#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibr s GLN 10 N 0.00 0.64 0.01 5.55 -2.07 -1.26 -0.43 119.66 122.10 1ibr s GLN 10 Ca 0.00 -0.95 0.00 0.00 -1.82 0.00 0.00 55.36 52.59 1ibr s GLN 10 Cb 0.00 -0.29 -0.01 0.00 -1.09 0.00 0.00 33.01 31.62 1ibr s GLN 10 CO 0.00 0.03 -0.02 -0.06 -1.32 0.00 0.00 175.29 173.93 1ibr s PHE 11 N -2.09 0.13 -0.22 9.60 0.08 -0.23 -4.97 117.98 120.29 1ibr s PHE 11 Ca -0.03 -0.18 -0.27 0.00 0.12 0.00 0.00 56.93 56.58 1ibr s PHE 11 Cb -0.05 -0.09 -0.00 0.00 -0.57 0.00 0.00 43.02 42.31 1ibr s PHE 11 CO -0.01 -0.06 0.92 0.21 -0.10 0.00 0.00 175.22 176.18 1ibr s LYS 12 N -0.48 4.25 -0.12 0.44 2.20 -1.26 -0.40 119.74 124.36 1ibr s LYS 12 Ca -0.05 1.15 0.02 0.00 -0.36 0.00 0.00 55.97 56.73 1ibr s LYS 12 Cb -0.03 -3.62 -0.00 0.00 -1.51 0.00 0.00 37.83 32.66 1ibr s LYS 12 CO -0.00 -0.52 -0.20 -1.17 -0.36 0.00 0.00 175.35 173.10 1ibr s LEU 13 N 2.81 2.29 -0.21 5.43 0.20 -0.35 -0.66 118.68 128.18 1ibr s LEU 13 Ca 0.40 -0.50 -0.06 0.00 0.69 0.00 0.00 54.13 54.66 1ibr s LEU 13 Cb -0.16 -1.48 -0.03 0.00 -0.43 0.00 0.00 46.19 44.10 1ibr s LEU 13 CO 0.08 0.14 0.02 0.68 -0.29 0.00 0.00 176.35 176.99 1ibr s VAL 14 N 0.45 4.11 -0.35 1.68 -7.23 -0.77 -0.38 120.40 117.91 1ibr s VAL 14 Ca -0.14 -0.26 -0.13 0.00 -1.81 0.00 0.00 61.98 59.64 1ibr s VAL 14 Cb -0.17 -2.87 -0.01 0.00 0.56 0.00 0.00 36.38 33.89 1ibr s VAL 14 CO 0.06 0.41 0.25 -0.22 -0.31 0.00 0.00 175.10 175.30 1ibr s LEU 15 N 1.04 4.59 0.18 1.32 2.96 -0.28 -1.97 118.68 126.54 1ibr s LEU 15 Ca 0.03 -0.47 0.04 0.00 -0.22 0.00 0.00 54.13 53.50 1ibr s LEU 15 Cb -0.14 -2.14 -0.05 0.00 0.50 0.00 0.00 46.19 44.35 1ibr s LEU 15 CO 0.02 -0.26 -0.06 0.68 -1.32 0.00 0.00 176.35 175.40 1ibr s VAL 16 N 1.72 1.14 0.00 1.68 -7.23 -0.69 -2.13 120.40 114.90 1ibr s VAL 16 Ca 0.06 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1ibr s VAL 16 Cb -0.18 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 34.71 1ibr s VAL 16 CO 0.10 -0.57 0.00 0.61 -0.31 0.00 0.00 175.10 174.94 1ibr n GLY 17 N -0.29 3.32 3.47 2.32 0.00 -1.26 -0.10 105.19 112.64 1ibr n GLY 17 Ca -0.08 -1.28 -0.34 0.00 0.00 0.00 0.00 46.02 44.33 1ibr n GLY 17 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ibr n ASP 18 N 0.00 -1.43 -4.76 1.61 9.92 -1.25 -3.96 116.55 116.69 1ibr n ASP 18 Ca 0.00 0.42 -0.41 0.00 -0.53 0.00 0.00 54.79 54.27 1ibr n ASP 18 Cb 0.00 -1.25 -0.02 0.00 -0.64 0.00 0.00 41.12 39.21 1ibr n ASP 18 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1ibr s GLY 19 N -1.93 2.57 0.00 0.44 0.00 -1.22 -2.82 107.32 104.36 1ibr s GLY 19 Ca 0.61 1.35 0.00 0.00 0.00 0.00 0.00 44.72 46.68 1ibr s GLY 19 CO 0.63 2.19 0.00 0.61 0.00 0.00 0.00 173.10 176.53 1ibr n GLY 20 N 1.62 0.75 0.01 0.20 0.00 -1.26 -4.91 105.19 101.60 1ibr n GLY 20 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 1ibr n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ibr n THR 21 N -2.38 0.33 -0.10 2.61 -2.24 -1.13 -4.90 114.28 106.46 1ibr n THR 21 Ca 0.00 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1ibr n THR 21 Cb 0.00 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.57 1ibr n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ibr n GLY 22 N 1.04 1.05 0.22 3.38 0.00 -1.26 -4.68 105.19 104.94 1ibr n GLY 22 Ca 0.06 -0.10 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 1ibr n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ibr h LYS 23 N 0.00 -0.42 -0.34 1.61 1.57 -1.90 -0.35 116.57 116.74 1ibr h LYS 23 Ca 0.00 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1ibr h LYS 23 Cb 0.01 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1ibr h LYS 23 CO 0.00 -0.28 0.18 1.15 -0.57 0.00 0.00 179.45 179.93 1ibr h THR 24 N -0.44 1.14 -0.48 -0.16 2.02 -1.95 -2.08 112.91 110.95 1ibr h THR 24 Ca -0.02 -0.38 0.04 0.00 0.77 0.00 0.00 66.41 66.83 1ibr h THR 24 Cb 0.37 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 1ibr h THR 24 CO 0.01 0.15 0.23 0.74 0.37 0.00 0.00 175.52 177.02 1ibr h THR 25 N 0.42 0.95 -0.59 3.16 2.02 -1.90 -1.12 112.91 115.85 1ibr h THR 25 Ca 0.12 -0.16 0.07 0.00 0.77 0.00 0.00 66.41 67.21 1ibr h THR 25 Cb 0.07 0.44 -0.06 0.00 -1.74 0.00 0.00 68.15 66.87 1ibr h THR 25 CO -0.02 0.08 0.28 0.15 0.37 0.00 0.00 175.52 176.38 1ibr h PHE 26 N 0.46 0.50 -0.19 3.16 3.57 -0.78 -1.38 116.94 122.27 1ibr h PHE 26 Ca 0.21 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.69 1ibr h PHE 26 Cb 0.13 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1ibr h PHE 26 CO -0.11 0.20 -0.06 0.28 -2.23 0.00 0.00 178.31 176.39 1ibr h VAL 27 N 0.51 1.29 -0.86 1.41 2.07 -0.80 -3.06 116.25 116.80 1ibr h VAL 27 Ca 0.28 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.78 1ibr h VAL 27 Cb 0.25 1.59 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 1ibr h VAL 27 CO -0.22 0.32 0.55 0.11 0.02 0.00 0.00 177.57 178.35 1ibr h LYS 28 N 0.09 1.03 -0.58 1.57 1.79 -1.01 -0.18 116.57 119.29 1ibr h LYS 28 Ca 0.05 -0.06 0.09 0.00 -2.18 0.00 0.00 60.65 58.55 1ibr h LYS 28 Cb 0.51 -0.23 -0.07 0.00 -1.58 0.00 0.00 32.23 30.86 1ibr h LYS 28 CO 0.02 0.68 0.19 -0.09 -1.08 0.00 0.00 179.45 179.17 1ibr h ARG 29 N 1.06 0.34 -0.08 3.15 9.65 -1.20 0.44 114.38 127.73 1ibr h ARG 29 Ca 0.35 -0.02 -0.14 0.00 -1.10 0.00 0.00 59.98 59.07 1ibr h ARG 29 Cb 0.04 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.53 1ibr h ARG 29 CO -0.13 0.22 -0.58 0.45 2.80 0.00 0.00 179.97 182.74 1ibr h HIS 30 N 0.35 0.34 0.46 2.20 3.86 -1.27 0.16 115.15 121.25 1ibr h HIS 30 Ca 0.29 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1ibr h HIS 30 Cb 0.38 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.79 1ibr h HIS 30 CO -0.19 0.78 -0.22 1.25 0.86 0.00 0.00 177.93 180.40 1ibr h LEU 31 N 0.20 -0.53 0.00 2.43 5.85 0.26 -3.40 115.31 120.12 1ibr h LEU 31 Ca -0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1ibr h LEU 31 Cb 1.07 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1ibr h LEU 31 CO 0.09 -0.12 -1.53 0.35 -0.34 0.00 0.00 178.44 176.89 1ibr n THR 32 N -5.09 0.00 -0.41 1.05 -2.24 0.14 -4.98 114.28 102.74 1ibr n THR 32 Ca -0.08 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1ibr n THR 32 Cb 0.25 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1ibr n THR 32 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ibr n GLY 33 N 1.70 0.83 3.84 3.38 0.00 0.55 -5.02 105.19 110.47 1ibr n GLY 33 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1ibr n GLY 33 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ibr s GLU 34 N -0.52 4.04 -0.40 1.61 2.12 -1.26 -4.90 118.70 119.39 1ibr s GLU 34 Ca 0.00 0.63 -0.12 0.00 0.36 0.00 0.00 54.97 55.85 1ibr s GLU 34 Cb 0.00 -2.67 0.04 0.00 0.26 0.00 0.00 34.13 31.76 1ibr s GLU 34 CO 0.00 0.30 0.24 0.12 -0.54 0.00 0.00 175.26 175.38 1ibr s PHE 35 N -1.75 3.26 -0.21 5.30 5.36 -1.26 -3.43 117.98 125.25 1ibr s PHE 35 Ca 0.47 -1.01 -0.29 0.00 -0.96 0.00 0.00 56.93 55.14 1ibr s PHE 35 Cb -0.13 -2.60 -0.02 0.00 -0.34 0.00 0.00 43.02 39.93 1ibr s PHE 35 CO 0.19 -0.69 1.51 -2.00 -1.46 0.00 0.00 175.22 172.78 1ibr s GLU 36 N 1.55 3.91 0.16 10.12 2.56 -1.26 -4.88 118.70 130.87 1ibr s GLU 36 Ca 0.03 1.63 0.16 0.00 0.00 0.00 0.00 54.97 56.78 1ibr s GLU 36 Cb -0.20 -3.97 -0.04 0.00 2.00 0.00 0.00 34.13 31.92 1ibr s GLU 36 CO 0.06 -1.15 1.12 0.87 -0.56 0.00 0.00 175.26 175.61 1ibr h LYS 37 N 10.02 0.00 -7.13 4.30 1.57 -2.01 -3.47 116.57 119.85 1ibr h LYS 37 Ca -0.32 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 57.96 1ibr h LYS 37 Cb 1.14 0.00 0.04 0.00 0.08 0.00 0.00 32.23 33.49 1ibr h LYS 37 CO 1.00 0.40 0.26 0.15 -0.57 0.00 0.00 179.45 180.68 1ibr s LYS 38 N -2.95 3.59 -0.37 3.15 1.02 -1.26 -5.05 119.74 117.88 1ibr s LYS 38 Ca 0.00 0.48 -0.04 0.00 0.02 0.00 0.00 55.97 56.44 1ibr s LYS 38 Cb 0.08 -2.24 0.08 0.00 -0.52 0.00 0.00 37.83 35.23 1ibr s LYS 38 CO 0.78 -0.36 0.13 -0.47 -0.92 0.00 0.00 175.35 174.51 1ibr s TYR 39 N -2.91 3.42 -0.32 3.18 5.04 -1.26 -5.02 117.35 119.48 1ibr s TYR 39 Ca 0.51 -2.03 0.02 0.00 -2.44 0.00 0.00 57.07 53.13 1ibr s TYR 39 Cb -0.11 -2.73 0.09 0.00 0.35 0.00 0.00 41.96 39.57 1ibr s TYR 39 CO 0.48 -0.88 0.04 0.08 -1.34 0.00 0.00 175.55 173.93 1ibr s VAL 40 N 1.24 1.83 0.19 3.14 1.01 -1.26 -5.10 120.40 121.44 1ibr s VAL 40 Ca 0.02 -1.93 -0.32 0.00 0.00 0.00 0.00 61.98 59.75 1ibr s VAL 40 Cb -0.21 -2.30 -0.16 0.00 0.00 0.00 0.00 36.38 33.71 1ibr s VAL 40 CO -0.02 -0.53 1.05 0.00 0.00 0.00 0.00 175.10 175.60 1ibr n ALA 41 N 4.46 -1.13 -1.86 5.51 0.00 -1.26 -4.94 120.51 121.30 1ibr n ALA 41 Ca -0.00 0.46 -0.40 0.00 0.00 0.00 0.00 53.44 53.49 1ibr n ALA 41 Cb 0.42 -1.96 -0.05 0.00 0.00 0.00 0.00 19.45 17.87 1ibr n ALA 41 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ibr s THR 42 N -0.44 3.87 -0.42 0.00 2.01 -1.26 -5.02 115.64 114.38 1ibr s THR 42 Ca 0.71 1.79 -0.12 0.00 0.31 0.00 0.00 61.69 64.38 1ibr s THR 42 Cb -0.86 -4.14 0.05 0.00 0.01 0.00 0.00 72.50 67.56 1ibr s THR 42 CO 0.54 0.39 0.29 -0.76 -0.69 0.00 0.00 174.62 174.39 1ibr s LEU 43 N -1.01 5.14 0.00 4.42 2.01 -1.26 -4.55 118.68 123.43 1ibr s LEU 43 Ca 0.44 -1.20 0.00 0.00 0.01 0.00 0.00 54.13 53.38 1ibr s LEU 43 Cb -0.28 -2.08 0.00 0.00 0.01 0.00 0.00 46.19 43.84 1ibr s LEU 43 CO 0.35 -0.51 0.00 0.61 1.01 0.00 0.00 176.35 177.82 1ibr n GLY 44 N 5.06 1.94 3.49 -3.19 0.00 0.11 -4.73 105.19 107.87 1ibr n GLY 44 Ca -0.11 0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 1ibr n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ibr s VAL 45 N 0.00 0.00 -0.09 1.61 0.11 -1.26 -1.86 120.40 118.90 1ibr s VAL 45 Ca 0.00 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1ibr s VAL 45 Cb 0.00 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.88 1ibr s VAL 45 CO 0.00 0.00 0.01 -0.70 -3.33 0.00 0.00 175.10 171.08 1ibr s GLU 46 N -2.54 0.61 -0.23 1.54 2.12 -0.32 -4.97 118.70 114.91 1ibr s GLU 46 Ca -0.02 0.02 -0.13 0.00 0.36 0.00 0.00 54.97 55.20 1ibr s GLU 46 Cb -0.01 -1.17 -0.04 0.00 0.26 0.00 0.00 34.13 33.17 1ibr s GLU 46 CO -0.04 -0.36 0.29 0.08 -0.54 0.00 0.00 175.26 174.69 1ibr s VAL 47 N 1.96 5.26 -0.05 3.70 1.01 -1.26 -1.04 120.40 129.99 1ibr s VAL 47 Ca 0.04 0.47 -0.00 0.00 0.00 0.00 0.00 61.98 62.48 1ibr s VAL 47 Cb -0.13 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.65 1ibr s VAL 47 CO -0.06 0.28 -0.00 -1.00 0.00 0.00 0.00 175.10 174.32 1ibr s HIS 48 N 1.32 0.47 0.05 5.22 3.76 -0.21 -4.98 115.29 120.93 1ibr s HIS 48 Ca 0.14 -0.06 -0.25 0.00 -0.15 0.00 0.00 55.06 54.74 1ibr s HIS 48 Cb -0.14 -0.58 -0.06 0.00 1.11 0.00 0.00 32.58 32.91 1ibr s HIS 48 CO 0.07 -0.21 0.75 -1.25 -0.85 0.00 0.00 174.74 173.26 1ibr s PRO 49 N 1.42 4.49 -0.13 8.40 0.04 -1.26 -1.01 135.00 146.94 1ibr s PRO 49 Ca -0.04 1.05 0.02 0.00 0.04 0.00 0.00 61.00 62.07 1ibr s PRO 49 Cb -0.13 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.06 1ibr s PRO 49 CO -0.03 0.31 -0.21 -0.51 0.04 0.00 0.00 177.00 176.61 1ibr s LEU 50 N -0.15 2.19 -0.12 -3.56 1.43 0.50 -4.95 118.68 114.02 1ibr s LEU 50 Ca 0.38 -0.56 -0.02 0.00 -1.03 0.00 0.00 54.13 52.90 1ibr s LEU 50 Cb -0.21 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 1ibr s LEU 50 CO 0.23 0.11 -0.03 -0.69 0.23 0.00 0.00 176.35 176.19 1ibr s VAL 51 N 0.67 3.97 -0.06 -1.59 1.01 -1.26 -0.45 120.40 122.69 1ibr s VAL 51 Ca -0.10 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 61.57 1ibr s VAL 51 Cb -0.16 -2.70 -0.00 0.00 0.00 0.00 0.00 36.38 33.52 1ibr s VAL 51 CO 0.02 0.54 -0.20 -0.36 0.00 0.00 0.00 175.10 175.10 1ibr s PHE 52 N -0.22 2.05 -0.11 5.22 0.40 -0.21 -4.98 117.98 120.13 1ibr s PHE 52 Ca 0.04 -0.67 -0.20 0.00 -0.60 0.00 0.00 56.93 55.51 1ibr s PHE 52 Cb -0.13 -1.37 -0.04 0.00 0.51 0.00 0.00 43.02 41.99 1ibr s PHE 52 CO 0.02 -0.24 0.54 -1.01 0.70 0.00 0.00 175.22 175.23 1ibr s HIS 53 N 0.11 3.52 0.26 0.36 3.76 -1.26 -0.68 115.29 121.36 1ibr s HIS 53 Ca -0.08 0.98 0.04 0.00 -0.15 0.00 0.00 55.06 55.85 1ibr s HIS 53 Cb -0.14 -2.63 -0.05 0.00 1.11 0.00 0.00 32.58 30.86 1ibr s HIS 53 CO 0.04 0.12 -0.01 0.95 -0.85 0.00 0.00 174.74 174.99 1ibr s THR 54 N 0.76 1.22 -2.00 1.30 -4.23 -1.17 0.32 115.64 111.84 1ibr s THR 54 Ca 0.29 -2.05 0.02 0.00 -1.18 0.00 0.00 61.69 58.76 1ibr s THR 54 Cb -0.16 -2.43 0.05 0.00 1.34 0.00 0.00 72.50 71.30 1ibr s THR 54 CO 0.12 -0.27 0.44 -0.46 -0.54 0.00 0.00 174.62 173.91 1ibr n ASN 55 N -0.50 0.00 -1.43 3.99 6.94 -0.93 -1.42 115.26 121.92 1ibr n ASN 55 Ca -0.05 -0.56 0.04 0.00 -0.02 0.00 0.00 54.58 53.99 1ibr n ASN 55 Cb 0.64 0.00 0.02 0.00 -2.36 0.00 0.00 39.78 38.08 1ibr n ASN 55 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1ibr n ARG 56 N -0.59 0.04 0.00 -3.83 1.74 -1.26 -4.99 116.66 107.76 1ibr n ARG 56 Ca 0.01 -1.98 0.00 0.00 -0.77 0.00 0.00 57.85 55.11 1ibr n ARG 56 Cb 0.01 -0.06 0.00 0.00 -1.02 0.00 0.00 32.46 31.38 1ibr n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ibr n GLY 57 N 0.44 1.11 3.77 -0.13 0.00 -0.51 -4.99 105.19 104.88 1ibr n GLY 57 Ca 0.06 -1.82 -0.40 0.00 0.00 0.00 0.00 46.02 43.86 1ibr n GLY 57 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ibr s PRO 58 N -2.82 4.23 -0.09 1.61 0.04 -1.26 -3.02 135.00 133.69 1ibr s PRO 58 Ca 0.00 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.12 1ibr s PRO 58 Cb 0.00 -2.91 -0.00 0.00 0.04 0.00 0.00 34.50 31.63 1ibr s PRO 58 CO 0.00 -0.23 -0.23 0.42 0.04 0.00 0.00 177.00 177.00 1ibr s ILE 59 N -1.24 1.97 -0.15 0.56 1.01 0.14 -4.54 121.20 118.95 1ibr s ILE 59 Ca 0.52 -0.98 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 1ibr s ILE 59 Cb -0.36 -1.70 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 1ibr s ILE 59 CO 0.46 0.54 -0.05 -0.75 0.00 0.00 0.00 174.94 175.15 1ibr s LYS 60 N 0.27 3.63 -0.27 2.79 2.20 0.43 -1.04 119.74 127.74 1ibr s LYS 60 Ca -0.15 -0.54 -0.06 0.00 -0.36 0.00 0.00 55.97 54.86 1ibr s LYS 60 Cb -0.17 -2.88 0.00 0.00 -1.51 0.00 0.00 37.83 33.27 1ibr s LYS 60 CO 0.07 0.23 0.04 -0.06 -0.36 0.00 0.00 175.35 175.28 1ibr s PHE 61 N 0.38 3.10 -0.63 4.03 0.08 0.40 -1.07 117.98 124.27 1ibr s PHE 61 Ca -0.05 -0.96 -0.23 0.00 0.12 0.00 0.00 56.93 55.82 1ibr s PHE 61 Cb -0.14 -2.20 0.06 0.00 -0.57 0.00 0.00 43.02 40.17 1ibr s PHE 61 CO 0.03 -0.56 0.94 -0.80 -0.10 0.00 0.00 175.22 174.73 1ibr s ASN 62 N 1.49 6.21 -0.31 1.36 0.01 0.46 -0.37 114.94 123.80 1ibr s ASN 62 Ca 0.03 -0.84 -0.25 0.00 -0.71 0.00 0.00 52.86 51.09 1ibr s ASN 62 Cb -0.16 -2.41 0.01 0.00 0.41 0.00 0.00 41.25 39.09 1ibr s ASN 62 CO 0.01 -1.36 0.88 -0.69 -1.51 0.00 0.00 177.10 174.43 1ibr s VAL 63 N 3.95 4.71 -0.68 1.60 1.01 -0.18 -1.21 120.40 129.59 1ibr s VAL 63 Ca 0.23 1.38 -0.17 0.00 0.00 0.00 0.00 61.98 63.43 1ibr s VAL 63 Cb -0.16 -4.23 0.15 0.00 0.00 0.00 0.00 36.38 32.14 1ibr s VAL 63 CO 0.12 -0.31 0.71 0.26 0.00 0.00 0.00 175.10 175.88 1ibr s TRP 64 N 3.17 3.32 -0.83 5.22 0.52 0.49 -1.04 118.94 129.78 1ibr s TRP 64 Ca 0.37 -1.41 -0.24 0.00 0.02 0.00 0.00 56.10 54.84 1ibr s TRP 64 Cb -0.14 -3.92 0.06 0.00 -1.15 0.00 0.00 33.47 28.32 1ibr s TRP 64 CO 0.13 -1.14 1.23 0.34 0.02 0.00 0.00 176.95 177.53 1ibr s ASP 65 N 3.18 6.33 0.60 2.95 2.15 -0.21 -1.12 116.67 130.55 1ibr s ASP 65 Ca 0.13 -1.11 -0.09 0.00 0.43 0.00 0.00 52.55 51.91 1ibr s ASP 65 Cb -0.20 -2.50 -0.02 0.00 -0.30 0.00 0.00 42.92 39.89 1ibr s ASP 65 CO -0.01 -1.53 0.97 0.42 -0.17 0.00 0.00 175.17 174.84 1ibr s THR 66 N 4.66 4.44 0.09 1.71 -4.23 -0.90 -1.18 115.64 120.23 1ibr s THR 66 Ca 0.35 0.55 -0.30 0.00 -1.18 0.00 0.00 61.69 61.11 1ibr s THR 66 Cb -0.07 -3.76 -0.05 0.00 1.34 0.00 0.00 72.50 69.96 1ibr s THR 66 CO 0.03 -0.92 0.96 0.00 -0.54 0.00 0.00 174.62 174.15 1ibr s ALA 67 N -3.08 3.23 -0.13 3.99 0.00 -0.78 -4.86 121.76 120.14 1ibr s ALA 67 Ca 0.54 0.56 0.17 0.00 0.00 0.00 0.00 51.96 53.23 1ibr s ALA 67 Cb -0.11 -3.28 -0.12 0.00 0.00 0.00 0.00 23.12 19.61 1ibr s ALA 67 CO 0.50 -0.06 0.85 0.78 0.00 0.00 0.00 175.76 177.84 1ibr h GLY 68 N 5.78 0.00 -4.96 0.00 0.00 -1.82 -3.44 103.07 98.63 1ibr h GLY 68 Ca -0.43 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.36 1ibr h GLY 68 CO 0.72 0.00 0.88 1.20 0.00 0.00 0.00 176.54 179.35 1ibr s GLN 69 N -2.95 4.26 0.27 4.80 -1.52 -1.26 -3.40 119.66 119.86 1ibr s GLN 69 Ca -0.03 1.97 0.00 0.00 -1.95 0.00 0.00 55.36 55.35 1ibr s GLN 69 Cb 0.09 -3.66 0.63 0.00 -0.22 0.00 0.00 33.01 29.84 1ibr s GLN 69 CO 0.81 -0.63 1.68 1.49 -0.25 0.00 0.00 175.29 178.38 1ibr h GLU 70 N 8.14 0.29 0.00 2.91 4.22 -2.00 -1.17 114.58 126.97 1ibr h GLU 70 Ca -0.37 -0.02 -0.08 0.00 0.08 0.00 0.00 59.36 58.98 1ibr h GLU 70 Cb 1.17 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1ibr h GLU 70 CO 0.92 0.19 -0.37 0.87 -2.18 0.00 0.00 179.01 178.43 1ibr h LYS 71 N 0.30 0.00 -0.61 1.92 1.57 -1.99 -3.01 116.57 114.75 1ibr h LYS 71 Ca 0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 1ibr h LYS 71 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1ibr h LYS 71 CO -0.56 0.37 0.00 1.19 -0.57 0.00 0.00 179.45 179.88 1ibr n PHE 72 N -3.95 1.93 -0.14 -1.35 3.72 -0.47 -4.66 117.46 112.55 1ibr n PHE 72 Ca -0.02 -0.69 0.14 0.00 -0.05 0.00 0.00 57.45 56.83 1ibr n PHE 72 Cb 0.42 -0.44 0.50 0.00 -0.94 0.00 0.00 39.48 39.02 1ibr n PHE 72 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1ibr h GLY 73 N 4.09 0.67 0.00 1.37 0.00 -1.34 0.32 103.07 108.17 1ibr h GLY 73 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1ibr h GLY 73 CO 0.42 0.08 0.00 0.61 0.00 0.00 0.00 176.54 177.66 1ibr n GLY 74 N -1.52 2.74 0.16 4.60 0.00 -1.26 -1.42 105.19 108.49 1ibr n GLY 74 Ca 0.12 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 46.02 1ibr n GLY 74 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ibr h LEU 75 N 0.00 0.00 0.00 0.99 3.38 -1.91 -3.47 115.31 114.30 1ibr h LEU 75 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ibr h LEU 75 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1ibr h LEU 75 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.07 1ibr n ARG 76 N -2.51 0.00 -0.33 1.13 1.74 -0.51 -1.12 116.66 115.06 1ibr n ARG 76 Ca 0.03 0.00 0.24 0.00 -0.77 0.00 0.00 57.85 57.35 1ibr n ARG 76 Cb 0.35 0.00 0.47 0.00 -1.02 0.00 0.00 32.46 32.27 1ibr n ARG 76 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1ibr h ASP 77 N 0.00 0.51 -0.05 0.55 3.32 -1.90 -0.23 116.42 118.62 1ibr h ASP 77 Ca 0.00 0.19 0.01 0.00 0.02 0.00 0.00 57.03 57.25 1ibr h ASP 77 Cb 0.00 0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 1ibr h ASP 77 CO 0.00 -0.13 0.24 1.23 -1.72 0.00 0.00 179.24 178.86 1ibr h GLY 78 N 0.33 0.00 2.00 2.75 0.00 -1.52 -0.01 103.07 106.62 1ibr h GLY 78 Ca 0.73 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.06 1ibr h GLY 78 CO -0.61 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.21 1ibr n TYR 79 N -3.09 0.83 0.97 5.60 4.01 -0.10 -3.38 117.16 121.99 1ibr n TYR 79 Ca -0.01 0.28 0.14 0.00 -0.16 0.00 0.00 57.90 58.14 1ibr n TYR 79 Cb 0.31 -0.95 0.54 0.00 -0.31 0.00 0.00 39.34 38.94 1ibr n TYR 79 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1ibr n TYR 80 N -2.21 0.07 -1.64 -0.72 4.01 -0.02 -4.83 117.16 111.83 1ibr n TYR 80 Ca 0.04 0.02 -0.49 0.00 -0.16 0.00 0.00 57.90 57.31 1ibr n TYR 80 Cb 0.34 -0.50 -0.05 0.00 -0.31 0.00 0.00 39.34 38.82 1ibr n TYR 80 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1ibr n ILE 81 N -1.56 0.48 -1.74 -0.72 5.41 -1.22 -1.37 119.36 118.64 1ibr n ILE 81 Ca 0.07 -0.15 -0.13 0.00 1.00 0.00 0.00 62.75 63.54 1ibr n ILE 81 Cb 0.35 -1.82 -0.03 0.00 -0.71 0.00 0.00 39.64 37.42 1ibr n ILE 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ibr n GLN 82 N 6.92 -0.95 -2.20 0.38 6.02 -1.26 -5.00 117.38 121.30 1ibr n GLN 82 Ca 0.27 0.82 -0.37 0.00 -0.01 0.00 0.00 57.00 57.70 1ibr n GLN 82 Cb 0.28 -4.94 -0.00 0.00 1.02 0.00 0.00 30.24 26.60 1ibr n GLN 82 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ibr s ALA 83 N -2.55 2.92 -0.70 -1.58 0.00 -0.47 -4.72 121.76 114.66 1ibr s ALA 83 Ca 0.00 0.97 0.09 0.00 0.00 0.00 0.00 51.96 53.02 1ibr s ALA 83 Cb 0.00 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1ibr s ALA 83 CO 0.00 -0.76 0.53 1.04 0.00 0.00 0.00 175.76 176.58 1ibr n GLN 84 N -0.64 2.62 -3.65 0.00 6.02 0.16 -4.97 117.38 116.92 1ibr n GLN 84 Ca 0.08 -0.44 -0.03 0.00 -0.01 0.00 0.00 57.00 56.60 1ibr n GLN 84 Cb 0.48 -1.01 -0.01 0.00 1.02 0.00 0.00 30.24 30.72 1ibr n GLN 84 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ibr s ALA 86 N -2.96 -1.08 -0.10 0.00 0.00 -0.77 -1.84 121.76 115.02 1ibr s ALA 86 Ca 0.11 0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.26 1ibr s ALA 86 Cb 0.00 0.60 0.01 0.00 0.00 0.00 0.00 23.12 23.74 1ibr s ALA 86 CO -0.02 -0.60 -0.15 0.42 0.00 0.00 0.00 175.76 175.41 1ibr s ILE 87 N -3.34 1.44 -0.25 0.00 1.01 -0.83 -1.00 121.20 118.24 1ibr s ILE 87 Ca -0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 59.95 1ibr s ILE 87 Cb 0.01 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 1ibr s ILE 87 CO -0.09 0.43 0.10 -0.63 0.00 0.00 0.00 174.94 174.75 1ibr s ILE 88 N 0.95 4.62 -0.09 2.92 1.01 0.38 -1.70 121.20 129.29 1ibr s ILE 88 Ca -0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.49 1ibr s ILE 88 Cb -0.15 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 1ibr s ILE 88 CO -0.01 0.34 -0.02 -0.32 0.00 0.00 0.00 174.94 174.93 1ibr s MET 89 N 1.46 3.00 0.13 2.79 1.75 0.86 0.10 119.30 129.38 1ibr s MET 89 Ca 0.06 -0.46 0.00 0.00 -1.25 0.00 0.00 55.69 54.04 1ibr s MET 89 Cb -0.15 -2.75 -0.04 0.00 2.84 0.00 0.00 34.83 34.73 1ibr s MET 89 CO 0.05 0.64 0.01 -0.59 -0.65 0.00 0.00 175.02 174.48 1ibr s PHE 90 N -0.72 0.91 -0.30 4.11 -0.12 -0.74 -3.80 117.98 117.31 1ibr s PHE 90 Ca 0.11 -1.11 -0.11 0.00 -0.05 0.00 0.00 56.93 55.78 1ibr s PHE 90 Cb -0.11 -0.53 -0.02 0.00 -0.63 0.00 0.00 43.02 41.72 1ibr s PHE 90 CO 0.02 -0.36 0.18 0.34 -0.05 0.00 0.00 175.22 175.34 1ibr s ASP 91 N -3.06 5.75 0.21 1.98 -1.08 -1.26 -1.33 116.67 117.88 1ibr s ASP 91 Ca 0.20 -0.33 0.17 0.00 -0.52 0.00 0.00 52.55 52.07 1ibr s ASP 91 Cb 0.07 -2.06 0.84 0.00 -1.46 0.00 0.00 42.92 40.31 1ibr s ASP 91 CO -0.00 -0.15 1.52 0.52 0.52 0.00 0.00 175.17 177.58 1ibr n VAL 92 N 5.03 1.18 0.92 1.11 0.31 -0.16 -0.83 118.33 125.89 1ibr n VAL 92 Ca -0.14 0.53 0.12 0.00 -0.01 0.00 0.00 64.34 64.84 1ibr n VAL 92 Cb 0.50 -1.49 0.25 0.00 -0.91 0.00 0.00 33.84 32.19 1ibr n VAL 92 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1ibr n THR 93 N -2.03 0.18 -3.67 2.52 -1.04 -1.26 -0.77 114.28 108.20 1ibr n THR 93 Ca 0.00 -0.51 -0.28 0.00 -2.04 0.00 0.00 64.05 61.22 1ibr n THR 93 Cb 0.09 1.02 -0.16 0.00 -1.82 0.00 0.00 70.33 69.45 1ibr n THR 93 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1ibr s SER 94 N -1.79 3.09 0.37 8.00 0.15 -0.01 -4.60 113.70 118.91 1ibr s SER 94 Ca 0.33 -1.00 0.06 0.00 0.70 0.00 0.00 55.95 56.05 1ibr s SER 94 Cb 0.21 -0.52 0.76 0.00 -1.71 0.00 0.00 66.02 64.76 1ibr s SER 94 CO 0.31 -0.36 1.99 0.03 1.20 0.00 0.00 173.24 176.40 1ibr h ARG 95 N 8.29 0.69 0.00 5.44 -0.00 -1.86 -2.33 114.38 124.61 1ibr h ARG 95 Ca -0.16 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.98 59.24 1ibr h ARG 95 Cb 1.09 -0.16 -0.01 0.00 0.00 0.00 0.00 29.97 30.90 1ibr h ARG 95 CO 0.37 0.46 -0.19 -0.24 0.00 0.00 0.00 179.97 180.37 1ibr h VAL 96 N 0.71 0.72 0.00 2.04 3.04 -1.95 -2.16 116.25 118.65 1ibr h VAL 96 Ca 0.27 -0.78 -0.06 0.00 -1.01 0.00 0.00 66.70 65.12 1ibr h VAL 96 Cb 0.17 1.48 -0.01 0.00 -2.01 0.00 0.00 31.29 30.92 1ibr h VAL 96 CO -0.08 0.18 -0.27 0.71 -1.01 0.00 0.00 177.57 177.10 1ibr h THR 97 N 0.00 0.57 0.08 3.17 1.35 -1.71 -2.12 112.91 114.25 1ibr h THR 97 Ca -0.00 -1.38 -0.27 0.00 -0.55 0.00 0.00 66.41 64.21 1ibr h THR 97 Cb 0.47 1.95 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 1ibr h THR 97 CO 0.02 0.27 -1.32 0.22 -0.25 0.00 0.00 175.52 174.46 1ibr h TYR 98 N 0.00 0.31 -0.18 4.73 3.20 -1.50 -3.26 116.97 120.27 1ibr h TYR 98 Ca -0.00 -0.23 -0.06 0.00 3.14 0.00 0.00 58.73 61.58 1ibr h TYR 98 Cb 0.93 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 1ibr h TYR 98 CO 0.00 1.22 -0.15 -0.22 -1.64 0.00 0.00 178.16 177.36 1ibr h LYS 99 N 0.05 0.30 -0.00 1.82 3.64 -1.12 -2.23 116.57 119.03 1ibr h LYS 99 Ca -0.15 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1ibr h LYS 99 Cb 1.94 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.72 1ibr h LYS 99 CO 0.16 0.46 -0.05 0.09 -2.27 0.00 0.00 179.45 177.84 1ibr n ASN 100 N -4.23 0.22 -0.20 4.20 5.03 -0.82 -4.14 115.26 115.32 1ibr n ASN 100 Ca -0.00 -0.43 -0.00 0.00 0.87 0.00 0.00 54.58 55.01 1ibr n ASN 100 Cb 0.30 -0.16 0.11 0.00 -1.02 0.00 0.00 39.78 39.01 1ibr n ASN 100 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 1ibr h VAL 101 N 0.27 0.76 -0.76 2.41 2.07 -1.44 -1.73 116.25 117.83 1ibr h VAL 101 Ca 0.00 -0.14 0.08 0.00 0.82 0.00 0.00 66.70 67.46 1ibr h VAL 101 Cb 0.29 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 1ibr h VAL 101 CO 0.00 0.07 0.50 -0.65 0.02 0.00 0.00 177.57 177.51 1ibr h PRO 102 N 0.39 0.72 -0.35 1.57 0.11 -1.79 -1.05 132.00 131.60 1ibr h PRO 102 Ca 0.30 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.25 1ibr h PRO 102 Cb 0.38 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 1ibr h PRO 102 CO -0.31 0.48 -0.29 -0.91 -0.21 0.00 0.00 178.00 176.76 1ibr h ASN 103 N 0.74 0.77 -0.47 -2.05 2.35 -1.60 -0.44 115.58 114.87 1ibr h ASN 103 Ca 0.34 -0.30 -0.13 0.00 -0.55 0.00 0.00 56.30 55.65 1ibr h ASN 103 Cb 0.35 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1ibr h ASN 103 CO -0.12 1.01 -0.23 -0.50 -1.65 0.00 0.00 177.43 175.94 1ibr h TRP 104 N 0.63 1.14 -0.69 1.19 4.06 -0.98 -2.20 115.95 119.10 1ibr h TRP 104 Ca 0.08 -0.28 -0.04 0.00 2.06 0.00 0.00 58.89 60.70 1ibr h TRP 104 Cb 0.81 -0.26 -0.03 0.00 -1.00 0.00 0.00 29.16 28.67 1ibr h TRP 104 CO 0.04 1.11 0.27 1.25 -3.56 0.00 0.00 178.44 177.55 1ibr h HIS 105 N 0.85 1.06 -0.57 0.49 2.76 -0.97 -1.75 115.15 117.02 1ibr h HIS 105 Ca 0.11 -0.08 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1ibr h HIS 105 Cb 0.81 -0.32 -0.03 0.00 1.55 0.00 0.00 27.41 29.43 1ibr h HIS 105 CO 0.05 0.82 0.27 -0.09 -1.30 0.00 0.00 177.93 177.68 1ibr h ARG 106 N 0.98 0.82 -0.59 5.26 2.43 -1.00 -2.02 114.38 120.27 1ibr h ARG 106 Ca 0.23 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1ibr h ARG 106 Cb 0.22 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 1ibr h ARG 106 CO -0.02 0.68 0.38 -0.44 -1.51 0.00 0.00 179.97 179.05 1ibr h ASP 107 N 0.77 0.63 0.02 -3.80 3.32 -1.03 -2.16 116.42 114.17 1ibr h ASP 107 Ca 0.19 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1ibr h ASP 107 Cb 0.13 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1ibr h ASP 107 CO -0.02 0.44 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.86 1ibr h LEU 108 N 0.75 -0.03 -0.43 1.55 3.38 -1.04 -3.13 115.31 116.36 1ibr h LEU 108 Ca 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1ibr h LEU 108 Cb -0.02 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1ibr h LEU 108 CO -0.08 0.03 0.00 1.33 0.09 0.00 0.00 178.44 179.81 1ibr n VAL 109 N -5.08 0.73 1.45 1.22 0.24 -0.78 0.00 118.33 116.11 1ibr n VAL 109 Ca -0.07 0.02 0.15 0.00 -2.04 0.00 0.00 64.34 62.39 1ibr n VAL 109 Cb 0.06 -0.93 0.69 0.00 -1.47 0.00 0.00 33.84 32.19 1ibr n VAL 109 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ibr n ARG 110 N -2.26 0.60 0.00 7.34 1.74 -0.82 -4.03 116.66 119.23 1ibr n ARG 110 Ca 0.03 -0.13 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1ibr n ARG 110 Cb 0.31 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1ibr n ARG 110 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1ibr n VAL 111 N -1.09 0.00 -3.93 1.55 0.31 -0.95 -5.03 118.33 109.19 1ibr n VAL 111 Ca 0.15 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 64.12 1ibr n VAL 111 Cb 0.25 -0.58 -0.13 0.00 -0.91 0.00 0.00 33.84 32.48 1ibr n VAL 111 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ibr n GLU 113 N 4.63 0.00 -3.11 0.00 2.13 -1.26 -4.38 120.64 118.64 1ibr n GLU 113 Ca -0.17 0.32 -0.19 0.00 0.66 0.00 0.00 57.16 57.78 1ibr n GLU 113 Cb 0.51 -1.19 -0.03 0.00 0.27 0.00 0.00 31.44 31.01 1ibr n GLU 113 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1ibr n ASN 114 N -1.24 1.37 -4.88 4.31 4.05 -1.26 -5.01 115.26 112.60 1ibr n ASN 114 Ca 0.00 -3.08 -0.31 0.00 0.45 0.00 0.00 54.58 51.64 1ibr n ASN 114 Cb 0.00 -0.60 -0.05 0.00 1.23 0.00 0.00 39.78 40.36 1ibr n ASN 114 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 1ibr s ILE 115 N -2.77 4.95 0.08 -1.44 -4.36 -1.26 -5.04 121.20 111.36 1ibr s ILE 115 Ca 0.40 0.38 -0.31 0.00 -0.26 0.00 0.00 60.65 60.87 1ibr s ILE 115 Cb 0.35 -3.65 -0.06 0.00 1.25 0.00 0.00 42.46 40.35 1ibr s ILE 115 CO -0.08 -0.14 1.26 -2.16 0.24 0.00 0.00 174.94 174.06 1ibr s PRO 116 N -3.02 4.39 -0.10 0.37 0.04 -1.26 -4.91 135.00 130.52 1ibr s PRO 116 Ca 0.47 1.87 0.02 0.00 0.04 0.00 0.00 61.00 63.40 1ibr s PRO 116 Cb -0.11 -3.32 0.01 0.00 0.04 0.00 0.00 34.50 31.12 1ibr s PRO 116 CO 0.24 -0.32 -0.16 0.42 0.04 0.00 0.00 177.00 177.22 1ibr s ILE 117 N 1.10 1.50 -0.13 0.56 1.01 -1.26 -1.84 121.20 122.13 1ibr s ILE 117 Ca 0.61 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 60.57 1ibr s ILE 117 Cb -0.32 -1.36 -0.03 0.00 0.01 0.00 0.00 42.46 40.76 1ibr s ILE 117 CO 0.29 0.44 -0.03 -0.69 0.00 0.00 0.00 174.94 174.96 1ibr s VAL 118 N 0.89 4.00 -0.20 2.92 1.01 -0.17 -3.78 120.40 125.06 1ibr s VAL 118 Ca -0.09 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 1ibr s VAL 118 Cb -0.15 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 1ibr s VAL 118 CO 0.00 0.52 0.20 -0.22 0.00 0.00 0.00 175.10 175.60 1ibr s LEU 119 N -0.00 4.18 -0.11 3.92 2.96 -0.40 -0.47 118.68 128.75 1ibr s LEU 119 Ca 0.01 0.28 0.02 0.00 -0.22 0.00 0.00 54.13 54.22 1ibr s LEU 119 Cb -0.13 -2.19 0.01 0.00 0.50 0.00 0.00 46.19 44.38 1ibr s LEU 119 CO 0.02 0.10 -0.17 0.00 -1.32 0.00 0.00 176.35 174.99 1ibr s GLY 121 N 0.81 1.92 0.33 0.00 0.00 -0.67 -1.80 107.32 107.91 1ibr s GLY 121 Ca -0.10 -1.62 0.03 0.00 0.00 0.00 0.00 44.72 43.03 1ibr s GLY 121 CO 0.01 1.12 0.50 0.21 0.00 0.00 0.00 173.10 174.94 1ibr s ASN 122 N 1.88 6.17 -0.43 1.64 2.47 -0.44 0.62 114.94 126.85 1ibr s ASN 122 Ca 0.10 0.20 -0.02 0.00 0.42 0.00 0.00 52.86 53.56 1ibr s ASN 122 Cb -0.18 -1.76 0.00 0.00 -1.45 0.00 0.00 41.25 37.86 1ibr s ASN 122 CO 0.12 -0.32 0.30 0.29 -3.72 0.00 0.00 177.10 173.77 1ibr n LYS 123 N -1.70 -2.10 0.00 0.43 5.02 -0.89 -0.98 118.16 117.93 1ibr n LYS 123 Ca -0.04 0.26 0.13 0.00 -2.02 0.00 0.00 58.31 56.63 1ibr n LYS 123 Cb 0.57 -3.61 0.69 0.00 -0.02 0.00 0.00 35.03 32.66 1ibr n LYS 123 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1ibr n VAL 124 N -3.37 0.12 0.13 -0.18 0.24 -1.01 -2.45 118.33 111.81 1ibr n VAL 124 Ca -0.01 0.03 -0.02 0.00 -2.04 0.00 0.00 64.34 62.30 1ibr n VAL 124 Cb 0.52 -0.61 0.14 0.00 -1.47 0.00 0.00 33.84 32.42 1ibr n VAL 124 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1ibr h ASP 125 N 0.00 0.01 -2.91 -1.34 2.03 -1.92 -3.45 116.42 108.84 1ibr h ASP 125 Ca 0.00 -0.01 -0.55 0.00 -0.73 0.00 0.00 57.03 55.75 1ibr h ASP 125 Cb 0.15 -0.00 0.08 0.00 -0.83 0.00 0.00 39.33 38.73 1ibr h ASP 125 CO 0.00 0.67 0.83 -0.38 -1.03 0.00 0.00 179.24 179.33 1ibr n ILE 126 N -3.76 0.72 0.00 4.15 2.08 -1.02 -4.94 119.36 116.58 1ibr n ILE 126 Ca -0.01 -0.18 0.00 0.00 0.56 0.00 0.00 62.75 63.12 1ibr n ILE 126 Cb 0.65 -1.80 0.00 0.00 -0.75 0.00 0.00 39.64 37.74 1ibr n ILE 126 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1ibr n LYS 127 N 2.58 0.00 -3.20 0.38 3.00 -1.26 -4.30 118.16 115.35 1ibr n LYS 127 Ca 0.11 0.38 -0.40 0.00 -0.00 0.00 0.00 58.31 58.40 1ibr n LYS 127 Cb 0.34 -0.87 -0.07 0.00 0.00 0.00 0.00 35.03 34.42 1ibr n LYS 127 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1ibr s ASP 128 N -2.97 6.43 0.08 3.14 -4.77 -1.26 -5.04 116.67 112.28 1ibr s ASP 128 Ca 0.00 0.42 -0.29 0.00 -3.30 0.00 0.00 52.55 49.39 1ibr s ASP 128 Cb 0.00 -2.29 -0.05 0.00 -1.09 0.00 0.00 42.92 39.48 1ibr s ASP 128 CO 0.00 -0.36 0.91 -0.13 0.70 0.00 0.00 175.17 176.29 1ibr s ARG 129 N 2.40 4.63 0.08 2.11 0.52 -1.26 -4.86 118.95 122.57 1ibr s ARG 129 Ca 0.22 1.34 0.11 0.00 -0.52 0.00 0.00 55.73 56.88 1ibr s ARG 129 Cb -0.15 -3.38 -0.17 0.00 0.52 0.00 0.00 34.95 31.76 1ibr s ARG 129 CO 0.10 0.20 1.03 0.87 0.02 0.00 0.00 175.30 177.52 1ibr h LYS 130 N 5.73 0.00 -3.94 3.54 1.79 -1.21 -3.40 116.57 119.08 1ibr h LYS 130 Ca -0.43 0.00 -0.70 0.00 -2.18 0.00 0.00 60.65 57.34 1ibr h LYS 130 Cb 1.21 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 31.52 1ibr h LYS 130 CO 0.72 0.67 -0.42 0.08 -1.08 0.00 0.00 179.45 179.42 1ibr s VAL 131 N -2.73 3.64 0.55 0.50 1.01 -0.37 -4.83 120.40 118.17 1ibr s VAL 131 Ca -0.01 -2.58 -0.15 0.00 0.00 0.00 0.00 61.98 59.24 1ibr s VAL 131 Cb 0.09 -3.41 -0.06 0.00 0.00 0.00 0.00 36.38 33.00 1ibr s VAL 131 CO 0.81 -0.81 1.00 -0.54 0.00 0.00 0.00 175.10 175.56 1ibr s LYS 132 N 0.43 3.79 0.29 2.72 1.02 -1.26 -4.88 119.74 121.84 1ibr s LYS 132 Ca 0.13 0.94 -0.06 0.00 0.02 0.00 0.00 55.97 57.01 1ibr s LYS 132 Cb -0.21 -2.11 0.53 0.00 -0.52 0.00 0.00 37.83 35.52 1ibr s LYS 132 CO -0.04 -0.41 1.56 0.00 -0.92 0.00 0.00 175.35 175.54 1ibr n ALA 133 N -1.91 0.31 0.03 5.17 0.00 -1.26 -0.35 120.51 122.50 1ibr n ALA 133 Ca 0.07 1.09 0.14 0.00 0.00 0.00 0.00 53.44 54.74 1ibr n ALA 133 Cb 0.54 -0.69 0.61 0.00 0.00 0.00 0.00 19.45 19.91 1ibr n ALA 133 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1ibr h LYS 134 N 0.00 0.14 0.00 0.00 3.64 -2.04 -2.07 116.57 116.24 1ibr h LYS 134 Ca 0.51 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.84 1ibr h LYS 134 Cb 0.86 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.64 1ibr h LYS 134 CO -1.01 0.09 -0.18 0.77 -2.27 0.00 0.00 179.45 176.85 1ibr h SER 135 N 0.15 0.00 -2.88 4.20 0.02 -1.06 -3.43 113.55 110.55 1ibr h SER 135 Ca 0.20 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.60 1ibr h SER 135 Cb 0.60 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.07 1ibr h SER 135 CO -0.03 0.18 1.04 -0.63 -1.14 0.00 0.00 176.83 176.26 1ibr s ILE 136 N -3.26 3.87 0.00 3.27 1.01 -0.78 -4.76 121.20 120.55 1ibr s ILE 136 Ca 0.04 0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.41 1ibr s ILE 136 Cb 0.07 -4.67 0.00 0.00 0.01 0.00 0.00 42.46 37.87 1ibr s ILE 136 CO 0.67 -1.40 0.06 1.33 0.00 0.00 0.00 174.94 175.61 1ibr n VAL 137 N 6.67 0.00 -0.24 2.92 0.24 -1.26 -4.84 118.33 121.83 1ibr n VAL 137 Ca 0.09 -0.24 0.08 0.00 -2.04 0.00 0.00 64.34 62.23 1ibr n VAL 137 Cb 0.49 1.13 0.34 0.00 -1.47 0.00 0.00 33.84 34.34 1ibr n VAL 137 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 1ibr h PHE 138 N 0.00 0.83 -0.35 6.34 3.57 -1.99 -1.33 116.94 124.01 1ibr h PHE 138 Ca 0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1ibr h PHE 138 Cb 0.07 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 1ibr h PHE 138 CO 0.00 0.39 0.09 1.12 -2.23 0.00 0.00 178.31 177.69 1ibr h HIS 139 N 0.78 0.51 -0.38 0.41 2.07 -1.88 -2.05 115.15 114.61 1ibr h HIS 139 Ca 0.37 -0.03 -0.12 0.00 -2.85 0.00 0.00 60.37 57.75 1ibr h HIS 139 Cb 0.41 -0.16 -0.01 0.00 2.57 0.00 0.00 27.41 30.22 1ibr h HIS 139 CO -0.00 0.45 -0.23 0.00 -3.07 0.00 0.00 177.93 175.08 1ibr h ARG 140 N 0.51 0.77 -0.68 5.12 3.08 -1.54 -0.25 114.38 121.38 1ibr h ARG 140 Ca 0.12 -0.31 -0.06 0.00 0.07 0.00 0.00 59.98 59.79 1ibr h ARG 140 Cb 0.19 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 1ibr h ARG 140 CO -0.00 0.92 0.18 0.87 -1.07 0.00 0.00 179.97 180.87 1ibr h LYS 141 N 0.67 1.09 -0.30 0.04 1.79 -1.20 -3.25 116.57 115.40 1ibr h LYS 141 Ca 0.09 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1ibr h LYS 141 Cb 0.74 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1ibr h LYS 141 CO 0.06 0.96 0.00 1.63 -1.08 0.00 0.00 179.45 181.02 1ibr n LYS 142 N -4.28 2.94 -3.69 3.15 4.76 -0.95 -4.99 118.16 115.10 1ibr n LYS 142 Ca 0.05 -2.53 -0.21 0.00 -2.87 0.00 0.00 58.31 52.74 1ibr n LYS 142 Cb 0.25 -1.62 0.03 0.00 -1.84 0.00 0.00 35.03 31.85 1ibr n LYS 142 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1ibr n ASN 143 N -0.07 -1.28 -4.90 4.39 3.02 -0.22 -5.00 115.26 111.20 1ibr n ASN 143 Ca 0.18 -0.82 -0.21 0.00 -0.03 0.00 0.00 54.58 53.70 1ibr n ASN 143 Cb 0.71 -4.07 -0.03 0.00 -0.61 0.00 0.00 39.78 35.78 1ibr n ASN 143 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ibr s LEU 144 N -6.65 3.75 0.15 3.41 1.43 -0.50 -5.03 118.68 115.24 1ibr s LEU 144 Ca 0.01 -0.37 -0.15 0.00 -1.03 0.00 0.00 54.13 52.59 1ibr s LEU 144 Cb -0.00 -2.41 -0.07 0.00 0.03 0.00 0.00 46.19 43.74 1ibr s LEU 144 CO 0.81 -0.34 0.57 -1.58 0.23 0.00 0.00 176.35 176.04 1ibr s GLN 145 N -4.04 4.03 0.10 1.70 2.00 -1.25 -4.74 119.66 117.47 1ibr s GLN 145 Ca 0.41 0.56 0.06 0.00 -2.00 0.00 0.00 55.36 54.39 1ibr s GLN 145 Cb -0.07 -2.95 -0.03 0.00 0.80 0.00 0.00 33.01 30.75 1ibr s GLN 145 CO 0.28 0.48 -0.15 -0.47 -0.50 0.00 0.00 175.29 174.93 1ibr s TYR 146 N -1.44 1.40 -0.14 1.67 5.04 -1.26 -1.28 117.35 121.34 1ibr s TYR 146 Ca 0.37 -0.50 -0.11 0.00 -2.44 0.00 0.00 57.07 54.40 1ibr s TYR 146 Cb -0.16 -0.76 0.04 0.00 0.35 0.00 0.00 41.96 41.44 1ibr s TYR 146 CO 0.19 0.13 0.36 0.71 -1.34 0.00 0.00 175.55 175.60 1ibr s TYR 147 N -1.67 -0.46 0.19 4.97 2.02 -0.91 -4.98 117.35 116.51 1ibr s TYR 147 Ca 0.05 1.05 -0.30 0.00 -0.37 0.00 0.00 57.07 57.50 1ibr s TYR 147 Cb -0.08 0.17 -0.08 0.00 -0.40 0.00 0.00 41.96 41.57 1ibr s TYR 147 CO 0.03 -0.25 1.01 -0.51 -1.57 0.00 0.00 175.55 174.26 1ibr s ASP 148 N 0.73 7.46 0.06 2.29 1.01 -1.26 -1.67 116.67 125.29 1ibr s ASP 148 Ca -0.04 1.98 -0.01 0.00 0.71 0.00 0.00 52.55 55.18 1ibr s ASP 148 Cb -0.05 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 1ibr s ASP 148 CO -0.05 -0.04 -0.02 -0.51 0.21 0.00 0.00 175.17 174.76 1ibr s ILE 149 N -0.58 0.21 -0.27 0.77 2.07 0.20 -4.70 121.20 118.90 1ibr s ILE 149 Ca 0.45 -1.81 -0.02 0.00 -1.41 0.00 0.00 60.65 57.86 1ibr s ILE 149 Cb -0.27 -1.57 0.15 0.00 0.13 0.00 0.00 42.46 40.91 1ibr s ILE 149 CO 0.33 -0.94 0.45 -0.55 -1.91 0.00 0.00 174.94 172.32 1ibr s SER 150 N -2.93 -0.30 0.51 4.50 0.15 -1.14 -2.10 113.70 112.38 1ibr s SER 150 Ca 0.09 0.39 0.30 0.00 0.70 0.00 0.00 55.95 57.42 1ibr s SER 150 Cb 0.08 1.46 1.20 0.00 -1.71 0.00 0.00 66.02 67.05 1ibr s SER 150 CO -0.09 -0.29 1.93 0.00 1.20 0.00 0.00 173.24 175.99 1ibr h ALA 151 N 8.12 1.02 0.02 5.45 0.00 -1.94 0.74 119.26 132.68 1ibr h ALA 151 Ca -0.19 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1ibr h ALA 151 Cb 1.16 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1ibr h ALA 151 CO 0.27 0.11 -0.29 -0.22 0.00 0.00 0.00 179.25 179.12 1ibr h LYS 152 N 0.00 0.05 -0.01 0.00 3.64 -1.96 -3.36 116.57 114.93 1ibr h LYS 152 Ca -0.00 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1ibr h LYS 152 Cb 0.59 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1ibr h LYS 152 CO 0.01 1.04 -0.24 -1.13 -2.27 0.00 0.00 179.45 176.86 1ibr n SER 153 N -4.51 1.19 -0.17 4.20 3.41 -1.22 -4.93 113.62 111.60 1ibr n SER 153 Ca -0.13 -1.03 -0.02 0.00 -0.26 0.00 0.00 58.87 57.42 1ibr n SER 153 Cb 0.56 0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 64.65 1ibr n SER 153 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ibr n ASN 154 N -0.47 -4.78 -4.65 4.04 4.13 0.24 -4.93 115.26 108.84 1ibr n ASN 154 Ca 0.13 0.06 -0.43 0.00 1.68 0.00 0.00 54.58 56.02 1ibr n ASN 154 Cb 0.36 -2.48 -0.03 0.00 -1.54 0.00 0.00 39.78 36.09 1ibr n ASN 154 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ibr n TYR 155 N -2.43 2.42 -1.52 3.10 9.36 -1.15 -1.87 117.16 125.06 1ibr n TYR 155 Ca -0.02 -0.31 -0.17 0.00 3.32 0.00 0.00 57.90 60.71 1ibr n TYR 155 Cb 0.33 -2.78 -0.07 0.00 -0.63 0.00 0.00 39.34 36.18 1ibr n TYR 155 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1ibr n ASN 156 N 8.05 -4.47 0.30 2.98 5.03 -1.26 -2.91 115.26 122.98 1ibr n ASN 156 Ca 0.22 0.41 0.20 0.00 0.87 0.00 0.00 54.58 56.28 1ibr n ASN 156 Cb 0.40 -4.04 1.04 0.00 -1.02 0.00 0.00 39.78 36.17 1ibr n ASN 156 CO 0.00 0.00 0.00 2.19 -1.83 0.00 0.00 177.26 177.62 1ibr h PHE 157 N 0.00 0.00 0.00 3.10 -0.00 -1.66 -2.07 116.94 116.31 1ibr h PHE 157 Ca -0.35 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 57.61 1ibr h PHE 157 Cb 1.11 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 37.06 1ibr h PHE 157 CO 0.48 0.00 -1.64 0.39 -0.00 0.00 0.00 178.31 177.54 1ibr n GLU 158 N -2.97 0.64 -0.29 6.09 1.02 -1.26 -4.56 120.64 119.31 1ibr n GLU 158 Ca -0.02 -0.07 0.01 0.00 -0.02 0.00 0.00 57.16 57.06 1ibr n GLU 158 Cb 0.12 -1.64 0.08 0.00 -0.02 0.00 0.00 31.44 29.98 1ibr n GLU 158 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1ibr h LYS 159 N 0.00 -0.03 -0.40 3.49 1.79 -1.76 -1.03 116.57 118.62 1ibr h LYS 159 Ca -0.02 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.53 1ibr h LYS 159 Cb 1.05 0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 31.64 1ibr h LYS 159 CO 0.00 -0.02 -0.02 -1.35 -1.08 0.00 0.00 179.45 176.99 1ibr h PRO 160 N -0.03 0.08 -0.22 3.15 0.11 -1.80 -0.73 132.00 132.56 1ibr h PRO 160 Ca 0.37 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.35 1ibr h PRO 160 Cb 0.60 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 1ibr h PRO 160 CO -0.85 0.06 -0.36 0.74 -0.21 0.00 0.00 178.00 177.38 1ibr h PHE 161 N 0.09 0.56 -0.25 0.65 0.04 -1.62 -2.02 116.94 114.39 1ibr h PHE 161 Ca 0.20 -0.15 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 1ibr h PHE 161 Cb 0.29 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 1ibr h PHE 161 CO -0.28 0.78 0.06 1.25 -0.60 0.00 0.00 178.31 179.52 1ibr h LEU 162 N 0.41 0.38 -0.36 1.54 5.85 -0.66 0.31 115.31 122.78 1ibr h LEU 162 Ca 0.04 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1ibr h LEU 162 Cb 0.82 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1ibr h LEU 162 CO 0.07 0.52 0.18 -0.25 -0.34 0.00 0.00 178.44 178.62 1ibr h TRP 163 N 0.23 0.51 -0.51 1.25 7.01 -1.07 -0.98 115.95 122.39 1ibr h TRP 163 Ca 0.08 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.04 1ibr h TRP 163 Cb 0.29 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.16 1ibr h TRP 163 CO 0.01 0.42 0.23 -0.07 -2.79 0.00 0.00 178.44 176.25 1ibr h LEU 164 N 0.45 0.67 -0.37 0.65 3.38 -1.25 -0.84 115.31 118.00 1ibr h LEU 164 Ca 0.13 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1ibr h LEU 164 Cb 0.09 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1ibr h LEU 164 CO -0.02 0.63 0.22 0.00 0.09 0.00 0.00 178.44 179.36 1ibr h ALA 165 N 1.07 0.47 -0.71 1.53 0.00 -0.71 0.35 119.26 121.26 1ibr h ALA 165 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1ibr h ALA 165 Cb 0.14 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1ibr h ALA 165 CO -0.02 -0.13 0.41 0.00 0.00 0.00 0.00 179.25 179.51 1ibr h ARG 166 N 0.44 0.97 0.01 0.00 3.08 -0.94 0.17 114.38 118.11 1ibr h ARG 166 Ca 0.15 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 1ibr h ARG 166 Cb 0.01 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.86 1ibr h ARG 166 CO -0.07 0.70 -0.00 -0.22 -1.07 0.00 0.00 179.97 179.30 1ibr h LYS 167 N 0.98 -0.01 -0.33 0.04 1.63 -0.02 -1.10 116.57 117.77 1ibr h LYS 167 Ca 0.25 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 60.00 1ibr h LYS 167 Cb -0.01 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.61 1ibr h LYS 167 CO -0.04 0.34 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.22 1ibr h LEU 168 N -0.36 0.57 -0.90 5.20 -0.00 -0.08 -3.14 115.31 116.61 1ibr h LEU 168 Ca -0.00 -0.31 -0.08 0.00 -0.00 0.00 0.00 57.88 57.48 1ibr h LEU 168 Cb 0.35 -0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 40.85 1ibr h LEU 168 CO 0.00 0.75 -0.39 0.40 -0.00 0.00 0.00 178.44 179.20 1ibr h ILE 169 N 0.39 0.91 0.00 1.22 1.08 -1.05 -3.47 117.51 116.59 1ibr h ILE 169 Ca 0.09 -1.57 0.00 0.00 -0.39 0.00 0.00 64.86 62.99 1ibr h ILE 169 Cb 0.46 1.95 0.00 0.00 -3.07 0.00 0.00 36.82 36.16 1ibr h ILE 169 CO 0.02 0.38 0.00 0.61 -0.69 0.00 0.00 178.15 178.47 1ibr n GLY 170 N 0.26 0.40 2.85 5.37 0.00 -0.44 -5.04 105.19 108.59 1ibr n GLY 170 Ca -0.00 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 1ibr n GLY 170 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ibr s ASP 171 N -2.98 3.61 0.26 1.61 -1.08 -1.05 -4.98 116.67 112.07 1ibr s ASP 171 Ca 0.00 -1.15 0.23 0.00 -0.52 0.00 0.00 52.55 51.11 1ibr s ASP 171 Cb 0.00 -0.98 1.00 0.00 -1.46 0.00 0.00 42.92 41.49 1ibr s ASP 171 CO 0.00 -0.28 1.69 -2.65 0.52 0.00 0.00 175.17 174.45 1ibr n PRO 172 N 4.80 0.18 0.00 4.34 -0.02 -1.26 -2.35 135.00 140.68 1ibr n PRO 172 Ca -0.09 0.46 0.14 0.00 -2.02 0.00 0.00 63.50 61.99 1ibr n PRO 172 Cb 0.45 -1.88 0.51 0.00 -0.02 0.00 0.00 33.50 32.55 1ibr n PRO 172 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ibr n ASN 173 N -2.23 1.50 -4.75 2.55 4.13 -1.26 -4.93 115.26 110.28 1ibr n ASN 173 Ca 0.01 -1.47 -0.42 0.00 1.68 0.00 0.00 54.58 54.39 1ibr n ASN 173 Cb 0.19 0.01 -0.02 0.00 -1.54 0.00 0.00 39.78 38.42 1ibr n ASN 173 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1ibr s LEU 174 N -2.03 4.34 0.14 3.41 2.96 -0.99 -4.99 118.68 121.52 1ibr s LEU 174 Ca 0.37 2.98 0.06 0.00 -0.22 0.00 0.00 54.13 57.32 1ibr s LEU 174 Cb 0.21 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.22 1ibr s LEU 174 CO 0.35 -0.94 -0.14 -1.61 -1.32 0.00 0.00 176.35 172.68 1ibr s GLU 175 N -0.45 1.09 0.01 1.98 0.41 -1.26 -4.95 118.70 115.52 1ibr s GLU 175 Ca 0.64 -1.31 -0.08 0.00 -0.41 0.00 0.00 54.97 53.81 1ibr s GLU 175 Cb -0.49 -0.96 -0.05 0.00 -1.78 0.00 0.00 34.13 30.85 1ibr s GLU 175 CO 0.48 0.18 0.29 -0.06 -0.49 0.00 0.00 175.26 175.66 1ibr s PHE 176 N -2.30 3.59 0.00 1.61 0.08 -1.26 -2.19 117.98 117.52 1ibr s PHE 176 Ca 0.12 0.64 0.00 0.00 0.12 0.00 0.00 56.93 57.81 1ibr s PHE 176 Cb -0.04 -2.04 0.00 0.00 -0.57 0.00 0.00 43.02 40.37 1ibr s PHE 176 CO 0.04 0.61 0.00 0.28 -0.10 0.00 0.00 175.22 176.05