#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhp n SER 2 N 0.00 -1.52 -3.82 1.61 2.88 -1.26 -5.05 113.62 106.46 1uhp n SER 2 Ca 0.00 1.30 -0.12 0.00 -1.33 0.00 0.00 58.87 58.72 1uhp n SER 2 Cb 0.00 -4.77 -0.12 0.00 -0.75 0.00 0.00 64.21 58.56 1uhp n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1uhp s SER 3 N -0.61 -0.15 0.48 -3.46 0.01 -1.26 -5.17 113.70 103.55 1uhp s SER 3 Ca -0.25 0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.31 1uhp s SER 3 Cb 0.02 0.31 -0.01 0.00 0.21 0.00 0.00 66.02 66.54 1uhp s SER 3 CO 0.69 -0.07 0.06 -0.83 0.41 0.00 0.00 173.24 173.50 1uhp s GLY 4 N -0.02 2.93 -0.25 3.44 0.00 -1.26 -5.13 107.32 107.03 1uhp s GLY 4 Ca -0.01 -0.56 0.01 0.00 0.00 0.00 0.00 44.72 44.17 1uhp s GLY 4 CO 0.00 -2.05 -0.10 -1.35 0.00 0.00 0.00 173.10 169.61 1uhp s SER 5 N -3.78 4.30 0.36 1.64 1.04 -1.26 -5.10 113.70 110.90 1uhp s SER 5 Ca 0.11 -1.20 0.04 0.00 0.48 0.00 0.00 55.95 55.37 1uhp s SER 5 Cb 0.01 -1.58 -0.05 0.00 0.10 0.00 0.00 66.02 64.50 1uhp s SER 5 CO 0.07 -0.16 0.06 -0.55 0.98 0.00 0.00 173.24 173.64 1uhp s SER 6 N 1.18 2.76 1.30 7.02 0.15 -1.26 -5.15 113.70 119.70 1uhp s SER 6 Ca -0.05 -1.45 -0.20 0.00 0.70 0.00 0.00 55.95 54.94 1uhp s SER 6 Cb -0.18 0.03 0.31 0.00 -1.71 0.00 0.00 66.02 64.46 1uhp s SER 6 CO -0.06 -0.66 0.95 0.61 1.20 0.00 0.00 173.24 175.28 1uhp n GLY 7 N -0.81 -3.13 3.77 9.45 0.00 -1.26 -5.07 105.19 108.14 1uhp n GLY 7 Ca -0.04 -1.43 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 1uhp n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uhp s LYS 8 N -5.18 2.19 -0.09 1.61 3.01 -1.01 -4.99 119.74 115.29 1uhp s LYS 8 Ca 0.65 -2.15 0.01 0.00 -1.01 0.00 0.00 55.97 53.47 1uhp s LYS 8 Cb -0.08 -1.78 0.02 0.00 -1.01 0.00 0.00 37.83 34.98 1uhp s LYS 8 CO 0.51 -0.33 -0.11 -1.54 0.51 0.00 0.00 175.35 174.39 1uhp s SER 9 N -3.96 1.99 0.20 2.83 1.04 -1.26 -2.18 113.70 112.35 1uhp s SER 9 Ca 0.24 -0.32 0.10 0.00 0.48 0.00 0.00 55.95 56.45 1uhp s SER 9 Cb 0.02 -0.87 -0.04 0.00 0.10 0.00 0.00 66.02 65.23 1uhp s SER 9 CO 0.14 -0.01 -0.12 -0.76 0.98 0.00 0.00 173.24 173.46 1uhp s LEU 10 N 1.01 2.87 -0.08 2.42 2.01 -0.11 -4.96 118.68 121.85 1uhp s LEU 10 Ca -0.08 -0.67 -0.01 0.00 0.01 0.00 0.00 54.13 53.39 1uhp s LEU 10 Cb -0.15 -1.54 -0.03 0.00 0.01 0.00 0.00 46.19 44.49 1uhp s LEU 10 CO -0.01 0.09 -0.03 -0.89 1.01 0.00 0.00 176.35 176.53 1uhp s THR 11 N -1.82 4.04 -0.01 5.49 2.01 -1.26 -1.21 115.64 122.88 1uhp s THR 11 Ca 0.25 -0.35 -0.01 0.00 0.31 0.00 0.00 61.69 61.89 1uhp s THR 11 Cb -0.08 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 69.76 1uhp s THR 11 CO 0.15 0.60 0.03 -1.48 -0.69 0.00 0.00 174.62 173.22 1uhp s LEU 12 N -0.85 1.65 -0.31 4.42 0.05 0.58 -4.97 118.68 119.24 1uhp s LEU 12 Ca 0.13 0.05 -0.12 0.00 0.05 0.00 0.00 54.13 54.23 1uhp s LEU 12 Cb -0.11 0.03 -0.03 0.00 -2.05 0.00 0.00 46.19 44.03 1uhp s LEU 12 CO 0.02 -0.05 0.24 0.54 -0.55 0.00 0.00 176.35 176.55 1uhp s VAL 13 N 0.35 5.28 0.19 1.48 0.11 -1.20 0.15 120.40 126.76 1uhp s VAL 13 Ca -0.03 0.01 0.08 0.00 -2.93 0.00 0.00 61.98 59.11 1uhp s VAL 13 Cb -0.04 -3.65 -0.04 0.00 -1.53 0.00 0.00 36.38 31.12 1uhp s VAL 13 CO -0.01 0.09 0.01 -0.76 -3.33 0.00 0.00 175.10 171.10 1uhp s LEU 14 N 1.79 3.32 0.37 2.54 1.43 0.11 -3.66 118.68 124.57 1uhp s LEU 14 Ca 0.08 -0.43 0.05 0.00 -1.03 0.00 0.00 54.13 52.80 1uhp s LEU 14 Cb -0.17 -1.94 -0.06 0.00 0.03 0.00 0.00 46.19 44.05 1uhp s LEU 14 CO 0.11 0.07 0.04 -1.00 0.23 0.00 0.00 176.35 175.80 1uhp s HIS 15 N -1.83 2.15 -0.70 0.29 3.76 -1.26 -1.28 115.29 116.41 1uhp s HIS 15 Ca 0.28 -0.88 -0.01 0.00 -0.15 0.00 0.00 55.06 54.30 1uhp s HIS 15 Cb -0.09 -1.47 0.18 0.00 1.11 0.00 0.00 32.58 32.31 1uhp s HIS 15 CO 0.19 0.16 0.52 1.03 -0.85 0.00 0.00 174.74 175.79 1uhp s ARG 16 N -3.82 2.70 -1.07 1.40 0.52 -1.26 -4.25 118.95 113.18 1uhp s ARG 16 Ca 0.33 -2.83 -0.23 0.00 -0.52 0.00 0.00 55.73 52.49 1uhp s ARG 16 Cb 0.08 -3.73 -0.03 0.00 0.52 0.00 0.00 34.95 31.80 1uhp s ARG 16 CO 0.16 -1.20 1.83 0.34 0.02 0.00 0.00 175.30 176.44 1uhp s ASP 17 N 0.16 5.56 -0.64 0.23 2.15 -0.96 -4.02 116.67 119.15 1uhp s ASP 17 Ca 0.21 -1.37 -0.07 0.00 0.43 0.00 0.00 52.55 51.75 1uhp s ASP 17 Cb -0.16 -2.57 0.01 0.00 -0.30 0.00 0.00 42.92 39.90 1uhp s ASP 17 CO -0.07 -2.43 0.66 -1.54 -0.17 0.00 0.00 175.17 171.62 1uhp n SER 18 N 12.50 -7.47 -3.97 -0.34 3.41 -1.26 -3.45 113.62 113.04 1uhp n SER 18 Ca 0.42 0.02 -0.41 0.00 -0.26 0.00 0.00 58.87 58.64 1uhp n SER 18 Cb 0.47 -4.83 0.02 0.00 -0.26 0.00 0.00 64.21 59.61 1uhp n SER 18 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uhp n GLY 19 N -1.25 -0.81 3.07 5.00 0.00 -1.26 -4.93 105.19 105.01 1uhp n GLY 19 Ca 0.00 0.35 0.04 0.00 0.00 0.00 0.00 46.02 46.41 1uhp n GLY 19 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uhp s SER 20 N -3.60 -0.80 0.43 1.61 0.15 -1.22 -5.01 113.70 105.26 1uhp s SER 20 Ca 0.44 -0.07 0.17 0.00 0.70 0.00 0.00 55.95 57.18 1uhp s SER 20 Cb -0.21 1.33 1.08 0.00 -1.71 0.00 0.00 66.02 66.51 1uhp s SER 20 CO 0.94 -0.13 1.91 -0.07 1.20 0.00 0.00 173.24 177.09 1uhp h LEU 21 N 6.97 0.37 -0.01 3.45 -0.00 -1.87 -2.56 115.31 121.66 1uhp h LEU 21 Ca -0.04 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.86 1uhp h LEU 21 Cb 1.19 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.80 1uhp h LEU 21 CO -0.01 0.18 0.00 0.61 -0.00 0.00 0.00 178.44 179.22 1uhp n GLY 22 N -1.53 1.06 3.68 0.83 0.00 -1.26 -3.21 105.19 104.75 1uhp n GLY 22 Ca 0.15 -0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.20 1uhp n GLY 22 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1uhp n PHE 23 N -0.09 -0.18 -4.52 1.61 -1.74 -1.26 0.37 117.46 111.65 1uhp n PHE 23 Ca 0.00 -0.56 -0.24 0.00 -0.56 0.00 0.00 57.45 56.09 1uhp n PHE 23 Cb 0.01 0.24 -0.11 0.00 1.52 0.00 0.00 39.48 41.14 1uhp n PHE 23 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 1uhp s ASN 24 N -3.67 3.31 0.02 5.98 -0.87 0.35 -4.88 114.94 115.18 1uhp s ASN 24 Ca 0.29 -1.26 0.00 0.00 -1.57 0.00 0.00 52.86 50.32 1uhp s ASN 24 Cb -0.00 -0.27 -0.02 0.00 -0.02 0.00 0.00 41.25 40.93 1uhp s ASN 24 CO -0.02 -0.35 -0.03 0.27 -2.57 0.00 0.00 177.10 174.40 1uhp s ILE 25 N -2.84 0.12 0.18 0.60 -4.36 -1.26 -3.68 121.20 109.96 1uhp s ILE 25 Ca 0.33 -0.82 0.01 0.00 -0.26 0.00 0.00 60.65 59.90 1uhp s ILE 25 Cb 0.05 -0.25 -0.04 0.00 1.25 0.00 0.00 42.46 43.47 1uhp s ILE 25 CO 0.15 -0.44 0.05 0.27 0.24 0.00 0.00 174.94 175.21 1uhp s ILE 26 N -1.30 0.43 0.00 8.37 -4.36 0.31 -4.86 121.20 119.79 1uhp s ILE 26 Ca -0.14 -1.97 0.00 0.00 -0.26 0.00 0.00 60.65 58.28 1uhp s ILE 26 Cb -0.09 -2.24 0.00 0.00 1.25 0.00 0.00 42.46 41.38 1uhp s ILE 26 CO -0.01 -0.33 0.00 0.61 0.24 0.00 0.00 174.94 175.45 1uhp n GLY 27 N -0.25 1.48 0.00 6.27 0.00 -1.25 0.43 105.19 111.87 1uhp n GLY 27 Ca -0.04 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1uhp n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uhp n GLY 28 N 2.49 1.02 3.52 -0.02 0.00 -1.12 -1.00 105.19 110.08 1uhp n GLY 28 Ca 0.00 -0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.51 1uhp n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uhp n ARG 29 N 0.00 0.58 -1.53 1.61 1.74 -1.26 -4.71 116.66 113.09 1uhp n ARG 29 Ca 0.00 0.21 -0.29 0.00 -0.77 0.00 0.00 57.85 57.00 1uhp n ARG 29 Cb 0.00 -1.59 0.15 0.00 -1.02 0.00 0.00 32.46 30.00 1uhp n ARG 29 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1uhp s PRO 30 N -0.42 0.86 1.18 5.56 0.04 -1.26 -4.56 135.00 136.39 1uhp s PRO 30 Ca 0.76 0.18 -0.17 0.00 0.04 0.00 0.00 61.00 61.81 1uhp s PRO 30 Cb -0.98 -1.82 0.21 0.00 0.04 0.00 0.00 34.50 31.95 1uhp s PRO 30 CO 0.54 -2.37 0.47 0.43 0.04 0.00 0.00 177.00 176.12 1uhp n SER 31 N -3.86 -2.44 -0.30 6.66 7.64 -1.26 -4.85 113.62 115.20 1uhp n SER 31 Ca 0.08 -0.26 -0.10 0.00 1.01 0.00 0.00 58.87 59.61 1uhp n SER 31 Cb 0.59 -1.05 -0.08 0.00 -1.01 0.00 0.00 64.21 62.66 1uhp n SER 31 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1uhp h VAL 32 N -2.54 0.00 -0.79 0.44 2.07 -1.97 -3.40 116.25 110.07 1uhp h VAL 32 Ca -0.54 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.02 1uhp h VAL 32 Cb 1.30 0.00 -0.19 0.00 -1.52 0.00 0.00 31.29 30.88 1uhp h VAL 32 CO 0.40 0.00 -0.32 -0.62 0.02 0.00 0.00 177.57 177.05 1uhp s ASP 33 N -5.00 -1.26 0.00 0.57 -1.08 -1.26 -4.99 116.67 103.65 1uhp s ASP 33 Ca -0.10 -0.24 0.00 0.00 -0.52 0.00 0.00 52.55 51.69 1uhp s ASP 33 Cb 0.09 1.69 0.00 0.00 -1.46 0.00 0.00 42.92 43.23 1uhp s ASP 33 CO 0.51 -0.19 0.00 -3.20 0.52 0.00 0.00 175.17 172.82 1uhp n ASN 34 N 4.78 0.00 -3.27 -0.34 2.85 -1.26 -4.74 115.26 113.28 1uhp n ASN 34 Ca 0.08 0.00 -0.23 0.00 -0.11 0.00 0.00 54.58 54.32 1uhp n ASN 34 Cb 0.57 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.61 1uhp n ASN 34 CO 0.00 0.00 0.00 1.57 -2.11 0.00 0.00 177.26 176.72 1uhp n HIS 35 N 0.00 -2.37 -1.55 1.20 -0.00 -1.26 -4.57 115.22 106.67 1uhp n HIS 35 Ca 0.00 0.99 -0.61 0.00 0.46 0.00 0.00 57.72 58.56 1uhp n HIS 35 Cb 0.00 -2.19 -0.10 0.00 -0.12 0.00 0.00 29.99 27.58 1uhp n HIS 35 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1uhp n ASP 36 N 0.18 1.40 0.00 0.26 2.03 -1.26 -4.39 116.55 114.77 1uhp n ASP 36 Ca -0.03 0.92 0.00 0.00 0.52 0.00 0.00 54.79 56.20 1uhp n ASP 36 Cb 0.56 -0.98 0.00 0.00 -0.72 0.00 0.00 41.12 39.97 1uhp n ASP 36 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1uhp n GLY 37 N 5.45 -0.14 1.30 0.27 0.00 -1.26 -5.13 105.19 105.68 1uhp n GLY 37 Ca 0.39 0.01 0.16 0.00 0.00 0.00 0.00 46.02 46.59 1uhp n GLY 37 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uhp n SER 38 N 0.00 -7.47 -4.20 1.61 7.64 -1.26 -4.84 113.62 105.11 1uhp n SER 38 Ca 0.00 0.74 -0.29 0.00 1.01 0.00 0.00 58.87 60.33 1uhp n SER 38 Cb 0.00 -4.11 0.22 0.00 -1.01 0.00 0.00 64.21 59.31 1uhp n SER 38 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1uhp s SER 39 N -6.50 1.55 -0.45 6.43 0.01 -1.26 -4.96 113.70 108.52 1uhp s SER 39 Ca 0.00 0.89 0.06 0.00 1.31 0.00 0.00 55.95 58.21 1uhp s SER 39 Cb 0.00 -1.34 0.21 0.00 0.21 0.00 0.00 66.02 65.10 1uhp s SER 39 CO 0.00 -3.77 0.59 -0.24 0.41 0.00 0.00 173.24 170.23 1uhp n SER 40 N -4.56 -1.65 -3.90 2.44 2.88 -1.26 -5.01 113.62 102.56 1uhp n SER 40 Ca 0.09 -2.76 -0.10 0.00 -1.33 0.00 0.00 58.87 54.77 1uhp n SER 40 Cb 0.58 0.53 -0.09 0.00 -0.75 0.00 0.00 64.21 64.48 1uhp n SER 40 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1uhp s GLU 41 N 0.15 0.64 0.28 -1.46 -1.05 -1.26 -4.25 118.70 111.74 1uhp s GLU 41 Ca 0.32 -0.74 -0.13 0.00 -0.15 0.00 0.00 54.97 54.27 1uhp s GLU 41 Cb 0.09 0.26 0.05 0.00 -0.44 0.00 0.00 34.13 34.09 1uhp s GLU 41 CO -0.15 -0.17 0.69 0.41 0.95 0.00 0.00 175.26 176.99 1uhp n GLY 42 N 0.67 1.06 2.99 -3.83 0.00 -1.25 -4.54 105.19 100.29 1uhp n GLY 42 Ca -0.19 -1.19 -0.26 0.00 0.00 0.00 0.00 46.02 44.39 1uhp n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uhp s ILE 43 N -2.24 1.15 0.12 -0.61 -1.09 -1.26 -2.79 121.20 114.49 1uhp s ILE 43 Ca 0.14 -0.44 0.01 0.00 -2.23 0.00 0.00 60.65 58.13 1uhp s ILE 43 Cb -0.04 -1.10 -0.04 0.00 -1.58 0.00 0.00 42.46 39.71 1uhp s ILE 43 CO 0.08 0.37 -0.01 -0.36 -1.23 0.00 0.00 174.94 173.80 1uhp s PHE 44 N 1.10 0.91 -0.24 3.97 0.40 0.17 -2.10 117.98 122.19 1uhp s PHE 44 Ca -0.06 -1.06 -0.08 0.00 -0.60 0.00 0.00 56.93 55.13 1uhp s PHE 44 Cb -0.14 -0.54 -0.04 0.00 0.51 0.00 0.00 43.02 42.81 1uhp s PHE 44 CO -0.02 -0.31 0.10 0.08 0.70 0.00 0.00 175.22 175.78 1uhp s VAL 45 N -3.80 4.73 -0.18 -0.44 1.01 -0.80 0.11 120.40 121.04 1uhp s VAL 45 Ca 0.18 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1uhp s VAL 45 Cb 0.07 -3.21 -0.12 0.00 0.00 0.00 0.00 36.38 33.12 1uhp s VAL 45 CO -0.01 0.35 -0.16 -0.24 0.00 0.00 0.00 175.10 175.03 1uhp n SER 46 N 4.60 2.57 -4.31 3.32 2.88 -1.24 0.15 113.62 121.59 1uhp n SER 46 Ca -0.16 -0.09 -0.28 0.00 -1.33 0.00 0.00 58.87 57.01 1uhp n SER 46 Cb 0.52 -0.29 -0.14 0.00 -0.75 0.00 0.00 64.21 63.54 1uhp n SER 46 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1uhp s LYS 47 N -2.36 1.63 -0.04 -1.46 2.36 -1.26 -4.65 119.74 113.95 1uhp s LYS 47 Ca -0.24 -1.05 -0.02 0.00 -2.55 0.00 0.00 55.97 52.11 1uhp s LYS 47 Cb 0.06 -1.79 0.03 0.00 -1.05 0.00 0.00 37.83 35.09 1uhp s LYS 47 CO 0.41 0.46 0.07 0.42 1.55 0.00 0.00 175.35 178.26 1uhp s ILE 48 N -0.81 -0.12 -0.21 5.43 1.01 -1.26 0.13 121.20 125.37 1uhp s ILE 48 Ca 0.10 0.38 -0.29 0.00 0.00 0.00 0.00 60.65 60.84 1uhp s ILE 48 Cb -0.10 -0.16 -0.01 0.00 0.01 0.00 0.00 42.46 42.21 1uhp s ILE 48 CO 0.02 0.16 1.25 -0.69 0.00 0.00 0.00 174.94 175.68 1uhp s VAL 49 N 1.99 4.28 0.00 2.92 1.01 0.16 -4.91 120.40 125.85 1uhp s VAL 49 Ca 0.02 1.52 0.00 0.00 0.00 0.00 0.00 61.98 63.53 1uhp s VAL 49 Cb -0.12 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1uhp s VAL 49 CO -0.03 -0.24 0.33 0.47 0.00 0.00 0.00 175.10 175.63 1uhp n ASP 50 N 6.87 0.00 -0.61 3.32 9.92 -1.26 -1.25 116.55 133.53 1uhp n ASP 50 Ca 0.14 0.33 0.48 0.00 -0.53 0.00 0.00 54.79 55.22 1uhp n ASP 50 Cb 0.45 0.00 0.76 0.00 -0.64 0.00 0.00 41.12 41.69 1uhp n ASP 50 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1uhp h SER 51 N 0.00 0.00 -2.92 -2.24 0.87 -1.95 -3.16 113.55 104.15 1uhp h SER 51 Ca 0.00 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.99 1uhp h SER 51 Cb 0.00 0.00 0.18 0.00 -0.44 0.00 0.00 62.40 62.14 1uhp h SER 51 CO 0.00 0.00 -0.55 0.61 -0.53 0.00 0.00 176.83 176.36 1uhp n GLY 52 N -1.88 -1.86 0.00 5.77 0.00 -0.38 -4.63 105.19 102.20 1uhp n GLY 52 Ca 0.40 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1uhp n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uhp n PRO 53 N -0.07 0.58 0.08 1.61 -0.04 -1.25 -0.81 135.00 135.10 1uhp n PRO 53 Ca 0.10 0.03 -0.21 0.00 -0.04 0.00 0.00 63.50 63.37 1uhp n PRO 53 Cb 0.49 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.30 1uhp n PRO 53 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uhp h ALA 54 N 3.33 0.15 0.08 0.55 0.00 -1.75 1.02 119.26 122.64 1uhp h ALA 54 Ca 0.00 -1.09 -0.34 0.00 0.00 0.00 0.00 54.91 53.48 1uhp h ALA 54 Cb 0.08 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1uhp h ALA 54 CO 0.00 1.02 -1.91 0.00 0.00 0.00 0.00 179.25 178.36 1uhp n ALA 55 N -2.77 0.94 -1.00 0.00 0.00 -1.09 -1.29 120.51 115.29 1uhp n ALA 55 Ca -0.21 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.59 1uhp n ALA 55 Cb 1.07 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1uhp n ALA 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uhp n LYS 56 N -3.72 0.00 -0.08 0.00 4.76 0.01 -4.14 118.16 114.99 1uhp n LYS 56 Ca -0.35 0.18 -0.07 0.00 -2.87 0.00 0.00 58.31 55.20 1uhp n LYS 56 Cb 0.95 -0.84 -0.15 0.00 -1.84 0.00 0.00 35.03 33.16 1uhp n LYS 56 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1uhp n GLU 57 N -0.51 0.96 -0.22 1.97 0.28 -1.23 -4.53 120.64 117.35 1uhp n GLU 57 Ca 0.00 -0.03 0.03 0.00 -0.16 0.00 0.00 57.16 57.00 1uhp n GLU 57 Cb 0.00 -1.47 0.07 0.00 1.43 0.00 0.00 31.44 31.47 1uhp n GLU 57 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1uhp n GLY 58 N 1.81 -1.08 1.43 -1.84 0.00 0.35 -4.70 105.19 101.16 1uhp n GLY 58 Ca -0.27 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1uhp n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uhp n GLY 59 N -1.37 0.75 3.61 -0.02 0.00 -0.41 -3.25 105.19 104.51 1uhp n GLY 59 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1uhp n GLY 59 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1uhp s LEU 60 N 0.00 1.18 -0.26 0.99 2.96 -0.68 -5.00 118.68 117.87 1uhp s LEU 60 Ca 0.00 1.13 -0.13 0.00 -0.22 0.00 0.00 54.13 54.92 1uhp s LEU 60 Cb 0.00 -3.16 0.09 0.00 0.50 0.00 0.00 46.19 43.62 1uhp s LEU 60 CO 0.00 -3.59 0.61 -1.58 -1.32 0.00 0.00 176.35 170.47 1uhp s GLN 61 N -4.93 0.59 0.43 1.98 0.74 -1.26 -4.80 119.66 112.40 1uhp s GLN 61 Ca 0.67 1.18 -0.21 0.00 0.05 0.00 0.00 55.36 57.06 1uhp s GLN 61 Cb -0.18 0.29 -0.15 0.00 1.10 0.00 0.00 33.01 34.07 1uhp s GLN 61 CO 0.59 -0.17 0.11 -0.89 -0.55 0.00 0.00 175.29 174.38 1uhp n ILE 62 N 4.66 0.70 -2.89 -2.34 5.41 -1.26 -2.93 119.36 120.72 1uhp n ILE 62 Ca -0.18 -0.50 -0.12 0.00 1.00 0.00 0.00 62.75 62.96 1uhp n ILE 62 Cb 0.55 -0.07 0.06 0.00 -0.71 0.00 0.00 39.64 39.47 1uhp n ILE 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1uhp n HIS 63 N -1.10 -1.69 -4.27 1.39 8.25 0.40 -4.99 115.22 113.21 1uhp n HIS 63 Ca 0.11 0.65 -0.26 0.00 -0.26 0.00 0.00 57.72 57.96 1uhp n HIS 63 Cb 0.41 -3.94 -0.08 0.00 1.12 0.00 0.00 29.99 27.50 1uhp n HIS 63 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 1uhp s ASP 64 N -3.61 4.27 -0.49 0.41 -4.77 -1.15 -4.89 116.67 106.45 1uhp s ASP 64 Ca 0.18 -1.15 0.03 0.00 -3.30 0.00 0.00 52.55 48.31 1uhp s ASP 64 Cb -0.02 -0.46 0.16 0.00 -1.09 0.00 0.00 42.92 41.50 1uhp s ASP 64 CO 0.53 -0.50 0.34 -0.60 0.70 0.00 0.00 175.17 175.64 1uhp s ARG 65 N -3.84 1.36 0.17 2.11 3.52 -1.26 -1.90 118.95 119.10 1uhp s ARG 65 Ca 0.39 -2.32 -0.33 0.00 -0.13 0.00 0.00 55.73 53.34 1uhp s ARG 65 Cb 0.05 -2.14 -0.15 0.00 -1.56 0.00 0.00 34.95 31.15 1uhp s ARG 65 CO 0.21 -1.29 1.27 -0.89 -0.81 0.00 0.00 175.30 173.80 1uhp n ILE 66 N 2.92 0.71 -0.09 4.11 5.41 -0.89 -2.69 119.36 128.83 1uhp n ILE 66 Ca 0.20 -0.18 -0.12 0.00 1.00 0.00 0.00 62.75 63.65 1uhp n ILE 66 Cb 0.40 -1.03 -0.08 0.00 -0.71 0.00 0.00 39.64 38.22 1uhp n ILE 66 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1uhp n ILE 67 N 1.88 0.97 -3.77 1.39 2.08 0.50 -4.15 119.36 118.27 1uhp n ILE 67 Ca 0.15 -0.36 -0.13 0.00 0.56 0.00 0.00 62.75 62.97 1uhp n ILE 67 Cb 0.26 -1.14 -0.09 0.00 -0.75 0.00 0.00 39.64 37.91 1uhp n ILE 67 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1uhp s GLU 68 N -2.34 0.62 -0.09 0.38 2.56 -1.22 -2.92 118.70 115.70 1uhp s GLU 68 Ca -0.23 -0.17 -0.03 0.00 0.00 0.00 0.00 54.97 54.54 1uhp s GLU 68 Cb 0.06 0.28 0.04 0.00 2.00 0.00 0.00 34.13 36.51 1uhp s GLU 68 CO 0.39 -0.16 0.06 0.54 -0.56 0.00 0.00 175.26 175.52 1uhp s VAL 69 N -1.22 0.01 -0.99 3.70 0.11 0.92 -0.52 120.40 122.41 1uhp s VAL 69 Ca -0.13 0.15 0.00 0.00 -2.93 0.00 0.00 61.98 59.08 1uhp s VAL 69 Cb -0.05 -0.38 0.00 0.00 -1.53 0.00 0.00 36.38 34.41 1uhp s VAL 69 CO 0.04 0.04 0.00 -3.20 -3.33 0.00 0.00 175.10 168.64 1uhp n ASN 70 N 5.26 -5.54 0.00 3.54 2.85 0.38 0.29 115.26 122.04 1uhp n ASN 70 Ca -0.05 0.23 0.00 0.00 -0.11 0.00 0.00 54.58 54.65 1uhp n ASN 70 Cb 0.50 -3.86 0.00 0.00 1.24 0.00 0.00 39.78 37.66 1uhp n ASN 70 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1uhp n GLY 71 N 0.05 0.76 3.66 8.20 0.00 -1.25 -4.89 105.19 111.72 1uhp n GLY 71 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1uhp n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1uhp s ARG 72 N -0.95 4.10 -0.17 1.61 0.52 0.15 -5.05 118.95 119.16 1uhp s ARG 72 Ca 0.00 -0.14 -0.29 0.00 -0.52 0.00 0.00 55.73 54.78 1uhp s ARG 72 Cb 0.00 -3.54 -0.01 0.00 0.52 0.00 0.00 34.95 31.92 1uhp s ARG 72 CO 0.00 0.04 1.16 0.34 0.02 0.00 0.00 175.30 176.85 1uhp s ASP 73 N 1.05 7.04 0.00 0.23 2.15 -1.26 -0.06 116.67 125.81 1uhp s ASP 73 Ca 0.11 1.58 0.00 0.00 0.43 0.00 0.00 52.55 54.67 1uhp s ASP 73 Cb -0.14 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 1uhp s ASP 73 CO 0.05 -0.68 0.54 0.18 -0.17 0.00 0.00 175.17 175.09 1uhp n LEU 74 N 6.21 1.04 -0.33 -1.34 4.77 -1.15 -4.65 117.00 121.54 1uhp n LEU 74 Ca 0.12 -1.04 0.17 0.00 -0.03 0.00 0.00 56.01 55.24 1uhp n LEU 74 Cb 0.46 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 41.95 1uhp n LEU 74 CO 0.54 0.26 1.20 -1.28 -1.33 0.00 0.00 177.39 176.78 1uhp h SER 75 N 0.00 0.63 -0.24 -1.43 0.87 -1.71 0.33 113.55 112.00 1uhp h SER 75 Ca 0.00 0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.62 1uhp h SER 75 Cb 0.19 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 1uhp h SER 75 CO 0.00 0.18 -0.02 -2.11 -0.53 0.00 0.00 176.83 174.36 1uhp n ARG 76 N -4.72 2.46 -2.91 2.24 1.85 -1.26 -4.18 116.66 110.14 1uhp n ARG 76 Ca 0.24 -2.88 -0.18 0.00 -1.00 0.00 0.00 57.85 54.03 1uhp n ARG 76 Cb 0.70 -1.79 0.02 0.00 -1.05 0.00 0.00 32.46 30.34 1uhp n ARG 76 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1uhp s ALA 77 N -2.93 4.37 0.38 2.89 0.00 0.12 -4.86 121.76 121.73 1uhp s ALA 77 Ca 0.41 -1.63 0.08 0.00 0.00 0.00 0.00 51.96 50.82 1uhp s ALA 77 Cb 0.35 -1.74 -0.03 0.00 0.00 0.00 0.00 23.12 21.70 1uhp s ALA 77 CO 0.06 -0.47 0.32 -0.08 0.00 0.00 0.00 175.76 175.59 1uhp s THR 78 N -2.50 2.97 0.28 0.00 -1.32 -1.26 -3.82 115.64 109.99 1uhp s THR 78 Ca 0.56 -1.40 0.03 0.00 -1.21 0.00 0.00 61.69 59.67 1uhp s THR 78 Cb -0.10 -3.06 0.27 0.00 -1.51 0.00 0.00 72.50 68.11 1uhp s THR 78 CO 0.35 -0.08 1.76 -0.74 -2.21 0.00 0.00 174.62 173.70 1uhp h HIS 79 N 1.17 0.87 0.11 9.09 2.76 -1.33 0.95 115.15 128.77 1uhp h HIS 79 Ca -0.43 0.04 0.01 0.00 -2.20 0.00 0.00 60.37 57.78 1uhp h HIS 79 Cb 1.26 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.96 1uhp h HIS 79 CO 0.54 0.16 -0.13 0.22 -1.30 0.00 0.00 177.93 177.41 1uhp h ASP 80 N 0.64 -0.35 -0.04 3.26 3.58 -1.95 0.22 116.42 121.77 1uhp h ASP 80 Ca 0.53 0.04 -0.00 0.00 0.42 0.00 0.00 57.03 58.02 1uhp h ASP 80 Cb 0.83 0.13 -0.00 0.00 1.72 0.00 0.00 39.33 42.01 1uhp h ASP 80 CO -0.40 -0.20 0.02 1.56 -2.88 0.00 0.00 179.24 177.33 1uhp h GLN 81 N -0.28 0.06 -0.41 0.28 1.08 -1.34 -1.22 115.11 113.28 1uhp h GLN 81 Ca 0.01 -0.01 0.09 0.00 -1.45 0.00 0.00 58.65 57.28 1uhp h GLN 81 Cb 0.28 -0.01 -0.09 0.00 -0.05 0.00 0.00 27.48 27.61 1uhp h GLN 81 CO -0.05 0.21 -0.23 0.00 -0.95 0.00 0.00 178.83 177.82 1uhp h ALA 82 N 0.84 0.04 0.13 3.87 0.00 0.11 0.55 119.26 124.80 1uhp h ALA 82 Ca 0.01 0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1uhp h ALA 82 Cb 0.18 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1uhp h ALA 82 CO -0.00 -0.60 -0.31 0.28 0.00 0.00 0.00 179.25 178.62 1uhp h VAL 83 N -0.15 0.34 -0.62 0.00 2.07 -0.42 0.20 116.25 117.67 1uhp h VAL 83 Ca 0.20 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.84 1uhp h VAL 83 Cb 0.46 0.34 -0.10 0.00 -1.52 0.00 0.00 31.29 30.47 1uhp h VAL 83 CO -0.50 0.00 0.08 -0.08 0.02 0.00 0.00 177.57 177.09 1uhp h GLU 84 N -0.54 0.19 0.20 1.57 4.81 0.02 0.59 114.58 121.42 1uhp h GLU 84 Ca 0.03 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1uhp h GLU 84 Cb 0.56 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 1uhp h GLU 84 CO -0.17 0.13 -0.38 0.00 -0.73 0.00 0.00 179.01 177.85 1uhp h ALA 85 N 1.52 -0.71 0.00 2.92 0.00 0.86 1.26 119.26 125.12 1uhp h ALA 85 Ca 0.33 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1uhp h ALA 85 Cb 0.52 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1uhp h ALA 85 CO -0.46 -0.95 -0.02 0.74 0.00 0.00 0.00 179.25 178.55 1uhp h PHE 86 N -0.66 0.00 0.02 0.00 0.04 0.14 1.36 116.94 117.84 1uhp h PHE 86 Ca 0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 1uhp h PHE 86 Cb 0.66 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.81 1uhp h PHE 86 CO -0.30 0.02 -0.01 -0.22 -0.60 0.00 0.00 178.31 177.20 1uhp h LYS 87 N 0.00 -0.03 0.00 1.51 3.64 0.21 -3.23 116.57 118.68 1uhp h LYS 87 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1uhp h LYS 87 Cb 0.05 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1uhp h LYS 87 CO 0.00 0.71 0.00 0.25 -2.27 0.00 0.00 179.45 178.14 1uhp n THR 88 N -4.71 0.04 -2.33 1.00 -2.24 0.41 -4.83 114.28 101.62 1uhp n THR 88 Ca -0.09 0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.36 1uhp n THR 88 Cb 0.36 -0.53 -0.01 0.00 -2.10 0.00 0.00 70.33 68.06 1uhp n THR 88 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uhp s ALA 89 N -2.50 2.75 0.15 6.98 0.00 0.46 -5.03 121.76 124.58 1uhp s ALA 89 Ca 0.30 0.78 0.11 0.00 0.00 0.00 0.00 51.96 53.15 1uhp s ALA 89 Cb 0.20 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 1uhp s ALA 89 CO 0.43 -0.66 -0.25 0.15 0.00 0.00 0.00 175.76 175.44 1uhp s LYS 90 N -3.24 1.47 0.16 0.00 -0.14 -1.26 -4.96 119.74 111.76 1uhp s LYS 90 Ca 0.71 -1.41 -0.17 0.00 -1.36 0.00 0.00 55.97 53.74 1uhp s LYS 90 Cb -0.22 -1.89 -0.07 0.00 -1.68 0.00 0.00 37.83 33.96 1uhp s LYS 90 CO 0.26 0.43 0.61 -1.21 -0.76 0.00 0.00 175.35 174.67 1uhp s GLU 91 N -2.31 4.10 0.24 1.68 8.01 -1.26 -2.61 118.70 126.56 1uhp s GLU 91 Ca 0.17 0.65 -0.30 0.00 0.01 0.00 0.00 54.97 55.50 1uhp s GLU 91 Cb -0.09 -2.97 -0.09 0.00 -4.31 0.00 0.00 34.13 26.67 1uhp s GLU 91 CO 0.08 0.48 1.09 -1.25 0.01 0.00 0.00 175.26 175.67 1uhp s PRO 92 N -1.82 4.63 -0.41 0.39 0.04 -1.26 -5.12 135.00 131.46 1uhp s PRO 92 Ca 0.38 1.76 -0.21 0.00 0.04 0.00 0.00 61.00 62.97 1uhp s PRO 92 Cb -0.16 -3.22 0.02 0.00 0.04 0.00 0.00 34.50 31.17 1uhp s PRO 92 CO 0.20 0.18 0.66 0.42 0.04 0.00 0.00 177.00 178.49 1uhp s ILE 93 N -0.83 4.83 -0.44 0.56 1.01 -0.41 -4.94 121.20 120.98 1uhp s ILE 93 Ca 0.46 0.34 -0.26 0.00 0.00 0.00 0.00 60.65 61.19 1uhp s ILE 93 Cb -0.31 -4.17 0.02 0.00 0.01 0.00 0.00 42.46 38.02 1uhp s ILE 93 CO 0.38 -0.50 0.95 -0.69 0.00 0.00 0.00 174.94 175.09 1uhp s VAL 94 N 2.83 4.46 0.13 2.92 1.01 -1.26 0.07 120.40 130.56 1uhp s VAL 94 Ca 0.24 0.91 0.08 0.00 0.00 0.00 0.00 61.98 63.21 1uhp s VAL 94 Cb -0.14 -4.44 -0.04 0.00 0.00 0.00 0.00 36.38 31.76 1uhp s VAL 94 CO 0.18 -0.79 -0.14 -0.69 0.00 0.00 0.00 175.10 173.65 1uhp s VAL 95 N 3.79 3.06 -0.01 2.92 1.01 0.39 0.14 120.40 131.71 1uhp s VAL 95 Ca 0.39 -1.48 0.03 0.00 0.00 0.00 0.00 61.98 60.91 1uhp s VAL 95 Cb -0.10 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.84 1uhp s VAL 95 CO 0.25 0.05 -0.09 -1.58 0.00 0.00 0.00 175.10 173.74 1uhp s GLN 96 N -2.33 0.76 0.25 2.72 0.74 0.32 0.21 119.66 122.34 1uhp s GLN 96 Ca 0.21 -0.31 0.05 0.00 0.05 0.00 0.00 55.36 55.36 1uhp s GLN 96 Cb -0.10 -0.73 -0.05 0.00 1.10 0.00 0.00 33.01 33.22 1uhp s GLN 96 CO 0.12 0.17 -0.03 0.14 -0.55 0.00 0.00 175.29 175.15 1uhp s VAL 97 N -0.11 1.32 -0.32 1.34 -7.23 -0.35 0.19 120.40 115.23 1uhp s VAL 97 Ca 0.02 -2.07 -0.03 0.00 -1.81 0.00 0.00 61.98 58.08 1uhp s VAL 97 Cb -0.05 -2.39 0.05 0.00 0.56 0.00 0.00 36.38 34.55 1uhp s VAL 97 CO -0.00 -0.31 0.05 -0.76 -0.31 0.00 0.00 175.10 173.76 1uhp s LEU 98 N -3.37 4.11 -0.23 1.32 1.02 -1.10 -0.93 118.68 119.51 1uhp s LEU 98 Ca 0.29 -1.26 -0.09 0.00 0.02 0.00 0.00 54.13 53.09 1uhp s LEU 98 Cb 0.05 -1.77 -0.04 0.00 0.02 0.00 0.00 46.19 44.44 1uhp s LEU 98 CO 0.10 -0.30 0.12 -0.13 0.02 0.00 0.00 176.35 176.16 1uhp s ARG 99 N 1.30 3.96 -0.02 1.70 3.00 -0.93 -4.40 118.95 123.56 1uhp s ARG 99 Ca -0.03 -0.33 0.01 0.00 0.00 0.00 0.00 55.73 55.37 1uhp s ARG 99 Cb -0.20 -3.42 0.01 0.00 0.00 0.00 0.00 34.95 31.34 1uhp s ARG 99 CO 0.00 0.05 -0.03 -0.98 0.00 0.00 0.00 175.30 174.34 1uhp s ARG 100 N 1.04 0.46 -0.13 3.54 3.03 -1.26 -2.39 118.95 123.24 1uhp s ARG 100 Ca 0.06 -0.08 -0.35 0.00 2.03 0.00 0.00 55.73 57.39 1uhp s ARG 100 Cb -0.14 -0.51 -0.12 0.00 -1.03 0.00 0.00 34.95 33.15 1uhp s ARG 100 CO 0.04 -0.01 1.88 -2.37 -1.13 0.00 0.00 175.30 173.71 1uhp n THR 101 N 3.56 0.53 -3.40 4.99 5.66 -1.26 -4.91 114.28 119.45 1uhp n THR 101 Ca -0.20 -0.11 0.01 0.00 -3.05 0.00 0.00 64.05 60.71 1uhp n THR 101 Cb 0.54 -1.78 -0.04 0.00 -1.55 0.00 0.00 70.33 67.49 1uhp n THR 101 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1uhp s SER 102 N 4.16 -0.48 0.00 1.09 0.15 -1.26 -5.15 113.70 112.21 1uhp s SER 102 Ca 0.94 0.67 0.00 0.00 0.70 0.00 0.00 55.95 58.26 1uhp s SER 102 Cb -0.75 1.50 0.00 0.00 -1.71 0.00 0.00 66.02 65.06 1uhp s SER 102 CO 0.54 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.49 1uhp n GLY 103 N 4.73 3.83 2.01 9.45 0.00 -1.26 -5.14 105.19 118.80 1uhp n GLY 103 Ca -0.10 -1.04 -0.16 0.00 0.00 0.00 0.00 46.02 44.72 1uhp n GLY 103 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uhp n PRO 104 N 0.00 -1.42 -5.11 1.61 -0.04 -1.26 -5.08 135.00 123.70 1uhp n PRO 104 Ca 0.00 -1.04 -0.28 0.00 -0.04 0.00 0.00 63.50 62.14 1uhp n PRO 104 Cb 0.00 -0.82 -0.16 0.00 -0.04 0.00 0.00 33.50 32.49 1uhp n PRO 104 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1uhp s SER 105 N -3.39 2.65 0.02 3.54 1.04 -1.26 -5.14 113.70 111.16 1uhp s SER 105 Ca 0.40 -0.41 0.08 0.00 0.48 0.00 0.00 55.95 56.49 1uhp s SER 105 Cb -0.02 -0.29 -0.03 0.00 0.10 0.00 0.00 66.02 65.78 1uhp s SER 105 CO 0.29 0.28 -0.22 -0.44 0.98 0.00 0.00 173.24 174.12 1uhp s SER 106 N -0.55 3.44 0.00 7.02 0.01 -1.26 -5.36 113.70 117.01 1uhp s SER 106 Ca 0.09 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.88 1uhp s SER 106 Cb -0.09 -0.47 0.00 0.00 0.21 0.00 0.00 66.02 65.68 1uhp s SER 106 CO -0.01 0.28 0.28 0.61 0.41 0.00 0.00 173.24 174.81