -0.05 -0.99 0.00 1.82 -1.41 -1.71 116.42 114.07 1uew h ASP 83 Ca -0.00 -0.48 0.01 0.00 -0.39 0.00 0.00 57.03 56.17 1uew h ASP 83 Cb 0.17 0.01 -0.05 0.00 0.68 0.00 0.00 39.33 40.14 1uew h ASP 83 CO 0.01 0.47 0.65 0.40 -1.61 0.00 0.00 179.24 179.16 1uew h ILE 84 N -0.60 1.26 -0.27 2.25 2.04 -1.34 0.19 117.51 121.04 1uew h ILE 84 Ca -0.01 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1uew h ILE 84 Cb 0.53 -0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1uew h ILE 84 CO 0.01 0.25 0.17 0.58 0.00 0.00 0.00 178.15 179.16 1uew h VAL 85 N 1.35 1.09 -0.51 1.67 2.07 -1.02 -2.39 116.25 118.50 1uew h VAL 85 Ca 0.36 -0.19 -0.07 0.00 0.82 0.00 0.00 66.70 67.62 1uew h VAL 85 Cb -0.14 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1uew h VAL 85 CO -0.08 0.08 0.05 0.50 0.02 0.00 0.00 177.57 178.15 1uew h LYS 86 N 0.35 0.87 -0.79 1.57 3.64 -0.56 -1.99 116.57 119.66 1uew h LYS 86 Ca 0.10 -0.25 0.18 0.00 -1.27 0.00 0.00 60.65 59.41 1uew h LYS 86 Cb -0.01 -0.09 -0.12 0.00 -0.41 0.00 0.00 32.23 31.60 1uew h LYS 86 CO -0.02 0.88 0.24 -0.07 -2.27 0.00 0.00 179.45 178.20 1uew h LEU 87 N 0.75 0.09 -0.08 5.20 -0.00 -0.44 0.26 115.31 121.08 1uew h LEU 87 Ca 0.15 0.15 -0.13 0.00 -0.00 0.00 0.00 57.88 58.05 1uew h LEU 87 Cb 0.45 0.19 0.01 0.00 -0.00 0.00 0.00 40.66 41.31 1uew h LEU 87 CO 0.02 -0.04 -0.47 0.40 -0.00 0.00 0.00 178.44 178.35 1uew h ILE 88 N 0.30 1.39 -0.93 1.22 2.04 -1.22 -2.31 117.51 118.00 1uew h ILE 88 Ca 0.47 -1.84 0.03 0.00 1.00 0.00 0.00 64.86 64.52 1uew h ILE 88 Cb 0.83 2.30 -0.05 0.00 -0.74 0.00 0.00 36.82 39.15 1uew h ILE 88 CO -0.53 0.54 0.61 0.50 0.00 0.00 0.00 178.15 179.27 1uew h LYS 89 N 0.01 1.14 -0.01 2.37 3.64 -0.39 -2.02 116.57 121.32 1uew h LYS 89 Ca -0.04 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1uew h LYS 89 Cb 1.13 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1uew h LYS 89 CO 0.10 0.75 -0.06 -0.25 -2.27 0.00 0.00 179.45 177.72 1uew n ASP 90 N -4.44 0.73 0.12 4.20 8.00 0.76 -4.66 116.55 121.26 1uew n ASP 90 Ca 0.12 -0.99 0.07 0.00 0.71 0.00 0.00 54.79 54.70 1uew n ASP 90 Cb 0.09 -0.02 0.37 0.00 -0.02 0.00 0.00 41.12 41.55 1uew n ASP 90 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1uew n ALA 91 N -0.59 0.91 -1.78 2.24 0.00 -0.76 -4.79 120.51 115.74 1uew n ALA 91 Ca 0.18 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1uew n ALA 91 Cb 0.27 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1uew n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uew n GLY 92 N -1.33 0.75 4.68 0.00 0.00 -1.26 -4.05 105.19 103.97 1uew n GLY 92 Ca -0.01 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.56 0.00 -4.85 0.99 4.77 -1.26 -4.91 117.00 111.18 1uew n LEU 93 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.62 1uew n LEU 93 Cb 0.39 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 1uew n LEU 93 CO 0.00 0.00 0.10 -0.44 -1.33 0.00 0.00 177.39 175.72 1uew s SER 94 N 0.00 6.72 -0.07 -1.43 0.01 -1.26 -1.49 113.70 116.18 1uew s SER 94 Ca 0.00 0.88 -0.05 0.00 1.31 0.00 0.00 55.95 58.09 1uew s SER 94 Cb 0.00 -2.21 0.03 0.00 0.21 0.00 0.00 66.02 64.04 1uew s SER 94 CO 0.00 0.22 0.18 0.54 0.41 0.00 0.00 173.24 174.59 1uew s VAL 95 N -1.29 -0.02 -0.32 3.43 0.11 -0.04 -4.73 120.40 117.54 1uew s VAL 95 Ca 0.30 0.07 0.00 0.00 -2.93 0.00 0.00 61.98 59.42 1uew s VAL 95 Cb -0.15 -0.27 0.07 0.00 -1.53 0.00 0.00 36.38 34.50 1uew s VAL 95 CO 0.16 0.03 0.02 -0.89 -3.33 0.00 0.00 175.10 171.09 1uew s THR 96 N 0.55 2.74 -0.43 5.04 2.01 -1.26 -0.95 115.64 123.33 1uew s THR 96 Ca -0.04 -1.74 -0.21 0.00 0.31 0.00 0.00 61.69 60.01 1uew s THR 96 Cb -0.05 -2.72 0.02 0.00 0.01 0.00 0.00 72.50 69.76 1uew s THR 96 CO -0.03 -0.29 0.67 -0.76 -0.69 0.00 0.00 174.62 173.52 1uew s LEU 97 N 1.13 4.43 -0.22 4.42 1.43 0.01 -2.35 118.68 127.52 1uew s LEU 97 Ca -0.01 -0.25 -0.29 0.00 -1.03 0.00 0.00 54.13 52.56 1uew s LEU 97 Cb -0.20 -2.78 0.00 0.00 0.03 0.00 0.00 46.19 43.24 1uew s LEU 97 CO -0.04 -0.79 1.10 -0.60 0.23 0.00 0.00 176.35 176.26 1uew s ARG 98 N 2.90 4.23 0.44 1.70 3.52 -1.24 -1.03 118.95 129.48 1uew s ARG 98 Ca 0.24 1.41 0.06 0.00 -0.13 0.00 0.00 55.73 57.31 1uew s ARG 98 Cb -0.14 -3.68 -0.05 0.00 -1.56 0.00 0.00 34.95 29.52 1uew s ARG 98 CO 0.19 -0.68 0.07 0.96 -0.81 0.00 0.00 175.30 175.04 1uew s ILE 99 N 3.33 1.85 0.00 4.11 -5.25 -0.29 -0.88 121.20 124.06 1uew s ILE 99 Ca 0.47 -1.90 0.00 0.00 -0.99 0.00 0.00 60.65 58.23 1uew s ILE 99 Cb -0.17 -2.74 0.00 0.00 2.95 0.00 0.00 42.46 42.50 1uew s ILE 99 CO 0.09 0.00 0.00 -0.38 -1.79 0.00 0.00 174.94 172.86 1uew n ILE 100 N -1.15 0.00 -2.32 8.37 5.41 -1.25 -1.45 119.36 126.97 1uew n ILE 100 Ca -0.07 0.34 -0.42 0.00 1.00 0.00 0.00 62.75 63.60 1uew n ILE 100 Cb 0.66 -1.33 -0.03 0.00 -0.71 0.00 0.00 39.64 38.24 1uew n ILE 100 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1uew s PRO 101 N -0.92 3.34 0.48 0.38 0.04 -1.26 -4.39 135.00 132.67 1uew s PRO 101 Ca 0.00 0.71 -0.18 0.00 0.04 0.00 0.00 61.00 61.58 1uew s PRO 101 Cb 0.00 -4.12 -0.09 0.00 0.04 0.00 0.00 34.50 30.33 1uew s PRO 101 CO 0.00 -1.87 0.96 -0.65 0.04 0.00 0.00 177.00 175.48 1uew s GLN 102 N 5.45 4.04 0.00 4.56 -0.21 -1.26 -4.83 119.66 127.40 1uew s GLN 102 Ca 0.59 0.98 0.29 0.00 0.02 0.00 0.00 55.36 57.24 1uew s GLN 102 Cb -0.13 -2.17 1.30 0.00 1.00 0.00 0.00 33.01 33.01 1uew s GLN 102 CO 0.28 -0.17 1.89 -0.85 -2.12 0.00 0.00 175.29 174.33 1uew n GLU 103 N -1.21 1.14 -0.01 2.91 0.28 -1.26 -4.07 120.64 118.42 1uew n GLU 103 Ca 0.06 -0.46 0.00 0.00 -0.16 0.00 0.00 57.16 56.60 1uew n GLU 103 Cb 0.54 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.92 1uew n GLU 103 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1uew n GLU 104 N -0.53 1.01 -3.54 3.44 -0.58 -1.26 -4.91 120.64 114.28 1uew n GLU 104 Ca 0.18 -0.86 -0.28 0.00 -0.42 0.00 0.00 57.16 55.78 1uew n GLU 104 Cb 0.27 -0.68 -0.12 0.00 -0.57 0.00 0.00 31.44 30.35 1uew n GLU 104 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1uew s LEU 105 N -0.36 1.83 0.97 -4.62 1.43 -1.26 -5.13 118.68 111.54 1uew s LEU 105 Ca 0.00 -2.70 -0.11 0.00 -1.03 0.00 0.00 54.13 50.30 1uew s LEU 105 Cb 0.00 -0.66 0.17 0.00 0.03 0.00 0.00 46.19 45.73 1uew s LEU 105 CO 0.00 -0.24 1.11 0.20 0.23 0.00 0.00 176.35 177.65 1uew s ASN 106 N 0.39 2.58 0.13 2.29 0.02 -1.26 -4.83 114.94 114.25 1uew s ASN 106 Ca 0.23 1.93 0.04 0.00 -1.02 0.00 0.00 52.86 54.04 1uew s ASN 106 Cb -0.14 -2.47 -0.04 0.00 0.02 0.00 0.00 41.25 38.63 1uew s ASN 106 CO -0.07 -3.27 -0.10 -0.44 0.02 0.00 0.00 177.10 173.23 1uew s SER 107 N -2.75 1.68 -0.79 -1.22 0.01 -1.26 -5.08 113.70 104.28 1uew s SER 107 Ca 0.66 -0.94 -0.25 0.00 1.31 0.00 0.00 55.95 56.73 1uew s SER 107 Cb -0.22 -0.00 -0.02 0.00 0.21 0.00 0.00 66.02 65.98 1uew s SER 107 CO 0.59 -0.30 1.82 -2.16 0.41 0.00 0.00 173.24 173.60 1uew s PRO 108 N -3.40 2.72 0.23 12.44 0.04 -1.26 -4.91 135.00 140.86 1uew s PRO 108 Ca 0.13 -0.02 -0.20 0.00 0.04 0.00 0.00 61.00 60.95 1uew s PRO 108 Cb 0.01 -4.77 0.03 0.00 0.04 0.00 0.00 34.50 29.81 1uew s PRO 108 CO 0.00 -2.95 0.63 -1.54 0.04 0.00 0.00 177.00 173.19 1uew s SER 109 N 7.49 -0.32 0.15 6.66 1.04 -1.26 -5.19 113.70 122.27 1uew s SER 109 Ca 0.64 -0.46 -0.17 0.00 0.48 0.00 0.00 55.95 56.44 1uew s SER 109 Cb -0.08 0.66 0.04 0.00 0.10 0.00 0.00 66.02 66.73 1uew s SER 109 CO 0.08 -1.19 0.45 -0.83 0.98 0.00 0.00 173.24 172.74 1uew s GLY 110 N -2.88 -0.28 0.94 7.32 0.00 -1.26 -5.18 107.32 105.98 1uew s GLY 110 Ca 0.09 -0.01 -0.15 0.00 0.00 0.00 0.00 44.72 44.65 1uew s GLY 110 CO 0.00 -0.23 1.27 2.56 0.00 0.00 0.00 173.10 176.70 1uew s PRO 111 N -3.81 0.82 0.17 2.90 0.04 -1.26 -5.13 135.00 128.74 1uew s PRO 111 Ca 0.04 -0.23 0.07 0.00 0.04 0.00 0.00 61.00 60.92 1uew s PRO 111 Cb 0.01 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.65 1uew s PRO 111 CO -0.10 -2.32 -0.15 -1.54 0.04 0.00 0.00 177.00 172.93 1uew s SER 112 N -4.70 2.44 0.34 6.66 1.04 -1.26 -5.06 113.70 113.16 1uew s SER 112 Ca 0.71 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 56.20 1uew s SER 112 Cb -0.06 -0.12 0.00 0.00 0.10 0.00 0.00 66.02 65.94 1uew s SER 112 CO 0.52 -0.14 0.00 -1.20 0.98 0.00 0.00 173.24 173.41 1uew n SER 113 N -0.01 -1.63 -0.31 7.02 7.64 -1.26 -5.38 113.62 119.68 1uew n SER 113 Ca -0.11 0.61 0.15 0.00 1.01 0.00 0.00 58.87 60.53 1uew n SER 113 Cb 0.59 1.67 0.67 0.00 -1.01 0.00 0.00 64.21 66.13 1uew n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64