#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u7p s ARG 3 N 0.00 4.27 0.02 -2.82 1.81 -1.26 -5.02 118.95 115.94 1u7p s ARG 3 Ca 0.00 2.29 0.01 0.00 -1.72 0.00 0.00 55.73 56.32 1u7p s ARG 3 Cb 0.00 -3.12 -0.04 0.00 -0.45 0.00 0.00 34.95 31.34 1u7p s ARG 3 CO 0.00 -0.43 0.03 -0.51 -0.68 0.00 0.00 175.30 173.71 1u7p s LEU 4 N -0.18 3.66 0.64 2.53 1.43 -1.26 -4.09 118.68 121.41 1u7p s LEU 4 Ca 0.60 0.02 -0.17 0.00 -1.03 0.00 0.00 54.13 53.55 1u7p s LEU 4 Cb -0.42 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.62 1u7p s LEU 4 CO 0.42 0.25 1.18 -2.16 0.23 0.00 0.00 176.35 176.26 1u7p s PRO 5 N -1.81 2.75 0.00 1.29 0.04 -1.26 -4.91 135.00 131.11 1u7p s PRO 5 Ca 0.22 1.69 0.24 0.00 0.04 0.00 0.00 61.00 63.19 1u7p s PRO 5 Cb -0.12 -1.92 0.49 0.00 0.04 0.00 0.00 34.50 33.00 1u7p s PRO 5 CO 0.14 -1.34 1.43 1.63 0.04 0.00 0.00 177.00 178.89 1u7p n LYS 6 N -2.04 2.19 -3.54 4.56 5.02 0.09 -4.78 118.16 119.67 1u7p n LYS 6 Ca 0.13 -1.76 -0.00 0.00 -2.02 0.00 0.00 58.31 54.66 1u7p n LYS 6 Cb 0.50 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 1u7p n LYS 6 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1u7p s LEU 7 N -1.78 -0.51 -0.16 -0.35 2.96 -1.23 -4.37 118.68 113.25 1u7p s LEU 7 Ca 0.34 0.76 -0.05 0.00 -0.22 0.00 0.00 54.13 54.96 1u7p s LEU 7 Cb 0.21 1.67 -0.03 0.00 0.50 0.00 0.00 46.19 48.53 1u7p s LEU 7 CO 0.31 -0.11 -0.01 0.00 -1.32 0.00 0.00 176.35 175.21 1u7p s ALA 8 N 1.81 3.12 -0.07 5.97 0.00 -0.18 -1.66 121.76 130.74 1u7p s ALA 8 Ca -0.06 -0.80 0.05 0.00 0.00 0.00 0.00 51.96 51.15 1u7p s ALA 8 Cb -0.05 -1.64 -0.01 0.00 0.00 0.00 0.00 23.12 21.43 1u7p s ALA 8 CO -0.16 0.23 -0.24 0.08 0.00 0.00 0.00 175.76 175.67 1u7p s VAL 9 N 0.29 1.99 -0.03 0.00 1.01 -0.05 -0.87 120.40 122.74 1u7p s VAL 9 Ca -0.01 -1.01 0.07 0.00 0.00 0.00 0.00 61.98 61.02 1u7p s VAL 9 Cb -0.14 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 1u7p s VAL 9 CO 0.02 0.55 -0.25 -0.36 0.00 0.00 0.00 175.10 175.06 1u7p s PHE 10 N 0.03 2.33 0.91 5.22 0.40 0.20 -1.29 117.98 125.77 1u7p s PHE 10 Ca -0.09 -0.52 -0.12 0.00 -0.60 0.00 0.00 56.93 55.60 1u7p s PHE 10 Cb -0.15 -1.51 0.14 0.00 0.51 0.00 0.00 43.02 42.01 1u7p s PHE 10 CO 0.05 -0.10 1.14 0.34 0.70 0.00 0.00 175.22 177.36 1u7p s ASP 11 N -0.46 3.54 -0.00 1.36 2.15 -0.70 -0.97 116.67 121.59 1u7p s ASP 11 Ca 0.06 0.93 -0.01 0.00 0.43 0.00 0.00 52.55 53.96 1u7p s ASP 11 Cb -0.11 -1.48 -0.00 0.00 -0.30 0.00 0.00 42.92 41.03 1u7p s ASP 11 CO 0.00 -2.53 -0.02 0.18 -0.17 0.00 0.00 175.17 172.64 1u7p n LEU 12 N -3.74 0.14 -4.68 -1.34 4.77 -1.26 -4.22 117.00 106.67 1u7p n LEU 12 Ca 0.07 0.02 -0.45 0.00 -0.03 0.00 0.00 56.01 55.62 1u7p n LEU 12 Cb 0.59 -0.27 -0.04 0.00 -2.33 0.00 0.00 43.42 41.37 1u7p n LEU 12 CO 0.57 -0.50 1.38 0.47 -1.33 0.00 0.00 177.39 177.98 1u7p n ASP 13 N -2.64 3.61 -0.99 -1.43 8.00 -1.26 -0.87 116.55 120.98 1u7p n ASP 13 Ca -0.01 1.02 -0.13 0.00 0.71 0.00 0.00 54.79 56.38 1u7p n ASP 13 Cb 0.02 -1.47 -0.06 0.00 -0.02 0.00 0.00 41.12 39.60 1u7p n ASP 13 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1u7p n TYR 14 N 5.02 0.00 0.00 1.24 4.02 0.47 -4.73 117.16 123.18 1u7p n TYR 14 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.08 1u7p n TYR 14 Cb 0.33 -2.60 0.00 0.00 -0.02 0.00 0.00 39.34 37.05 1u7p n TYR 14 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1u7p n THR 15 N -2.44 0.00 -0.05 -0.72 -1.04 -0.37 -3.92 114.28 105.73 1u7p n THR 15 Ca -0.13 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.87 1u7p n THR 15 Cb 0.52 -1.21 -0.14 0.00 -1.82 0.00 0.00 70.33 67.68 1u7p n THR 15 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1u7p n LEU 16 N -2.85 0.00 -3.87 -4.42 4.77 -0.05 -0.92 117.00 109.67 1u7p n LEU 16 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 1u7p n LEU 16 Cb 0.37 0.24 -0.12 0.00 -2.33 0.00 0.00 43.42 41.59 1u7p n LEU 16 CO 0.00 0.24 -0.23 -1.66 -1.33 0.00 0.00 177.39 174.41 1u7p s TRP 17 N -2.81 -0.02 -0.99 -1.77 -2.14 -1.18 -1.28 118.94 108.75 1u7p s TRP 17 Ca -0.08 0.05 -0.07 0.00 2.66 0.00 0.00 56.10 58.66 1u7p s TRP 17 Cb 0.08 -0.02 -0.10 0.00 -3.10 0.00 0.00 33.47 30.33 1u7p s TRP 17 CO 0.75 -0.15 2.62 -0.35 -2.66 0.00 0.00 176.95 177.16 1u7p n PRO 18 N 2.32 2.60 -3.70 3.25 -0.04 -1.26 0.18 135.00 138.35 1u7p n PRO 18 Ca -0.17 -1.60 0.03 0.00 -0.04 0.00 0.00 63.50 61.72 1u7p n PRO 18 Cb 0.57 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 1u7p n PRO 18 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1u7p s PHE 19 N 2.50 -0.01 -0.31 0.54 -0.12 -1.26 -4.92 117.98 114.40 1u7p s PHE 19 Ca 0.54 -0.06 -0.11 0.00 -0.05 0.00 0.00 56.93 57.25 1u7p s PHE 19 Cb 0.16 0.53 -0.02 0.00 -0.63 0.00 0.00 43.02 43.06 1u7p s PHE 19 CO -0.04 -0.17 0.19 -1.58 -0.05 0.00 0.00 175.22 173.58 1u7p s TRP 20 N -2.18 3.20 0.37 3.49 0.51 -1.26 -3.18 118.94 119.89 1u7p s TRP 20 Ca 0.19 -0.25 0.38 0.00 -2.12 0.00 0.00 56.10 54.30 1u7p s TRP 20 Cb 0.04 -2.41 1.99 0.00 -0.81 0.00 0.00 33.47 32.28 1u7p s TRP 20 CO -0.04 -0.34 2.15 -0.24 -0.51 0.00 0.00 176.95 177.96 1u7p h VAL 21 N 5.51 0.00 -0.33 4.03 3.04 -1.96 0.22 116.25 126.76 1u7p h VAL 21 Ca -0.33 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 65.30 1u7p h VAL 21 Cb 1.16 0.93 0.00 0.00 -2.01 0.00 0.00 31.29 31.37 1u7p h VAL 21 CO 0.61 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.27 1u7p n ASP 22 N -2.86 2.95 0.11 3.17 5.75 -1.26 -4.57 116.55 119.84 1u7p n ASP 22 Ca -0.02 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.84 1u7p n ASP 22 Cb 0.09 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 39.97 1u7p n ASP 22 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1u7p n THR 23 N 1.16 0.43 0.57 2.12 -1.04 -0.01 -4.94 114.28 112.58 1u7p n THR 23 Ca 0.18 0.14 0.13 0.00 -2.04 0.00 0.00 64.05 62.47 1u7p n THR 23 Cb 0.53 -0.88 0.42 0.00 -1.82 0.00 0.00 70.33 68.58 1u7p n THR 23 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1u7p n HIS 24 N -3.47 0.95 -4.49 -1.42 8.25 -0.77 -4.87 115.22 109.39 1u7p n HIS 24 Ca 0.00 0.29 -0.24 0.00 -0.26 0.00 0.00 57.72 57.52 1u7p n HIS 24 Cb 0.00 -0.98 -0.10 0.00 1.12 0.00 0.00 29.99 30.03 1u7p n HIS 24 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1u7p s VAL 25 N -3.15 1.88 -0.44 1.59 -7.23 -1.26 -5.05 120.40 106.73 1u7p s VAL 25 Ca 0.09 -2.13 0.03 0.00 -1.81 0.00 0.00 61.98 58.16 1u7p s VAL 25 Cb 0.11 -2.61 0.12 0.00 0.56 0.00 0.00 36.38 34.57 1u7p s VAL 25 CO 0.56 -0.21 0.19 -0.62 -0.31 0.00 0.00 175.10 174.71 1u7p s ASP 26 N -3.54 4.24 0.85 4.85 2.15 -1.26 -4.82 116.67 119.13 1u7p s ASP 26 Ca 0.32 -2.62 -0.10 0.00 0.43 0.00 0.00 52.55 50.57 1u7p s ASP 26 Cb 0.04 -1.43 0.10 0.00 -0.30 0.00 0.00 42.92 41.33 1u7p s ASP 26 CO 0.15 -0.29 1.12 -2.84 -0.17 0.00 0.00 175.17 173.13 1u7p s PRO 27 N 0.28 1.61 0.94 4.34 0.02 -1.26 -1.16 135.00 139.77 1u7p s PRO 27 Ca 0.15 1.34 -0.13 0.00 0.02 0.00 0.00 61.00 62.38 1u7p s PRO 27 Cb -0.23 -1.81 0.16 0.00 0.02 0.00 0.00 34.50 32.63 1u7p s PRO 27 CO -0.04 -2.15 1.14 -2.14 -0.33 0.00 0.00 177.00 173.49 1u7p s PRO 28 N -4.78 0.87 0.40 5.54 0.02 -1.26 -4.78 135.00 131.01 1u7p s PRO 28 Ca 0.64 0.24 0.08 0.00 0.02 0.00 0.00 61.00 61.97 1u7p s PRO 28 Cb -0.20 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 1u7p s PRO 28 CO 0.57 -2.37 0.21 -0.06 -0.33 0.00 0.00 177.00 175.02 1u7p s PHE 29 N -3.27 2.64 0.00 6.54 0.40 -1.26 -3.47 117.98 119.57 1u7p s PHE 29 Ca 0.65 -0.53 -0.25 0.00 -0.60 0.00 0.00 56.93 56.19 1u7p s PHE 29 Cb -0.14 -1.95 0.06 0.00 0.51 0.00 0.00 43.02 41.50 1u7p s PHE 29 CO 0.54 0.15 0.57 -3.38 0.70 0.00 0.00 175.22 173.80 1u7p s HIS 30 N -2.55 -0.51 -0.36 0.36 -3.43 -0.51 -4.98 115.29 103.31 1u7p s HIS 30 Ca 0.42 0.74 -0.23 0.00 -0.80 0.00 0.00 55.06 55.19 1u7p s HIS 30 Cb 0.01 0.36 0.01 0.00 -1.43 0.00 0.00 32.58 31.53 1u7p s HIS 30 CO 0.24 -0.61 0.76 0.21 -2.00 0.00 0.00 174.74 173.33 1u7p s LYS 31 N -1.81 3.76 1.11 -0.38 2.20 -1.26 -0.67 119.74 122.68 1u7p s LYS 31 Ca -0.09 0.29 -0.16 0.00 -0.36 0.00 0.00 55.97 55.66 1u7p s LYS 31 Cb -0.01 -3.80 0.24 0.00 -1.51 0.00 0.00 37.83 32.75 1u7p s LYS 31 CO 0.04 -0.81 1.09 0.45 -0.36 0.00 0.00 175.35 175.76 1u7p s SER 32 N 1.81 1.70 0.18 1.43 0.15 0.16 -4.88 113.70 114.24 1u7p s SER 32 Ca 0.30 0.94 -0.14 0.00 0.70 0.00 0.00 55.95 57.75 1u7p s SER 32 Cb -0.14 -1.43 0.08 0.00 -1.71 0.00 0.00 66.02 62.83 1u7p s SER 32 CO 0.16 -3.68 1.84 0.77 1.20 0.00 0.00 173.24 173.53 1u7p h SER 33 N -2.27 0.60 0.00 5.45 4.64 -1.96 -1.51 113.55 118.50 1u7p h SER 33 Ca -0.51 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 1u7p h SER 33 Cb 1.32 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1u7p h SER 33 CO 0.47 0.43 0.00 -0.90 -0.87 0.00 0.00 176.83 175.96 1u7p n ASP 34 N -4.72 0.00 0.00 4.97 5.75 -1.26 -4.79 116.55 116.49 1u7p n ASP 34 Ca 0.03 -0.64 0.00 0.00 -0.01 0.00 0.00 54.79 54.17 1u7p n ASP 34 Cb 0.03 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 1u7p n ASP 34 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1u7p n GLY 35 N -0.17 2.86 3.82 6.12 0.00 -0.57 -5.02 105.19 112.22 1u7p n GLY 35 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1u7p n GLY 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1u7p s THR 36 N -1.88 4.05 -0.03 2.61 -4.23 -1.26 -4.66 115.64 110.24 1u7p s THR 36 Ca 0.00 0.79 -0.16 0.00 -1.18 0.00 0.00 61.69 61.14 1u7p s THR 36 Cb 0.00 -3.46 -0.05 0.00 1.34 0.00 0.00 72.50 70.33 1u7p s THR 36 CO 0.00 -0.75 0.42 -0.69 -0.54 0.00 0.00 174.62 173.06 1u7p s VAL 37 N -2.82 5.07 0.12 2.29 1.01 -1.26 0.40 120.40 125.20 1u7p s VAL 37 Ca 0.60 0.86 0.05 0.00 0.00 0.00 0.00 61.98 63.49 1u7p s VAL 37 Cb -0.14 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1u7p s VAL 37 CO 0.47 0.51 -0.13 -0.13 0.00 0.00 0.00 175.10 175.82 1u7p s ARG 38 N -0.62 0.98 0.47 2.72 1.81 0.15 -1.34 118.95 123.13 1u7p s ARG 38 Ca 0.24 -1.21 0.06 0.00 -1.72 0.00 0.00 55.73 53.09 1u7p s ARG 38 Cb -0.16 -0.84 0.06 0.00 -0.45 0.00 0.00 34.95 33.55 1u7p s ARG 38 CO 0.12 0.16 0.46 -0.40 -0.68 0.00 0.00 175.30 174.96 1u7p n ASP 39 N 0.58 2.21 0.34 0.23 5.75 -1.20 -1.43 116.55 123.03 1u7p n ASP 39 Ca -0.16 -2.48 0.21 0.00 -0.01 0.00 0.00 54.79 52.36 1u7p n ASP 39 Cb 0.57 -0.15 1.12 0.00 -1.03 0.00 0.00 41.12 41.63 1u7p n ASP 39 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1u7p h ARG 40 N 0.00 0.00 -0.67 0.11 3.08 -1.17 0.33 114.38 116.06 1u7p h ARG 40 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1u7p h ARG 40 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.11 1u7p h ARG 40 CO 0.41 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.85 1u7p n ARG 41 N -3.02 2.69 -1.85 0.04 1.74 -1.26 -4.93 116.66 110.08 1u7p n ARG 41 Ca -0.03 -2.43 -0.13 0.00 -0.77 0.00 0.00 57.85 54.49 1u7p n ARG 41 Cb 0.14 -1.57 -0.03 0.00 -1.02 0.00 0.00 32.46 29.98 1u7p n ARG 41 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u7p n GLY 42 N 1.49 0.54 3.79 -0.13 0.00 0.10 -4.99 105.19 105.99 1u7p n GLY 42 Ca 0.22 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1u7p n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1u7p s GLN 43 N -3.93 4.11 -0.79 1.61 -0.21 -1.26 -4.81 119.66 114.39 1u7p s GLN 43 Ca 0.00 1.47 -0.26 0.00 0.02 0.00 0.00 55.36 56.59 1u7p s GLN 43 Cb 0.00 -2.46 0.03 0.00 1.00 0.00 0.00 33.01 31.58 1u7p s GLN 43 CO 0.00 -0.18 1.30 1.21 -2.12 0.00 0.00 175.29 175.51 1u7p s ASN 44 N -1.65 6.22 -0.07 5.90 3.04 -1.26 -3.25 114.94 123.87 1u7p s ASN 44 Ca 0.59 -0.65 -0.25 0.00 0.04 0.00 0.00 52.86 52.59 1u7p s ASN 44 Cb -0.21 -2.56 -0.03 0.00 -1.54 0.00 0.00 41.25 36.91 1u7p s ASN 44 CO 0.26 -1.77 0.79 -0.63 -3.04 0.00 0.00 177.10 172.71 1u7p s ILE 45 N 5.56 4.98 -0.01 -5.21 -1.09 -0.45 -5.04 121.20 119.94 1u7p s ILE 45 Ca 0.37 1.63 -0.13 0.00 -2.23 0.00 0.00 60.65 60.29 1u7p s ILE 45 Cb -0.07 -4.13 0.02 0.00 -1.58 0.00 0.00 42.46 36.70 1u7p s ILE 45 CO 0.10 0.19 0.26 -1.10 -1.23 0.00 0.00 174.94 173.16 1u7p s GLN 46 N 1.07 0.61 0.74 2.79 -0.21 -1.26 -4.19 119.66 119.22 1u7p s GLN 46 Ca 0.41 -0.25 -0.06 0.00 0.02 0.00 0.00 55.36 55.48 1u7p s GLN 46 Cb -0.18 0.27 0.10 0.00 1.00 0.00 0.00 33.01 34.19 1u7p s GLN 46 CO 0.20 -0.16 1.04 -0.51 -2.12 0.00 0.00 175.29 173.74 1u7p s LEU 47 N -1.33 2.86 0.20 2.90 1.43 -1.26 -4.33 118.68 119.15 1u7p s LEU 47 Ca -0.14 0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 52.88 1u7p s LEU 47 Cb -0.06 -2.73 -0.09 0.00 0.03 0.00 0.00 46.19 43.34 1u7p s LEU 47 CO 0.03 -1.81 1.41 -0.31 0.23 0.00 0.00 176.35 175.91 1u7p s TYR 48 N -3.30 3.12 0.24 0.29 1.51 -0.40 -4.87 117.35 113.94 1u7p s TYR 48 Ca 0.63 1.01 -0.02 0.00 -1.01 0.00 0.00 57.07 57.69 1u7p s TYR 48 Cb -0.08 -3.75 0.50 0.00 -0.11 0.00 0.00 41.96 38.51 1u7p s TYR 48 CO 0.46 -2.52 1.24 -0.35 -1.11 0.00 0.00 175.55 173.27 1u7p n PRO 49 N 2.89 -0.07 -0.17 -1.71 -0.04 -1.26 -1.98 135.00 132.67 1u7p n PRO 49 Ca 0.08 1.21 0.08 0.00 -0.04 0.00 0.00 63.50 64.83 1u7p n PRO 49 Cb 0.41 -1.87 0.25 0.00 -0.04 0.00 0.00 33.50 32.25 1u7p n PRO 49 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1u7p n GLU 50 N -5.19 1.92 -0.12 0.54 1.02 -1.26 -4.51 120.64 113.04 1u7p n GLU 50 Ca 0.16 -1.41 -0.05 0.00 -0.02 0.00 0.00 57.16 55.84 1u7p n GLU 50 Cb 0.52 -1.36 0.02 0.00 -0.02 0.00 0.00 31.44 30.60 1u7p n GLU 50 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1u7p h VAL 51 N 2.49 0.66 -0.62 2.62 2.07 -1.65 -1.45 116.25 120.36 1u7p h VAL 51 Ca 0.00 -0.02 0.10 0.00 0.82 0.00 0.00 66.70 67.60 1u7p h VAL 51 Cb 0.56 0.60 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 1u7p h VAL 51 CO 0.00 0.01 0.24 -0.65 0.02 0.00 0.00 177.57 177.19 1u7p h PRO 52 N 0.06 0.40 -0.04 1.57 0.11 -1.84 -1.22 132.00 131.04 1u7p h PRO 52 Ca 0.19 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 66.17 1u7p h PRO 52 Cb 0.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.29 1u7p h PRO 52 CO -0.36 0.27 -0.49 1.49 -0.21 0.00 0.00 178.00 178.70 1u7p h GLU 53 N 0.42 0.10 0.01 1.05 4.57 -1.79 -0.20 114.58 118.74 1u7p h GLU 53 Ca 0.32 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.44 1u7p h GLU 53 Cb 0.40 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 1u7p h GLU 53 CO -0.32 0.57 -0.00 0.28 -1.18 0.00 0.00 179.01 178.36 1u7p h VAL 54 N 0.08 1.07 -0.39 0.32 2.07 -0.25 0.38 116.25 119.53 1u7p h VAL 54 Ca 0.00 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 1u7p h VAL 54 Cb 0.89 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1u7p h VAL 54 CO 0.07 0.06 0.02 -0.07 0.02 0.00 0.00 177.57 177.68 1u7p h LEU 55 N -0.12 0.57 -0.59 2.57 3.38 -1.09 -2.61 115.31 117.41 1u7p h LEU 55 Ca -0.00 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 1u7p h LEU 55 Cb 0.11 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1u7p h LEU 55 CO 0.00 0.62 -0.08 1.23 0.09 0.00 0.00 178.44 180.30 1u7p h GLY 56 N 0.87 1.12 0.97 0.83 0.00 -0.40 -2.49 103.07 103.98 1u7p h GLY 56 Ca 0.12 -0.88 -0.02 0.00 0.00 0.00 0.00 47.33 46.56 1u7p h GLY 56 CO 0.01 0.81 0.24 3.21 0.00 0.00 0.00 176.54 180.81 1u7p h ARG 57 N 0.92 0.73 -0.97 4.80 3.08 0.09 -1.58 114.38 121.46 1u7p h ARG 57 Ca 0.15 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.10 1u7p h ARG 57 Cb 0.65 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.52 1u7p h ARG 57 CO 0.04 0.61 0.64 -0.07 -1.07 0.00 0.00 179.97 180.13 1u7p h LEU 58 N 0.68 1.10 -1.10 3.04 3.38 -1.39 -0.73 115.31 120.29 1u7p h LEU 58 Ca 0.17 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1u7p h LEU 58 Cb 0.12 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1u7p h LEU 58 CO -0.02 0.80 0.04 -0.61 0.09 0.00 0.00 178.44 178.74 1u7p h GLN 59 N 1.30 0.68 0.00 1.13 4.15 -1.03 0.74 115.11 122.08 1u7p h GLN 59 Ca 0.36 -0.15 -0.05 0.00 0.77 0.00 0.00 58.65 59.58 1u7p h GLN 59 Cb -0.14 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.45 1u7p h GLN 59 CO -0.08 0.67 -0.21 0.77 -1.93 0.00 0.00 178.83 178.04 1u7p h SER 60 N 0.65 0.00 0.62 -0.69 0.02 -0.25 -2.32 113.55 111.57 1u7p h SER 60 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1u7p h SER 60 Cb 0.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1u7p h SER 60 CO 0.01 0.21 -0.42 0.18 -1.14 0.00 0.00 176.83 175.68 1u7p n LEU 61 N -3.31 0.42 0.00 5.07 4.77 -0.40 -4.92 117.00 118.63 1u7p n LEU 61 Ca 0.01 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1u7p n LEU 61 Cb 0.46 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1u7p n LEU 61 CO 0.34 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1u7p n GLY 62 N 1.49 0.50 3.49 -0.72 0.00 -0.45 -5.02 105.19 104.47 1u7p n GLY 62 Ca 0.06 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 1u7p n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u7p s VAL 63 N -2.00 5.11 0.60 1.61 1.01 0.13 -5.00 120.40 121.86 1u7p s VAL 63 Ca 0.00 -0.30 -0.19 0.00 0.00 0.00 0.00 61.98 61.49 1u7p s VAL 63 Cb 0.00 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 1u7p s VAL 63 CO 0.00 -0.36 1.25 -2.16 0.00 0.00 0.00 175.10 173.82 1u7p s PRO 64 N 2.09 2.87 0.06 2.72 0.04 -1.26 -4.17 135.00 137.35 1u7p s PRO 64 Ca 0.12 1.94 0.09 0.00 0.04 0.00 0.00 61.00 63.18 1u7p s PRO 64 Cb -0.17 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 1u7p s PRO 64 CO 0.13 -1.32 -0.23 0.08 0.04 0.00 0.00 177.00 175.70 1u7p s VAL 65 N -1.50 2.39 0.11 -0.36 1.01 -1.25 -1.01 120.40 119.79 1u7p s VAL 65 Ca 0.78 -1.38 -0.00 0.00 0.00 0.00 0.00 61.98 61.38 1u7p s VAL 65 Cb -0.34 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1u7p s VAL 65 CO 0.36 0.31 0.02 0.00 0.00 0.00 0.00 175.10 175.79 1u7p s ALA 66 N -0.89 0.85 0.01 5.51 0.00 -0.05 -0.85 121.76 126.33 1u7p s ALA 66 Ca 0.13 -1.41 0.05 0.00 0.00 0.00 0.00 51.96 50.74 1u7p s ALA 66 Cb -0.10 0.61 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 1u7p s ALA 66 CO 0.04 -0.41 -0.15 0.00 0.00 0.00 0.00 175.76 175.23 1u7p s ALA 67 N -3.93 2.67 -0.30 0.00 0.00 -0.40 -0.63 121.76 119.17 1u7p s ALA 67 Ca 0.19 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 51.02 1u7p s ALA 67 Cb 0.07 -0.87 0.11 0.00 0.00 0.00 0.00 23.12 22.44 1u7p s ALA 67 CO -0.02 0.57 0.15 0.00 0.00 0.00 0.00 175.76 176.47 1u7p s ALA 68 N -0.87 0.71 0.07 0.00 0.00 -0.14 -0.62 121.76 120.90 1u7p s ALA 68 Ca 0.14 -1.28 0.09 0.00 0.00 0.00 0.00 51.96 50.91 1u7p s ALA 68 Cb -0.11 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 1u7p s ALA 68 CO 0.04 -1.76 -0.25 0.45 0.00 0.00 0.00 175.76 174.24 1u7p s SER 69 N 1.85 3.03 0.00 0.00 0.15 0.49 -4.14 113.70 115.09 1u7p s SER 69 Ca 0.11 -0.62 0.21 0.00 0.70 0.00 0.00 55.95 56.36 1u7p s SER 69 Cb -0.18 -0.25 0.40 0.00 -1.71 0.00 0.00 66.02 64.28 1u7p s SER 69 CO -0.28 0.21 1.35 -1.14 1.20 0.00 0.00 173.24 174.59 1u7p n ARG 70 N 1.57 2.41 -2.21 5.44 0.63 -1.26 -1.81 116.66 121.44 1u7p n ARG 70 Ca -0.17 -2.21 -0.36 0.00 -0.92 0.00 0.00 57.85 54.18 1u7p n ARG 70 Cb 0.52 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 31.96 1u7p n ARG 70 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 1u7p s THR 71 N -1.39 3.05 -0.58 5.15 -1.32 -1.26 -3.42 115.64 115.87 1u7p s THR 71 Ca 0.36 0.69 0.24 0.00 -1.21 0.00 0.00 61.69 61.77 1u7p s THR 71 Cb 0.21 -3.31 0.02 0.00 -1.51 0.00 0.00 72.50 67.92 1u7p s THR 71 CO 0.29 -0.10 1.24 0.77 -2.21 0.00 0.00 174.62 174.61 1u7p h SER 72 N 1.43 0.00 -0.71 8.08 4.64 -1.95 -3.27 113.55 121.77 1u7p h SER 72 Ca -0.50 -0.20 -0.73 0.00 -0.47 0.00 0.00 61.79 59.89 1u7p h SER 72 Cb 1.26 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.27 1u7p h SER 72 CO 0.58 0.10 2.73 1.21 -0.87 0.00 0.00 176.83 180.58 1u7p n GLU 73 N -2.18 3.60 0.02 4.77 4.07 -1.26 -4.72 120.64 124.94 1u7p n GLU 73 Ca 0.03 -3.03 -0.12 0.00 -0.06 0.00 0.00 57.16 53.98 1u7p n GLU 73 Cb 0.46 -2.95 -0.06 0.00 -0.06 0.00 0.00 31.44 28.82 1u7p n GLU 73 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 1u7p h ILE 74 N 3.47 1.03 -0.51 6.31 2.04 -1.88 -0.99 117.51 126.97 1u7p h ILE 74 Ca 0.59 -0.07 -0.08 0.00 1.00 0.00 0.00 64.86 66.29 1u7p h ILE 74 Cb 0.51 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1u7p h ILE 74 CO 1.70 0.02 -0.00 0.06 0.00 0.00 0.00 178.15 179.94 1u7p h GLN 75 N 0.03 0.85 -0.35 2.37 -0.00 -1.96 -1.74 115.11 114.31 1u7p h GLN 75 Ca 0.01 -0.24 -0.06 0.00 -0.00 0.00 0.00 58.65 58.36 1u7p h GLN 75 Cb 0.02 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.48 27.39 1u7p h GLN 75 CO -0.00 0.85 -0.03 0.78 -0.00 0.00 0.00 178.83 180.43 1u7p h GLY 76 N 0.99 0.68 0.99 0.06 0.00 -1.91 -1.56 103.07 102.31 1u7p h GLY 76 Ca 0.15 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1u7p h GLY 76 CO 0.02 0.48 -0.19 0.00 0.00 0.00 0.00 176.54 176.86 1u7p h ALA 77 N 0.84 -0.52 -0.60 3.60 0.00 -0.99 -2.37 119.26 119.22 1u7p h ALA 77 Ca 0.09 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1u7p h ALA 77 Cb 0.50 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 1u7p h ALA 77 CO 0.02 -0.78 0.30 -0.91 0.00 0.00 0.00 179.25 177.89 1u7p h ASN 78 N -0.54 0.42 -0.99 0.00 2.35 -1.33 -2.42 115.58 113.06 1u7p h ASN 78 Ca -0.05 0.04 0.06 0.00 -0.55 0.00 0.00 56.30 55.80 1u7p h ASN 78 Cb 0.41 -0.04 -0.06 0.00 0.05 0.00 0.00 38.32 38.68 1u7p h ASN 78 CO 0.09 0.27 0.64 -0.61 -1.65 0.00 0.00 177.43 176.18 1u7p h GLN 79 N 0.57 1.15 -0.69 0.81 4.15 -1.11 -2.08 115.11 117.90 1u7p h GLN 79 Ca 0.28 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.56 1u7p h GLN 79 Cb 0.21 -0.26 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 1u7p h GLN 79 CO -0.20 0.76 0.18 -0.07 -1.93 0.00 0.00 178.83 177.57 1u7p h LEU 80 N 1.19 1.03 -1.33 -2.39 3.38 -0.94 0.33 115.31 116.58 1u7p h LEU 80 Ca 0.42 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 1u7p h LEU 80 Cb 0.13 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1u7p h LEU 80 CO -0.16 0.98 0.16 -0.07 0.09 0.00 0.00 178.44 179.44 1u7p h LEU 81 N 1.04 0.55 0.23 1.67 3.38 -1.16 -1.61 115.31 119.41 1u7p h LEU 81 Ca 0.22 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1u7p h LEU 81 Cb 0.35 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1u7p h LEU 81 CO -0.00 0.52 -0.11 -0.33 0.09 0.00 0.00 178.44 178.61 1u7p h GLU 82 N 0.61 -0.30 -0.71 1.13 4.39 -0.91 0.16 114.58 118.94 1u7p h GLU 82 Ca 0.15 0.02 0.20 0.00 0.34 0.00 0.00 59.36 60.06 1u7p h GLU 82 Cb 0.15 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.83 1u7p h GLU 82 CO -0.01 0.03 0.51 -0.07 -1.16 0.00 0.00 179.01 178.31 1u7p h LEU 83 N -0.96 0.07 -2.30 1.33 3.38 -0.84 0.21 115.31 116.21 1u7p h LEU 83 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1u7p h LEU 83 Cb 0.47 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1u7p h LEU 83 CO 0.05 0.03 0.00 0.49 0.09 0.00 0.00 178.44 179.10 1u7p n PHE 84 N -4.36 1.04 -3.74 1.13 3.01 -0.62 -4.93 117.46 108.99 1u7p n PHE 84 Ca 0.14 -0.42 -0.22 0.00 1.01 0.00 0.00 57.45 57.96 1u7p n PHE 84 Cb 0.73 -0.18 0.02 0.00 -0.01 0.00 0.00 39.48 40.05 1u7p n PHE 84 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1u7p n ASP 85 N 0.74 -1.09 -0.00 4.37 9.92 0.75 -4.89 116.55 126.35 1u7p n ASP 85 Ca 0.18 -0.86 0.04 0.00 -0.53 0.00 0.00 54.79 53.62 1u7p n ASP 85 Cb 0.65 -3.87 -0.05 0.00 -0.64 0.00 0.00 41.12 37.22 1u7p n ASP 85 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1u7p n LEU 86 N -4.28 0.17 -0.33 0.64 4.77 0.51 -4.64 117.00 113.83 1u7p n LEU 86 Ca -0.30 -0.25 0.17 0.00 -0.03 0.00 0.00 56.01 55.61 1u7p n LEU 86 Cb 0.68 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 42.14 1u7p n LEU 86 CO 0.69 0.04 1.12 1.23 -1.33 0.00 0.00 177.39 179.15 1u7p h GLY 87 N 1.55 1.83 1.79 -0.72 0.00 -1.72 0.15 103.07 105.94 1u7p h GLY 87 Ca 0.00 -0.26 0.02 0.00 0.00 0.00 0.00 47.33 47.09 1u7p h GLY 87 CO 0.00 -0.28 0.09 0.07 0.00 0.00 0.00 176.54 176.41 1u7p h LYS 88 N 0.50 0.00 0.00 4.80 2.10 -1.90 -2.74 116.57 119.34 1u7p h LYS 88 Ca 0.63 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 59.09 1u7p h LYS 88 Cb 1.24 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.54 1u7p h LYS 88 CO -0.51 0.00 -1.19 1.88 -2.00 0.00 0.00 179.45 177.64 1u7p h TYR 89 N 0.00 0.00 -3.40 0.07 -1.99 -1.03 -3.46 116.97 107.17 1u7p h TYR 89 Ca 0.04 0.00 -0.59 0.00 2.00 0.00 0.00 58.73 60.18 1u7p h TYR 89 Cb 0.21 0.00 -0.09 0.00 2.00 0.00 0.00 36.73 38.85 1u7p h TYR 89 CO 0.00 0.78 0.05 -0.06 -0.00 0.00 0.00 178.16 178.93 1u7p s PHE 90 N -2.79 3.43 -0.24 4.88 0.40 -1.03 -3.94 117.98 118.69 1u7p s PHE 90 Ca -0.01 0.95 0.21 0.00 -0.60 0.00 0.00 56.93 57.48 1u7p s PHE 90 Cb 0.09 -2.74 0.03 0.00 0.51 0.00 0.00 43.02 40.91 1u7p s PHE 90 CO 0.80 -0.06 1.12 -0.84 0.70 0.00 0.00 175.22 176.95 1u7p h ILE 91 N 5.01 0.17 -2.83 0.64 3.07 -1.30 -3.47 117.51 118.81 1u7p h ILE 91 Ca -0.35 -1.30 -0.11 0.00 1.55 0.00 0.00 64.86 64.65 1u7p h ILE 91 Cb 1.16 1.76 -0.21 0.00 -0.27 0.00 0.00 36.82 39.27 1u7p h ILE 91 CO 0.76 0.10 -0.20 -1.58 -1.05 0.00 0.00 178.15 176.18 1u7p s GLN 92 N -3.22 0.69 -0.19 0.16 2.00 -1.25 -5.07 119.66 112.77 1u7p s GLN 92 Ca 0.01 0.03 -0.04 0.00 -2.00 0.00 0.00 55.36 53.36 1u7p s GLN 92 Cb 0.08 0.31 0.06 0.00 0.80 0.00 0.00 33.01 34.27 1u7p s GLN 92 CO 0.77 -0.18 0.06 1.03 -0.50 0.00 0.00 175.29 176.48 1u7p s ARG 93 N -1.00 0.39 -0.46 1.67 0.52 -1.26 -1.27 118.95 117.54 1u7p s ARG 93 Ca -0.10 -0.31 -0.13 0.00 -0.52 0.00 0.00 55.73 54.66 1u7p s ARG 93 Cb -0.04 -1.95 0.08 0.00 0.52 0.00 0.00 34.95 33.56 1u7p s ARG 93 CO 0.04 -0.68 0.36 -1.21 0.02 0.00 0.00 175.30 173.83 1u7p s GLU 94 N 1.98 2.83 -0.28 3.54 0.41 0.21 -4.95 118.70 122.44 1u7p s GLU 94 Ca 0.01 -1.45 -0.01 0.00 -0.41 0.00 0.00 54.97 53.11 1u7p s GLU 94 Cb -0.17 -4.03 0.09 0.00 -1.78 0.00 0.00 34.13 28.24 1u7p s GLU 94 CO -0.10 -1.05 0.06 0.42 -0.49 0.00 0.00 175.26 174.10 1u7p s ILE 95 N 1.55 0.93 -0.27 -1.63 1.01 -1.26 -0.38 121.20 121.16 1u7p s ILE 95 Ca 0.04 -1.23 -0.33 0.00 0.00 0.00 0.00 60.65 59.13 1u7p s ILE 95 Cb -0.25 -1.58 0.17 0.00 0.01 0.00 0.00 42.46 40.81 1u7p s ILE 95 CO 0.04 -0.51 1.32 -0.72 0.00 0.00 0.00 174.94 175.08 1u7p s TYR 96 N 1.62 -0.06 0.88 3.97 -0.85 -0.75 -4.83 117.35 117.33 1u7p s TYR 96 Ca 0.06 0.08 -0.12 0.00 -0.52 0.00 0.00 57.07 56.57 1u7p s TYR 96 Cb -0.17 0.50 0.11 0.00 0.38 0.00 0.00 41.96 42.77 1u7p s TYR 96 CO -0.19 -0.07 1.06 -2.30 -1.52 0.00 0.00 175.55 172.53 1u7p n PRO 97 N 0.28 -0.23 0.00 -3.49 -0.02 -1.22 -4.08 135.00 126.24 1u7p n PRO 97 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1u7p n PRO 97 Cb 0.58 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1u7p n PRO 97 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u7p n GLY 98 N 0.54 1.97 3.75 -1.23 0.00 -1.26 -5.01 105.19 103.95 1u7p n GLY 98 Ca 0.12 -2.08 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 1u7p n GLY 98 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1u7p s SER 99 N 0.00 7.07 0.00 1.61 0.15 -1.26 -4.86 113.70 116.41 1u7p s SER 99 Ca 0.00 2.38 0.14 0.00 0.70 0.00 0.00 55.95 59.17 1u7p s SER 99 Cb 0.00 -2.63 0.76 0.00 -1.71 0.00 0.00 66.02 62.45 1u7p s SER 99 CO 0.00 -0.33 1.32 0.29 1.20 0.00 0.00 173.24 175.72 1u7p n LYS 100 N 1.53 0.31 0.16 5.44 5.02 -1.26 -1.80 118.16 127.57 1u7p n LYS 100 Ca 0.01 0.08 0.02 0.00 -2.02 0.00 0.00 58.31 56.40 1u7p n LYS 100 Cb 0.44 -1.50 0.33 0.00 -0.02 0.00 0.00 35.03 34.28 1u7p n LYS 100 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1u7p h VAL 101 N 0.00 1.28 -0.07 -0.18 2.07 -1.90 -2.01 116.25 115.43 1u7p h VAL 101 Ca 0.00 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 1u7p h VAL 101 Cb 0.07 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1u7p h VAL 101 CO 0.00 0.38 -0.03 0.74 0.02 0.00 0.00 177.57 178.68 1u7p h THR 102 N 0.05 1.31 -0.70 2.57 2.02 -1.74 -1.32 112.91 115.11 1u7p h THR 102 Ca 0.00 -1.01 0.05 0.00 0.77 0.00 0.00 66.41 66.23 1u7p h THR 102 Cb 0.68 1.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.88 1u7p h THR 102 CO 0.05 0.28 0.40 0.45 0.37 0.00 0.00 175.52 177.07 1u7p h HIS 103 N -0.22 0.74 -0.03 3.16 -0.00 -1.63 -1.92 115.15 115.25 1u7p h HIS 103 Ca 0.02 0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.30 1u7p h HIS 103 Cb 0.46 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.62 1u7p h HIS 103 CO 0.06 0.37 -0.51 0.74 -0.00 0.00 0.00 177.93 178.60 1u7p h PHE 104 N 0.75 0.11 -0.34 2.45 -1.00 -1.30 -1.47 116.94 116.15 1u7p h PHE 104 Ca 0.31 -0.03 -0.05 0.00 2.81 0.00 0.00 57.97 61.00 1u7p h PHE 104 Cb 0.16 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.68 1u7p h PHE 104 CO -0.07 0.58 -0.00 0.93 -1.61 0.00 0.00 178.31 178.14 1u7p h GLU 105 N 0.07 0.60 -0.51 1.51 5.08 -0.63 0.46 114.58 121.15 1u7p h GLU 105 Ca -0.00 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.10 1u7p h GLU 105 Cb 0.92 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1u7p h GLU 105 CO 0.07 0.72 0.02 0.00 -1.00 0.00 0.00 179.01 178.83 1u7p h ARG 106 N 0.40 0.84 -0.32 2.33 3.08 -1.26 -0.54 114.38 118.91 1u7p h ARG 106 Ca 0.09 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1u7p h ARG 106 Cb 0.45 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1u7p h ARG 106 CO 0.02 0.83 0.14 -0.07 -1.07 0.00 0.00 179.97 179.82 1u7p h LEU 107 N 0.79 0.44 -0.70 3.04 3.38 -0.96 -0.39 115.31 120.91 1u7p h LEU 107 Ca 0.16 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.03 1u7p h LEU 107 Cb 0.44 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 1u7p h LEU 107 CO 0.02 0.46 0.41 -0.74 0.09 0.00 0.00 178.44 178.68 1u7p h HIS 108 N 0.38 0.76 -0.40 1.13 2.76 -0.52 0.73 115.15 120.00 1u7p h HIS 108 Ca 0.11 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.22 1u7p h HIS 108 Cb 0.15 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.86 1u7p h HIS 108 CO -0.01 0.40 -0.07 1.25 -1.30 0.00 0.00 177.93 178.20 1u7p h HIS 109 N 0.78 0.83 -0.06 5.26 -0.00 -0.74 0.19 115.15 121.41 1u7p h HIS 109 Ca 0.30 -0.17 -0.24 0.00 -0.00 0.00 0.00 60.37 60.26 1u7p h HIS 109 Cb 0.12 -0.21 0.01 0.00 -0.00 0.00 0.00 27.41 27.33 1u7p h HIS 109 CO -0.06 0.86 -0.91 0.87 -0.00 0.00 0.00 177.93 178.70 1u7p h LYS 110 N 0.56 0.65 0.00 5.26 1.57 -0.81 -3.34 116.57 120.46 1u7p h LYS 110 Ca 0.10 -0.62 -0.13 0.00 -1.87 0.00 0.00 60.65 58.14 1u7p h LYS 110 Cb 0.58 0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 1u7p h LYS 110 CO 0.03 1.23 -1.37 0.25 -0.57 0.00 0.00 179.45 179.02 1u7p n THR 111 N -3.86 1.01 -0.96 -0.16 -2.24 0.23 -4.95 114.28 103.35 1u7p n THR 111 Ca -0.08 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 1u7p n THR 111 Cb 0.81 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 1u7p n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u7p n GLY 112 N 1.35 0.57 3.70 3.38 0.00 0.66 -4.99 105.19 109.86 1u7p n GLY 112 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1u7p n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u7p s VAL 113 N -2.49 4.94 0.50 1.61 1.01 -1.24 -5.03 120.40 119.70 1u7p s VAL 113 Ca 0.00 1.70 -0.23 0.00 0.00 0.00 0.00 61.98 63.45 1u7p s VAL 113 Cb 0.00 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.16 1u7p s VAL 113 CO 0.00 0.15 1.32 -2.84 0.00 0.00 0.00 175.10 173.73 1u7p s PRO 114 N 1.30 3.41 0.28 2.72 0.02 -1.26 -4.64 135.00 136.83 1u7p s PRO 114 Ca 0.42 2.16 -0.01 0.00 0.02 0.00 0.00 61.00 63.59 1u7p s PRO 114 Cb -0.18 -2.38 0.46 0.00 0.02 0.00 0.00 34.50 32.41 1u7p s PRO 114 CO 0.19 -0.95 1.88 0.74 -0.33 0.00 0.00 177.00 178.53 1u7p h PHE 115 N 1.80 1.16 -0.10 6.54 -1.00 -1.94 -1.21 116.94 122.20 1u7p h PHE 115 Ca -0.50 0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.34 1u7p h PHE 115 Cb 1.28 -0.38 -0.00 0.00 3.61 0.00 0.00 35.95 40.46 1u7p h PHE 115 CO 0.49 0.58 0.14 0.66 -1.61 0.00 0.00 178.31 178.57 1u7p h SER 116 N 1.12 0.00 -0.63 2.17 4.64 -1.81 -1.26 113.55 117.78 1u7p h SER 116 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1u7p h SER 116 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1u7p h SER 116 CO -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.78 1u7p n GLN 117 N -3.62 4.09 -4.21 4.77 1.13 -0.46 -4.75 117.38 114.34 1u7p n GLN 117 Ca -0.00 -2.99 -0.31 0.00 -1.94 0.00 0.00 57.00 51.76 1u7p n GLN 117 Cb 0.24 -2.01 -0.08 0.00 0.11 0.00 0.00 30.24 28.50 1u7p n GLN 117 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1u7p s MET 118 N -2.12 2.67 -0.00 -1.09 -1.94 -0.48 -0.73 119.30 115.62 1u7p s MET 118 Ca 0.53 -0.72 0.08 0.00 -1.71 0.00 0.00 55.69 53.86 1u7p s MET 118 Cb 0.36 -2.61 -0.02 0.00 2.01 0.00 0.00 34.83 34.57 1u7p s MET 118 CO 0.22 0.58 -0.25 0.54 -0.01 0.00 0.00 175.02 176.10 1u7p s VAL 119 N -1.20 2.15 -0.06 -6.03 0.11 -0.67 -1.39 120.40 113.31 1u7p s VAL 119 Ca 0.23 -1.18 0.02 0.00 -2.93 0.00 0.00 61.98 58.12 1u7p s VAL 119 Cb -0.12 -1.78 0.02 0.00 -1.53 0.00 0.00 36.38 32.97 1u7p s VAL 119 CO 0.14 0.51 -0.09 0.12 -3.33 0.00 0.00 175.10 172.45 1u7p s PHE 120 N -0.68 1.17 -0.19 1.54 5.36 0.99 -0.87 117.98 125.30 1u7p s PHE 120 Ca 0.11 -0.40 -0.03 0.00 -0.96 0.00 0.00 56.93 55.64 1u7p s PHE 120 Cb -0.10 -0.90 -0.01 0.00 -0.34 0.00 0.00 43.02 41.66 1u7p s PHE 120 CO 0.00 -0.24 -0.06 -0.06 -1.46 0.00 0.00 175.22 173.40 1u7p s PHE 121 N 0.77 2.94 -0.14 10.12 0.40 -0.42 0.62 117.98 132.28 1u7p s PHE 121 Ca -0.13 -0.75 -0.19 0.00 -0.60 0.00 0.00 56.93 55.27 1u7p s PHE 121 Cb -0.15 -2.03 0.05 0.00 0.51 0.00 0.00 43.02 41.40 1u7p s PHE 121 CO 0.02 -0.38 0.49 0.34 0.70 0.00 0.00 175.22 176.39 1u7p s ASP 122 N 1.05 -0.48 0.07 1.36 -1.08 -0.91 -1.73 116.67 114.95 1u7p s ASP 122 Ca 0.01 0.81 0.25 0.00 -0.52 0.00 0.00 52.55 53.10 1u7p s ASP 122 Cb -0.15 0.84 0.52 0.00 -1.46 0.00 0.00 42.92 42.67 1u7p s ASP 122 CO -0.00 -0.27 1.44 -0.90 0.52 0.00 0.00 175.17 175.95 1u7p n ASP 123 N 2.31 0.56 -4.68 -0.34 5.75 -1.26 -1.81 116.55 117.08 1u7p n ASP 123 Ca -0.15 0.05 -0.36 0.00 -0.01 0.00 0.00 54.79 54.32 1u7p n ASP 123 Cb 0.56 0.08 -0.09 0.00 -1.03 0.00 0.00 41.12 40.65 1u7p n ASP 123 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1u7p s GLU 124 N -3.09 4.09 0.39 0.11 0.41 -1.26 -4.74 118.70 114.62 1u7p s GLU 124 Ca 0.09 -0.27 0.06 0.00 -0.41 0.00 0.00 54.97 54.44 1u7p s GLU 124 Cb 0.15 -3.43 0.78 0.00 -1.78 0.00 0.00 34.13 29.86 1u7p s GLU 124 CO 0.69 0.19 2.01 -0.97 -0.49 0.00 0.00 175.26 176.69 1u7p h ASN 125 N 7.04 0.48 -0.72 -0.19 -1.24 -1.97 -2.45 115.58 116.54 1u7p h ASN 125 Ca -0.39 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 56.59 1u7p h ASN 125 Cb 1.16 -0.12 -0.04 0.00 0.73 0.00 0.00 38.32 40.05 1u7p h ASN 125 CO 0.71 0.41 0.46 -0.09 -1.29 0.00 0.00 177.43 177.62 1u7p h ARG 126 N 0.55 0.97 -0.11 6.67 9.65 -1.99 0.02 114.38 130.13 1u7p h ARG 126 Ca 0.14 -0.07 -0.16 0.00 -1.10 0.00 0.00 59.98 58.79 1u7p h ARG 126 Cb 0.05 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 28.41 1u7p h ARG 126 CO -0.02 0.66 -0.61 -0.91 2.80 0.00 0.00 179.97 181.89 1u7p h ASN 127 N 0.99 0.44 -0.41 -3.80 2.35 -1.88 -1.22 115.58 112.06 1u7p h ASN 127 Ca 0.26 -0.25 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1u7p h ASN 127 Cb -0.07 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 1u7p h ASN 127 CO -0.05 0.94 0.24 0.40 -1.65 0.00 0.00 177.43 177.32 1u7p h ILE 128 N 0.29 1.13 0.45 2.81 1.08 -0.98 -1.03 117.51 121.27 1u7p h ILE 128 Ca -0.01 -0.31 -0.02 0.00 -0.39 0.00 0.00 64.86 64.13 1u7p h ILE 128 Cb 1.14 0.60 0.00 0.00 -3.07 0.00 0.00 36.82 35.49 1u7p h ILE 128 CO 0.10 0.13 -0.22 0.40 -0.69 0.00 0.00 178.15 177.88 1u7p h ILE 129 N 0.54 0.52 -0.02 -0.67 2.04 -0.93 -0.40 117.51 118.60 1u7p h ILE 129 Ca 0.15 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.76 1u7p h ILE 129 Cb 0.00 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 1u7p h ILE 129 CO -0.03 0.05 -0.25 0.44 0.00 0.00 0.00 178.15 178.37 1u7p h ASP 130 N -0.78 -0.73 0.36 1.72 3.32 -1.14 -2.70 116.42 116.46 1u7p h ASP 130 Ca -0.06 0.10 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 1u7p h ASP 130 Cb 0.55 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 1u7p h ASP 130 CO 0.10 -0.31 -0.47 0.58 -1.72 0.00 0.00 179.24 177.42 1u7p h VAL 131 N -0.37 1.34 0.00 -1.35 2.07 -1.26 -3.07 116.25 113.61 1u7p h VAL 131 Ca 0.07 -1.65 -0.02 0.00 0.82 0.00 0.00 66.70 65.91 1u7p h VAL 131 Cb 0.46 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 32.05 1u7p h VAL 131 CO -0.23 0.48 -0.09 1.23 0.02 0.00 0.00 177.57 178.98 1u7p h GLY 132 N 1.36 0.00 2.00 2.17 0.00 -0.74 -1.80 103.07 106.06 1u7p h GLY 132 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1u7p h GLY 132 CO 0.07 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.15 1u7p n ARG 133 N -4.11 0.18 0.04 4.80 1.74 -1.12 -1.64 116.66 116.55 1u7p n ARG 133 Ca -0.03 0.52 0.12 0.00 -0.77 0.00 0.00 57.85 57.70 1u7p n ARG 133 Cb 0.18 -1.93 0.25 0.00 -1.02 0.00 0.00 32.46 29.94 1u7p n ARG 133 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1u7p n LEU 134 N -2.28 0.58 0.00 0.55 4.77 -0.68 -4.93 117.00 115.01 1u7p n LEU 134 Ca 0.01 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1u7p n LEU 134 Cb 0.15 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1u7p n LEU 134 CO 0.16 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 1u7p n GLY 135 N 1.40 0.58 3.76 -0.72 0.00 -0.65 -4.59 105.19 104.97 1u7p n GLY 135 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1u7p n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u7p s VAL 136 N -2.00 2.58 -0.37 1.61 1.01 -1.24 -4.16 120.40 117.83 1u7p s VAL 136 Ca 0.00 0.41 -0.24 0.00 0.00 0.00 0.00 61.98 62.14 1u7p s VAL 136 Cb 0.00 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.20 1u7p s VAL 136 CO 0.00 -0.03 0.85 -0.89 0.00 0.00 0.00 175.10 175.02 1u7p s THR 137 N -1.47 4.66 -0.20 3.92 2.01 -0.48 -4.59 115.64 119.48 1u7p s THR 137 Ca 0.71 0.99 -0.06 0.00 0.31 0.00 0.00 61.69 63.64 1u7p s THR 137 Cb -0.33 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 67.88 1u7p s THR 137 CO 0.39 -0.50 0.03 0.00 -0.69 0.00 0.00 174.62 173.85 1u7p s ILE 139 N 0.94 4.53 -0.58 0.00 -1.09 0.20 -4.95 121.20 120.24 1u7p s ILE 139 Ca 0.02 -0.78 -0.26 0.00 -2.23 0.00 0.00 60.65 57.40 1u7p s ILE 139 Cb -0.14 -3.48 0.04 0.00 -1.58 0.00 0.00 42.46 37.29 1u7p s ILE 139 CO 0.02 -0.17 1.07 -2.28 -1.23 0.00 0.00 174.94 172.36 1u7p s HIS 140 N 1.56 2.67 0.54 3.97 2.46 -1.26 -2.15 115.29 123.08 1u7p s HIS 140 Ca 0.02 0.13 0.03 0.00 0.47 0.00 0.00 55.06 55.71 1u7p s HIS 140 Cb -0.19 -4.31 0.04 0.00 -0.13 0.00 0.00 32.58 27.99 1u7p s HIS 140 CO 0.06 -1.52 0.75 0.96 -2.47 0.00 0.00 174.74 172.52 1u7p s ILE 141 N 4.51 2.67 0.01 0.89 -4.36 -0.75 -4.99 121.20 119.17 1u7p s ILE 141 Ca 0.35 -0.74 -0.12 0.00 -0.26 0.00 0.00 60.65 59.88 1u7p s ILE 141 Cb -0.10 -2.93 0.02 0.00 1.25 0.00 0.00 42.46 40.69 1u7p s ILE 141 CO 0.21 0.00 0.26 -0.13 0.24 0.00 0.00 174.94 175.52 1u7p s ARG 142 N -4.71 0.66 -1.90 0.37 0.52 -1.26 -4.41 118.95 108.22 1u7p s ARG 142 Ca 0.58 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 55.44 1u7p s ARG 142 Cb -0.10 0.28 0.00 0.00 0.52 0.00 0.00 34.95 35.66 1u7p s ARG 142 CO 0.38 -0.18 0.00 -0.25 0.02 0.00 0.00 175.30 175.26 1u7p n ASP 143 N 1.12 -5.23 -0.54 0.23 8.00 -1.26 -4.78 116.55 114.09 1u7p n ASP 143 Ca -0.21 0.44 0.07 0.00 0.71 0.00 0.00 54.79 55.80 1u7p n ASP 143 Cb 0.57 -4.31 -0.02 0.00 -0.02 0.00 0.00 41.12 37.34 1u7p n ASP 143 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1u7p n GLY 144 N -0.68 -1.86 3.78 0.44 0.00 -1.25 -4.90 105.19 100.72 1u7p n GLY 144 Ca -0.18 -1.37 -0.36 0.00 0.00 0.00 0.00 46.02 44.11 1u7p n GLY 144 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1u7p s MET 145 N -1.97 3.87 0.21 1.61 -1.94 -0.10 -4.96 119.30 116.01 1u7p s MET 145 Ca 0.00 1.59 -0.16 0.00 -1.71 0.00 0.00 55.69 55.41 1u7p s MET 145 Cb 0.00 -2.36 0.02 0.00 2.01 0.00 0.00 34.83 34.50 1u7p s MET 145 CO 0.00 -0.41 0.51 -1.54 -0.01 0.00 0.00 175.02 173.57 1u7p s SER 146 N -1.58 -0.21 0.27 3.03 1.04 -1.26 -4.62 113.70 110.37 1u7p s SER 146 Ca 0.63 -0.59 -0.04 0.00 0.48 0.00 0.00 55.95 56.43 1u7p s SER 146 Cb -0.24 0.58 0.35 0.00 0.10 0.00 0.00 66.02 66.81 1u7p s SER 146 CO 0.29 -1.08 1.94 -0.07 0.98 0.00 0.00 173.24 175.30 1u7p h LEU 147 N 2.22 1.07 -0.62 2.42 3.38 -1.97 -0.93 115.31 120.88 1u7p h LEU 147 Ca -0.28 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.57 1u7p h LEU 147 Cb 1.26 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1u7p h LEU 147 CO 0.37 0.76 -0.05 -0.61 0.09 0.00 0.00 178.44 179.00 1u7p h GLN 148 N 1.25 1.04 -0.39 1.13 4.15 -2.00 -1.88 115.11 118.41 1u7p h GLN 148 Ca 0.36 -0.35 -0.05 0.00 0.77 0.00 0.00 58.65 59.38 1u7p h GLN 148 Cb -0.10 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.49 1u7p h GLN 148 CO -0.09 1.04 0.05 1.15 -1.93 0.00 0.00 178.83 179.05 1u7p h THR 149 N 0.94 1.20 -0.01 2.39 2.02 -1.72 -1.49 112.91 116.24 1u7p h THR 149 Ca 0.16 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.58 1u7p h THR 149 Cb 0.61 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1u7p h THR 149 CO 0.04 0.27 -0.00 0.25 0.37 0.00 0.00 175.52 176.44 1u7p h LEU 150 N 0.58 0.01 -0.60 2.58 5.85 -0.92 -0.90 115.31 121.92 1u7p h LEU 150 Ca 0.13 -0.43 0.10 0.00 0.84 0.00 0.00 57.88 58.52 1u7p h LEU 150 Cb 0.30 -0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 1u7p h LEU 150 CO 0.00 0.44 0.20 0.74 -0.34 0.00 0.00 178.44 179.49 1u7p h THR 151 N -0.41 0.75 -0.74 1.05 2.02 -1.10 0.49 112.91 114.97 1u7p h THR 151 Ca 0.00 -0.13 -0.04 0.00 0.77 0.00 0.00 66.41 67.01 1u7p h THR 151 Cb 0.43 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 1u7p h THR 151 CO 0.00 0.07 0.30 1.56 0.37 0.00 0.00 175.52 177.82 1u7p h GLN 152 N 0.37 1.10 -0.42 6.66 4.20 -1.24 -1.72 115.11 124.06 1u7p h GLN 152 Ca 0.30 -0.20 -0.11 0.00 0.06 0.00 0.00 58.65 58.70 1u7p h GLN 152 Cb 0.39 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 1u7p h GLN 152 CO -0.32 0.90 -0.18 0.78 -0.67 0.00 0.00 178.83 179.33 1u7p h GLY 153 N 1.06 0.87 1.88 3.46 0.00 -0.12 -0.42 103.07 109.81 1u7p h GLY 153 Ca 0.25 -0.72 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 1u7p h GLY 153 CO -0.02 0.66 -0.46 1.41 0.00 0.00 0.00 176.54 178.13 1u7p h LEU 154 N 0.71 0.14 -0.21 3.11 3.38 -0.76 -1.40 115.31 120.28 1u7p h LEU 154 Ca 0.11 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.87 1u7p h LEU 154 Cb 0.70 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1u7p h LEU 154 CO 0.05 0.59 -0.42 -0.08 0.09 0.00 0.00 178.44 178.67 1u7p h GLU 155 N 0.11 0.65 -0.68 1.13 4.57 -0.95 -1.27 114.58 118.13 1u7p h GLU 155 Ca 0.01 -0.42 -0.03 0.00 -1.18 0.00 0.00 59.36 57.73 1u7p h GLU 155 Cb 0.86 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.47 1u7p h GLU 155 CO 0.07 1.04 0.29 1.15 -1.18 0.00 0.00 179.01 180.38 1u7p h THR 156 N 0.34 1.23 -0.25 0.32 2.02 -0.88 -1.20 112.91 114.49 1u7p h THR 156 Ca 0.01 -0.70 -0.07 0.00 0.77 0.00 0.00 66.41 66.42 1u7p h THR 156 Cb 1.02 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1u7p h THR 156 CO 0.09 0.28 -0.12 0.15 0.37 0.00 0.00 175.52 176.30 1u7p h PHE 157 N 0.98 0.60 0.07 3.16 3.57 -1.18 -1.86 116.94 122.29 1u7p h PHE 157 Ca 0.23 -0.15 0.02 0.00 3.53 0.00 0.00 57.97 61.60 1u7p h PHE 157 Cb 0.16 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1u7p h PHE 157 CO 0.01 0.79 -0.21 0.00 -2.23 0.00 0.00 178.31 176.67 1u7p h ALA 158 N 0.73 -0.31 -0.82 2.41 0.00 -0.90 -2.04 119.26 118.33 1u7p h ALA 158 Ca 0.06 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1u7p h ALA 158 Cb 0.63 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1u7p h ALA 158 CO 0.04 -0.72 0.54 0.87 0.00 0.00 0.00 179.25 179.97 1u7p h LYS 159 N -0.37 1.00 -0.45 0.00 1.57 -1.23 -1.84 116.57 115.25 1u7p h LYS 159 Ca 0.04 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1u7p h LYS 159 Cb 0.41 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1u7p h LYS 159 CO -0.14 0.66 0.20 0.00 -0.57 0.00 0.00 179.45 179.60 1u7p h ALA 160 N 1.52 1.50 -0.04 3.86 0.00 -0.78 -0.06 119.26 125.26 1u7p h ALA 160 Ca 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1u7p h ALA 160 Cb 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1u7p h ALA 160 CO -0.09 0.39 0.00 1.04 0.00 0.00 0.00 179.25 180.59 1u7p n GLN 161 N -4.38 1.30 0.00 0.00 1.13 -0.72 -3.23 117.38 111.48 1u7p n GLN 161 Ca 0.03 -0.45 0.04 0.00 -1.94 0.00 0.00 57.00 54.69 1u7p n GLN 161 Cb 0.13 -1.40 0.03 0.00 0.11 0.00 0.00 30.24 29.11 1u7p n GLN 161 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1u7p n ALA 162 N -0.39 2.55 0.00 -1.58 0.00 -0.31 -4.97 120.51 115.81 1u7p n ALA 162 Ca 0.18 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1u7p n ALA 162 Cb 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.34 1u7p n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u7p n GLY 163 N 0.58 0.21 0.46 0.00 0.00 -1.01 -5.07 105.19 100.36 1u7p n GLY 163 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.21 1u7p n GLY 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36