#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhp s SER 2 N 0.00 1.59 -0.30 1.61 0.15 -1.26 -5.11 113.70 110.38 1uhp s SER 2 Ca 0.00 -0.41 -0.17 0.00 0.70 0.00 0.00 55.95 56.07 1uhp s SER 2 Cb 0.00 0.36 0.21 0.00 -1.71 0.00 0.00 66.02 64.88 1uhp s SER 2 CO 0.00 -0.35 1.28 -0.55 1.20 0.00 0.00 173.24 174.83 1uhp s SER 3 N 2.32 -0.06 -0.12 5.45 0.15 -1.26 -5.17 113.70 115.00 1uhp s SER 3 Ca 0.08 0.10 -0.09 0.00 0.70 0.00 0.00 55.95 56.74 1uhp s SER 3 Cb -0.15 0.90 0.04 0.00 -1.71 0.00 0.00 66.02 65.10 1uhp s SER 3 CO -0.18 -0.02 0.31 -0.83 1.20 0.00 0.00 173.24 173.72 1uhp s GLY 4 N 0.91 -0.23 0.19 9.45 0.00 -1.26 -5.02 107.32 111.37 1uhp s GLY 4 Ca -0.06 1.03 0.00 0.00 0.00 0.00 0.00 44.72 45.69 1uhp s GLY 4 CO -0.11 1.06 0.00 -1.26 0.00 0.00 0.00 173.10 172.80 1uhp n SER 5 N 3.52 -1.70 -4.62 1.64 2.88 -1.26 -5.15 113.62 108.94 1uhp n SER 5 Ca -0.18 0.63 -0.29 0.00 -1.33 0.00 0.00 58.87 57.69 1uhp n SER 5 Cb 0.56 1.85 0.19 0.00 -0.75 0.00 0.00 64.21 66.06 1uhp n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1uhp s SER 6 N -1.91 2.31 0.00 -3.46 0.15 -1.26 -5.05 113.70 104.48 1uhp s SER 6 Ca 0.00 1.66 0.00 0.00 0.70 0.00 0.00 55.95 58.31 1uhp s SER 6 Cb 0.00 -2.31 0.00 0.00 -1.71 0.00 0.00 66.02 62.00 1uhp s SER 6 CO 0.00 -3.40 0.00 0.61 1.20 0.00 0.00 173.24 171.65 1uhp n GLY 7 N -0.05 0.71 3.44 9.45 0.00 -1.26 -5.07 105.19 112.40 1uhp n GLY 7 Ca 0.06 -1.60 -0.29 0.00 0.00 0.00 0.00 46.02 44.19 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 0.63 1.61 -0.17 1.61 3.01 -1.17 -4.97 119.74 120.30 1uhp s LYS 8 Ca 0.00 -1.25 -0.05 0.00 -1.01 0.00 0.00 55.97 53.66 1uhp s LYS 8 Cb 0.00 -2.01 -0.03 0.00 -1.01 0.00 0.00 37.83 34.78 1uhp s LYS 8 CO 0.00 0.47 -0.01 -1.54 0.51 0.00 0.00 175.35 174.78 1uhp s SER 9 N -2.04 4.96 0.18 2.83 1.04 -1.26 -1.42 113.70 117.99 1uhp s SER 9 Ca 0.16 -0.10 0.08 0.00 0.48 0.00 0.00 55.95 56.56 1uhp s SER 9 Cb -0.10 -1.83 -0.04 0.00 0.10 0.00 0.00 66.02 64.15 1uhp s SER 9 CO 0.08 0.15 -0.16 -0.76 0.98 0.00 0.00 173.24 173.53 1uhp s LEU 10 N 0.48 2.49 -0.06 2.42 1.43 -0.74 -4.99 118.68 119.71 1uhp s LEU 10 Ca -0.02 -0.93 0.01 0.00 -1.03 0.00 0.00 54.13 52.16 1uhp s LEU 10 Cb -0.14 -0.71 -0.03 0.00 0.03 0.00 0.00 46.19 45.34 1uhp s LEU 10 CO 0.02 -0.12 -0.05 -0.89 0.23 0.00 0.00 176.35 175.54 1uhp s THR 11 N -2.50 3.83 -0.01 5.49 2.01 -1.26 -1.80 115.64 121.40 1uhp s THR 11 Ca 0.18 -0.49 0.00 0.00 0.31 0.00 0.00 61.69 61.69 1uhp s THR 11 Cb -0.03 -2.60 0.01 0.00 0.01 0.00 0.00 72.50 69.89 1uhp s THR 11 CO 0.06 0.56 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.78 1uhp s LEU 12 N -0.96 1.71 -0.32 4.42 1.02 0.56 -4.97 118.68 120.15 1uhp s LEU 12 Ca 0.14 -0.02 -0.13 0.00 0.02 0.00 0.00 54.13 54.14 1uhp s LEU 12 Cb -0.11 -0.10 -0.03 0.00 0.02 0.00 0.00 46.19 45.97 1uhp s LEU 12 CO 0.03 -0.02 0.28 0.54 0.02 0.00 0.00 176.35 177.19 1uhp s VAL 13 N 0.32 5.25 0.15 -1.59 0.11 -1.19 0.12 120.40 123.57 1uhp s VAL 13 Ca -0.03 0.04 0.04 0.00 -2.93 0.00 0.00 61.98 59.10 1uhp s VAL 13 Cb -0.05 -3.70 -0.04 0.00 -1.53 0.00 0.00 36.38 31.07 1uhp s VAL 13 CO -0.01 0.05 0.18 -0.76 -3.33 0.00 0.00 175.10 171.23 1uhp s LEU 14 N 1.86 3.97 0.22 2.54 1.43 0.59 -3.77 118.68 125.52 1uhp s LEU 14 Ca 0.09 -0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.18 1uhp s LEU 14 Cb -0.17 -2.58 -0.05 0.00 0.03 0.00 0.00 46.19 43.43 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 -1.72 1.41 -0.55 0.29 3.76 -1.26 -1.99 115.29 115.23 1uhp s HIS 15 Ca 0.32 -1.06 -0.02 0.00 -0.15 0.00 0.00 55.06 54.15 1uhp s HIS 15 Cb -0.11 -0.82 0.14 0.00 1.11 0.00 0.00 32.58 32.91 1uhp s HIS 15 CO 0.25 -0.22 0.35 1.03 -0.85 0.00 0.00 174.74 175.29 1uhp s ARG 16 N -3.95 2.32 -1.26 1.40 0.52 -1.26 -4.14 118.95 112.58 1uhp s ARG 16 Ca 0.30 -2.33 -0.15 0.00 -0.52 0.00 0.00 55.73 53.03 1uhp s ARG 16 Cb 0.07 -3.64 0.13 0.00 0.52 0.00 0.00 34.95 32.03 1uhp s ARG 16 CO 0.09 -1.13 1.63 -3.47 0.02 0.00 0.00 175.30 172.43 1uhp n ASP 17 N 3.77 5.03 -1.23 0.23 2.03 -1.23 -4.09 116.55 121.06 1uhp n ASP 17 Ca 0.05 -2.96 -0.00 0.00 0.52 0.00 0.00 54.79 52.39 1uhp n ASP 17 Cb 0.38 -1.62 0.00 0.00 -0.72 0.00 0.00 41.12 39.16 1uhp n ASP 17 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1uhp n SER 18 N 6.37 -2.02 -3.77 1.67 2.88 -1.26 -4.13 113.62 113.36 1uhp n SER 18 Ca 0.42 -0.01 -0.27 0.00 -1.33 0.00 0.00 58.87 57.68 1uhp n SER 18 Cb 0.43 -0.56 0.02 0.00 -0.75 0.00 0.00 64.21 63.35 1uhp n SER 18 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uhp n GLY 19 N -1.20 -0.58 3.14 0.46 0.00 -1.26 -4.96 105.19 100.80 1uhp n GLY 19 Ca -0.00 0.28 0.01 0.00 0.00 0.00 0.00 46.02 46.31 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 -3.97 -1.35 0.32 1.61 0.15 -1.26 -5.01 113.70 104.19 1uhp s SER 20 Ca 0.21 -0.69 0.10 0.00 0.70 0.00 0.00 55.95 56.27 1uhp s SER 20 Cb -0.07 1.73 0.91 0.00 -1.71 0.00 0.00 66.02 66.87 1uhp s SER 20 CO 0.86 -0.15 1.71 -0.07 1.20 0.00 0.00 173.24 176.79 1uhp h LEU 21 N 6.75 0.60 0.00 3.45 -0.00 -1.91 -3.26 115.31 120.94 1uhp h LEU 21 Ca 0.04 0.15 0.00 0.00 -0.00 0.00 0.00 57.88 58.07 1uhp h LEU 21 Cb 1.19 0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.92 1uhp h LEU 21 CO 0.07 0.04 0.00 0.61 -0.00 0.00 0.00 178.44 179.16 1uhp n GLY 22 N -1.31 0.79 3.91 0.83 0.00 -1.26 -3.13 105.19 105.02 1uhp n GLY 22 Ca 0.27 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.33 1uhp n GLY 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1uhp s PHE 23 N -1.51 0.00 0.14 1.61 -0.71 -1.26 -0.78 117.98 115.46 1uhp s PHE 23 Ca 0.00 -0.04 -0.03 0.00 -1.04 0.00 0.00 56.93 55.82 1uhp s PHE 23 Cb 0.00 0.52 -0.03 0.00 -1.21 0.00 0.00 43.02 42.30 1uhp s PHE 23 CO 0.00 -0.09 0.10 -0.80 -1.34 0.00 0.00 175.22 173.10 1uhp s ASN 24 N -3.69 0.25 0.24 1.98 -0.87 -1.01 -4.94 114.94 106.90 1uhp s ASN 24 Ca 0.27 -1.14 0.07 0.00 -1.57 0.00 0.00 52.86 50.50 1uhp s ASN 24 Cb 0.02 0.32 -0.05 0.00 -0.02 0.00 0.00 41.25 41.52 1uhp s ASN 24 CO -0.03 -0.76 -0.09 0.27 -2.57 0.00 0.00 177.10 173.91 1uhp s ILE 25 N -4.03 1.65 0.15 0.60 -4.36 -1.26 -3.29 121.20 110.67 1uhp s ILE 25 Ca 0.22 -2.16 0.03 0.00 -0.26 0.00 0.00 60.65 58.49 1uhp s ILE 25 Cb 0.07 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.47 1uhp s ILE 25 CO 0.01 -0.44 -0.06 0.27 0.24 0.00 0.00 174.94 174.97 1uhp s ILE 26 N -3.02 0.95 0.00 8.37 -4.36 0.18 -4.84 121.20 118.48 1uhp s ILE 26 Ca 0.26 -2.01 0.00 0.00 -0.26 0.00 0.00 60.65 58.64 1uhp s ILE 26 Cb 0.02 -1.92 0.00 0.00 1.25 0.00 0.00 42.46 41.81 1uhp s ILE 26 CO 0.09 -0.68 0.00 0.61 0.24 0.00 0.00 174.94 175.21 1uhp n GLY 27 N -0.19 -0.72 3.44 6.27 0.00 -1.25 -2.21 105.19 110.52 1uhp n GLY 27 Ca -0.09 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.50 1uhp n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uhp s GLY 28 N -0.26 -0.14 0.05 -0.02 0.00 -1.26 -3.09 107.32 102.59 1uhp s GLY 28 Ca 0.00 3.08 0.03 0.00 0.00 0.00 0.00 44.72 47.83 1uhp s GLY 28 CO 0.00 3.14 -0.10 0.50 0.00 0.00 0.00 173.10 176.64 1uhp s ARG 29 N 2.26 0.64 1.06 2.90 3.00 -1.26 -4.81 118.95 122.75 1uhp s ARG 29 Ca -0.04 -0.76 -0.17 0.00 0.00 0.00 0.00 55.73 54.76 1uhp s ARG 29 Cb -0.06 -0.52 0.23 0.00 0.00 0.00 0.00 34.95 34.61 1uhp s ARG 29 CO -0.17 0.11 1.21 -1.25 0.00 0.00 0.00 175.30 175.20 1uhp s PRO 30 N -1.45 -0.15 0.94 3.54 0.04 -1.26 -5.01 135.00 131.66 1uhp s PRO 30 Ca -0.06 -0.20 -0.12 0.00 0.04 0.00 0.00 61.00 60.67 1uhp s PRO 30 Cb -0.09 -1.73 0.16 0.00 0.04 0.00 0.00 34.50 32.87 1uhp s PRO 30 CO 0.01 -2.97 1.10 -1.12 0.04 0.00 0.00 177.00 174.05 1uhp s SER 31 N -4.37 3.11 -0.10 6.66 0.01 -1.26 -4.99 113.70 112.76 1uhp s SER 31 Ca 0.72 1.28 0.15 0.00 1.31 0.00 0.00 55.95 59.41 1uhp s SER 31 Cb -0.07 -1.95 -0.21 0.00 0.21 0.00 0.00 66.02 63.99 1uhp s SER 31 CO 0.54 -2.84 0.17 1.33 0.41 0.00 0.00 173.24 172.85 1uhp n VAL 32 N -3.99 0.66 0.00 3.43 0.24 -1.26 -5.03 118.33 112.38 1uhp n VAL 32 Ca 0.06 -0.55 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 1uhp n VAL 32 Cb 0.57 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.61 1uhp n VAL 32 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1uhp n ASP 33 N -2.39 0.00 0.00 -1.34 8.00 -1.26 -5.03 116.55 114.53 1uhp n ASP 33 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.33 1uhp n ASP 33 Cb 0.79 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.89 1uhp n ASP 33 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1uhp n ASN 34 N 0.00 0.00 -4.64 -2.24 5.15 -1.26 -5.10 115.26 107.17 1uhp n ASN 34 Ca 0.00 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.56 1uhp n ASN 34 Cb 0.00 0.17 -0.03 0.00 -0.53 0.00 0.00 39.78 39.39 1uhp n ASN 34 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 1uhp s HIS 35 N -1.53 1.23 0.26 1.20 3.76 -1.26 -4.95 115.29 114.00 1uhp s HIS 35 Ca 0.00 -0.13 -0.14 0.00 -0.15 0.00 0.00 55.06 54.64 1uhp s HIS 35 Cb 0.00 -4.14 -0.08 0.00 1.11 0.00 0.00 32.58 29.47 1uhp s HIS 35 CO 0.00 -5.09 0.66 -0.51 -0.85 0.00 0.00 174.74 168.95 1uhp s ASP 36 N 5.75 6.78 -0.31 1.40 1.11 -1.26 -4.96 116.67 125.18 1uhp s ASP 36 Ca 0.93 1.17 -0.09 0.00 0.18 0.00 0.00 52.55 54.74 1uhp s ASP 36 Cb -0.39 -2.33 0.19 0.00 1.07 0.00 0.00 42.92 41.45 1uhp s ASP 36 CO 0.39 -0.09 1.02 -0.83 1.18 0.00 0.00 175.17 176.84 1uhp s GLY 37 N -2.13 -1.22 0.32 0.21 0.00 -1.26 -5.12 107.32 98.11 1uhp s GLY 37 Ca 0.49 1.65 0.00 0.00 0.00 0.00 0.00 44.72 46.86 1uhp s GLY 37 CO 0.19 4.17 0.00 1.44 0.00 0.00 0.00 173.10 178.90 1uhp n SER 38 N 4.48 -8.76 -3.64 1.64 7.64 -1.26 -5.08 113.62 108.64 1uhp n SER 38 Ca 0.08 1.24 -0.02 0.00 1.01 0.00 0.00 58.87 61.18 1uhp n SER 38 Cb 0.60 -4.60 -0.07 0.00 -1.01 0.00 0.00 64.21 59.14 1uhp n SER 38 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1uhp s SER 39 N -1.60 -0.44 -0.19 6.43 1.04 -1.26 -5.15 113.70 112.54 1uhp s SER 39 Ca 0.00 0.71 -0.04 0.00 0.48 0.00 0.00 55.95 57.10 1uhp s SER 39 Cb 0.00 1.14 0.09 0.00 0.10 0.00 0.00 66.02 67.35 1uhp s SER 39 CO 0.00 -0.11 0.23 -0.44 0.98 0.00 0.00 173.24 173.90 1uhp s SER 40 N 1.20 1.11 0.22 7.02 0.01 -1.26 -5.15 113.70 116.85 1uhp s SER 40 Ca -0.08 -0.03 0.08 0.00 1.31 0.00 0.00 55.95 57.23 1uhp s SER 40 Cb -0.04 0.47 -0.04 0.00 0.21 0.00 0.00 66.02 66.62 1uhp s SER 40 CO -0.14 -0.31 0.04 -1.61 0.41 0.00 0.00 173.24 171.64 1uhp s GLU 41 N 2.35 2.48 -0.08 12.44 8.01 -1.26 -5.11 118.70 137.53 1uhp s GLU 41 Ca 0.06 -1.21 -0.06 0.00 0.01 0.00 0.00 54.97 53.77 1uhp s GLU 41 Cb -0.15 -2.33 0.03 0.00 -4.31 0.00 0.00 34.13 27.37 1uhp s GLU 41 CO -0.11 0.41 0.21 0.20 0.01 0.00 0.00 175.26 175.98 1uhp s GLY 42 N -3.40 -0.14 -0.29 -1.39 0.00 -1.26 -4.31 107.32 96.53 1uhp s GLY 42 Ca 0.30 0.72 -0.10 0.00 0.00 0.00 0.00 44.72 45.63 1uhp s GLY 42 CO 0.20 0.77 0.17 -0.42 0.00 0.00 0.00 173.10 173.82 1uhp s ILE 43 N 0.53 5.01 0.08 0.90 -1.09 -1.24 -3.85 121.20 121.53 1uhp s ILE 43 Ca -0.03 -0.03 0.03 0.00 -2.23 0.00 0.00 60.65 58.39 1uhp s ILE 43 Cb -0.05 -3.42 -0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1uhp s ILE 43 CO -0.03 0.21 -0.10 -0.36 -1.23 0.00 0.00 174.94 173.44 1uhp s PHE 44 N 1.71 0.95 -0.19 3.97 0.40 -0.94 -2.52 117.98 121.36 1uhp s PHE 44 Ca 0.06 -0.60 -0.20 0.00 -0.60 0.00 0.00 56.93 55.60 1uhp s PHE 44 Cb -0.16 -0.54 -0.03 0.00 0.51 0.00 0.00 43.02 42.80 1uhp s PHE 44 CO 0.09 -0.03 0.59 0.08 0.70 0.00 0.00 175.22 176.64 1uhp s VAL 45 N -2.03 5.06 -0.01 -0.44 1.01 -0.64 0.49 120.40 123.84 1uhp s VAL 45 Ca -0.00 1.10 0.07 0.00 0.00 0.00 0.00 61.98 63.16 1uhp s VAL 45 Cb -0.05 -3.91 -0.11 0.00 0.00 0.00 0.00 36.38 32.31 1uhp s VAL 45 CO 0.00 0.15 0.15 -0.24 0.00 0.00 0.00 175.10 175.16 1uhp n SER 46 N 4.83 3.34 -4.12 3.32 2.88 -1.21 0.17 113.62 122.84 1uhp n SER 46 Ca -0.03 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.37 1uhp n SER 46 Cb 0.50 1.28 -0.11 0.00 -0.75 0.00 0.00 64.21 65.13 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 -2.48 0.70 -0.28 -1.46 2.20 -1.26 -4.88 119.74 112.29 1uhp s LYS 47 Ca -0.03 -0.97 -0.03 0.00 -0.36 0.00 0.00 55.97 54.58 1uhp s LYS 47 Cb 0.04 -0.41 0.16 0.00 -1.51 0.00 0.00 37.83 36.11 1uhp s LYS 47 CO 0.30 0.07 0.53 0.42 -0.36 0.00 0.00 175.35 176.30 1uhp s ILE 48 N -1.98 -0.86 0.56 5.43 1.01 -1.26 -2.41 121.20 121.70 1uhp s ILE 48 Ca -0.02 -0.01 -0.19 0.00 0.00 0.00 0.00 60.65 60.43 1uhp s ILE 48 Cb -0.06 -0.92 -0.05 0.00 0.01 0.00 0.00 42.46 41.44 1uhp s ILE 48 CO -0.00 -0.03 1.16 0.68 0.00 0.00 0.00 174.94 176.75 1uhp s VAL 49 N 2.75 2.94 0.00 2.92 -7.23 0.04 -4.95 120.40 116.87 1uhp s VAL 49 Ca 0.14 0.59 0.00 0.00 -1.81 0.00 0.00 61.98 60.90 1uhp s VAL 49 Cb -0.15 -3.24 0.00 0.00 0.56 0.00 0.00 36.38 33.56 1uhp s VAL 49 CO -0.19 -0.12 0.05 0.47 -0.31 0.00 0.00 175.10 175.00 1uhp n ASP 50 N -1.40 0.00 -0.26 4.85 9.92 -1.26 -3.87 116.55 124.52 1uhp n ASP 50 Ca 0.12 0.06 0.02 0.00 -0.53 0.00 0.00 54.79 54.46 1uhp n ASP 50 Cb 0.50 -0.01 0.06 0.00 -0.64 0.00 0.00 41.12 41.04 1uhp n ASP 50 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1uhp n SER 51 N -0.53 -0.36 -2.84 -2.24 7.64 -1.26 -3.84 113.62 110.19 1uhp n SER 51 Ca 0.00 1.23 -0.26 0.00 1.01 0.00 0.00 58.87 60.84 1uhp n SER 51 Cb 0.00 -0.33 0.01 0.00 -1.01 0.00 0.00 64.21 62.88 1uhp n SER 51 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uhp n GLY 52 N -1.39 -2.15 0.04 0.23 0.00 -1.26 -4.55 105.19 96.11 1uhp n GLY 52 Ca 0.09 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 1.01 0.08 0.14 1.61 -0.04 -1.26 -1.92 135.00 134.63 1uhp n PRO 53 Ca 0.05 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1uhp n PRO 53 Cb 0.31 -1.63 0.18 0.00 -0.04 0.00 0.00 33.50 32.33 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 2.62 0.92 0.06 0.55 0.00 -1.82 1.13 119.26 122.73 1uhp h ALA 54 Ca 0.00 -0.53 -0.37 0.00 0.00 0.00 0.00 54.91 54.01 1uhp h ALA 54 Cb 0.44 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1uhp h ALA 54 CO 0.00 0.73 -2.15 0.00 0.00 0.00 0.00 179.25 177.83 1uhp n ALA 55 N -2.38 1.18 -1.00 0.00 0.00 -1.06 -2.18 120.51 115.08 1uhp n ALA 55 Ca -0.01 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1uhp n ALA 55 Cb 0.62 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.59 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 -3.30 0.00 -0.05 0.00 4.76 -0.81 -4.42 118.16 114.34 1uhp n LYS 56 Ca -0.35 0.06 0.02 0.00 -2.87 0.00 0.00 58.31 55.17 1uhp n LYS 56 Cb 1.04 -0.84 -0.16 0.00 -1.84 0.00 0.00 35.03 33.24 1uhp n LYS 56 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1uhp n GLU 57 N -0.39 0.72 -0.20 1.97 1.02 -1.03 -4.56 120.64 118.17 1uhp n GLU 57 Ca 0.00 -0.11 -0.03 0.00 -0.02 0.00 0.00 57.16 57.00 1uhp n GLU 57 Cb 0.00 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 29.90 1uhp n GLU 57 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1uhp n GLY 58 N 1.53 -1.15 0.67 0.62 0.00 0.39 -4.68 105.19 102.57 1uhp n GLY 58 Ca -0.16 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 -1.17 1.32 3.33 -0.02 0.00 -0.92 -3.13 105.19 104.59 1uhp n GLY 59 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1uhp n GLY 59 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1uhp n LEU 60 N 0.00 -1.95 -3.60 0.99 7.94 -1.16 -5.04 117.00 114.18 1uhp n LEU 60 Ca 0.00 -0.09 -0.03 0.00 -1.11 0.00 0.00 56.01 54.78 1uhp n LEU 60 Cb 0.00 -1.04 -0.06 0.00 0.53 0.00 0.00 43.42 42.85 1uhp n LEU 60 CO 0.00 -3.16 0.52 -1.10 -1.11 0.00 0.00 177.39 172.54 1uhp s GLN 61 N -3.66 0.48 0.48 1.96 -0.21 -1.26 -4.90 119.66 112.55 1uhp s GLN 61 Ca 0.59 0.93 -0.19 0.00 0.02 0.00 0.00 55.36 56.71 1uhp s GLN 61 Cb -0.15 0.27 -0.14 0.00 1.00 0.00 0.00 33.01 33.99 1uhp s GLN 61 CO 0.66 -0.12 0.02 -0.89 -2.12 0.00 0.00 175.29 172.84 1uhp n ILE 62 N 4.35 0.45 -2.70 1.08 5.41 -1.26 -2.09 119.36 124.59 1uhp n ILE 62 Ca -0.16 -0.50 -0.13 0.00 1.00 0.00 0.00 62.75 62.96 1uhp n ILE 62 Cb 0.56 -0.08 0.02 0.00 -0.71 0.00 0.00 39.64 39.42 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 -1.37 -1.12 -4.06 1.39 8.25 0.45 -4.95 115.22 113.81 1uhp n HIS 63 Ca 0.09 0.31 -0.34 0.00 -0.26 0.00 0.00 57.72 57.52 1uhp n HIS 63 Cb 0.45 -2.98 -0.15 0.00 1.12 0.00 0.00 29.99 28.42 1uhp n HIS 63 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1uhp s ASP 64 N -2.85 3.52 -0.51 0.41 1.01 -0.89 -4.88 116.67 112.48 1uhp s ASP 64 Ca 0.18 -0.62 -0.25 0.00 0.71 0.00 0.00 52.55 52.57 1uhp s ASP 64 Cb -0.08 -1.56 0.03 0.00 1.01 0.00 0.00 42.92 42.33 1uhp s ASP 64 CO 0.22 -0.02 0.94 -0.60 0.21 0.00 0.00 175.17 175.92 1uhp s ARG 65 N 1.33 3.42 0.34 8.23 3.52 -1.26 -1.61 118.95 132.93 1uhp s ARG 65 Ca 0.05 -0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.30 1uhp s ARG 65 Cb -0.14 -3.99 -0.11 0.00 -1.56 0.00 0.00 34.95 29.15 1uhp s ARG 65 CO -0.10 -1.37 1.42 0.42 -0.81 0.00 0.00 175.30 174.86 1uhp s ILE 66 N 3.88 2.36 -0.19 4.11 1.01 -1.05 -2.24 121.20 129.09 1uhp s ILE 66 Ca 0.34 0.36 -0.05 0.00 0.00 0.00 0.00 60.65 61.29 1uhp s ILE 66 Cb -0.11 -3.23 -0.10 0.00 0.01 0.00 0.00 42.46 39.03 1uhp s ILE 66 CO 0.23 0.08 -0.21 -0.38 0.00 0.00 0.00 174.94 174.66 1uhp n ILE 67 N 0.86 1.04 -3.81 2.92 2.08 0.36 -3.87 119.36 118.93 1uhp n ILE 67 Ca 0.01 -0.32 -0.12 0.00 0.56 0.00 0.00 62.75 62.89 1uhp n ILE 67 Cb 0.40 -1.51 -0.09 0.00 -0.75 0.00 0.00 39.64 37.69 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 -2.35 0.65 -0.07 0.38 2.56 -1.22 -2.64 118.70 116.00 1uhp s GLU 68 Ca -0.26 -0.38 -0.03 0.00 0.00 0.00 0.00 54.97 54.31 1uhp s GLU 68 Cb 0.09 0.28 0.04 0.00 2.00 0.00 0.00 34.13 36.53 1uhp s GLU 68 CO 0.37 -0.18 0.08 0.54 -0.56 0.00 0.00 175.26 175.51 1uhp s VAL 69 N -1.77 -0.13 -1.45 3.70 0.11 0.40 -0.49 120.40 120.77 1uhp s VAL 69 Ca -0.11 0.30 0.00 0.00 -2.93 0.00 0.00 61.98 59.24 1uhp s VAL 69 Cb -0.04 -0.26 0.00 0.00 -1.53 0.00 0.00 36.38 34.55 1uhp s VAL 69 CO 0.01 0.09 0.00 -3.20 -3.33 0.00 0.00 175.10 168.67 1uhp n ASN 70 N 5.30 -4.99 0.00 3.54 2.85 0.58 0.13 115.26 122.67 1uhp n ASN 70 Ca -0.04 0.34 0.00 0.00 -0.11 0.00 0.00 54.58 54.77 1uhp n ASN 70 Cb 0.50 -4.04 0.00 0.00 1.24 0.00 0.00 39.78 37.48 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 -0.02 0.34 3.70 8.20 0.00 -1.25 -4.88 105.19 111.27 1uhp n GLY 71 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.94 4.25 0.20 1.61 0.52 0.35 -5.05 118.95 119.88 1uhp s ARG 72 Ca 0.00 0.30 -0.30 0.00 -0.52 0.00 0.00 55.73 55.21 1uhp s ARG 72 Cb 0.00 -3.49 -0.08 0.00 0.52 0.00 0.00 34.95 31.91 1uhp s ARG 72 CO 0.00 0.06 0.98 0.34 0.02 0.00 0.00 175.30 176.70 1uhp s ASP 73 N 0.81 7.53 0.00 0.23 -1.08 -1.26 0.15 116.67 123.05 1uhp s ASP 73 Ca 0.22 1.94 0.08 0.00 -0.52 0.00 0.00 52.55 54.28 1uhp s ASP 73 Cb -0.15 -2.60 0.14 0.00 -1.46 0.00 0.00 42.92 38.85 1uhp s ASP 73 CO 0.08 0.02 1.00 0.18 0.52 0.00 0.00 175.17 176.97 1uhp n LEU 74 N 1.97 0.25 -0.08 -1.34 4.77 -1.08 -4.74 117.00 116.75 1uhp n LEU 74 Ca -0.00 -1.40 -0.12 0.00 -0.03 0.00 0.00 56.01 54.45 1uhp n LEU 74 Cb 0.47 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.52 1uhp n LEU 74 CO 0.51 0.52 0.66 0.77 -1.33 0.00 0.00 177.39 178.52 1uhp h SER 75 N 0.33 0.52 -0.27 -1.43 4.64 -1.67 -3.24 113.55 112.43 1uhp h SER 75 Ca -0.12 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 1uhp h SER 75 Cb 1.52 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1uhp h SER 75 CO 0.01 0.81 0.00 -2.11 -0.87 0.00 0.00 176.83 174.67 1uhp n ARG 76 N -4.50 2.75 -1.56 4.77 1.85 -1.26 -3.71 116.66 114.99 1uhp n ARG 76 Ca -0.04 -1.90 -0.29 0.00 -1.00 0.00 0.00 57.85 54.62 1uhp n ARG 76 Cb 0.34 -1.22 0.16 0.00 -1.05 0.00 0.00 32.46 30.70 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 -0.99 1.71 0.18 2.89 0.00 -1.22 -4.48 121.76 119.86 1uhp s ALA 77 Ca 0.18 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.41 1uhp s ALA 77 Cb 0.10 -2.94 -0.03 0.00 0.00 0.00 0.00 23.12 20.24 1uhp s ALA 77 CO 0.13 -2.53 0.27 0.95 0.00 0.00 0.00 175.76 174.58 1uhp s THR 78 N -3.39 5.11 0.59 0.00 -4.23 -1.26 -4.33 115.64 108.12 1uhp s THR 78 Ca 0.67 -0.88 0.29 0.00 -1.18 0.00 0.00 61.69 60.59 1uhp s THR 78 Cb -0.11 -3.68 0.40 0.00 1.34 0.00 0.00 72.50 70.45 1uhp s THR 78 CO 0.53 -0.18 1.76 -0.74 -0.54 0.00 0.00 174.62 175.46 1uhp h HIS 79 N 1.87 0.00 -0.06 3.99 2.76 -1.85 0.76 115.15 122.61 1uhp h HIS 79 Ca -0.49 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 57.60 1uhp h HIS 79 Cb 1.21 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.17 1uhp h HIS 79 CO 0.52 0.00 -0.28 -0.44 -1.30 0.00 0.00 177.93 176.43 1uhp h ASP 80 N 0.00 0.35 0.37 3.26 3.32 -1.93 -1.84 116.42 119.96 1uhp h ASP 80 Ca 0.31 -0.65 -0.02 0.00 0.02 0.00 0.00 57.03 56.69 1uhp h ASP 80 Cb 1.66 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 41.11 1uhp h ASP 80 CO -0.00 0.94 -0.18 1.56 -1.72 0.00 0.00 179.24 179.84 1uhp h GLN 81 N -0.21 -0.47 -0.41 3.56 4.20 -0.01 -0.57 115.11 121.19 1uhp h GLN 81 Ca -0.02 0.03 0.09 0.00 0.06 0.00 0.00 58.65 58.81 1uhp h GLN 81 Cb 0.93 0.11 -0.09 0.00 0.30 0.00 0.00 27.48 28.73 1uhp h GLN 81 CO 0.06 -0.18 -0.21 0.00 -0.67 0.00 0.00 178.83 177.83 1uhp h ALA 82 N -0.25 0.09 0.06 3.87 0.00 -0.80 0.71 119.26 122.95 1uhp h ALA 82 Ca -0.05 0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1uhp h ALA 82 Cb 0.51 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 1uhp h ALA 82 CO 0.08 -0.57 -0.33 0.28 0.00 0.00 0.00 179.25 178.71 1uhp h VAL 83 N -0.13 0.29 -0.70 0.00 2.07 -1.29 0.51 116.25 117.00 1uhp h VAL 83 Ca 0.20 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.83 1uhp h VAL 83 Cb 0.44 0.29 -0.08 0.00 -1.52 0.00 0.00 31.29 30.42 1uhp h VAL 83 CO -0.49 0.00 0.30 -0.08 0.02 0.00 0.00 177.57 177.32 1uhp h GLU 84 N -0.52 0.48 0.01 1.57 4.81 0.16 0.47 114.58 121.56 1uhp h GLU 84 Ca 0.04 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1uhp h GLU 84 Cb 0.58 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1uhp h GLU 84 CO -0.23 0.32 -0.26 0.00 -0.73 0.00 0.00 179.01 178.10 1uhp h ALA 85 N 1.47 -0.36 0.00 2.92 0.00 0.15 1.31 119.26 124.75 1uhp h ALA 85 Ca 0.36 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 1uhp h ALA 85 Cb 0.47 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1uhp h ALA 85 CO -0.33 -0.77 -0.16 0.74 0.00 0.00 0.00 179.25 178.74 1uhp h PHE 86 N -0.40 0.00 -0.02 0.00 0.04 0.12 1.12 116.94 117.79 1uhp h PHE 86 Ca 0.06 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.72 1uhp h PHE 86 Cb 0.49 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.64 1uhp h PHE 86 CO -0.29 0.16 -0.43 -0.22 -0.60 0.00 0.00 178.31 176.93 1uhp h LYS 87 N 0.00 0.33 -0.03 1.51 3.64 0.18 -3.15 116.57 119.05 1uhp h LYS 87 Ca -0.00 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1uhp h LYS 87 Cb 0.35 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1uhp h LYS 87 CO 0.02 1.01 0.00 0.25 -2.27 0.00 0.00 179.45 178.46 1uhp n THR 88 N -4.35 0.02 -2.38 1.00 -2.24 0.43 -4.89 114.28 101.88 1uhp n THR 88 Ca -0.10 -0.20 -0.34 0.00 -2.27 0.00 0.00 64.05 61.14 1uhp n THR 88 Cb 0.58 0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 69.06 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 -1.98 2.78 0.18 6.98 0.00 0.38 -5.02 121.76 125.08 1uhp s ALA 89 Ca 0.39 0.68 0.11 0.00 0.00 0.00 0.00 51.96 53.14 1uhp s ALA 89 Cb 0.21 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 1uhp s ALA 89 CO 0.33 -0.55 -0.23 0.15 0.00 0.00 0.00 175.76 175.46 1uhp s LYS 90 N -3.33 1.44 0.12 0.00 -0.14 -1.26 -4.97 119.74 111.60 1uhp s LYS 90 Ca 0.69 -1.46 -0.17 0.00 -1.36 0.00 0.00 55.97 53.67 1uhp s LYS 90 Cb -0.19 -1.74 -0.07 0.00 -1.68 0.00 0.00 37.83 34.15 1uhp s LYS 90 CO 0.24 0.38 0.57 -1.21 -0.76 0.00 0.00 175.35 174.57 1uhp s GLU 91 N -2.58 4.10 0.29 1.68 2.02 -1.26 -2.53 118.70 120.42 1uhp s GLU 91 Ca 0.18 0.63 -0.29 0.00 0.02 0.00 0.00 54.97 55.51 1uhp s GLU 91 Cb -0.08 -3.06 -0.09 0.00 0.10 0.00 0.00 34.13 30.99 1uhp s GLU 91 CO 0.09 0.55 1.08 -1.25 0.02 0.00 0.00 175.26 175.74 1uhp s PRO 92 N -1.57 4.59 -0.42 0.39 0.04 -1.26 -5.12 135.00 131.65 1uhp s PRO 92 Ca 0.34 1.73 -0.19 0.00 0.04 0.00 0.00 61.00 62.92 1uhp s PRO 92 Cb -0.17 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.29 1uhp s PRO 92 CO 0.19 0.19 0.57 0.42 0.04 0.00 0.00 177.00 178.41 1uhp s ILE 93 N -1.24 4.92 -0.47 0.56 1.01 -0.84 -4.93 121.20 120.21 1uhp s ILE 93 Ca 0.46 0.07 -0.26 0.00 0.00 0.00 0.00 60.65 60.91 1uhp s ILE 93 Cb -0.30 -4.12 0.03 0.00 0.01 0.00 0.00 42.46 38.08 1uhp s ILE 93 CO 0.38 -0.48 0.99 -0.69 0.00 0.00 0.00 174.94 175.14 1uhp s VAL 94 N 2.59 4.39 0.13 2.92 1.01 -1.26 -0.30 120.40 129.88 1uhp s VAL 94 Ca 0.20 0.88 0.09 0.00 0.00 0.00 0.00 61.98 63.14 1uhp s VAL 94 Cb -0.15 -4.49 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 1uhp s VAL 94 CO 0.17 -0.89 -0.17 -0.69 0.00 0.00 0.00 175.10 173.52 1uhp s VAL 95 N 3.97 2.90 0.00 2.92 1.01 0.32 0.21 120.40 131.73 1uhp s VAL 95 Ca 0.40 -1.54 0.02 0.00 0.00 0.00 0.00 61.98 60.87 1uhp s VAL 95 Cb -0.09 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1uhp s VAL 95 CO 0.28 0.06 -0.07 -1.58 0.00 0.00 0.00 175.10 173.79 1uhp s GLN 96 N -2.27 0.58 0.22 2.72 0.74 0.35 0.21 119.66 122.21 1uhp s GLN 96 Ca 0.19 -0.31 0.04 0.00 0.05 0.00 0.00 55.36 55.33 1uhp s GLN 96 Cb -0.10 -0.54 -0.05 0.00 1.10 0.00 0.00 33.01 33.41 1uhp s GLN 96 CO 0.11 0.15 -0.01 0.14 -0.55 0.00 0.00 175.29 175.12 1uhp s VAL 97 N -0.29 1.05 -0.31 1.34 -7.23 -0.74 0.13 120.40 114.35 1uhp s VAL 97 Ca 0.02 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.16 1uhp s VAL 97 Cb -0.03 -2.31 0.08 0.00 0.56 0.00 0.00 36.38 34.68 1uhp s VAL 97 CO -0.00 -0.36 0.01 -0.76 -0.31 0.00 0.00 175.10 173.68 1uhp s LEU 98 N -3.30 4.20 0.00 1.32 1.02 -0.95 -1.80 118.68 119.18 1uhp s LEU 98 Ca 0.28 -1.69 0.01 0.00 0.02 0.00 0.00 54.13 52.75 1uhp s LEU 98 Cb 0.05 -1.65 -0.00 0.00 0.02 0.00 0.00 46.19 44.61 1uhp s LEU 98 CO 0.08 -0.31 -0.03 0.00 0.02 0.00 0.00 176.35 176.11 1uhp s ARG 99 N 1.08 0.26 1.01 1.70 1.70 -0.50 -4.34 118.95 119.86 1uhp s ARG 99 Ca 0.00 -0.15 -0.12 0.00 -0.47 0.00 0.00 55.73 54.99 1uhp s ARG 99 Cb -0.20 -0.24 0.15 0.00 -0.57 0.00 0.00 34.95 34.09 1uhp s ARG 99 CO -0.05 0.06 0.80 2.89 -1.08 0.00 0.00 175.30 177.93 1uhp n ARG 100 N 2.90 -1.02 -0.02 3.89 0.00 -1.26 -3.02 116.66 118.14 1uhp n ARG 100 Ca -0.13 -0.25 -0.17 0.00 -0.00 0.00 0.00 57.85 57.30 1uhp n ARG 100 Cb 0.59 -2.12 -0.08 0.00 -0.00 0.00 0.00 32.46 30.84 1uhp n ARG 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1uhp h THR 101 N -2.02 1.34 -3.76 8.89 1.03 -1.96 -3.45 112.91 112.98 1uhp h THR 101 Ca -0.49 -1.92 -0.51 0.00 -0.01 0.00 0.00 66.41 63.48 1uhp h THR 101 Cb 1.30 2.17 0.03 0.00 -1.07 0.00 0.00 68.15 70.58 1uhp h THR 101 CO 0.41 0.59 0.55 -0.55 -0.01 0.00 0.00 175.52 176.50 1uhp s SER 102 N -6.86 7.06 -0.29 0.00 0.15 -1.26 -5.03 113.70 107.47 1uhp s SER 102 Ca -0.12 2.41 -0.08 0.00 0.70 0.00 0.00 55.95 58.86 1uhp s SER 102 Cb 0.06 -2.63 0.14 0.00 -1.71 0.00 0.00 66.02 61.88 1uhp s SER 102 CO 0.86 -0.32 0.63 -0.83 1.20 0.00 0.00 173.24 174.77 1uhp s GLY 103 N -0.55 -0.75 1.03 9.45 0.00 -1.26 -5.16 107.32 110.08 1uhp s GLY 103 Ca 0.48 2.21 -0.16 0.00 0.00 0.00 0.00 44.72 47.24 1uhp s GLY 103 CO 0.44 3.08 1.20 2.56 0.00 0.00 0.00 173.10 180.37 1uhp s PRO 104 N 2.87 0.14 0.21 2.90 0.04 -1.26 -5.10 135.00 134.81 1uhp s PRO 104 Ca -0.01 -0.09 -0.01 0.00 0.04 0.00 0.00 61.00 60.93 1uhp s PRO 104 Cb -0.13 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 1uhp s PRO 104 CO -0.19 -2.80 0.12 -1.54 0.04 0.00 0.00 177.00 172.63 1uhp s SER 105 N -4.30 0.35 -0.19 6.66 1.04 -1.26 -5.03 113.70 110.97 1uhp s SER 105 Ca 0.70 -1.38 -0.08 0.00 0.48 0.00 0.00 55.95 55.66 1uhp s SER 105 Cb -0.09 0.34 0.03 0.00 0.10 0.00 0.00 66.02 66.40 1uhp s SER 105 CO 0.54 -0.82 0.17 -0.24 0.98 0.00 0.00 173.24 173.87 1uhp n SER 106 N -0.30 -2.90 0.00 7.02 2.88 -1.26 -5.38 113.62 113.68 1uhp n SER 106 Ca 0.01 1.30 0.00 0.00 -1.33 0.00 0.00 58.87 58.85 1uhp n SER 106 Cb 0.66 -4.78 0.00 0.00 -0.75 0.00 0.00 64.21 59.34 1uhp n SER 106 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42