#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u5s n GLY 2 N 0.00 -1.01 1.79 1.08 0.00 -1.26 -5.01 105.19 100.78 1u5s n GLY 2 Ca 0.00 0.73 -0.04 0.00 0.00 0.00 0.00 46.02 46.71 1u5s n GLY 2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u5s n SER 3 N 2.16 -1.13 -4.78 1.61 3.41 -1.26 -4.96 113.62 108.68 1u5s n SER 3 Ca 0.10 -1.96 -0.35 0.00 -0.26 0.00 0.00 58.87 56.40 1u5s n SER 3 Cb 0.64 0.46 -0.02 0.00 -0.26 0.00 0.00 64.21 65.02 1u5s n SER 3 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1u5s s ARG 4 N 0.06 3.77 -0.76 4.33 3.52 -1.26 -4.88 118.95 123.73 1u5s s ARG 4 Ca 0.04 1.51 -0.26 0.00 -0.13 0.00 0.00 55.73 56.90 1u5s s ARG 4 Cb 0.21 -2.22 -0.07 0.00 -1.56 0.00 0.00 34.95 31.32 1u5s s ARG 4 CO -0.06 -0.48 2.11 0.08 -0.81 0.00 0.00 175.30 176.14 1u5s s VAL 5 N -1.80 3.26 0.05 7.11 1.01 -1.26 -4.51 120.40 124.26 1u5s s VAL 5 Ca 0.66 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.53 1u5s s VAL 5 Cb -0.21 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1u5s s VAL 5 CO 0.25 -0.57 0.00 0.18 0.00 0.00 0.00 175.10 174.96 1u5s n LEU 6 N 15.23 0.44 -3.13 3.92 4.77 -1.26 -4.83 117.00 132.14 1u5s n LEU 6 Ca 0.37 0.07 -0.20 0.00 -0.03 0.00 0.00 56.01 56.22 1u5s n LEU 6 Cb 0.48 -0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.40 1u5s n LEU 6 CO 0.62 -0.34 -0.18 1.41 -1.33 0.00 0.00 177.39 177.57 1u5s n HIS 7 N -3.20 -1.40 -1.43 -1.77 8.25 -1.26 -1.54 115.22 112.88 1u5s n HIS 7 Ca 0.00 -2.95 -0.32 0.00 -0.26 0.00 0.00 57.72 54.19 1u5s n HIS 7 Cb 0.27 0.34 0.08 0.00 1.12 0.00 0.00 29.99 31.80 1u5s n HIS 7 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1u5s s VAL 8 N -0.30 3.24 -0.09 1.59 1.01 -1.26 -4.24 120.40 120.36 1u5s s VAL 8 Ca 0.33 0.47 -0.05 0.00 0.00 0.00 0.00 61.98 62.74 1u5s s VAL 8 Cb 0.12 -2.96 0.04 0.00 0.00 0.00 0.00 36.38 33.59 1u5s s VAL 8 CO -0.15 -0.46 0.21 0.68 0.00 0.00 0.00 175.10 175.37 1u5s s VAL 9 N -2.67 -0.04 -0.20 2.92 -7.23 -1.15 -1.35 120.40 110.68 1u5s s VAL 9 Ca 0.64 0.14 -0.10 0.00 -1.81 0.00 0.00 61.98 60.84 1u5s s VAL 9 Cb -0.19 -0.32 -0.05 0.00 0.56 0.00 0.00 36.38 36.38 1u5s s VAL 9 CO 0.50 0.06 0.14 -1.10 -0.31 0.00 0.00 175.10 174.39 1u5s s GLN 10 N 1.06 4.17 0.72 4.82 -1.52 -1.16 -1.91 119.66 125.84 1u5s s GLN 10 Ca -0.08 -0.21 -0.15 0.00 -1.95 0.00 0.00 55.36 52.97 1u5s s GLN 10 Cb -0.09 -3.44 0.04 0.00 -0.22 0.00 0.00 33.01 29.29 1u5s s GLN 10 CO -0.06 0.26 1.19 0.99 -0.25 0.00 0.00 175.29 177.42 1u5s s THR 11 N 0.48 2.43 -0.08 -0.19 2.01 -1.24 -2.83 115.64 116.22 1u5s s THR 11 Ca 0.08 0.21 0.06 0.00 0.31 0.00 0.00 61.69 62.36 1u5s s THR 11 Cb -0.12 -2.77 -0.09 0.00 0.01 0.00 0.00 72.50 69.54 1u5s s THR 11 CO -0.01 -0.12 0.17 0.18 -0.69 0.00 0.00 174.62 174.16 1u5s n LEU 12 N -2.70 0.08 -3.76 4.42 4.77 -1.16 -4.13 117.00 114.52 1u5s n LEU 12 Ca 0.13 -0.14 -0.13 0.00 -0.03 0.00 0.00 56.01 55.84 1u5s n LEU 12 Cb 0.50 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 1u5s n LEU 12 CO 0.48 0.02 0.01 -0.31 -1.33 0.00 0.00 177.39 176.26 1u5s s TYR 13 N -2.20 -0.27 -1.19 -1.77 2.02 -1.26 -5.01 117.35 107.68 1u5s s TYR 13 Ca -0.01 0.58 -0.22 0.00 -0.37 0.00 0.00 57.07 57.05 1u5s s TYR 13 Cb 0.04 0.11 -0.04 0.00 -0.40 0.00 0.00 41.96 41.68 1u5s s TYR 13 CO 0.26 -0.29 1.86 -1.25 -1.57 0.00 0.00 175.55 174.56 1u5s s PRO 14 N -0.59 2.95 0.98 -1.71 0.04 -1.26 -4.26 135.00 131.15 1u5s s PRO 14 Ca -0.07 -1.32 -0.13 0.00 0.04 0.00 0.00 61.00 59.53 1u5s s PRO 14 Cb -0.04 -5.31 0.18 0.00 0.04 0.00 0.00 34.50 29.37 1u5s s PRO 14 CO 0.02 -3.39 1.11 0.12 0.04 0.00 0.00 177.00 174.91 1u5s s PHE 15 N 8.83 2.18 -0.17 0.56 5.36 -1.03 -4.84 117.98 128.87 1u5s s PHE 15 Ca 0.64 0.90 -0.04 0.00 -0.96 0.00 0.00 56.93 57.47 1u5s s PHE 15 Cb 0.00 -3.33 0.06 0.00 -0.34 0.00 0.00 43.02 39.41 1u5s s PHE 15 CO 0.10 -2.78 0.06 -1.12 -1.46 0.00 0.00 175.22 170.02 1u5s s SER 16 N -3.69 2.45 -0.17 6.13 0.01 -1.26 -3.38 113.70 113.78 1u5s s SER 16 Ca 0.65 -0.62 -0.02 0.00 1.31 0.00 0.00 55.95 57.26 1u5s s SER 16 Cb -0.17 -0.38 0.05 0.00 0.21 0.00 0.00 66.02 65.74 1u5s s SER 16 CO 0.56 -0.32 0.02 -0.55 0.41 0.00 0.00 173.24 173.36 1u5s s SER 17 N 2.03 2.70 -0.38 2.44 0.15 -1.25 -4.94 113.70 114.45 1u5s s SER 17 Ca 0.01 -0.70 0.01 0.00 0.70 0.00 0.00 55.95 55.98 1u5s s SER 17 Cb -0.16 -0.60 0.12 0.00 -1.71 0.00 0.00 66.02 63.67 1u5s s SER 17 CO -0.08 -0.28 0.17 0.68 1.20 0.00 0.00 173.24 174.93 1u5s s VAL 18 N 1.86 1.21 0.00 4.45 -7.23 -1.26 -2.05 120.40 117.37 1u5s s VAL 18 Ca 0.00 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.10 1u5s s VAL 18 Cb -0.16 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 34.91 1u5s s VAL 18 CO -0.07 -0.80 0.00 0.41 -0.31 0.00 0.00 175.10 174.33 1u5s n THR 19 N 4.10 0.00 -0.07 5.32 -1.04 -1.26 -4.97 114.28 116.36 1u5s n THR 19 Ca 0.04 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.96 1u5s n THR 19 Cb 0.38 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.82 1u5s n THR 19 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1u5s h GLU 20 N 0.00 0.00 -0.52 -2.82 3.07 -2.00 -3.37 114.58 108.93 1u5s h GLU 20 Ca 0.00 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.60 1u5s h GLU 20 Cb 0.00 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 27.76 1u5s h GLU 20 CO 0.00 0.55 0.12 0.39 -1.40 0.00 0.00 179.01 178.67 1u5s n GLU 21 N -4.65 2.05 -3.94 2.33 -0.58 -1.26 -4.97 120.64 109.63 1u5s n GLU 21 Ca -0.09 -3.13 -0.30 0.00 -0.42 0.00 0.00 57.16 53.22 1u5s n GLU 21 Cb 0.32 -1.92 -0.04 0.00 -0.57 0.00 0.00 31.44 29.23 1u5s n GLU 21 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1u5s s GLU 22 N -3.24 3.39 -0.31 3.49 8.01 -1.26 0.15 118.70 128.93 1u5s s GLU 22 Ca 0.48 -0.49 -0.05 0.00 0.01 0.00 0.00 54.97 54.92 1u5s s GLU 22 Cb 0.42 -3.00 0.03 0.00 -4.31 0.00 0.00 34.13 27.28 1u5s s GLU 22 CO 0.03 0.59 0.05 -1.17 0.01 0.00 0.00 175.26 174.77 1u5s s LEU 23 N -2.64 3.98 -0.18 1.80 1.98 -1.10 -4.37 118.68 118.15 1u5s s LEU 23 Ca 0.34 -1.06 -0.15 0.00 -2.89 0.00 0.00 54.13 50.37 1u5s s LEU 23 Cb -0.13 -1.80 -0.04 0.00 0.66 0.00 0.00 46.19 44.88 1u5s s LEU 23 CO 0.28 -0.26 0.33 0.21 -1.89 0.00 0.00 176.35 175.02 1u5s s ASN 24 N 1.37 6.43 -0.14 3.68 3.04 -0.87 -3.78 114.94 124.66 1u5s s ASN 24 Ca -0.02 0.50 -0.17 0.00 0.04 0.00 0.00 52.86 53.21 1u5s s ASN 24 Cb -0.19 -2.20 0.04 0.00 -1.54 0.00 0.00 41.25 37.36 1u5s s ASN 24 CO 0.01 0.02 0.46 0.72 -3.04 0.00 0.00 177.10 175.27 1u5s s PHE 25 N 0.85 -0.47 0.46 0.43 -0.71 -1.22 -4.89 117.98 112.43 1u5s s PHE 25 Ca 0.17 1.10 -0.11 0.00 -1.04 0.00 0.00 56.93 57.05 1u5s s PHE 25 Cb -0.14 0.18 -0.06 0.00 -1.21 0.00 0.00 43.02 41.79 1u5s s PHE 25 CO 0.06 -0.29 0.85 -1.83 -1.34 0.00 0.00 175.22 172.67 1u5s s GLU 26 N -0.09 3.77 0.53 1.99 1.03 -1.26 -2.48 118.70 122.20 1u5s s GLU 26 Ca -0.03 0.59 -0.21 0.00 0.03 0.00 0.00 54.97 55.35 1u5s s GLU 26 Cb -0.03 -2.29 -0.07 0.00 -0.80 0.00 0.00 34.13 30.94 1u5s s GLU 26 CO 0.02 -0.17 1.07 0.36 -1.33 0.00 0.00 175.26 175.21 1u5s n LYS 27 N -1.64 1.25 -1.77 -4.83 -0.00 -1.26 -3.50 118.16 106.40 1u5s n LYS 27 Ca 0.04 0.46 0.00 0.00 -0.00 0.00 0.00 58.31 58.81 1u5s n LYS 27 Cb 0.54 -2.23 0.00 0.00 -0.00 0.00 0.00 35.03 33.34 1u5s n LYS 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1u5s n GLY 28 N 1.13 0.75 3.11 2.58 0.00 -1.26 -4.95 105.19 106.54 1u5s n GLY 28 Ca 0.11 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 1u5s n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1u5s s GLU 29 N -3.45 2.63 -0.43 1.61 -6.30 -1.23 -4.91 118.70 106.62 1u5s s GLU 29 Ca 0.00 -1.09 -0.28 0.00 -2.50 0.00 0.00 54.97 51.10 1u5s s GLU 29 Cb 0.00 -2.77 0.00 0.00 0.00 0.00 0.00 34.13 31.36 1u5s s GLU 29 CO 0.00 -0.40 1.54 0.99 0.02 0.00 0.00 175.26 177.41 1u5s s THR 30 N 1.21 3.75 -0.14 -1.70 2.01 -1.26 -3.64 115.64 115.86 1u5s s THR 30 Ca -0.02 0.73 -0.05 0.00 0.31 0.00 0.00 61.69 62.66 1u5s s THR 30 Cb -0.17 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 1u5s s THR 30 CO -0.08 -0.74 0.03 -0.04 -0.69 0.00 0.00 174.62 173.09 1u5s s MET 31 N 5.33 3.58 -0.57 4.92 -1.94 -0.80 0.35 119.30 130.17 1u5s s MET 31 Ca 0.65 -0.38 -0.21 0.00 -1.71 0.00 0.00 55.69 54.04 1u5s s MET 31 Cb -0.15 -3.03 0.07 0.00 2.01 0.00 0.00 34.83 33.73 1u5s s MET 31 CO 0.31 0.43 0.81 -1.83 -0.01 0.00 0.00 175.02 174.73 1u5s s GLU 32 N -0.11 3.16 -0.75 2.03 -1.05 0.88 -2.94 118.70 119.90 1u5s s GLU 32 Ca 0.05 -0.80 -0.26 0.00 -0.15 0.00 0.00 54.97 53.82 1u5s s GLU 32 Cb -0.12 -4.15 -0.10 0.00 -0.44 0.00 0.00 34.13 29.32 1u5s s GLU 32 CO 0.02 -1.50 2.26 0.08 0.95 0.00 0.00 175.26 177.07 1u5s s VAL 33 N 3.34 3.14 0.09 1.83 1.01 -1.26 -0.29 120.40 128.26 1u5s s VAL 33 Ca 0.20 -0.08 -0.23 0.00 0.00 0.00 0.00 61.98 61.87 1u5s s VAL 33 Cb -0.18 -3.32 -0.15 0.00 0.00 0.00 0.00 36.38 32.73 1u5s s VAL 33 CO 0.12 -0.31 1.73 0.40 0.00 0.00 0.00 175.10 177.05 1u5s h ILE 34 N 7.53 0.97 -3.67 2.22 2.04 -1.39 -3.46 117.51 121.75 1u5s h ILE 34 Ca -0.04 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 1u5s h ILE 34 Cb 1.06 0.97 -0.15 0.00 -0.74 0.00 0.00 36.82 37.95 1u5s h ILE 34 CO 1.10 0.00 -0.36 -0.70 0.00 0.00 0.00 178.15 178.18 1u5s s GLU 35 N -6.18 0.79 -0.44 2.37 2.56 0.88 -4.99 118.70 113.69 1u5s s GLU 35 Ca -0.13 -0.80 0.09 0.00 0.00 0.00 0.00 54.97 54.13 1u5s s GLU 35 Cb 0.06 0.32 0.29 0.00 2.00 0.00 0.00 34.13 36.81 1u5s s GLU 35 CO 0.66 -0.24 0.67 1.63 -0.56 0.00 0.00 175.26 177.41 1u5s n LYS 36 N 0.27 1.32 -1.54 4.30 4.01 -1.26 -0.38 118.16 124.88 1u5s n LYS 36 Ca -0.17 -3.65 -0.30 0.00 -0.51 0.00 0.00 58.31 53.69 1u5s n LYS 36 Cb 0.61 -1.63 0.10 0.00 -0.51 0.00 0.00 35.03 33.60 1u5s n LYS 36 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1u5s s PRO 37 N -2.02 1.94 -0.20 1.97 0.04 -1.26 -5.00 135.00 130.46 1u5s s PRO 37 Ca 0.39 0.60 -0.15 0.00 0.04 0.00 0.00 61.00 61.88 1u5s s PRO 37 Cb 0.24 -1.90 -0.20 0.00 0.04 0.00 0.00 34.50 32.67 1u5s s PRO 37 CO -0.09 -1.72 0.14 -1.91 0.04 0.00 0.00 177.00 173.47 1u5s n GLU 38 N -3.49 0.63 0.00 4.56 0.00 -1.26 -4.65 120.64 116.43 1u5s n GLU 38 Ca 0.07 0.42 0.00 0.00 0.00 0.00 0.00 57.16 57.65 1u5s n GLU 38 Cb 0.57 -1.69 0.00 0.00 0.00 0.00 0.00 31.44 30.32 1u5s n GLU 38 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1u5s n ASN 39 N -4.06 0.00 0.00 4.31 3.02 -1.26 -3.58 115.26 113.69 1u5s n ASN 39 Ca -0.36 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.19 1u5s n ASN 39 Cb 0.83 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.00 1u5s n ASN 39 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1u5s n ASP 40 N 0.00 0.00 0.28 6.41 9.92 -1.26 -5.01 116.55 126.88 1u5s n ASP 40 Ca 0.00 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.14 1u5s n ASP 40 Cb 0.00 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.42 1u5s n ASP 40 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1u5s h PRO 41 N 0.00 -0.73 0.00 -0.24 0.13 -1.97 -3.48 132.00 125.71 1u5s h PRO 41 Ca 0.00 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1u5s h PRO 41 Cb 0.00 0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.30 1u5s h PRO 41 CO 0.00 -0.47 0.00 0.39 -0.23 0.00 0.00 178.00 177.69 1u5s n GLU 42 N -5.28 0.00 -1.34 0.86 1.02 -1.23 -5.10 120.64 109.56 1u5s n GLU 42 Ca -0.10 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.75 1u5s n GLU 42 Cb 0.30 0.00 0.13 0.00 -0.02 0.00 0.00 31.44 31.85 1u5s n GLU 42 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1u5s s TRP 43 N -0.83 2.46 0.03 -0.32 0.51 -1.26 -3.64 118.94 115.89 1u5s s TRP 43 Ca 0.00 1.15 0.05 0.00 -2.12 0.00 0.00 56.10 55.18 1u5s s TRP 43 Cb 0.00 -3.18 -0.02 0.00 -0.81 0.00 0.00 33.47 29.45 1u5s s TRP 43 CO 0.00 -2.27 -0.14 -1.58 -0.51 0.00 0.00 176.95 172.45 1u5s s TRP 44 N -3.04 1.26 -0.82 -1.98 0.51 -1.05 -4.45 118.94 109.38 1u5s s TRP 44 Ca 0.63 -0.34 -0.26 0.00 -2.12 0.00 0.00 56.10 54.01 1u5s s TRP 44 Cb -0.17 -0.76 0.03 0.00 -0.81 0.00 0.00 33.47 31.77 1u5s s TRP 44 CO 0.56 0.03 1.39 0.15 -0.51 0.00 0.00 176.95 178.57 1u5s s LYS 45 N -1.04 3.25 -0.13 4.98 1.02 0.49 -2.96 119.74 125.35 1u5s s LYS 45 Ca 0.02 -0.45 0.01 0.00 0.02 0.00 0.00 55.97 55.57 1u5s s LYS 45 Cb -0.08 -4.58 -0.01 0.00 -0.52 0.00 0.00 37.83 32.65 1u5s s LYS 45 CO 0.01 -2.25 -0.16 0.00 -0.92 0.00 0.00 175.35 172.03 1u5s s LYS 47 N 0.47 4.10 -0.18 0.00 2.20 0.61 -3.05 119.74 123.89 1u5s s LYS 47 Ca -0.11 0.90 -0.14 0.00 -0.36 0.00 0.00 55.97 56.26 1u5s s LYS 47 Cb -0.16 -2.29 -0.05 0.00 -1.51 0.00 0.00 37.83 33.82 1u5s s LYS 47 CO 0.05 0.04 0.29 0.54 -0.36 0.00 0.00 175.35 175.91 1u5s s ASN 48 N -2.30 6.39 0.57 1.43 6.03 2.31 -0.09 114.94 129.29 1u5s s ASN 48 Ca 0.58 0.45 0.22 0.00 -1.03 0.00 0.00 52.86 53.08 1u5s s ASN 48 Cb -0.10 -2.18 1.18 0.00 -3.03 0.00 0.00 41.25 37.13 1u5s s ASN 48 CO 0.16 0.06 1.63 0.00 -2.03 0.00 0.00 177.10 176.93 1u5s h ALA 49 N 6.91 1.37 0.00 3.54 0.00 -0.40 3.24 119.26 133.92 1u5s h ALA 49 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1u5s h ALA 49 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1u5s h ALA 49 CO 0.74 -0.37 0.00 0.54 0.00 0.00 0.00 179.25 180.16 1u5s n ARG 50 N -2.60 0.12 -0.71 0.00 1.74 -1.26 -4.76 116.66 109.19 1u5s n ARG 50 Ca -0.01 0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1u5s n ARG 50 Cb 0.43 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 1u5s n ARG 50 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u5s n GLY 51 N -0.66 1.28 3.18 -0.13 0.00 1.07 -5.11 105.19 104.82 1u5s n GLY 51 Ca 0.04 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 1u5s n GLY 51 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1u5s s GLN 52 N -1.85 0.95 0.09 1.61 0.74 -0.64 -4.86 119.66 115.71 1u5s s GLN 52 Ca 0.00 -1.44 0.04 0.00 0.05 0.00 0.00 55.36 54.00 1u5s s GLN 52 Cb 0.00 0.03 -0.03 0.00 1.10 0.00 0.00 33.01 34.10 1u5s s GLN 52 CO 0.00 -0.18 -0.10 0.08 -0.55 0.00 0.00 175.29 174.53 1u5s s VAL 53 N -3.87 0.94 0.00 1.34 1.01 -1.26 0.57 120.40 119.13 1u5s s VAL 53 Ca 0.21 -1.59 0.00 0.00 0.00 0.00 0.00 61.98 60.61 1u5s s VAL 53 Cb 0.07 -1.30 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1u5s s VAL 53 CO 0.01 -0.52 0.00 0.61 0.00 0.00 0.00 175.10 175.20 1u5s n GLY 54 N 0.66 1.74 3.79 4.51 0.00 -1.17 -4.60 105.19 110.11 1u5s n GLY 54 Ca -0.17 -0.62 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 1u5s n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u5s s LEU 55 N 0.00 3.74 -0.22 0.99 2.01 0.40 -3.19 118.68 122.41 1u5s s LEU 55 Ca 0.00 2.03 -0.18 0.00 0.01 0.00 0.00 54.13 55.99 1u5s s LEU 55 Cb 0.00 -4.57 0.06 0.00 0.01 0.00 0.00 46.19 41.69 1u5s s LEU 55 CO 0.00 -1.06 0.57 0.54 1.01 0.00 0.00 176.35 177.41 1u5s s VAL 56 N -1.96 -0.00 -0.29 -1.59 0.11 -1.16 -2.71 120.40 112.80 1u5s s VAL 56 Ca 0.69 0.01 -0.36 0.00 -2.93 0.00 0.00 61.98 59.40 1u5s s VAL 56 Cb -0.20 -0.81 -0.12 0.00 -1.53 0.00 0.00 36.38 33.72 1u5s s VAL 56 CO 0.26 0.01 2.06 -2.65 -3.33 0.00 0.00 175.10 171.44 1u5s n PRO 57 N 3.26 1.28 0.00 1.54 -0.02 -1.26 -2.51 135.00 137.29 1u5s n PRO 57 Ca -0.16 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1u5s n PRO 57 Cb 0.56 -2.43 0.01 0.00 -0.02 0.00 0.00 33.50 31.62 1u5s n PRO 57 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1u5s n LYS 58 N 7.43 0.02 0.00 -0.52 2.85 -1.24 -0.54 118.16 126.15 1u5s n LYS 58 Ca 0.35 0.00 0.09 0.00 -1.05 0.00 0.00 58.31 57.71 1u5s n LYS 58 Cb 0.22 -1.34 -0.06 0.00 -0.65 0.00 0.00 35.03 33.20 1u5s n LYS 58 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1u5s n ASN 59 N -0.84 1.35 -0.58 -5.58 3.02 -1.26 -4.19 115.26 107.17 1u5s n ASN 59 Ca 0.00 -1.17 0.07 0.00 -0.03 0.00 0.00 54.58 53.45 1u5s n ASN 59 Cb 0.00 0.76 0.23 0.00 -0.61 0.00 0.00 39.78 40.16 1u5s n ASN 59 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1u5s n TYR 60 N -0.82 0.36 -3.83 3.10 4.02 0.30 -4.87 117.16 115.42 1u5s n TYR 60 Ca 0.06 -0.18 -0.10 0.00 -0.01 0.00 0.00 57.90 57.66 1u5s n TYR 60 Cb 0.35 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.60 1u5s n TYR 60 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1u5s s VAL 61 N -1.64 0.12 0.26 -0.72 -7.23 -1.26 -3.01 120.40 106.93 1u5s s VAL 61 Ca 0.26 -0.95 0.07 0.00 -1.81 0.00 0.00 61.98 59.55 1u5s s VAL 61 Cb 0.13 -1.06 -0.04 0.00 0.56 0.00 0.00 36.38 35.98 1u5s s VAL 61 CO 0.19 -0.52 0.18 0.68 -0.31 0.00 0.00 175.10 175.32 1u5s s VAL 62 N -3.02 4.20 -0.13 1.32 -7.23 -1.13 -4.96 120.40 109.46 1u5s s VAL 62 Ca -0.02 -1.47 -0.03 0.00 -1.81 0.00 0.00 61.98 58.65 1u5s s VAL 62 Cb 0.01 -3.30 -0.03 0.00 0.56 0.00 0.00 36.38 33.61 1u5s s VAL 62 CO -0.06 -0.33 -0.01 0.54 -0.31 0.00 0.00 175.10 174.92 1u5s s VAL 63 N -2.18 4.17 -0.07 1.32 0.11 -1.26 -3.01 120.40 119.47 1u5s s VAL 63 Ca 0.34 -0.28 -0.09 0.00 -2.93 0.00 0.00 61.98 59.02 1u5s s VAL 63 Cb -0.07 -2.80 -0.03 0.00 -1.53 0.00 0.00 36.38 31.95 1u5s s VAL 63 CO 0.24 0.54 -0.18 0.18 -3.33 0.00 0.00 175.10 172.56 1u5s n LEU 64 N 2.92 1.18 -4.77 2.54 4.32 -0.46 -4.99 117.00 117.74 1u5s n LEU 64 Ca -0.18 0.19 -0.34 0.00 -0.02 0.00 0.00 56.01 55.66 1u5s n LEU 64 Cb 0.53 -0.55 0.01 0.00 -1.62 0.00 0.00 43.42 41.79 1u5s n LEU 64 CO 0.31 -0.43 0.77 -0.94 -1.22 0.00 0.00 177.39 175.88 1u5s s SER 65 N -5.40 5.57 0.02 -1.43 1.04 -1.26 -4.89 113.70 107.35 1u5s s SER 65 Ca -0.15 2.11 -0.10 0.00 0.48 0.00 0.00 55.95 58.30 1u5s s SER 65 Cb 0.02 -2.57 0.01 0.00 0.10 0.00 0.00 66.02 63.58 1u5s s SER 65 CO 0.22 -1.32 0.20 1.51 0.98 0.00 0.00 173.24 174.82 1u5s s ASP 66 N -2.03 -0.00 -0.03 7.02 -4.77 -0.59 -3.99 116.67 112.28 1u5s s ASP 66 Ca 0.71 -0.25 -0.01 0.00 -3.30 0.00 0.00 52.55 49.70 1u5s s ASP 66 Cb -0.22 0.27 -0.00 0.00 -1.09 0.00 0.00 42.92 41.87 1u5s s ASP 66 CO 0.31 -0.49 -0.01 1.23 0.70 0.00 0.00 175.17 176.91 1u5s h GLY 67 N 3.75 0.00 -7.41 2.12 0.00 -1.95 -3.42 103.07 96.16 1u5s h GLY 67 Ca -0.31 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.87 1u5s h GLY 67 CO 0.45 0.00 0.55 -1.55 0.00 0.00 0.00 176.54 175.99 1u5s n PRO 68 N -2.79 0.69 -3.77 4.80 -0.04 -1.26 -4.84 135.00 127.79 1u5s n PRO 68 Ca -0.01 -0.58 -0.33 0.00 -0.04 0.00 0.00 63.50 62.55 1u5s n PRO 68 Cb 0.02 -3.57 -0.10 0.00 -0.04 0.00 0.00 33.50 29.82 1u5s n PRO 68 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u5s s ALA 69 N 13.81 3.92 -0.14 0.55 0.00 -1.26 -5.06 121.76 133.58 1u5s s ALA 69 Ca 0.96 -3.71 -0.25 0.00 0.00 0.00 0.00 51.96 48.96 1u5s s ALA 69 Cb -0.17 -2.51 -0.02 0.00 0.00 0.00 0.00 23.12 20.42 1u5s s ALA 69 CO 0.15 -2.11 0.80 -0.51 0.00 0.00 0.00 175.76 174.09 1u5s s LEU 70 N -1.11 4.21 0.00 0.00 1.43 -1.26 -5.23 118.68 116.71 1u5s s LEU 70 Ca 0.24 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.52 1u5s s LEU 70 Cb -0.10 -3.20 0.00 0.00 0.03 0.00 0.00 46.19 42.92 1u5s s LEU 70 CO -0.11 -0.33 0.00 1.57 0.23 0.00 0.00 176.35 177.70