#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 4.39 0.05 -0.78 3.52 -1.26 -5.06 118.95 119.82 1u7p s ARG 3 Ca 0.00 0.77 0.00 0.00 -0.13 0.00 0.00 55.73 56.37 1u7p s ARG 3 Cb 0.00 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 1u7p s ARG 3 CO 0.00 0.04 0.18 -0.51 -0.81 0.00 0.00 175.30 174.20 1u7p s LEU 4 N 0.90 4.24 0.73 -0.88 1.43 -1.26 -4.19 118.68 119.66 1u7p s LEU 4 Ca 0.34 0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 53.55 1u7p s LEU 4 Cb -0.17 -2.81 0.04 0.00 0.03 0.00 0.00 46.19 43.28 1u7p s LEU 4 CO 0.16 0.18 1.09 -2.16 0.23 0.00 0.00 176.35 175.85 1u7p s PRO 5 N -2.40 2.48 0.00 1.29 0.04 -1.26 -4.94 135.00 130.20 1u7p s PRO 5 Ca 0.33 1.20 0.26 0.00 0.04 0.00 0.00 61.00 62.83 1u7p s PRO 5 Cb -0.13 -1.92 0.73 0.00 0.04 0.00 0.00 34.50 33.22 1u7p s PRO 5 CO 0.25 -1.48 1.55 1.63 0.04 0.00 0.00 177.00 179.00 1u7p n LYS 6 N -3.19 1.20 -3.64 4.56 4.76 0.56 -4.79 118.16 117.62 1u7p n LYS 6 Ca 0.09 -0.76 -0.07 0.00 -2.87 0.00 0.00 58.31 54.70 1u7p n LYS 6 Cb 0.53 -1.48 -0.07 0.00 -1.84 0.00 0.00 35.03 32.17 1u7p n LYS 6 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1u7p s LEU 7 N -2.33 -0.69 -0.19 -0.35 2.96 -1.20 -4.29 118.68 112.60 1u7p s LEU 7 Ca 0.28 1.15 -0.02 0.00 -0.22 0.00 0.00 54.13 55.32 1u7p s LEU 7 Cb 0.20 2.09 -0.00 0.00 0.50 0.00 0.00 46.19 48.97 1u7p s LEU 7 CO 0.46 -0.19 -0.10 0.00 -1.32 0.00 0.00 176.35 175.21 1u7p s ALA 8 N 1.15 2.67 -0.10 5.97 0.00 -0.33 -1.57 121.76 129.54 1u7p s ALA 8 Ca -0.06 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.78 1u7p s ALA 8 Cb -0.05 -1.48 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 1u7p s ALA 8 CO -0.13 -0.26 -0.10 0.08 0.00 0.00 0.00 175.76 175.34 1u7p s VAL 9 N 1.18 3.35 0.04 0.00 1.01 -0.15 -1.35 120.40 124.48 1u7p s VAL 9 Ca 0.02 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.51 1u7p s VAL 9 Cb -0.14 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1u7p s VAL 9 CO -0.03 0.55 -0.26 -0.36 0.00 0.00 0.00 175.10 175.00 1u7p s PHE 10 N -0.12 2.26 0.83 5.22 0.40 -0.21 -1.45 117.98 124.92 1u7p s PHE 10 Ca -0.00 -0.41 -0.10 0.00 -0.60 0.00 0.00 56.93 55.82 1u7p s PHE 10 Cb -0.13 -1.36 0.13 0.00 0.51 0.00 0.00 43.02 42.17 1u7p s PHE 10 CO 0.03 0.12 1.17 0.34 0.70 0.00 0.00 175.22 177.58 1u7p s ASP 11 N -1.22 3.97 -0.06 1.36 2.15 -0.82 -0.85 116.67 121.20 1u7p s ASP 11 Ca 0.11 0.29 -0.08 0.00 0.43 0.00 0.00 52.55 53.31 1u7p s ASP 11 Cb -0.10 -0.61 -0.03 0.00 -0.30 0.00 0.00 42.92 41.88 1u7p s ASP 11 CO 0.02 -2.17 -0.15 0.18 -0.17 0.00 0.00 175.17 172.88 1u7p n LEU 12 N -3.33 0.98 -4.72 -1.34 4.77 -1.26 -4.32 117.00 107.79 1u7p n LEU 12 Ca 0.12 0.16 -0.43 0.00 -0.03 0.00 0.00 56.01 55.83 1u7p n LEU 12 Cb 0.60 -0.52 -0.02 0.00 -2.33 0.00 0.00 43.42 41.15 1u7p n LEU 12 CO 0.49 -0.44 1.15 0.47 -1.33 0.00 0.00 177.39 177.73 1u7p n ASP 13 N -3.47 3.44 -1.91 -1.43 8.00 -1.26 -0.88 116.55 119.03 1u7p n ASP 13 Ca -0.06 1.15 -0.14 0.00 0.71 0.00 0.00 54.79 56.45 1u7p n ASP 13 Cb 0.22 -1.53 -0.03 0.00 -0.02 0.00 0.00 41.12 39.75 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 2.02 -0.84 0.06 1.24 4.02 0.17 -4.63 117.16 119.20 1u7p n TYR 14 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.99 1u7p n TYR 14 Cb 0.35 -2.81 0.00 0.00 -0.02 0.00 0.00 39.34 36.85 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 -2.70 0.44 -0.08 -0.72 -1.04 -0.70 -3.65 114.28 105.84 1u7p n THR 15 Ca -0.15 0.15 -0.07 0.00 -2.04 0.00 0.00 64.05 61.94 1u7p n THR 15 Cb 0.54 -1.08 -0.16 0.00 -1.82 0.00 0.00 70.33 67.81 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 -3.25 0.06 -3.95 -4.42 4.77 -0.06 -1.11 117.00 109.04 1u7p n LEU 16 Ca 0.00 0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.89 1u7p n LEU 16 Cb 0.09 0.40 -0.13 0.00 -2.33 0.00 0.00 43.42 41.46 1u7p n LEU 16 CO 0.00 0.41 -0.37 -1.66 -1.33 0.00 0.00 177.39 174.44 1u7p s TRP 17 N -2.66 0.25 -1.24 -1.77 -2.14 -1.21 -1.26 118.94 108.90 1u7p s TRP 17 Ca -0.09 -0.28 -0.08 0.00 2.66 0.00 0.00 56.10 58.31 1u7p s TRP 17 Cb 0.07 -0.16 -0.09 0.00 -3.10 0.00 0.00 33.47 30.19 1u7p s TRP 17 CO 0.84 -0.08 2.69 -0.35 -2.66 0.00 0.00 176.95 177.38 1u7p n PRO 18 N 2.29 2.97 0.00 3.25 -0.04 -1.26 0.43 135.00 142.65 1u7p n PRO 18 Ca -0.18 -1.83 0.00 0.00 -0.04 0.00 0.00 63.50 61.45 1u7p n PRO 18 Cb 0.57 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 1u7p n PRO 18 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1u7p n PHE 19 N 3.71 0.00 -3.40 0.54 1.16 -1.26 -4.89 117.46 113.32 1u7p n PHE 19 Ca 0.63 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.81 1u7p n PHE 19 Cb 0.24 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.02 1u7p n PHE 19 CO 0.00 0.00 0.00 -1.58 -1.87 0.00 0.00 176.76 173.31 1u7p s TRP 20 N -2.00 3.22 0.56 2.97 0.51 -1.26 -3.29 118.94 119.66 1u7p s TRP 20 Ca 0.00 0.18 0.39 0.00 -2.12 0.00 0.00 56.10 54.55 1u7p s TRP 20 Cb 0.00 -2.63 2.11 0.00 -0.81 0.00 0.00 33.47 32.14 1u7p s TRP 20 CO 0.00 -0.34 2.28 -0.24 -0.51 0.00 0.00 176.95 178.14 1u7p h VAL 21 N 5.47 0.15 -0.33 4.03 3.04 -1.96 -0.20 116.25 126.46 1u7p h VAL 21 Ca -0.31 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 1u7p h VAL 21 Cb 1.15 1.10 0.00 0.00 -2.01 0.00 0.00 31.29 31.53 1u7p h VAL 21 CO 0.67 0.01 0.00 -0.90 -1.01 0.00 0.00 177.57 176.34 1u7p n ASP 22 N -3.27 2.50 0.02 3.17 5.75 -1.26 -4.52 116.55 118.94 1u7p n ASP 22 Ca -0.02 -1.88 0.00 0.00 -0.01 0.00 0.00 54.79 52.87 1u7p n ASP 22 Cb 0.12 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 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 0.86 0.10 0.30 2.12 -1.04 -0.15 -4.93 114.28 111.54 1u7p n THR 23 Ca 0.17 0.03 0.17 0.00 -2.04 0.00 0.00 64.05 62.39 1u7p n THR 23 Cb 0.44 -0.59 0.82 0.00 -1.82 0.00 0.00 70.33 69.18 1u7p n THR 23 CO 0.00 0.00 0.00 0.45 -0.64 0.00 0.00 175.07 174.88 1u7p h HIS 24 N 0.00 0.00 -2.63 -1.42 3.86 -1.67 -3.45 115.15 109.84 1u7p h HIS 24 Ca 0.00 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.71 1u7p h HIS 24 Cb 0.00 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.33 1u7p h HIS 24 CO 0.00 0.00 -0.69 0.14 0.86 0.00 0.00 177.93 178.24 1u7p s VAL 25 N -3.75 1.73 -0.40 2.45 -7.23 -1.26 -5.06 120.40 106.88 1u7p s VAL 25 Ca -0.01 -2.16 0.02 0.00 -1.81 0.00 0.00 61.98 58.02 1u7p s VAL 25 Cb 0.10 -2.38 0.11 0.00 0.56 0.00 0.00 36.38 34.77 1u7p s VAL 25 CO 0.41 -0.35 0.13 -1.81 -0.31 0.00 0.00 175.10 173.17 1u7p s ASP 26 N -3.43 4.82 0.97 4.85 1.01 -1.26 -4.85 116.67 118.78 1u7p s ASP 26 Ca 0.28 -2.30 -0.11 0.00 0.71 0.00 0.00 52.55 51.14 1u7p s ASP 26 Cb 0.02 -1.68 0.18 0.00 1.01 0.00 0.00 42.92 42.45 1u7p s ASP 26 CO 0.11 -0.39 1.12 -2.84 0.21 0.00 0.00 175.17 173.38 1u7p s PRO 27 N 0.72 0.58 0.93 8.23 0.02 -1.26 -0.84 135.00 143.38 1u7p s PRO 27 Ca 0.12 1.36 -0.14 0.00 0.02 0.00 0.00 61.00 62.36 1u7p s PRO 27 Cb -0.21 -1.69 0.16 0.00 0.02 0.00 0.00 34.50 32.78 1u7p s PRO 27 CO -0.06 -2.87 1.22 -1.25 -0.33 0.00 0.00 177.00 173.71 1u7p s PRO 28 N -4.61 0.98 0.36 5.54 0.04 -1.26 -4.61 135.00 131.44 1u7p s PRO 28 Ca 0.67 -0.06 0.08 0.00 0.04 0.00 0.00 61.00 61.73 1u7p s PRO 28 Cb -0.23 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 1u7p s PRO 28 CO 0.59 -2.24 0.06 -0.06 0.04 0.00 0.00 177.00 175.40 1u7p s PHE 29 N -3.58 2.57 -0.08 0.56 0.40 -1.26 -3.20 117.98 113.39 1u7p s PHE 29 Ca 0.68 -0.49 -0.31 0.00 -0.60 0.00 0.00 56.93 56.21 1u7p s PHE 29 Cb -0.09 -1.64 0.12 0.00 0.51 0.00 0.00 43.02 41.91 1u7p s PHE 29 CO 0.52 0.39 0.99 -3.38 0.70 0.00 0.00 175.22 174.44 1u7p s HIS 30 N -2.55 -0.29 -0.11 0.36 -3.43 -0.83 -4.97 115.29 103.46 1u7p s HIS 30 Ca 0.37 0.25 -0.25 0.00 -0.80 0.00 0.00 55.06 54.62 1u7p s HIS 30 Cb 0.02 0.52 -0.03 0.00 -1.43 0.00 0.00 32.58 31.66 1u7p s HIS 30 CO 0.20 -0.42 0.79 0.15 -2.00 0.00 0.00 174.74 173.46 1u7p s LYS 31 N -2.58 4.38 0.00 -0.38 1.02 -1.26 -0.82 119.74 120.09 1u7p s LYS 31 Ca 0.05 1.00 0.00 0.00 0.02 0.00 0.00 55.97 57.04 1u7p s LYS 31 Cb -0.01 -3.51 0.00 0.00 -0.52 0.00 0.00 37.83 33.79 1u7p s LYS 31 CO -0.06 -0.14 0.00 -1.13 -0.92 0.00 0.00 175.35 173.10 1u7p n SER 32 N 4.51 0.00 -0.35 2.83 3.41 0.08 -4.84 113.62 119.27 1u7p n SER 32 Ca 0.02 -0.74 0.27 0.00 -0.26 0.00 0.00 58.87 58.16 1u7p n SER 32 Cb 0.50 0.00 0.57 0.00 -0.26 0.00 0.00 64.21 65.02 1u7p n SER 32 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1u7p h SER 33 N 0.00 0.34 -0.20 4.04 4.64 -1.97 -0.16 113.55 120.25 1u7p h SER 33 Ca 0.00 0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 1u7p h SER 33 Cb 0.00 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1u7p h SER 33 CO 0.00 0.02 -0.01 -0.90 -0.87 0.00 0.00 176.83 175.07 1u7p n ASP 34 N -4.57 3.36 0.00 4.97 5.75 -1.26 -4.98 116.55 119.81 1u7p n ASP 34 Ca 0.28 -3.10 0.00 0.00 -0.01 0.00 0.00 54.79 51.95 1u7p n ASP 34 Cb 1.04 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 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 -0.81 2.98 3.77 6.12 0.00 -0.07 -5.03 105.19 112.15 1u7p n GLY 35 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.57 2.28 0.08 2.61 -4.23 -1.26 -4.25 115.64 109.29 1u7p s THR 36 Ca 0.00 0.28 -0.30 0.00 -1.18 0.00 0.00 61.69 60.49 1u7p s THR 36 Cb 0.00 -3.18 -0.06 0.00 1.34 0.00 0.00 72.50 70.61 1u7p s THR 36 CO 0.00 0.06 1.12 -0.69 -0.54 0.00 0.00 174.62 174.58 1u7p s VAL 37 N -0.99 4.18 0.08 2.29 1.01 -1.26 -0.74 120.40 124.97 1u7p s VAL 37 Ca 0.53 1.64 0.02 0.00 0.00 0.00 0.00 61.98 64.16 1u7p s VAL 37 Cb -0.44 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 31.85 1u7p s VAL 37 CO 0.58 0.17 -0.07 -0.13 0.00 0.00 0.00 175.10 175.65 1u7p s ARG 38 N 0.68 0.71 0.28 2.72 0.52 -0.00 -0.14 118.95 123.72 1u7p s ARG 38 Ca 0.55 -1.12 0.04 0.00 -0.52 0.00 0.00 55.73 54.68 1u7p s ARG 38 Cb -0.27 -0.21 0.05 0.00 0.52 0.00 0.00 34.95 35.03 1u7p s ARG 38 CO 0.30 0.00 0.39 -0.40 0.02 0.00 0.00 175.30 175.61 1u7p n ASP 39 N 0.50 0.97 0.27 0.23 5.68 -1.09 -1.97 116.55 121.14 1u7p n ASP 39 Ca -0.16 -1.71 0.18 0.00 -0.50 0.00 0.00 54.79 52.60 1u7p n ASP 39 Cb 0.59 -0.21 0.94 0.00 -1.14 0.00 0.00 41.12 41.29 1u7p n ASP 39 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1u7p h ARG 40 N 0.00 0.00 -0.30 0.11 2.43 -0.95 -0.24 114.38 115.43 1u7p h ARG 40 Ca -0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 1u7p h ARG 40 Cb 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1u7p h ARG 40 CO 0.18 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.18 1u7p n ARG 41 N -3.48 2.45 -0.80 0.20 5.12 -1.26 -4.95 116.66 113.93 1u7p n ARG 41 Ca -0.01 -2.20 0.00 0.00 -1.93 0.00 0.00 57.85 53.72 1u7p n ARG 41 Cb 0.24 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 1u7p n ARG 41 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1u7p n GLY 42 N 1.45 0.71 3.77 -0.13 0.00 -0.10 -5.02 105.19 105.87 1u7p n GLY 42 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.20 4.21 -0.56 1.61 -0.21 -1.26 -4.71 119.66 118.54 1u7p s GLN 43 Ca 0.00 2.36 -0.28 0.00 0.02 0.00 0.00 55.36 57.45 1u7p s GLN 43 Cb 0.00 -3.00 0.03 0.00 1.00 0.00 0.00 33.01 31.04 1u7p s GLN 43 CO 0.00 -0.36 1.18 1.21 -2.12 0.00 0.00 175.29 175.20 1u7p s ASN 44 N -0.37 6.48 -0.29 5.90 3.84 -1.26 -2.66 114.94 126.58 1u7p s ASN 44 Ca 0.51 0.17 -0.21 0.00 0.21 0.00 0.00 52.86 53.54 1u7p s ASN 44 Cb -0.42 -2.55 -0.01 0.00 -0.55 0.00 0.00 41.25 37.71 1u7p s ASN 44 CO 0.57 -1.44 0.65 -0.63 -2.79 0.00 0.00 177.10 173.46 1u7p s ILE 45 N 4.86 4.93 0.12 -5.21 -1.09 0.81 -5.02 121.20 120.60 1u7p s ILE 45 Ca 0.44 0.98 0.04 0.00 -2.23 0.00 0.00 60.65 59.88 1u7p s ILE 45 Cb -0.07 -4.00 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 1u7p s ILE 45 CO 0.27 -0.10 -0.10 -1.10 -1.23 0.00 0.00 174.94 172.68 1u7p s GLN 46 N 2.62 0.94 0.44 2.79 -0.21 -1.26 -4.20 119.66 120.78 1u7p s GLN 46 Ca 0.26 -1.29 0.01 0.00 0.02 0.00 0.00 55.36 54.36 1u7p s GLN 46 Cb -0.15 -0.56 -0.01 0.00 1.00 0.00 0.00 33.01 33.30 1u7p s GLN 46 CO 0.11 0.07 0.66 -0.51 -2.12 0.00 0.00 175.29 173.50 1u7p s LEU 47 N -2.78 3.68 0.39 2.90 1.43 -1.26 -4.24 118.68 118.79 1u7p s LEU 47 Ca 0.11 0.28 -0.27 0.00 -1.03 0.00 0.00 54.13 53.22 1u7p s LEU 47 Cb -0.00 -3.16 -0.09 0.00 0.03 0.00 0.00 46.19 42.96 1u7p s LEU 47 CO -0.00 -0.67 1.35 -0.31 0.23 0.00 0.00 176.35 176.94 1u7p s TYR 48 N -2.53 2.79 0.23 0.29 1.51 -0.39 -4.88 117.35 114.37 1u7p s TYR 48 Ca 0.48 1.36 -0.07 0.00 -1.01 0.00 0.00 57.07 57.83 1u7p s TYR 48 Cb -0.10 -3.75 0.38 0.00 -0.11 0.00 0.00 41.96 38.38 1u7p s TYR 48 CO 0.38 -2.27 1.31 -0.35 -1.11 0.00 0.00 175.55 173.51 1u7p n PRO 49 N 0.28 -0.08 -0.24 -1.71 -0.04 -1.26 -2.09 135.00 129.87 1u7p n PRO 49 Ca 0.03 1.31 0.09 0.00 -0.04 0.00 0.00 63.50 64.89 1u7p n PRO 49 Cb 0.42 -1.96 0.24 0.00 -0.04 0.00 0.00 33.50 32.16 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 -5.37 2.18 -0.09 0.54 1.02 -1.26 -4.53 120.64 113.12 1u7p n GLU 50 Ca 0.13 -1.82 -0.07 0.00 -0.02 0.00 0.00 57.16 55.39 1u7p n GLU 50 Cb 0.42 -1.41 -0.00 0.00 -0.02 0.00 0.00 31.44 30.42 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 3.07 0.37 -0.80 2.62 2.07 -1.68 0.36 116.25 122.27 1u7p h VAL 51 Ca 0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1u7p h VAL 51 Cb 0.70 0.37 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1u7p h VAL 51 CO 0.00 0.00 0.46 -0.65 0.02 0.00 0.00 177.57 177.40 1u7p h PRO 52 N -0.19 0.78 -0.15 1.57 0.11 -1.83 -0.35 132.00 131.94 1u7p h PRO 52 Ca 0.17 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.13 1u7p h PRO 52 Cb 0.46 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.38 1u7p h PRO 52 CO -0.46 0.52 -0.36 0.93 -0.21 0.00 0.00 178.00 178.42 1u7p h GLU 53 N 0.81 0.31 -0.12 1.05 5.08 -1.54 -0.60 114.58 119.56 1u7p h GLU 53 Ca 0.38 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1u7p h GLU 53 Cb 0.29 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1u7p h GLU 53 CO -0.22 0.63 0.02 0.28 -1.00 0.00 0.00 179.01 178.73 1u7p h VAL 54 N 0.27 1.21 -0.39 3.13 2.07 0.76 0.19 116.25 123.49 1u7p h VAL 54 Ca 0.03 -0.66 -0.09 0.00 0.82 0.00 0.00 66.70 66.80 1u7p h VAL 54 Cb 0.76 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1u7p h VAL 54 CO 0.06 0.19 -0.12 -0.07 0.02 0.00 0.00 177.57 177.65 1u7p h LEU 55 N -0.02 0.68 -0.92 2.57 3.38 -0.98 -2.40 115.31 117.63 1u7p h LEU 55 Ca 0.04 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 1u7p h LEU 55 Cb 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1u7p h LEU 55 CO 0.00 0.83 -0.47 1.23 0.09 0.00 0.00 178.44 180.13 1u7p h GLY 56 N 0.97 0.18 1.03 0.83 0.00 -0.97 -2.09 103.07 103.03 1u7p h GLY 56 Ca 0.11 -0.19 -0.09 0.00 0.00 0.00 0.00 47.33 47.16 1u7p h GLY 56 CO 0.04 0.17 -0.04 -0.09 0.00 0.00 0.00 176.54 176.62 1u7p h ARG 57 N 0.14 0.92 -0.49 4.80 9.65 -0.64 0.50 114.38 129.26 1u7p h ARG 57 Ca 0.01 -0.31 -0.06 0.00 -1.10 0.00 0.00 59.98 58.51 1u7p h ARG 57 Cb 0.88 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.36 1u7p h ARG 57 CO 0.07 0.96 0.05 -0.07 2.80 0.00 0.00 179.97 183.78 1u7p h LEU 58 N 0.78 0.75 -0.42 3.80 3.38 -1.22 -0.84 115.31 121.54 1u7p h LEU 58 Ca 0.14 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 1u7p h LEU 58 Cb 0.57 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1u7p h LEU 58 CO 0.03 0.78 -0.19 -0.61 0.09 0.00 0.00 178.44 178.55 1u7p h GLN 59 N 0.75 0.87 -0.65 1.13 4.15 -1.02 -0.58 115.11 119.75 1u7p h GLN 59 Ca 0.15 -0.37 0.06 0.00 0.77 0.00 0.00 58.65 59.26 1u7p h GLN 59 Cb 0.38 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.00 1u7p h GLN 59 CO 0.01 1.02 0.43 1.03 -1.93 0.00 0.00 178.83 179.39 1u7p h SER 60 N 0.69 0.58 0.55 -0.69 0.87 -0.27 -0.70 113.55 114.59 1u7p h SER 60 Ca 0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1u7p h SER 60 Cb 0.75 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 1u7p h SER 60 CO 0.06 0.38 -0.15 0.18 -0.53 0.00 0.00 176.83 176.77 1u7p n LEU 61 N -4.48 0.34 -0.18 2.23 4.77 -0.38 -4.93 117.00 114.38 1u7p n LEU 61 Ca 0.09 0.14 -0.02 0.00 -0.03 0.00 0.00 56.01 56.19 1u7p n LEU 61 Cb 0.22 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1u7p n LEU 61 CO 0.34 0.07 -0.02 0.61 -1.33 0.00 0.00 177.39 177.06 1u7p n GLY 62 N 1.37 0.38 3.41 -0.72 0.00 -0.27 -5.02 105.19 104.33 1u7p n GLY 62 Ca 0.11 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.08 4.64 0.67 1.61 1.01 -0.29 -5.03 120.40 120.94 1u7p s VAL 63 Ca 0.00 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.13 1u7p s VAL 63 Cb 0.00 -3.51 -0.00 0.00 0.00 0.00 0.00 36.38 32.87 1u7p s VAL 63 CO 0.00 -0.13 1.19 -2.65 0.00 0.00 0.00 175.10 173.51 1u7p n PRO 64 N 5.00 0.90 -4.66 2.72 -0.02 -1.26 -4.36 135.00 133.33 1u7p n PRO 64 Ca -0.12 0.36 -0.25 0.00 -2.02 0.00 0.00 63.50 61.47 1u7p n PRO 64 Cb 0.47 -2.43 -0.14 0.00 -0.02 0.00 0.00 33.50 31.38 1u7p n PRO 64 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1u7p s VAL 65 N -1.54 1.56 0.11 -1.45 1.01 -1.26 -1.19 120.40 117.64 1u7p s VAL 65 Ca 0.80 -1.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.67 1u7p s VAL 65 Cb -0.37 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 1u7p s VAL 65 CO 0.43 0.22 0.05 0.00 0.00 0.00 0.00 175.10 175.81 1u7p s ALA 66 N -0.74 0.70 0.02 5.51 0.00 -0.46 -0.92 121.76 125.87 1u7p s ALA 66 Ca 0.07 -1.35 0.07 0.00 0.00 0.00 0.00 51.96 50.75 1u7p s ALA 66 Cb -0.08 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.72 1u7p s ALA 66 CO 0.01 -0.47 -0.21 0.00 0.00 0.00 0.00 175.76 175.09 1u7p s ALA 67 N -4.01 2.43 -0.28 0.00 0.00 -0.80 -1.04 121.76 118.06 1u7p s ALA 67 Ca 0.19 -1.17 -0.03 0.00 0.00 0.00 0.00 51.96 50.95 1u7p s ALA 67 Cb 0.07 -0.66 0.11 0.00 0.00 0.00 0.00 23.12 22.64 1u7p s ALA 67 CO -0.02 0.55 0.20 0.00 0.00 0.00 0.00 175.76 176.49 1u7p s ALA 68 N -0.81 0.14 0.04 0.00 0.00 -0.03 -0.32 121.76 120.78 1u7p s ALA 68 Ca 0.12 -0.67 0.07 0.00 0.00 0.00 0.00 51.96 51.49 1u7p s ALA 68 Cb -0.10 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.47 1u7p s ALA 68 CO 0.03 -1.62 -0.20 0.45 0.00 0.00 0.00 175.76 174.41 1u7p s SER 69 N 2.22 2.44 0.00 0.00 0.15 0.18 -4.10 113.70 114.59 1u7p s SER 69 Ca 0.09 -0.52 0.23 0.00 0.70 0.00 0.00 55.95 56.45 1u7p s SER 69 Cb -0.15 -0.20 0.46 0.00 -1.71 0.00 0.00 66.02 64.42 1u7p s SER 69 CO -0.33 0.16 1.42 0.54 1.20 0.00 0.00 173.24 176.23 1u7p n ARG 70 N 1.86 2.35 -1.77 5.44 1.74 -1.25 -1.32 116.66 123.71 1u7p n ARG 70 Ca -0.17 -2.03 -0.37 0.00 -0.77 0.00 0.00 57.85 54.52 1u7p n ARG 70 Cb 0.53 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.55 1u7p n ARG 70 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1u7p s THR 71 N -1.61 2.15 -0.44 0.55 -1.32 -1.26 -3.35 115.64 110.37 1u7p s THR 71 Ca 0.36 0.09 0.23 0.00 -1.21 0.00 0.00 61.69 61.17 1u7p s THR 71 Cb 0.22 -3.01 -0.10 0.00 -1.51 0.00 0.00 72.50 68.10 1u7p s THR 71 CO 0.31 -0.02 0.98 -1.54 -2.21 0.00 0.00 174.62 172.14 1u7p n SER 72 N -1.91 0.60 -3.72 8.08 3.41 -1.26 -3.42 113.62 115.40 1u7p n SER 72 Ca 0.15 -0.01 -0.42 0.00 -0.26 0.00 0.00 58.87 58.33 1u7p n SER 72 Cb 0.49 0.80 -0.00 0.00 -0.26 0.00 0.00 64.21 65.24 1u7p n SER 72 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1u7p n GLU 73 N -2.20 3.63 -0.08 4.33 4.07 -1.26 -4.75 120.64 124.38 1u7p n GLU 73 Ca 0.01 -3.20 -0.11 0.00 -0.06 0.00 0.00 57.16 53.80 1u7p n GLU 73 Cb 0.48 -2.94 -0.04 0.00 -0.06 0.00 0.00 31.44 28.89 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 3.53 1.21 -0.63 6.31 2.04 -1.90 -2.08 117.51 125.98 1u7p h ILE 74 Ca 0.53 -0.69 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 1u7p h ILE 74 Cb 0.54 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 1u7p h ILE 74 CO 1.67 0.22 0.19 0.06 0.00 0.00 0.00 178.15 180.30 1u7p h GLN 75 N 0.25 0.99 -0.22 2.37 -0.00 -1.97 -1.31 115.11 115.23 1u7p h GLN 75 Ca 0.08 -0.22 -0.03 0.00 -0.00 0.00 0.00 58.65 58.48 1u7p h GLN 75 Cb 0.28 -0.14 -0.01 0.00 -0.00 0.00 0.00 27.48 27.61 1u7p h GLN 75 CO 0.00 0.88 0.03 0.78 -0.00 0.00 0.00 178.83 180.52 1u7p h GLY 76 N 0.92 0.40 0.67 0.06 0.00 -1.95 0.43 103.07 103.60 1u7p h GLY 76 Ca 0.20 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.31 1u7p h GLY 76 CO -0.00 0.25 0.19 0.00 0.00 0.00 0.00 176.54 176.98 1u7p h ALA 77 N 0.83 0.56 -0.40 3.60 0.00 -1.23 -0.24 119.26 122.38 1u7p h ALA 77 Ca 0.07 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1u7p h ALA 77 Cb 0.34 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1u7p h ALA 77 CO 0.01 -0.18 -0.12 -0.91 0.00 0.00 0.00 179.25 178.04 1u7p h ASN 78 N 0.39 0.71 -0.69 0.00 2.35 -1.14 -2.55 115.58 114.64 1u7p h ASN 78 Ca 0.21 -0.21 -0.07 0.00 -0.55 0.00 0.00 56.30 55.67 1u7p h ASN 78 Cb 0.16 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 1u7p h ASN 78 CO -0.18 0.85 0.14 -0.61 -1.65 0.00 0.00 177.43 175.98 1u7p h GLN 79 N 0.65 1.12 -0.49 0.81 4.15 -0.05 -2.24 115.11 119.07 1u7p h GLN 79 Ca 0.11 -0.28 -0.03 0.00 0.77 0.00 0.00 58.65 59.21 1u7p h GLN 79 Cb 0.58 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 1u7p h GLN 79 CO 0.04 1.01 0.18 -0.07 -1.93 0.00 0.00 178.83 178.05 1u7p h LEU 80 N 1.06 0.69 -1.49 -2.39 3.38 -0.90 0.25 115.31 115.90 1u7p h LEU 80 Ca 0.21 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 58.04 1u7p h LEU 80 Cb 0.41 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1u7p h LEU 80 CO 0.01 0.69 0.39 -0.07 0.09 0.00 0.00 178.44 179.55 1u7p h LEU 81 N 0.65 0.56 0.09 1.67 3.38 -1.22 0.77 115.31 121.21 1u7p h LEU 81 Ca 0.16 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1u7p h LEU 81 Cb 0.23 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1u7p h LEU 81 CO -0.01 0.38 -0.04 -0.33 0.09 0.00 0.00 178.44 178.52 1u7p h GLU 82 N 0.64 -0.12 -0.74 1.13 3.07 -0.80 0.48 114.58 118.24 1u7p h GLU 82 Ca 0.25 0.01 0.10 0.00 -0.50 0.00 0.00 59.36 59.21 1u7p h GLU 82 Cb 0.17 0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.05 1u7p h GLU 82 CO -0.07 0.41 0.49 -0.07 -1.40 0.00 0.00 179.01 178.37 1u7p h LEU 83 N -0.84 0.57 -1.11 1.33 3.38 -0.19 -0.08 115.31 118.37 1u7p h LEU 83 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u7p h LEU 83 Cb 0.58 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1u7p h LEU 83 CO 0.02 0.34 0.00 0.49 0.09 0.00 0.00 178.44 179.38 1u7p n PHE 84 N -4.49 0.30 -3.78 1.13 3.01 0.24 -4.93 117.46 108.92 1u7p n PHE 84 Ca 0.12 -0.15 -0.23 0.00 1.01 0.00 0.00 57.45 58.20 1u7p n PHE 84 Cb 0.34 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.82 1u7p n PHE 84 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1u7p n ASP 85 N 0.34 -1.17 -0.00 4.37 2.03 -0.04 -4.89 116.55 117.18 1u7p n ASP 85 Ca 0.14 -0.90 0.06 0.00 0.52 0.00 0.00 54.79 54.61 1u7p n ASP 85 Cb 0.30 -3.66 -0.08 0.00 -0.72 0.00 0.00 41.12 36.96 1u7p n ASP 85 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1u7p n LEU 86 N -4.30 0.44 -0.09 -2.67 4.77 0.14 -4.54 117.00 110.75 1u7p n LEU 86 Ca -0.29 -0.37 0.18 0.00 -0.03 0.00 0.00 56.01 55.50 1u7p n LEU 86 Cb 0.68 0.00 0.59 0.00 -2.33 0.00 0.00 43.42 42.35 1u7p n LEU 86 CO 0.71 0.11 1.20 1.23 -1.33 0.00 0.00 177.39 179.31 1u7p h GLY 87 N 2.84 0.39 2.00 -0.72 0.00 -1.86 0.90 103.07 106.61 1u7p h GLY 87 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1u7p h GLY 87 CO 0.00 0.03 0.00 0.58 0.00 0.00 0.00 176.54 177.15 1u7p n LYS 88 N -4.43 0.08 0.05 4.80 2.85 -1.26 -2.39 118.16 117.87 1u7p n LYS 88 Ca 0.12 0.45 0.11 0.00 -1.05 0.00 0.00 58.31 57.94 1u7p n LYS 88 Cb 0.57 -1.71 -0.08 0.00 -0.65 0.00 0.00 35.03 33.17 1u7p n LYS 88 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1u7p n TYR 89 N -1.88 0.55 -4.09 5.58 4.02 0.31 -4.93 117.16 116.72 1u7p n TYR 89 Ca 0.01 0.16 -0.35 0.00 -0.01 0.00 0.00 57.90 57.71 1u7p n TYR 89 Cb 0.11 -0.77 -0.09 0.00 -0.02 0.00 0.00 39.34 38.57 1u7p n TYR 89 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1u7p s PHE 90 N -3.42 3.26 -0.89 -0.72 0.40 -1.00 -4.20 117.98 111.40 1u7p s PHE 90 Ca -0.04 0.12 0.22 0.00 -0.60 0.00 0.00 56.93 56.63 1u7p s PHE 90 Cb 0.11 -2.00 -0.00 0.00 0.51 0.00 0.00 43.02 41.64 1u7p s PHE 90 CO 0.84 0.26 1.03 0.44 0.70 0.00 0.00 175.22 178.50 1u7p n ILE 91 N 3.10 0.03 -3.68 0.64 -5.35 -0.10 -4.94 119.36 109.06 1u7p n ILE 91 Ca -0.17 -0.06 -0.15 0.00 -0.27 0.00 0.00 62.75 62.10 1u7p n ILE 91 Cb 0.53 0.63 -0.08 0.00 -1.74 0.00 0.00 39.64 38.98 1u7p n ILE 91 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1u7p s GLN 92 N -3.06 0.77 -0.06 6.28 -1.52 -1.25 -5.06 119.66 115.77 1u7p s GLN 92 Ca 0.07 0.05 -0.03 0.00 -1.95 0.00 0.00 55.36 53.51 1u7p s GLN 92 Cb 0.16 0.36 0.04 0.00 -0.22 0.00 0.00 33.01 33.34 1u7p s GLN 92 CO 0.82 -0.21 0.11 1.03 -0.25 0.00 0.00 175.29 176.78 1u7p s ARG 93 N -1.10 -0.02 -0.37 2.91 0.52 -1.26 -1.91 118.95 117.73 1u7p s ARG 93 Ca -0.11 0.46 0.02 0.00 -0.52 0.00 0.00 55.73 55.57 1u7p s ARG 93 Cb -0.03 -0.37 0.11 0.00 0.52 0.00 0.00 34.95 35.17 1u7p s ARG 93 CO 0.06 -0.30 0.11 -1.21 0.02 0.00 0.00 175.30 173.97 1u7p s GLU 94 N 2.13 1.66 -0.30 3.54 0.41 0.57 -4.96 118.70 121.74 1u7p s GLU 94 Ca 0.03 -1.91 0.01 0.00 -0.41 0.00 0.00 54.97 52.69 1u7p s GLU 94 Cb -0.12 -3.32 0.09 0.00 -1.78 0.00 0.00 34.13 29.00 1u7p s GLU 94 CO -0.04 -0.99 0.05 0.42 -0.49 0.00 0.00 175.26 174.21 1u7p s ILE 95 N 0.89 1.45 -0.23 -1.63 1.01 -1.26 -0.65 121.20 120.78 1u7p s ILE 95 Ca 0.11 -1.67 -0.34 0.00 0.00 0.00 0.00 60.65 58.75 1u7p s ILE 95 Cb -0.20 -2.02 0.16 0.00 0.01 0.00 0.00 42.46 40.40 1u7p s ILE 95 CO -0.07 -0.54 1.26 -0.72 0.00 0.00 0.00 174.94 174.88 1u7p s TYR 96 N 1.34 -0.10 0.91 3.97 -0.85 -0.44 -4.88 117.35 117.31 1u7p s TYR 96 Ca 0.07 0.11 -0.11 0.00 -0.52 0.00 0.00 57.07 56.63 1u7p s TYR 96 Cb -0.18 0.50 0.14 0.00 0.38 0.00 0.00 41.96 42.80 1u7p s TYR 96 CO -0.16 -0.13 1.12 -2.14 -1.52 0.00 0.00 175.55 172.72 1u7p s PRO 97 N -1.82 1.06 0.00 -3.49 0.02 -1.21 -3.97 135.00 125.58 1u7p s PRO 97 Ca 0.09 1.35 0.00 0.00 0.02 0.00 0.00 61.00 62.45 1u7p s PRO 97 Cb -0.01 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.76 1u7p s PRO 97 CO -0.05 -2.54 0.00 0.41 -0.33 0.00 0.00 177.00 174.50 1u7p n GLY 98 N -0.10 2.90 3.73 0.52 0.00 -1.26 -5.00 105.19 105.98 1u7p n GLY 98 Ca 0.10 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.66 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 6.39 0.00 1.61 0.15 -1.26 -4.84 113.70 115.74 1u7p s SER 99 Ca 0.00 2.89 0.14 0.00 0.70 0.00 0.00 55.95 59.68 1u7p s SER 99 Cb 0.00 -2.62 0.81 0.00 -1.71 0.00 0.00 66.02 62.51 1u7p s SER 99 CO 0.00 -0.94 1.24 0.29 1.20 0.00 0.00 173.24 175.03 1u7p n LYS 100 N 3.09 0.43 0.04 5.44 5.02 -1.26 -1.55 118.16 129.37 1u7p n LYS 100 Ca 0.12 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.38 1u7p n LYS 100 Cb 0.36 -1.50 0.21 0.00 -0.02 0.00 0.00 35.03 34.09 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 1.27 -0.27 -0.18 2.07 -1.88 -1.93 116.25 115.34 1u7p h VAL 101 Ca 0.00 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 1u7p h VAL 101 Cb 0.00 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1u7p h VAL 101 CO 0.00 0.41 0.07 0.74 0.02 0.00 0.00 177.57 178.81 1u7p h THR 102 N 0.35 1.21 -0.22 2.57 2.02 -1.65 -0.70 112.91 116.49 1u7p h THR 102 Ca 0.05 -0.68 0.02 0.00 0.77 0.00 0.00 66.41 66.57 1u7p h THR 102 Cb 0.71 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 1u7p h THR 102 CO 0.05 0.22 0.06 0.45 0.37 0.00 0.00 175.52 176.68 1u7p h HIS 103 N 0.26 0.11 -0.33 3.16 -0.00 -1.63 -1.78 115.15 114.94 1u7p h HIS 103 Ca 0.08 0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.38 1u7p h HIS 103 Cb 0.27 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.65 1u7p h HIS 103 CO 0.01 0.05 -0.14 0.74 -0.00 0.00 0.00 177.93 178.59 1u7p h PHE 104 N 0.16 0.63 -0.47 2.45 -1.00 -1.24 -0.72 116.94 116.74 1u7p h PHE 104 Ca 0.10 -0.11 -0.06 0.00 2.81 0.00 0.00 57.97 60.71 1u7p h PHE 104 Cb 0.08 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.45 1u7p h PHE 104 CO -0.13 0.69 0.06 0.93 -1.61 0.00 0.00 178.31 178.25 1u7p h GLU 105 N 0.53 0.74 -0.26 1.51 5.08 -0.78 0.30 114.58 121.70 1u7p h GLU 105 Ca 0.09 -0.17 -0.15 0.00 -1.00 0.00 0.00 59.36 58.13 1u7p h GLU 105 Cb 0.55 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1u7p h GLU 105 CO 0.03 0.72 -0.45 0.00 -1.00 0.00 0.00 179.01 178.31 1u7p h ARG 106 N 0.71 0.66 -0.41 2.33 3.08 -0.80 -1.66 114.38 118.29 1u7p h ARG 106 Ca 0.15 -0.37 -0.11 0.00 0.07 0.00 0.00 59.98 59.72 1u7p h ARG 106 Cb 0.35 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1u7p h ARG 106 CO 0.01 0.98 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.62 1u7p h LEU 107 N 0.53 0.81 -0.46 3.04 3.38 -0.52 -0.99 115.31 121.10 1u7p h LEU 107 Ca 0.03 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 1u7p h LEU 107 Cb 0.99 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1u7p h LEU 107 CO 0.09 0.99 0.19 -0.74 0.09 0.00 0.00 178.44 179.06 1u7p h HIS 108 N 0.71 0.69 -0.09 1.13 2.76 -0.20 -0.92 115.15 119.23 1u7p h HIS 108 Ca 0.10 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1u7p h HIS 108 Cb 0.71 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 29.46 1u7p h HIS 108 CO 0.04 0.59 0.03 1.25 -1.30 0.00 0.00 177.93 178.54 1u7p h HIS 109 N 0.60 0.13 -0.04 5.26 -0.00 -1.09 0.47 115.15 120.49 1u7p h HIS 109 Ca 0.15 -0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.39 1u7p h HIS 109 Cb 0.18 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 27.54 1u7p h HIS 109 CO 0.00 0.26 -0.56 0.87 -0.00 0.00 0.00 177.93 178.50 1u7p h LYS 110 N -0.02 0.11 0.00 5.26 1.57 -1.13 -3.32 116.57 119.05 1u7p h LYS 110 Ca 0.03 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1u7p h LYS 110 Cb 0.18 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1u7p h LYS 110 CO -0.00 0.64 -1.85 0.25 -0.57 0.00 0.00 179.45 177.92 1u7p n THR 111 N -3.89 0.19 -0.87 -0.16 -2.24 -0.36 -4.98 114.28 101.96 1u7p n THR 111 Ca -0.02 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 1u7p n THR 111 Cb 0.57 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 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 1.60 0.77 3.72 3.38 0.00 0.17 -4.98 105.19 109.84 1u7p n GLY 112 Ca -0.07 0.00 -0.42 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 -3.28 3.79 0.45 1.61 1.01 -1.25 -4.99 120.40 117.75 1u7p s VAL 113 Ca 0.00 1.32 -0.24 0.00 0.00 0.00 0.00 61.98 63.06 1u7p s VAL 113 Cb 0.00 -3.85 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 1u7p s VAL 113 CO 0.00 0.12 1.25 -2.84 0.00 0.00 0.00 175.10 173.63 1u7p s PRO 114 N 0.85 3.72 0.27 2.72 0.02 -1.26 -4.66 135.00 136.66 1u7p s PRO 114 Ca 0.59 2.01 0.01 0.00 0.02 0.00 0.00 61.00 63.62 1u7p s PRO 114 Cb -0.32 -2.52 0.58 0.00 0.02 0.00 0.00 34.50 32.27 1u7p s PRO 114 CO 0.31 -0.65 1.76 0.74 -0.33 0.00 0.00 177.00 178.83 1u7p h PHE 115 N 2.19 0.81 -0.07 6.54 0.05 -1.94 -0.45 116.94 124.07 1u7p h PHE 115 Ca -0.50 0.03 0.02 0.00 3.82 0.00 0.00 57.97 61.35 1u7p h PHE 115 Cb 1.26 -0.23 -0.00 0.00 2.00 0.00 0.00 35.95 38.98 1u7p h PHE 115 CO 0.52 0.18 0.08 0.66 -0.18 0.00 0.00 178.31 179.57 1u7p h SER 116 N 0.64 0.00 -0.50 2.17 4.64 -1.79 -1.59 113.55 117.11 1u7p h SER 116 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1u7p h SER 116 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1u7p h SER 116 CO -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.58 1u7p n GLN 117 N -3.84 3.54 -4.45 4.77 1.13 -0.18 -4.70 117.38 113.64 1u7p n GLN 117 Ca -0.01 -2.38 -0.33 0.00 -1.94 0.00 0.00 57.00 52.34 1u7p n GLN 117 Cb 0.18 -1.90 -0.10 0.00 0.11 0.00 0.00 30.24 28.53 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 -2.01 2.74 0.04 -1.09 -1.94 -0.60 -0.32 119.30 116.11 1u7p s MET 118 Ca 0.42 -0.59 0.06 0.00 -1.71 0.00 0.00 55.69 53.88 1u7p s MET 118 Cb 0.29 -2.62 -0.03 0.00 2.01 0.00 0.00 34.83 34.48 1u7p s MET 118 CO 0.17 0.64 -0.16 0.54 -0.01 0.00 0.00 175.02 176.21 1u7p s VAL 119 N -0.94 2.94 -0.03 -6.03 0.11 -0.61 -1.12 120.40 114.72 1u7p s VAL 119 Ca 0.16 -1.12 0.00 0.00 -2.93 0.00 0.00 61.98 58.09 1u7p s VAL 119 Cb -0.11 -2.25 0.03 0.00 -1.53 0.00 0.00 36.38 32.52 1u7p s VAL 119 CO 0.05 0.34 0.01 0.12 -3.33 0.00 0.00 175.10 172.30 1u7p s PHE 120 N -0.94 0.27 -0.19 1.54 5.36 0.85 -0.98 117.98 123.88 1u7p s PHE 120 Ca 0.15 0.03 -0.03 0.00 -0.96 0.00 0.00 56.93 56.12 1u7p s PHE 120 Cb -0.11 -0.40 -0.01 0.00 -0.34 0.00 0.00 43.02 42.16 1u7p s PHE 120 CO 0.06 -0.13 -0.06 -0.06 -1.46 0.00 0.00 175.22 173.57 1u7p s PHE 121 N 1.14 2.94 -0.01 10.12 0.40 -0.53 0.87 117.98 132.90 1u7p s PHE 121 Ca -0.08 -0.79 -0.09 0.00 -0.60 0.00 0.00 56.93 55.37 1u7p s PHE 121 Cb -0.13 -2.04 0.01 0.00 0.51 0.00 0.00 43.02 41.37 1u7p s PHE 121 CO -0.02 -0.41 0.19 0.34 0.70 0.00 0.00 175.22 176.01 1u7p s ASP 122 N 1.11 -0.06 0.00 1.36 -1.08 -0.87 -1.94 116.67 115.19 1u7p s ASP 122 Ca 0.01 -0.04 0.26 0.00 -0.52 0.00 0.00 52.55 52.26 1u7p s ASP 122 Cb -0.15 0.27 0.68 0.00 -1.46 0.00 0.00 42.92 42.26 1u7p s ASP 122 CO -0.01 -0.34 1.53 -0.67 0.52 0.00 0.00 175.17 176.20 1u7p n ASP 123 N 1.67 0.69 -4.56 -0.34 -0.08 -1.26 -1.65 116.55 111.03 1u7p n ASP 123 Ca -0.21 -0.51 -0.37 0.00 -1.51 0.00 0.00 54.79 52.20 1u7p n ASP 123 Cb 0.56 0.15 -0.11 0.00 2.34 0.00 0.00 41.12 44.06 1u7p n ASP 123 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1u7p s GLU 124 N -2.76 3.88 0.36 -0.67 2.02 -1.26 -4.81 118.70 115.45 1u7p s GLU 124 Ca 0.18 -0.37 0.09 0.00 0.02 0.00 0.00 54.97 54.89 1u7p s GLU 124 Cb 0.18 -3.47 0.82 0.00 0.10 0.00 0.00 34.13 31.76 1u7p s GLU 124 CO 0.60 -0.09 1.88 -0.91 0.02 0.00 0.00 175.26 176.77 1u7p h ASN 125 N 7.98 0.65 0.16 -0.19 4.21 -1.96 -1.77 115.58 124.65 1u7p h ASN 125 Ca -0.37 0.04 -0.12 0.00 1.21 0.00 0.00 56.30 57.06 1u7p h ASN 125 Cb 1.18 -0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 38.27 1u7p h ASN 125 CO 0.59 0.34 -0.41 -0.09 -1.29 0.00 0.00 177.43 176.57 1u7p h ARG 126 N 0.69 0.33 -0.25 0.81 9.65 -1.99 -1.76 114.38 121.86 1u7p h ARG 126 Ca 0.43 -0.16 -0.17 0.00 -1.10 0.00 0.00 59.98 58.98 1u7p h ARG 126 Cb 0.69 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.26 1u7p h ARG 126 CO -0.19 0.69 -0.52 -0.91 2.80 0.00 0.00 179.97 181.84 1u7p h ASN 127 N 0.28 0.79 -0.79 -3.80 2.35 -1.77 -0.94 115.58 111.70 1u7p h ASN 127 Ca 0.02 -0.41 -0.02 0.00 -0.55 0.00 0.00 56.30 55.34 1u7p h ASN 127 Cb 0.85 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.96 1u7p h ASN 127 CO 0.07 1.16 0.40 0.40 -1.65 0.00 0.00 177.43 177.81 1u7p h ILE 128 N 0.56 1.24 0.45 2.81 1.08 -1.18 -1.62 117.51 120.85 1u7p h ILE 128 Ca 0.02 -0.65 -0.02 0.00 -0.39 0.00 0.00 64.86 63.81 1u7p h ILE 128 Cb 1.09 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 35.07 1u7p h ILE 128 CO 0.11 0.28 -0.22 0.40 -0.69 0.00 0.00 178.15 178.03 1u7p h ILE 129 N 1.10 0.40 -0.08 -0.67 2.04 -1.16 -2.10 117.51 117.04 1u7p h ILE 129 Ca 0.27 -0.51 0.04 0.00 1.00 0.00 0.00 64.86 65.66 1u7p h ILE 129 Cb 0.09 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 1u7p h ILE 129 CO -0.04 0.07 -0.21 0.44 0.00 0.00 0.00 178.15 178.41 1u7p h ASP 130 N -0.97 -0.64 0.43 1.72 3.32 -1.10 -2.13 116.42 117.06 1u7p h ASP 130 Ca -0.06 0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 1u7p h ASP 130 Cb 0.57 0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 1u7p h ASP 130 CO 0.10 -0.27 -0.29 0.58 -1.72 0.00 0.00 179.24 177.65 1u7p h VAL 131 N -0.30 1.00 -0.16 -1.35 2.07 -1.42 -2.75 116.25 113.36 1u7p h VAL 131 Ca 0.08 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 1u7p h VAL 131 Cb 0.41 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1u7p h VAL 131 CO -0.25 0.28 0.05 1.23 0.02 0.00 0.00 177.57 178.90 1u7p h GLY 132 N 1.15 0.23 2.00 2.17 0.00 -0.69 -1.85 103.07 106.08 1u7p h GLY 132 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1u7p h GLY 132 CO 0.04 0.09 0.00 0.54 0.00 0.00 0.00 176.54 177.21 1u7p n ARG 133 N -4.46 0.15 0.05 4.80 1.74 -1.04 -1.31 116.66 116.60 1u7p n ARG 133 Ca -0.01 0.59 0.12 0.00 -0.77 0.00 0.00 57.85 57.78 1u7p n ARG 133 Cb 0.12 -1.94 0.15 0.00 -1.02 0.00 0.00 32.46 29.77 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 -2.25 0.67 0.00 0.55 4.77 -0.69 -4.95 117.00 115.09 1u7p n LEU 134 Ca -0.01 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1u7p n LEU 134 Cb 0.08 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1u7p n LEU 134 CO 0.12 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 1u7p n GLY 135 N 1.35 0.46 3.77 -0.72 0.00 -0.43 -4.52 105.19 105.11 1u7p n GLY 135 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 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 2.95 -0.40 1.61 1.01 -1.23 -4.12 120.40 118.21 1u7p s VAL 136 Ca 0.00 0.77 -0.28 0.00 0.00 0.00 0.00 61.98 62.47 1u7p s VAL 136 Cb 0.00 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 32.99 1u7p s VAL 136 CO 0.00 0.04 1.05 -0.89 0.00 0.00 0.00 175.10 175.30 1u7p s THR 137 N -1.43 4.41 -0.22 3.92 2.01 -0.27 -4.60 115.64 119.45 1u7p s THR 137 Ca 0.61 1.32 -0.08 0.00 0.31 0.00 0.00 61.69 63.84 1u7p s THR 137 Cb -0.32 -4.47 -0.04 0.00 0.01 0.00 0.00 72.50 67.68 1u7p s THR 137 CO 0.40 -0.73 0.08 0.00 -0.69 0.00 0.00 174.62 173.68 1u7p s ILE 139 N 1.11 4.10 -0.09 0.00 -1.09 0.25 -4.95 121.20 120.53 1u7p s ILE 139 Ca 0.05 -0.95 -0.28 0.00 -2.23 0.00 0.00 60.65 57.24 1u7p s ILE 139 Cb -0.14 -3.27 -0.02 0.00 -1.58 0.00 0.00 42.46 37.45 1u7p s ILE 139 CO 0.04 -0.15 0.92 -2.28 -1.23 0.00 0.00 174.94 172.24 1u7p s HIS 140 N 1.47 3.53 0.19 3.97 5.65 -1.26 -2.06 115.29 126.78 1u7p s HIS 140 Ca 0.00 1.50 0.07 0.00 0.25 0.00 0.00 55.06 56.88 1u7p s HIS 140 Cb -0.19 -3.09 -0.04 0.00 -1.18 0.00 0.00 32.58 28.08 1u7p s HIS 140 CO 0.04 -0.15 0.07 0.96 -0.65 0.00 0.00 174.74 175.01 1u7p s ILE 141 N 1.69 4.04 -0.06 0.89 -4.36 -0.66 -4.96 121.20 117.79 1u7p s ILE 141 Ca 0.45 -1.34 0.06 0.00 -0.26 0.00 0.00 60.65 59.57 1u7p s ILE 141 Cb -0.18 -3.07 -0.09 0.00 1.25 0.00 0.00 42.46 40.37 1u7p s ILE 141 CO 0.19 -0.15 0.04 0.54 0.24 0.00 0.00 174.94 175.80 1u7p n ARG 142 N -0.36 2.52 -2.30 0.37 1.74 -1.26 -4.50 116.66 112.87 1u7p n ARG 142 Ca -0.09 -0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 56.90 1u7p n ARG 142 Cb 0.56 -1.17 0.05 0.00 -1.02 0.00 0.00 32.46 30.87 1u7p n ARG 142 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1u7p n ASP 143 N -2.18 2.75 -0.28 0.55 8.00 -1.26 -5.13 116.55 119.00 1u7p n ASP 143 Ca -0.10 -2.76 0.04 0.00 0.71 0.00 0.00 54.79 52.68 1u7p n ASP 143 Cb 0.65 -0.42 -0.01 0.00 -0.02 0.00 0.00 41.12 41.32 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 -0.58 -1.58 3.81 0.44 0.00 -1.24 -4.91 105.19 101.14 1u7p n GLY 144 Ca 0.21 -1.45 -0.33 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.52 4.05 0.23 1.61 -1.94 -0.27 -4.95 119.30 116.52 1u7p s MET 145 Ca 0.00 1.18 -0.21 0.00 -1.71 0.00 0.00 55.69 54.95 1u7p s MET 145 Cb 0.00 -2.15 0.04 0.00 2.01 0.00 0.00 34.83 34.73 1u7p s MET 145 CO 0.00 -0.19 0.65 -1.54 -0.01 0.00 0.00 175.02 173.93 1u7p s SER 146 N -2.21 -0.35 0.24 3.03 1.04 -1.26 -4.62 113.70 109.56 1u7p s SER 146 Ca 0.63 -0.41 -0.07 0.00 0.48 0.00 0.00 55.95 56.59 1u7p s SER 146 Cb -0.11 0.67 0.25 0.00 0.10 0.00 0.00 66.02 66.92 1u7p s SER 146 CO 0.17 -1.19 1.91 -0.07 0.98 0.00 0.00 173.24 175.04 1u7p h LEU 147 N 2.03 1.06 -0.13 2.42 3.38 -1.96 -1.04 115.31 121.07 1u7p h LEU 147 Ca -0.25 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1u7p h LEU 147 Cb 1.27 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1u7p h LEU 147 CO 0.30 0.75 0.05 -0.61 0.09 0.00 0.00 178.44 179.02 1u7p h GLN 148 N 1.24 0.19 -0.90 1.13 4.15 -1.99 -1.38 115.11 117.55 1u7p h GLN 148 Ca 0.35 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.80 1u7p h GLN 148 Cb -0.11 -0.03 -0.06 0.00 0.21 0.00 0.00 27.48 27.49 1u7p h GLN 148 CO -0.09 0.28 0.57 1.15 -1.93 0.00 0.00 178.83 178.81 1u7p h THR 149 N 0.06 1.05 0.23 2.39 2.02 -1.85 -0.82 112.91 115.99 1u7p h THR 149 Ca 0.04 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.86 1u7p h THR 149 Cb 0.16 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1u7p h THR 149 CO -0.00 0.19 -0.11 0.25 0.37 0.00 0.00 175.52 176.22 1u7p h LEU 150 N 1.03 -0.26 -0.68 2.58 5.85 -0.89 -0.53 115.31 122.41 1u7p h LEU 150 Ca 0.39 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 59.14 1u7p h LEU 150 Cb 0.17 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.21 1u7p h LEU 150 CO -0.17 -0.13 0.38 0.74 -0.34 0.00 0.00 178.44 178.91 1u7p h THR 151 N -0.36 0.97 -0.72 1.05 2.02 -0.79 0.12 112.91 115.19 1u7p h THR 151 Ca -0.03 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 66.87 1u7p h THR 151 Cb 0.28 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.86 1u7p h THR 151 CO 0.05 0.13 0.30 1.56 0.37 0.00 0.00 175.52 177.93 1u7p h GLN 152 N 0.70 1.08 -0.62 6.66 4.20 -0.99 -1.03 115.11 125.11 1u7p h GLN 152 Ca 0.31 -0.19 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 1u7p h GLN 152 Cb 0.19 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1u7p h GLN 152 CO -0.18 0.88 0.08 0.78 -0.67 0.00 0.00 178.83 179.71 1u7p h GLY 153 N 1.03 1.12 1.78 3.46 0.00 -0.21 -1.54 103.07 108.71 1u7p h GLY 153 Ca 0.24 -0.76 -0.08 0.00 0.00 0.00 0.00 47.33 46.73 1u7p h GLY 153 CO -0.02 0.70 -0.28 1.41 0.00 0.00 0.00 176.54 178.36 1u7p h LEU 154 N 0.94 0.26 -0.14 3.11 3.38 -0.43 -1.41 115.31 121.02 1u7p h LEU 154 Ca 0.19 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 1u7p h LEU 154 Cb 0.46 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1u7p h LEU 154 CO 0.02 0.54 -0.14 -0.33 0.09 0.00 0.00 178.44 178.61 1u7p h GLU 155 N 0.23 0.34 -0.93 1.13 5.08 -0.97 -1.86 114.58 117.60 1u7p h GLU 155 Ca 0.03 -0.18 0.11 0.00 -1.00 0.00 0.00 59.36 58.32 1u7p h GLU 155 Cb 0.61 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.79 1u7p h GLU 155 CO 0.04 0.73 0.57 1.15 -1.00 0.00 0.00 179.01 180.50 1u7p h THR 156 N -0.04 0.92 -0.18 1.13 2.02 -1.06 -0.32 112.91 115.40 1u7p h THR 156 Ca 0.02 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 1u7p h THR 156 Cb 0.67 -0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1u7p h THR 156 CO 0.03 0.17 0.07 0.15 0.37 0.00 0.00 175.52 176.31 1u7p h PHE 157 N 0.93 0.27 -0.04 3.16 3.57 -1.10 -2.24 116.94 121.49 1u7p h PHE 157 Ca 0.46 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.96 1u7p h PHE 157 Cb 0.42 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1u7p h PHE 157 CO -0.03 0.34 -0.09 0.00 -2.23 0.00 0.00 178.31 176.30 1u7p h ALA 158 N 0.91 -0.06 0.02 2.41 0.00 -0.40 -1.58 119.26 120.55 1u7p h ALA 158 Ca 0.06 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1u7p h ALA 158 Cb 0.18 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1u7p h ALA 158 CO -0.00 -0.57 -0.26 0.87 0.00 0.00 0.00 179.25 179.28 1u7p h LYS 159 N -0.14 -0.40 -0.65 0.00 1.57 -1.07 0.88 116.57 116.76 1u7p h LYS 159 Ca 0.05 0.03 0.16 0.00 -1.87 0.00 0.00 60.65 59.02 1u7p h LYS 159 Cb 0.20 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 1u7p h LYS 159 CO -0.12 -0.27 0.46 0.00 -0.57 0.00 0.00 179.45 178.95 1u7p h ALA 160 N 0.39 2.40 -0.01 3.86 0.00 -1.16 0.91 119.26 125.64 1u7p h ALA 160 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1u7p h ALA 160 Cb 0.49 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1u7p h ALA 160 CO -0.22 -0.58 -0.41 1.04 0.00 0.00 0.00 179.25 179.08 1u7p n GLN 161 N -4.41 0.61 0.00 0.00 1.13 -0.56 -5.11 117.38 109.04 1u7p n GLN 161 Ca 0.12 -0.40 0.00 0.00 -1.94 0.00 0.00 57.00 54.79 1u7p n GLN 161 Cb 0.62 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.48 1u7p n GLN 161 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62