#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k5g s VAL 9 N 0.00 5.07 -0.07 1.69 1.01 -1.25 -4.98 120.40 121.86 1k5g s VAL 9 Ca 0.00 0.91 0.04 0.00 0.00 0.00 0.00 61.98 62.93 1k5g s VAL 9 Cb 0.00 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1k5g s VAL 9 CO 0.00 0.47 -0.20 -1.10 0.00 0.00 0.00 175.10 174.28 1k5g s GLN 10 N -0.37 2.76 -0.03 2.72 -0.21 -1.26 -0.06 119.66 123.20 1k5g s GLN 10 Ca 0.25 -0.81 0.06 0.00 0.02 0.00 0.00 55.36 54.88 1k5g s GLN 10 Cb -0.16 -2.33 -0.01 0.00 1.00 0.00 0.00 33.01 31.51 1k5g s GLN 10 CO 0.12 0.39 -0.21 -0.06 -2.12 0.00 0.00 175.29 173.41 1k5g s PHE 11 N -0.14 1.95 -0.49 0.91 0.08 0.59 -4.97 117.98 115.91 1k5g s PHE 11 Ca -0.03 -0.48 -0.17 0.00 0.12 0.00 0.00 56.93 56.37 1k5g s PHE 11 Cb -0.14 -1.28 0.06 0.00 -0.57 0.00 0.00 43.02 41.10 1k5g s PHE 11 CO 0.04 -0.12 0.52 0.21 -0.10 0.00 0.00 175.22 175.77 1k5g s LYS 12 N -0.25 3.06 -0.20 0.44 2.20 -1.26 0.75 119.74 124.48 1k5g s LYS 12 Ca 0.02 -1.08 -0.07 0.00 -0.36 0.00 0.00 55.97 54.48 1k5g s LYS 12 Cb -0.10 -4.11 -0.04 0.00 -1.51 0.00 0.00 37.83 32.07 1k5g s LYS 12 CO 0.01 -1.12 0.05 -1.17 -0.36 0.00 0.00 175.35 172.76 1k5g s LEU 13 N 2.19 3.63 -0.33 5.43 2.96 -1.09 -0.94 118.68 130.51 1k5g s LEU 13 Ca 0.10 -0.04 -0.17 0.00 -0.22 0.00 0.00 54.13 53.80 1k5g s LEU 13 Cb -0.21 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 1k5g s LEU 13 CO 0.10 0.11 0.48 -0.69 -1.32 0.00 0.00 176.35 175.03 1k5g s VAL 14 N 0.77 5.05 -0.27 1.68 1.01 -0.74 0.09 120.40 127.99 1k5g s VAL 14 Ca 0.03 0.37 -0.13 0.00 0.00 0.00 0.00 61.98 62.25 1k5g s VAL 14 Cb -0.14 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 1k5g s VAL 14 CO 0.02 -0.14 0.29 -0.22 0.00 0.00 0.00 175.10 175.05 1k5g s LEU 15 N 2.31 4.03 0.14 3.92 2.96 -0.64 -0.45 118.68 130.95 1k5g s LEU 15 Ca 0.18 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 1k5g s LEU 15 Cb -0.16 -2.29 -0.04 0.00 0.50 0.00 0.00 46.19 44.20 1k5g s LEU 15 CO 0.12 -0.12 -0.00 0.54 -1.32 0.00 0.00 176.35 175.57 1k5g s VAL 16 N 1.89 0.54 0.00 1.68 0.11 -0.20 -1.92 120.40 122.50 1k5g s VAL 16 Ca 0.12 -1.95 0.00 0.00 -2.93 0.00 0.00 61.98 57.22 1k5g s VAL 16 Cb -0.16 -1.98 0.00 0.00 -1.53 0.00 0.00 36.38 32.72 1k5g s VAL 16 CO 0.10 -0.59 0.00 0.61 -3.33 0.00 0.00 175.10 171.89 1k5g n GLY 17 N -0.15 2.87 3.70 6.54 0.00 -1.26 -0.99 105.19 115.89 1k5g n GLY 17 Ca -0.08 -1.37 -0.37 0.00 0.00 0.00 0.00 46.02 44.20 1k5g n GLY 17 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1k5g n ASP 18 N 0.00 1.80 -4.77 1.61 9.92 -1.24 -3.85 116.55 120.02 1k5g n ASP 18 Ca 0.00 0.84 -0.36 0.00 -0.53 0.00 0.00 54.79 54.74 1k5g n ASP 18 Cb 0.00 -1.51 0.01 0.00 -0.64 0.00 0.00 41.12 38.97 1k5g n ASP 18 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1k5g s GLY 19 N -1.29 2.72 -0.57 0.44 0.00 -1.20 -3.45 107.32 103.96 1k5g s GLY 19 Ca 0.80 0.93 0.00 0.00 0.00 0.00 0.00 44.72 46.44 1k5g s GLY 19 CO 0.43 1.33 0.00 0.61 0.00 0.00 0.00 173.10 175.47 1k5g n GLY 20 N 0.35 0.43 0.13 0.20 0.00 -1.26 -4.94 105.19 100.09 1k5g n GLY 20 Ca 0.10 -0.70 -0.17 0.00 0.00 0.00 0.00 46.02 45.25 1k5g n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k5g n THR 21 N -3.51 1.49 0.00 2.61 -2.24 -1.22 -4.95 114.28 106.46 1k5g n THR 21 Ca -0.07 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 1k5g n THR 21 Cb 0.40 -1.34 0.00 0.00 -2.10 0.00 0.00 70.33 67.29 1k5g n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k5g n GLY 22 N 2.20 -0.08 0.33 3.38 0.00 -1.26 -4.74 105.19 105.02 1k5g n GLY 22 Ca -0.44 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 1k5g n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k5g h LYS 23 N 0.00 -0.01 0.14 1.61 1.57 -1.95 0.35 116.57 118.27 1k5g h LYS 23 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1k5g h LYS 23 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1k5g h LYS 23 CO 0.00 -0.01 -0.07 1.79 -0.57 0.00 0.00 179.45 180.60 1k5g h THR 24 N -0.01 0.97 -0.78 -0.16 1.35 -1.97 -1.06 112.91 111.25 1k5g h THR 24 Ca 0.12 -0.45 0.16 0.00 -0.55 0.00 0.00 66.41 65.70 1k5g h THR 24 Cb 0.32 1.25 -0.15 0.00 -1.73 0.00 0.00 68.15 67.84 1k5g h THR 24 CO -0.72 0.11 -0.17 0.74 -0.25 0.00 0.00 175.52 175.23 1k5g h THR 25 N -0.40 0.23 0.69 6.82 2.02 -1.70 1.01 112.91 121.58 1k5g h THR 25 Ca -0.02 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 1k5g h THR 25 Cb 0.32 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1k5g h THR 25 CO 0.03 0.00 -0.47 0.15 0.37 0.00 0.00 175.52 175.61 1k5g h PHE 26 N 0.01 -1.25 -0.91 3.16 3.57 -0.19 -1.08 116.94 120.25 1k5g h PHE 26 Ca 0.38 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.96 1k5g h PHE 26 Cb 0.60 0.46 -0.07 0.00 2.79 0.00 0.00 35.95 39.73 1k5g h PHE 26 CO -0.60 -0.68 0.56 0.28 -2.23 0.00 0.00 178.31 175.64 1k5g h VAL 27 N -1.10 0.98 0.36 1.41 2.07 0.28 -2.13 116.25 118.11 1k5g h VAL 27 Ca -0.09 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 1k5g h VAL 27 Cb 0.90 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1k5g h VAL 27 CO 0.06 0.17 -0.28 0.50 0.02 0.00 0.00 177.57 178.04 1k5g h LYS 28 N 0.96 -0.60 -0.97 1.57 1.63 0.12 -2.27 116.57 117.02 1k5g h LYS 28 Ca 0.42 0.04 0.32 0.00 -0.85 0.00 0.00 60.65 60.58 1k5g h LYS 28 Cb 0.31 0.14 -0.16 0.00 -0.60 0.00 0.00 32.23 31.92 1k5g h LYS 28 CO -0.22 -0.40 0.39 -0.09 -3.45 0.00 0.00 179.45 175.69 1k5g h ARG 29 N -0.62 0.16 0.00 1.90 2.43 -1.00 0.92 114.38 118.17 1k5g h ARG 29 Ca -0.05 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1k5g h ARG 29 Cb 0.52 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1k5g h ARG 29 CO 0.01 0.11 0.00 0.72 -1.51 0.00 0.00 179.97 179.30 1k5g n HIS 30 N -5.21 0.00 -0.60 2.20 8.25 -0.82 0.57 115.22 119.60 1k5g n HIS 30 Ca 0.29 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 1k5g n HIS 30 Cb 0.95 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.79 1k5g n HIS 30 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 1k5g n LEU 31 N -1.27 0.73 0.00 2.41 -0.00 0.31 -4.83 117.00 114.35 1k5g n LEU 31 Ca 0.06 -0.73 0.00 0.00 -0.00 0.00 0.00 56.01 55.33 1k5g n LEU 31 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.51 1k5g n LEU 31 CO 0.09 0.18 0.00 0.41 -0.00 0.00 0.00 177.39 178.07 1k5g n THR 32 N -0.17 0.00 0.00 1.47 -1.04 -0.73 -5.01 114.28 108.81 1k5g n THR 32 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1k5g n THR 32 Cb 0.36 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 1k5g n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1k5g n GLY 33 N 0.10 2.53 3.77 3.41 0.00 0.19 -5.01 105.19 110.19 1k5g n GLY 33 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1k5g n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1k5g s GLU 34 N -0.48 3.87 -0.78 1.61 -1.05 -1.26 -4.85 118.70 115.75 1k5g s GLU 34 Ca 0.00 1.87 -0.12 0.00 -0.15 0.00 0.00 54.97 56.57 1k5g s GLU 34 Cb 0.00 -2.55 0.21 0.00 -0.44 0.00 0.00 34.13 31.35 1k5g s GLU 34 CO 0.00 -0.49 0.71 0.12 0.95 0.00 0.00 175.26 176.55 1k5g s PHE 35 N -1.44 3.69 -0.33 4.83 5.36 -1.26 -3.40 117.98 125.43 1k5g s PHE 35 Ca 0.61 -2.07 -0.28 0.00 -0.96 0.00 0.00 56.93 54.23 1k5g s PHE 35 Cb -0.31 -3.73 -0.04 0.00 -0.34 0.00 0.00 43.02 38.60 1k5g s PHE 35 CO 0.39 -0.97 2.13 -2.00 -1.46 0.00 0.00 175.22 173.31 1k5g s GLU 36 N 0.20 2.93 0.03 10.12 2.56 -1.26 -4.80 118.70 128.49 1k5g s GLU 36 Ca 0.17 1.66 0.25 0.00 0.00 0.00 0.00 54.97 57.05 1k5g s GLU 36 Cb -0.13 -4.37 0.58 0.00 2.00 0.00 0.00 34.13 32.20 1k5g s GLU 36 CO -0.08 -2.33 1.47 0.36 -0.56 0.00 0.00 175.26 174.13 1k5g n LYS 37 N 8.76 0.08 -3.11 4.30 2.85 -1.26 -4.85 118.16 124.93 1k5g n LYS 37 Ca 0.29 0.02 -0.39 0.00 -1.05 0.00 0.00 58.31 57.18 1k5g n LYS 37 Cb 0.48 -1.55 -0.05 0.00 -0.65 0.00 0.00 35.03 33.26 1k5g n LYS 37 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1k5g s LYS 38 N -3.04 4.41 -0.65 -1.58 -0.14 -1.26 -5.01 119.74 112.47 1k5g s LYS 38 Ca 0.10 0.78 -0.24 0.00 -1.36 0.00 0.00 55.97 55.25 1k5g s LYS 38 Cb 0.17 -3.44 0.05 0.00 -1.68 0.00 0.00 37.83 32.93 1k5g s LYS 38 CO 0.68 0.09 1.03 -0.47 -0.76 0.00 0.00 175.35 175.92 1k5g s TYR 39 N 0.74 2.62 -0.34 3.18 5.04 -1.26 -4.98 117.35 122.34 1k5g s TYR 39 Ca 0.35 -0.29 0.04 0.00 -2.44 0.00 0.00 57.07 54.72 1k5g s TYR 39 Cb -0.17 -4.32 0.10 0.00 0.35 0.00 0.00 41.96 37.92 1k5g s TYR 39 CO 0.16 -1.67 0.06 0.08 -1.34 0.00 0.00 175.55 172.84 1k5g s VAL 40 N 4.41 2.31 0.04 3.14 1.01 -1.26 -5.08 120.40 124.96 1k5g s VAL 40 Ca 0.27 -2.36 -0.36 0.00 0.00 0.00 0.00 61.98 59.53 1k5g s VAL 40 Cb -0.14 -2.71 -0.19 0.00 0.00 0.00 0.00 36.38 33.35 1k5g s VAL 40 CO 0.14 -0.60 0.93 0.00 0.00 0.00 0.00 175.10 175.56 1k5g n ALA 41 N 4.24 -3.39 -2.81 5.51 0.00 -1.26 -4.88 120.51 117.92 1k5g n ALA 41 Ca 0.04 0.55 -0.43 0.00 0.00 0.00 0.00 53.44 53.60 1k5g n ALA 41 Cb 0.42 -1.66 -0.03 0.00 0.00 0.00 0.00 19.45 18.18 1k5g n ALA 41 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1k5g s THR 42 N -0.18 4.39 0.06 0.00 2.01 -1.26 -5.01 115.64 115.64 1k5g s THR 42 Ca 0.82 -0.95 -0.31 0.00 0.31 0.00 0.00 61.69 61.57 1k5g s THR 42 Cb -1.16 -4.82 -0.08 0.00 0.01 0.00 0.00 72.50 66.45 1k5g s THR 42 CO 0.55 -1.60 1.70 -0.76 -0.69 0.00 0.00 174.62 173.82 1k5g s LEU 43 N 3.72 4.37 0.00 4.42 1.02 -1.26 -4.21 118.68 126.74 1k5g s LEU 43 Ca 0.32 2.50 0.00 0.00 0.02 0.00 0.00 54.13 56.98 1k5g s LEU 43 Cb -0.07 -3.56 0.00 0.00 0.02 0.00 0.00 46.19 42.58 1k5g s LEU 43 CO -0.03 -0.92 0.00 0.61 0.02 0.00 0.00 176.35 176.03 1k5g n GLY 44 N 4.09 1.51 3.43 -3.19 0.00 -1.26 -4.71 105.19 105.06 1k5g n GLY 44 Ca 0.17 0.03 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 1k5g n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k5g s VAL 45 N 0.00 -0.01 -0.19 1.61 0.11 -1.26 -2.09 120.40 118.58 1k5g s VAL 45 Ca 0.00 0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.08 1k5g s VAL 45 Cb 0.00 -0.76 0.00 0.00 -1.53 0.00 0.00 36.38 34.09 1k5g s VAL 45 CO 0.00 0.01 -0.13 -1.61 -3.33 0.00 0.00 175.10 170.04 1k5g s GLU 46 N 1.08 3.19 -0.45 1.54 2.02 -0.48 -4.98 118.70 120.62 1k5g s GLU 46 Ca -0.06 -0.74 -0.21 0.00 0.02 0.00 0.00 54.97 53.98 1k5g s GLU 46 Cb -0.06 -2.73 0.03 0.00 0.10 0.00 0.00 34.13 31.46 1k5g s GLU 46 CO -0.10 -0.14 0.68 0.08 0.02 0.00 0.00 175.26 175.81 1k5g s VAL 47 N 1.21 4.78 -0.17 2.63 1.01 -1.26 -1.74 120.40 126.86 1k5g s VAL 47 Ca 0.02 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.13 1k5g s VAL 47 Cb -0.14 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 31.97 1k5g s VAL 47 CO -0.06 -0.65 -0.04 -1.00 0.00 0.00 0.00 175.10 173.36 1k5g s HIS 48 N 2.95 3.00 -0.14 5.22 3.76 -0.51 -4.98 115.29 124.59 1k5g s HIS 48 Ca 0.24 -0.43 -0.09 0.00 -0.15 0.00 0.00 55.06 54.62 1k5g s HIS 48 Cb -0.14 -1.99 -0.05 0.00 1.11 0.00 0.00 32.58 31.52 1k5g s HIS 48 CO 0.20 -0.15 0.17 -1.25 -0.85 0.00 0.00 174.74 172.86 1k5g s PRO 49 N 0.62 3.80 -0.04 8.40 0.04 -1.26 -0.82 135.00 145.74 1k5g s PRO 49 Ca -0.03 -0.09 0.05 0.00 0.04 0.00 0.00 61.00 60.97 1k5g s PRO 49 Cb -0.14 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 31.10 1k5g s PRO 49 CO 0.02 0.57 -0.20 -0.51 0.04 0.00 0.00 177.00 176.93 1k5g s LEU 50 N -0.44 1.98 0.05 -3.56 1.43 0.17 -4.97 118.68 113.33 1k5g s LEU 50 Ca 0.14 -0.39 0.06 0.00 -1.03 0.00 0.00 54.13 52.91 1k5g s LEU 50 Cb -0.12 -1.07 -0.03 0.00 0.03 0.00 0.00 46.19 45.00 1k5g s LEU 50 CO 0.03 0.20 -0.14 0.68 0.23 0.00 0.00 176.35 177.34 1k5g s VAL 51 N -0.14 3.07 0.04 -1.59 -7.23 -1.26 -0.04 120.40 113.25 1k5g s VAL 51 Ca -0.01 -1.12 0.02 0.00 -1.81 0.00 0.00 61.98 59.06 1k5g s VAL 51 Cb -0.11 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.48 1k5g s VAL 51 CO 0.02 0.30 -0.07 -0.36 -0.31 0.00 0.00 175.10 174.68 1k5g s PHE 52 N -1.00 0.62 -0.16 2.82 0.08 -0.31 -4.99 117.98 115.04 1k5g s PHE 52 Ca 0.16 -0.45 -0.04 0.00 0.12 0.00 0.00 56.93 56.72 1k5g s PHE 52 Cb -0.11 -0.38 -0.03 0.00 -0.57 0.00 0.00 43.02 41.94 1k5g s PHE 52 CO 0.07 -0.08 -0.02 -1.01 -0.10 0.00 0.00 175.22 174.08 1k5g s HIS 53 N -1.23 3.05 0.43 0.36 3.76 -1.26 -0.99 115.29 119.40 1k5g s HIS 53 Ca -0.09 -0.29 0.04 0.00 -0.15 0.00 0.00 55.06 54.57 1k5g s HIS 53 Cb -0.09 -1.99 -0.04 0.00 1.11 0.00 0.00 32.58 31.57 1k5g s HIS 53 CO 0.00 -0.05 0.04 0.95 -0.85 0.00 0.00 174.74 174.83 1k5g s THR 54 N 0.46 1.32 -1.44 1.30 -4.23 -0.65 0.26 115.64 112.65 1k5g s THR 54 Ca -0.03 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.61 1k5g s THR 54 Cb -0.14 -2.55 0.22 0.00 1.34 0.00 0.00 72.50 71.37 1k5g s THR 54 CO 0.03 0.00 1.31 -0.46 -0.54 0.00 0.00 174.62 174.96 1k5g n ASN 55 N -1.08 0.00 -0.58 3.99 6.94 -1.06 -1.79 115.26 121.68 1k5g n ASN 55 Ca -0.10 0.09 0.06 0.00 -0.02 0.00 0.00 54.58 54.61 1k5g n ASN 55 Cb 0.67 -0.28 0.20 0.00 -2.36 0.00 0.00 39.78 38.01 1k5g n ASN 55 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1k5g n ARG 56 N -1.28 1.59 0.00 -3.83 1.74 -1.26 -5.09 116.66 108.53 1k5g n ARG 56 Ca 0.06 -3.17 0.00 0.00 -0.77 0.00 0.00 57.85 53.97 1k5g n ARG 56 Cb 0.10 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 29.91 1k5g n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k5g n GLY 57 N -1.16 0.97 3.77 -0.13 0.00 -0.74 -4.97 105.19 102.93 1k5g n GLY 57 Ca 0.20 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.80 1k5g n GLY 57 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1k5g s PRO 58 N -1.69 4.47 0.12 1.61 0.04 -1.26 -1.64 135.00 136.65 1k5g s PRO 58 Ca 0.00 1.03 0.09 0.00 0.04 0.00 0.00 61.00 62.16 1k5g s PRO 58 Cb 0.00 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 1k5g s PRO 58 CO 0.00 0.47 -0.21 0.96 0.04 0.00 0.00 177.00 178.25 1k5g s ILE 59 N -0.69 1.81 -0.18 0.56 -4.36 -0.16 -3.85 121.20 114.32 1k5g s ILE 59 Ca 0.35 -1.64 0.01 0.00 -0.26 0.00 0.00 60.65 59.12 1k5g s ILE 59 Cb -0.21 -1.67 0.03 0.00 1.25 0.00 0.00 42.46 41.86 1k5g s ILE 59 CO 0.23 -0.08 -0.15 -0.75 0.24 0.00 0.00 174.94 174.43 1k5g s LYS 60 N -2.08 2.50 -0.17 0.37 2.20 0.91 -1.16 119.74 122.31 1k5g s LYS 60 Ca 0.09 -0.80 -0.20 0.00 -0.36 0.00 0.00 55.97 54.70 1k5g s LYS 60 Cb -0.09 -2.43 -0.03 0.00 -1.51 0.00 0.00 37.83 33.77 1k5g s LYS 60 CO 0.05 -0.30 0.58 -0.06 -0.36 0.00 0.00 175.35 175.26 1k5g s PHE 61 N 1.35 3.43 -1.04 4.03 2.99 0.95 -0.30 117.98 129.39 1k5g s PHE 61 Ca 0.02 0.92 -0.12 0.00 0.00 0.00 0.00 56.93 57.76 1k5g s PHE 61 Cb -0.14 -2.72 0.23 0.00 0.00 0.00 0.00 43.02 40.39 1k5g s PHE 61 CO -0.10 -0.06 1.07 -0.80 -0.00 0.00 0.00 175.22 175.33 1k5g s ASN 62 N 1.03 7.08 -0.24 1.36 0.01 0.23 -0.66 114.94 123.75 1k5g s ASN 62 Ca 0.28 -3.13 -0.28 0.00 -0.71 0.00 0.00 52.86 49.02 1k5g s ASN 62 Cb -0.16 -2.26 -0.04 0.00 0.41 0.00 0.00 41.25 39.21 1k5g s ASN 62 CO 0.11 -0.50 2.02 -0.69 -1.51 0.00 0.00 177.10 176.53 1k5g s VAL 63 N -0.10 3.21 -0.85 1.60 1.01 0.00 -2.68 120.40 122.59 1k5g s VAL 63 Ca 0.29 0.22 -0.19 0.00 0.00 0.00 0.00 61.98 62.31 1k5g s VAL 63 Cb -0.08 -3.27 0.13 0.00 0.00 0.00 0.00 36.38 33.16 1k5g s VAL 63 CO -0.07 -0.16 1.02 0.26 0.00 0.00 0.00 175.10 176.15 1k5g s TRP 64 N 7.34 3.12 -0.08 5.22 0.52 0.11 -1.43 118.94 133.75 1k5g s TRP 64 Ca 0.91 -1.30 -0.30 0.00 0.02 0.00 0.00 56.10 55.43 1k5g s TRP 64 Cb -0.30 -4.21 -0.04 0.00 -1.15 0.00 0.00 33.47 27.78 1k5g s TRP 64 CO 0.35 -1.44 1.40 0.34 0.02 0.00 0.00 176.95 177.62 1k5g s ASP 65 N 3.48 6.85 0.43 2.95 -1.08 -0.71 -1.63 116.67 126.97 1k5g s ASP 65 Ca 0.27 1.96 0.07 0.00 -0.52 0.00 0.00 52.55 54.34 1k5g s ASP 65 Cb -0.09 -2.54 -0.02 0.00 -1.46 0.00 0.00 42.92 38.81 1k5g s ASP 65 CO -0.05 -0.78 0.35 0.42 0.52 0.00 0.00 175.17 175.63 1k5g s THR 66 N 3.24 2.45 -0.24 1.71 -4.23 -0.81 -1.38 115.64 116.39 1k5g s THR 66 Ca 0.62 -1.42 -0.15 0.00 -1.18 0.00 0.00 61.69 59.55 1k5g s THR 66 Cb -0.28 -2.88 -0.04 0.00 1.34 0.00 0.00 72.50 70.65 1k5g s THR 66 CO 0.22 0.00 0.38 0.00 -0.54 0.00 0.00 174.62 174.69 1k5g s ALA 67 N -2.54 3.57 -1.18 3.99 0.00 -0.89 -4.87 121.76 119.84 1k5g s ALA 67 Ca 0.45 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1k5g s ALA 67 Cb -0.02 -2.67 0.00 0.00 0.00 0.00 0.00 23.12 20.43 1k5g s ALA 67 CO 0.26 -0.48 0.46 0.41 0.00 0.00 0.00 175.76 176.41 1k5g n GLY 68 N 4.30 0.82 0.24 0.00 0.00 -1.25 -3.42 105.19 105.87 1k5g n GLY 68 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1k5g n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1k5g n GLN 69 N -0.00 0.51 -1.15 1.61 3.00 -1.26 -3.24 117.38 116.84 1k5g n GLN 69 Ca 0.00 0.19 -0.55 0.00 -0.01 0.00 0.00 57.00 56.63 1k5g n GLN 69 Cb 0.16 -1.35 -0.11 0.00 0.00 0.00 0.00 30.24 28.94 1k5g n GLN 69 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1k5g n GLU 70 N -3.80 0.00 -1.69 -1.09 1.02 -1.22 -4.82 120.64 109.04 1k5g n GLU 70 Ca -0.44 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.29 1k5g n GLU 70 Cb 0.85 -1.37 0.01 0.00 -0.02 0.00 0.00 31.44 30.90 1k5g n GLU 70 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1k5g n LYS 71 N 6.84 1.88 -1.99 3.49 5.02 -1.26 -4.89 118.16 127.24 1k5g n LYS 71 Ca 0.50 0.67 -0.41 0.00 -2.02 0.00 0.00 58.31 57.05 1k5g n LYS 71 Cb -0.04 -2.32 -0.02 0.00 -0.02 0.00 0.00 35.03 32.64 1k5g n LYS 71 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1k5g s PHE 72 N -1.18 2.90 -2.93 2.13 0.40 -1.26 -4.80 117.98 113.24 1k5g s PHE 72 Ca 0.60 1.24 0.00 0.00 -0.60 0.00 0.00 56.93 58.17 1k5g s PHE 72 Cb -0.53 -3.82 0.00 0.00 0.51 0.00 0.00 43.02 39.18 1k5g s PHE 72 CO 0.59 -2.42 0.00 0.41 0.70 0.00 0.00 175.22 174.50 1k5g n GLY 73 N 1.05 -1.52 0.26 4.36 0.00 -1.26 -4.96 105.19 103.12 1k5g n GLY 73 Ca 0.02 -1.08 0.14 0.00 0.00 0.00 0.00 46.02 45.09 1k5g n GLY 73 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1k5g h GLY 74 N 0.00 0.00 2.00 -0.02 0.00 -1.97 -2.36 103.07 100.72 1k5g h GLY 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1k5g h GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 1k5g n LEU 75 N -3.40 0.55 0.02 3.11 4.77 -1.26 -1.10 117.00 119.68 1k5g n LEU 75 Ca -0.01 0.73 0.11 0.00 -0.03 0.00 0.00 56.01 56.81 1k5g n LEU 75 Cb 0.29 -0.77 -0.06 0.00 -2.33 0.00 0.00 43.42 40.55 1k5g n LEU 75 CO 0.29 -0.86 -0.26 -1.14 -1.33 0.00 0.00 177.39 174.09 1k5g n ARG 76 N -2.21 0.43 -0.19 3.23 0.63 -0.89 -4.58 116.66 113.08 1k5g n ARG 76 Ca -0.01 -0.05 0.12 0.00 -0.92 0.00 0.00 57.85 56.99 1k5g n ARG 76 Cb 0.07 -1.59 0.23 0.00 0.45 0.00 0.00 32.46 31.61 1k5g n ARG 76 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1k5g n ASP 77 N -2.12 0.03 -0.25 6.15 10.43 -0.26 -0.88 116.55 129.64 1k5g n ASP 77 Ca -0.00 0.96 0.06 0.00 2.57 0.00 0.00 54.79 58.37 1k5g n ASP 77 Cb 0.49 -0.39 0.17 0.00 1.84 0.00 0.00 41.12 43.22 1k5g n ASP 77 CO 0.00 0.00 0.00 1.23 -1.07 0.00 0.00 177.20 177.36 1k5g h GLY 78 N 0.00 0.91 0.85 0.44 0.00 -1.81 -0.72 103.07 102.74 1k5g h GLY 78 Ca 0.40 0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.78 1k5g h GLY 78 CO -0.50 -0.27 -0.15 -0.97 0.00 0.00 0.00 176.54 174.65 1k5g h TYR 79 N 0.14 -0.38 -0.34 5.60 0.05 -1.38 -3.28 116.97 117.38 1k5g h TYR 79 Ca 0.42 -0.01 0.04 0.00 0.05 0.00 0.00 58.73 59.23 1k5g h TYR 79 Cb 0.74 0.13 -0.04 0.00 1.01 0.00 0.00 36.73 38.57 1k5g h TYR 79 CO -0.37 -0.14 0.12 1.88 -1.05 0.00 0.00 178.16 178.60 1k5g h TYR 80 N -0.58 0.21 -1.53 4.88 0.99 -1.53 -3.43 116.97 115.99 1k5g h TYR 80 Ca -0.04 0.02 -0.59 0.00 2.00 0.00 0.00 58.73 60.11 1k5g h TYR 80 Cb 0.42 -0.05 0.15 0.00 1.00 0.00 0.00 36.73 38.25 1k5g h TYR 80 CO -0.01 0.09 -0.86 -0.89 -0.00 0.00 0.00 178.16 176.48 1k5g n ILE 81 N -5.02 0.72 -1.18 -2.88 2.08 -0.32 -1.36 119.36 111.41 1k5g n ILE 81 Ca 0.01 -0.47 0.00 0.00 0.56 0.00 0.00 62.75 62.84 1k5g n ILE 81 Cb 0.12 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.01 1k5g n ILE 81 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1k5g n GLN 82 N 1.24 -1.25 -1.05 0.38 6.02 -1.26 -4.91 117.38 116.56 1k5g n GLN 82 Ca 0.11 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.81 1k5g n GLN 82 Cb 0.37 -3.93 0.21 0.00 1.02 0.00 0.00 30.24 27.90 1k5g n GLN 82 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1k5g s ALA 83 N -1.10 0.59 0.00 -1.58 0.00 -0.47 -4.77 121.76 114.43 1k5g s ALA 83 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.46 1k5g s ALA 83 Cb 0.00 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 20.05 1k5g s ALA 83 CO 0.00 -3.22 0.21 1.04 0.00 0.00 0.00 175.76 173.79 1k5g n GLN 84 N -4.47 0.00 0.00 0.00 6.02 -0.12 -4.93 117.38 113.88 1k5g n GLN 84 Ca 0.07 -0.21 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 1k5g n GLN 84 Cb 0.58 -0.49 0.00 0.00 1.02 0.00 0.00 30.24 31.35 1k5g n GLN 84 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1k5g s ALA 86 N -2.00 -1.93 -0.05 0.00 0.00 -0.90 -1.79 121.76 115.09 1k5g s ALA 86 Ca 0.00 0.74 0.01 0.00 0.00 0.00 0.00 51.96 52.71 1k5g s ALA 86 Cb 0.00 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.52 1k5g s ALA 86 CO 0.00 -0.89 -0.05 0.42 0.00 0.00 0.00 175.76 175.24 1k5g s ILE 87 N -2.86 0.60 -0.17 0.00 1.01 0.41 -2.36 121.20 117.83 1k5g s ILE 87 Ca 0.11 -0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.57 1k5g s ILE 87 Cb 0.01 -0.63 -0.03 0.00 0.01 0.00 0.00 42.46 41.81 1k5g s ILE 87 CO -0.03 0.25 0.02 -0.63 0.00 0.00 0.00 174.94 174.55 1k5g s ILE 88 N 1.08 4.39 0.10 2.92 1.01 -0.83 -1.03 121.20 128.84 1k5g s ILE 88 Ca -0.08 -0.18 0.10 0.00 0.00 0.00 0.00 60.65 60.49 1k5g s ILE 88 Cb -0.14 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 1k5g s ILE 88 CO -0.01 0.48 -0.25 -0.32 0.00 0.00 0.00 174.94 174.84 1k5g s MET 89 N 0.30 1.44 0.03 2.79 1.75 -0.16 -0.97 119.30 124.47 1k5g s MET 89 Ca 0.00 -1.24 -0.15 0.00 -1.25 0.00 0.00 55.69 53.05 1k5g s MET 89 Cb -0.13 -1.80 0.03 0.00 2.84 0.00 0.00 34.83 35.76 1k5g s MET 89 CO 0.01 0.44 0.34 -0.59 -0.65 0.00 0.00 175.02 174.57 1k5g s PHE 90 N -1.01 -0.17 -0.38 4.11 -0.12 -0.41 -3.73 117.98 116.29 1k5g s PHE 90 Ca 0.12 0.11 -0.22 0.00 -0.05 0.00 0.00 56.93 56.88 1k5g s PHE 90 Cb -0.10 0.13 0.01 0.00 -0.63 0.00 0.00 43.02 42.43 1k5g s PHE 90 CO 0.05 -0.50 0.73 0.34 -0.05 0.00 0.00 175.22 175.79 1k5g s ASP 91 N -1.89 6.48 0.53 1.98 3.68 -1.26 -0.72 116.67 125.47 1k5g s ASP 91 Ca -0.07 0.19 0.18 0.00 2.13 0.00 0.00 52.55 54.98 1k5g s ASP 91 Cb -0.02 -2.37 0.97 0.00 -1.45 0.00 0.00 42.92 40.05 1k5g s ASP 91 CO -0.01 -0.72 1.49 0.58 0.13 0.00 0.00 175.17 176.64 1k5g h VAL 92 N 5.77 0.00 -0.38 1.11 2.07 -1.64 0.56 116.25 123.74 1k5g h VAL 92 Ca -0.25 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1k5g h VAL 92 Cb 1.10 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1k5g h VAL 92 CO 0.90 0.00 0.00 0.35 0.02 0.00 0.00 177.57 178.84 1k5g n THR 93 N -2.47 0.55 -3.90 2.57 -2.24 -1.26 -1.32 114.28 106.22 1k5g n THR 93 Ca -0.01 -0.78 -0.30 0.00 -2.27 0.00 0.00 64.05 60.69 1k5g n THR 93 Cb 0.48 0.92 -0.15 0.00 -2.10 0.00 0.00 70.33 69.48 1k5g n THR 93 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1k5g s SER 94 N -1.34 4.41 0.19 3.42 0.15 0.20 -4.71 113.70 116.01 1k5g s SER 94 Ca 0.35 -2.14 -0.12 0.00 0.70 0.00 0.00 55.95 54.74 1k5g s SER 94 Cb 0.21 -1.35 0.17 0.00 -1.71 0.00 0.00 66.02 63.33 1k5g s SER 94 CO 0.28 -0.37 1.76 -0.09 1.20 0.00 0.00 173.24 176.03 1k5g h ARG 95 N 7.56 0.41 -0.94 5.44 2.43 -1.87 0.14 114.38 127.55 1k5g h ARG 95 Ca -0.07 -0.02 0.22 0.00 -0.81 0.00 0.00 59.98 59.30 1k5g h ARG 95 Cb 1.00 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 30.38 1k5g h ARG 95 CO 0.52 0.27 0.62 0.28 -1.51 0.00 0.00 179.97 180.15 1k5g h VAL 96 N 0.42 0.63 -0.01 0.20 2.07 -1.93 -0.14 116.25 117.49 1k5g h VAL 96 Ca 0.24 -0.13 -0.14 0.00 0.82 0.00 0.00 66.70 67.49 1k5g h VAL 96 Cb 0.22 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1k5g h VAL 96 CO -0.21 0.07 -0.66 0.00 0.02 0.00 0.00 177.57 176.79 1k5g h THR 97 N 0.37 1.46 0.05 2.57 1.03 -1.28 -3.10 112.91 114.01 1k5g h THR 97 Ca 0.49 -2.22 -0.14 0.00 -0.01 0.00 0.00 66.41 64.54 1k5g h THR 97 Cb 1.29 2.19 0.01 0.00 -1.07 0.00 0.00 68.15 70.57 1k5g h THR 97 CO -0.19 0.64 -0.59 0.22 -0.01 0.00 0.00 175.52 175.59 1k5g h TYR 98 N 0.04 0.49 -0.17 0.00 3.20 -0.76 -3.19 116.97 116.58 1k5g h TYR 98 Ca -0.01 -0.31 0.05 0.00 3.14 0.00 0.00 58.73 61.60 1k5g h TYR 98 Cb 1.17 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 1k5g h TYR 98 CO 0.01 1.17 0.41 0.87 -1.64 0.00 0.00 178.16 178.97 1k5g h LYS 99 N -0.32 0.00 0.00 1.82 6.56 -1.12 0.27 116.57 123.78 1k5g h LYS 99 Ca -0.09 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1k5g h LYS 99 Cb 1.37 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.03 1k5g h LYS 99 CO 0.11 0.00 -0.54 0.09 -2.06 0.00 0.00 179.45 177.06 1k5g n ASN 100 N -3.21 0.68 -0.24 0.86 4.13 -1.18 -4.24 115.26 112.07 1k5g n ASN 100 Ca 0.02 0.15 0.01 0.00 1.68 0.00 0.00 54.58 56.44 1k5g n ASN 100 Cb 0.50 0.05 0.08 0.00 -1.54 0.00 0.00 39.78 38.87 1k5g n ASN 100 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1k5g h VAL 101 N 0.00 0.29 -0.78 2.41 2.07 -0.54 -1.31 116.25 118.39 1k5g h VAL 101 Ca 0.00 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.70 1k5g h VAL 101 Cb 0.72 0.29 -0.12 0.00 -1.52 0.00 0.00 31.29 30.66 1k5g h VAL 101 CO 0.00 0.00 0.15 -0.65 0.02 0.00 0.00 177.57 177.09 1k5g h PRO 102 N -0.00 0.21 -0.51 1.57 0.11 -1.77 0.28 132.00 131.89 1k5g h PRO 102 Ca 0.34 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.36 1k5g h PRO 102 Cb 0.52 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 1k5g h PRO 102 CO -0.73 0.14 0.02 -0.91 -0.21 0.00 0.00 178.00 176.31 1k5g h ASN 103 N 0.22 0.87 0.49 -2.05 2.35 -1.52 -2.99 115.58 112.94 1k5g h ASN 103 Ca 0.45 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.88 1k5g h ASN 103 Cb 0.81 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.95 1k5g h ASN 103 CO -0.58 0.95 -0.23 -0.50 -1.65 0.00 0.00 177.43 175.41 1k5g h TRP 104 N 0.76 -0.61 -0.93 1.19 -0.00 -0.76 -2.05 115.95 113.56 1k5g h TRP 104 Ca 0.15 -0.01 -0.54 0.00 -0.00 0.00 0.00 58.89 58.48 1k5g h TRP 104 Cb 0.49 0.20 -0.08 0.00 -0.00 0.00 0.00 29.16 29.77 1k5g h TRP 104 CO 0.04 -0.37 1.48 -1.58 -0.00 0.00 0.00 178.44 178.01 1k5g s HIS 105 N -6.07 2.41 0.00 0.49 2.46 0.84 -1.65 115.29 113.76 1k5g s HIS 105 Ca -0.16 -0.64 0.00 0.00 0.47 0.00 0.00 55.06 54.73 1k5g s HIS 105 Cb 0.04 -4.53 0.00 0.00 -0.13 0.00 0.00 32.58 27.96 1k5g s HIS 105 CO 0.63 -1.81 0.00 -2.13 -2.47 0.00 0.00 174.74 168.96 1k5g n ARG 106 N 8.72 0.00 0.29 2.88 0.63 -1.21 -4.72 116.66 123.26 1k5g n ARG 106 Ca 0.39 0.00 0.18 0.00 -0.92 0.00 0.00 57.85 57.50 1k5g n ARG 106 Cb 0.49 0.00 0.89 0.00 0.45 0.00 0.00 32.46 34.29 1k5g n ARG 106 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 1k5g h ASP 107 N 0.00 0.00 0.00 6.15 3.58 -1.07 -0.32 116.42 124.76 1k5g h ASP 107 Ca 0.00 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.37 1k5g h ASP 107 Cb 0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1k5g h ASP 107 CO 0.00 0.04 -0.57 0.25 -2.88 0.00 0.00 179.24 176.08 1k5g h LEU 108 N 0.00 0.00 0.00 2.28 6.46 -1.54 -3.35 115.31 119.15 1k5g h LEU 108 Ca -0.00 -0.41 0.00 0.00 -0.12 0.00 0.00 57.88 57.35 1k5g h LEU 108 Cb 0.27 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1k5g h LEU 108 CO 0.01 1.03 0.00 1.33 -0.62 0.00 0.00 178.44 180.18 1k5g n VAL 109 N -4.58 0.00 0.11 1.05 0.24 -1.07 -2.58 118.33 111.51 1k5g n VAL 109 Ca -0.15 0.00 -0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1k5g n VAL 109 Cb 0.42 -0.51 -0.02 0.00 -1.47 0.00 0.00 33.84 32.26 1k5g n VAL 109 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1k5g h ARG 110 N 0.00 0.00 0.00 7.34 2.43 -1.20 -2.17 114.38 120.78 1k5g h ARG 110 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1k5g h ARG 110 Cb 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1k5g h ARG 110 CO 0.00 0.61 -1.32 1.33 -1.51 0.00 0.00 179.97 179.09 1k5g n VAL 111 N -3.24 0.07 0.02 0.20 0.24 -1.08 -4.66 118.33 109.88 1k5g n VAL 111 Ca 0.01 -0.17 0.11 0.00 -2.04 0.00 0.00 64.34 62.25 1k5g n VAL 111 Cb 0.79 0.15 -0.16 0.00 -1.47 0.00 0.00 33.84 33.15 1k5g n VAL 111 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1k5g n GLU 113 N -2.21 0.00 -3.73 0.00 1.02 -0.82 -4.18 120.64 110.72 1k5g n GLU 113 Ca -0.04 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.74 1k5g n GLU 113 Cb 0.54 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.86 1k5g n GLU 113 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1k5g s ASN 114 N -4.00 5.25 -0.03 1.62 3.84 -1.26 -4.85 114.94 115.51 1k5g s ASN 114 Ca 0.00 -2.56 -0.09 0.00 0.21 0.00 0.00 52.86 50.42 1k5g s ASN 114 Cb 0.00 -1.85 0.01 0.00 -0.55 0.00 0.00 41.25 38.86 1k5g s ASN 114 CO 0.00 -0.44 0.21 0.27 -2.79 0.00 0.00 177.10 174.35 1k5g s ILE 115 N 0.37 0.05 0.28 -5.21 -4.36 -1.26 -5.07 121.20 106.00 1k5g s ILE 115 Ca 0.14 -0.40 -0.30 0.00 -0.26 0.00 0.00 60.65 59.83 1k5g s ILE 115 Cb -0.21 -0.44 -0.12 0.00 1.25 0.00 0.00 42.46 42.93 1k5g s ILE 115 CO -0.04 -0.22 1.45 -2.65 0.24 0.00 0.00 174.94 173.73 1k5g n PRO 116 N 1.93 2.31 -3.72 0.37 -0.02 -1.26 -4.89 135.00 129.72 1k5g n PRO 116 Ca -0.19 0.82 -0.13 0.00 -2.02 0.00 0.00 63.50 61.98 1k5g n PRO 116 Cb 0.57 -2.51 -0.14 0.00 -0.02 0.00 0.00 33.50 31.40 1k5g n PRO 116 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1k5g s ILE 117 N -0.29 -0.10 -0.15 4.25 1.01 -1.26 -2.13 121.20 122.53 1k5g s ILE 117 Ca 0.64 0.20 -0.02 0.00 0.00 0.00 0.00 60.65 61.46 1k5g s ILE 117 Cb -0.57 -0.32 -0.02 0.00 0.01 0.00 0.00 42.46 41.56 1k5g s ILE 117 CO 0.52 0.08 -0.07 0.68 0.00 0.00 0.00 174.94 176.15 1k5g s VAL 118 N 1.44 3.56 -0.19 2.92 -7.23 -0.99 -1.67 120.40 118.23 1k5g s VAL 118 Ca -0.07 -0.48 -0.18 0.00 -1.81 0.00 0.00 61.98 59.45 1k5g s VAL 118 Cb -0.11 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.25 1k5g s VAL 118 CO -0.07 0.50 0.48 -0.22 -0.31 0.00 0.00 175.10 175.48 1k5g s LEU 119 N 0.44 4.16 -0.16 1.32 2.96 0.14 -1.97 118.68 125.56 1k5g s LEU 119 Ca -0.06 0.64 0.00 0.00 -0.22 0.00 0.00 54.13 54.50 1k5g s LEU 119 Cb -0.15 -2.65 0.00 0.00 0.50 0.00 0.00 46.19 43.89 1k5g s LEU 119 CO 0.04 -0.14 -0.16 0.00 -1.32 0.00 0.00 176.35 174.77 1k5g s GLY 121 N 0.97 2.14 0.78 0.00 0.00 -0.77 -1.28 107.32 109.16 1k5g s GLY 121 Ca -0.03 -2.64 -0.10 0.00 0.00 0.00 0.00 44.72 41.96 1k5g s GLY 121 CO -0.03 1.28 1.12 0.21 0.00 0.00 0.00 173.10 175.68 1k5g s ASN 122 N 3.35 4.45 -1.33 1.64 2.47 0.10 -1.36 114.94 124.25 1k5g s ASN 122 Ca 0.07 0.53 -0.08 0.00 0.42 0.00 0.00 52.86 53.81 1k5g s ASN 122 Cb -0.25 -1.03 0.01 0.00 -1.45 0.00 0.00 41.25 38.53 1k5g s ASN 122 CO 0.01 -1.88 1.16 0.29 -3.72 0.00 0.00 177.10 172.96 1k5g n LYS 123 N -3.19 -7.83 0.00 0.43 5.02 -0.85 -1.85 118.16 109.89 1k5g n LYS 123 Ca 0.09 0.82 0.10 0.00 -2.02 0.00 0.00 58.31 57.30 1k5g n LYS 123 Cb 0.61 -5.85 0.47 0.00 -0.02 0.00 0.00 35.03 30.23 1k5g n LYS 123 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1k5g n VAL 124 N -4.94 0.49 0.17 -0.18 0.24 -0.93 -2.42 118.33 110.77 1k5g n VAL 124 Ca -0.01 0.12 0.04 0.00 -2.04 0.00 0.00 64.34 62.46 1k5g n VAL 124 Cb 0.57 -0.79 0.25 0.00 -1.47 0.00 0.00 33.84 32.39 1k5g n VAL 124 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1k5g h ASP 125 N 0.00 0.00 -3.91 -1.34 2.03 -1.89 -3.45 116.42 107.86 1k5g h ASP 125 Ca 0.00 0.00 -0.54 0.00 -0.73 0.00 0.00 57.03 55.76 1k5g h ASP 125 Cb 0.24 0.00 0.10 0.00 -0.83 0.00 0.00 39.33 38.84 1k5g h ASP 125 CO 0.00 0.43 0.76 -0.63 -1.03 0.00 0.00 179.24 178.77 1k5g s ILE 126 N -3.42 2.16 0.00 4.15 1.09 -1.01 -4.98 121.20 119.19 1k5g s ILE 126 Ca 0.01 0.16 0.00 0.00 -1.10 0.00 0.00 60.65 59.72 1k5g s ILE 126 Cb 0.10 -3.10 0.00 0.00 -1.06 0.00 0.00 42.46 38.40 1k5g s ILE 126 CO 0.70 0.04 0.53 1.17 -0.10 0.00 0.00 174.94 177.28 1k5g n LYS 127 N 0.59 0.00 -1.84 2.79 4.81 -1.26 -4.15 118.16 119.09 1k5g n LYS 127 Ca 0.01 0.14 -0.21 0.00 -0.87 0.00 0.00 58.31 57.38 1k5g n LYS 127 Cb 0.40 -1.03 -0.07 0.00 0.02 0.00 0.00 35.03 34.34 1k5g n LYS 127 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1k5g s ASP 128 N -2.22 4.41 0.31 3.14 1.11 -1.26 -4.94 116.67 117.22 1k5g s ASP 128 Ca 0.00 -0.89 -0.23 0.00 0.18 0.00 0.00 52.55 51.61 1k5g s ASP 128 Cb 0.00 -2.58 -0.10 0.00 1.07 0.00 0.00 42.92 41.32 1k5g s ASP 128 CO 0.00 -3.60 0.88 -0.60 1.18 0.00 0.00 175.17 173.03 1k5g s ARG 129 N 7.62 4.44 -0.13 8.23 3.52 -1.26 -4.83 118.95 136.53 1k5g s ARG 129 Ca 0.77 1.16 -0.08 0.00 -0.13 0.00 0.00 55.73 57.46 1k5g s ARG 129 Cb -0.06 -2.74 -0.06 0.00 -1.56 0.00 0.00 34.95 30.53 1k5g s ARG 129 CO 0.10 0.27 -0.19 1.63 -0.81 0.00 0.00 175.30 176.30 1k5g n LYS 130 N 0.43 0.31 -3.06 5.12 5.02 -0.57 -4.86 118.16 120.55 1k5g n LYS 130 Ca 0.01 0.13 -0.45 0.00 -2.02 0.00 0.00 58.31 55.99 1k5g n LYS 130 Cb 0.51 -1.02 -0.04 0.00 -0.02 0.00 0.00 35.03 34.46 1k5g n LYS 130 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1k5g s VAL 131 N -2.30 4.84 0.68 -0.18 1.01 -0.43 -5.00 120.40 119.01 1k5g s VAL 131 Ca -0.20 -1.25 -0.11 0.00 0.00 0.00 0.00 61.98 60.41 1k5g s VAL 131 Cb 0.07 -4.59 0.00 0.00 0.00 0.00 0.00 36.38 31.87 1k5g s VAL 131 CO 0.26 -1.26 1.06 -0.54 0.00 0.00 0.00 175.10 174.62 1k5g s LYS 132 N 2.54 3.01 0.19 2.72 1.02 -1.26 -4.87 119.74 123.08 1k5g s LYS 132 Ca 0.19 0.97 -0.18 0.00 0.02 0.00 0.00 55.97 56.97 1k5g s LYS 132 Cb -0.16 -2.00 0.15 0.00 -0.52 0.00 0.00 37.83 35.30 1k5g s LYS 132 CO 0.01 -1.04 1.61 0.00 -0.92 0.00 0.00 175.35 175.00 1k5g h ALA 133 N -0.57 0.12 -3.00 5.17 0.00 -1.98 -3.23 119.26 115.77 1k5g h ALA 133 Ca -0.44 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1k5g h ALA 133 Cb 1.21 0.63 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1k5g h ALA 133 CO 0.57 -0.58 0.00 1.63 0.00 0.00 0.00 179.25 180.87 1k5g n LYS 134 N -5.43 0.00 -0.21 0.00 4.76 -1.26 -2.88 118.16 113.13 1k5g n LYS 134 Ca 0.05 0.19 0.16 0.00 -2.87 0.00 0.00 58.31 55.84 1k5g n LYS 134 Cb 0.34 -0.82 0.25 0.00 -1.84 0.00 0.00 35.03 32.96 1k5g n LYS 134 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1k5g n SER 135 N -0.51 0.01 -4.63 4.39 7.64 -1.22 -4.49 113.62 114.81 1k5g n SER 135 Ca 0.00 0.33 -0.43 0.00 1.01 0.00 0.00 58.87 59.78 1k5g n SER 135 Cb 0.00 -0.16 -0.03 0.00 -1.01 0.00 0.00 64.21 63.01 1k5g n SER 135 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1k5g s ILE 136 N -3.65 3.08 0.00 0.44 -1.09 -1.14 -4.75 121.20 114.09 1k5g s ILE 136 Ca -0.02 0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.50 1k5g s ILE 136 Cb 0.09 -3.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.88 1k5g s ILE 136 CO 0.28 -0.04 0.00 0.52 -1.23 0.00 0.00 174.94 174.47 1k5g n VAL 137 N 6.75 0.00 -0.24 2.92 0.31 -1.26 -4.84 118.33 121.97 1k5g n VAL 137 Ca 0.25 0.00 0.21 0.00 -0.01 0.00 0.00 64.34 64.79 1k5g n VAL 137 Cb 0.43 -0.43 0.37 0.00 -0.91 0.00 0.00 33.84 33.30 1k5g n VAL 137 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1k5g n PHE 138 N -2.10 0.48 0.10 3.52 7.35 -1.26 0.14 117.46 125.69 1k5g n PHE 138 Ca 0.00 0.48 0.00 0.00 -0.76 0.00 0.00 57.45 57.18 1k5g n PHE 138 Cb 0.36 -0.88 0.31 0.00 0.35 0.00 0.00 39.48 39.62 1k5g n PHE 138 CO 0.00 0.00 0.00 1.12 -0.76 0.00 0.00 176.76 177.12 1k5g h HIS 139 N 0.00 0.27 -0.45 -5.13 2.07 -1.88 -2.41 115.15 107.62 1k5g h HIS 139 Ca 0.49 -0.05 -0.02 0.00 -2.85 0.00 0.00 60.37 57.94 1k5g h HIS 139 Cb 1.50 -0.07 -0.02 0.00 2.57 0.00 0.00 27.41 31.39 1k5g h HIS 139 CO -0.00 0.48 0.19 0.00 -3.07 0.00 0.00 177.93 175.54 1k5g h ARG 140 N 0.22 0.66 0.00 5.12 -0.00 0.86 -1.97 114.38 119.27 1k5g h ARG 140 Ca 0.04 -0.11 0.00 0.00 -0.50 0.00 0.00 59.98 59.40 1k5g h ARG 140 Cb 0.57 -0.11 0.00 0.00 0.00 0.00 0.00 29.97 30.43 1k5g h ARG 140 CO 0.04 0.59 0.00 1.63 0.00 0.00 0.00 179.97 182.23 1k5g n LYS 141 N -4.62 0.01 -0.09 0.04 4.76 -1.11 -4.05 118.16 113.10 1k5g n LYS 141 Ca 0.01 0.01 0.02 0.00 -2.87 0.00 0.00 58.31 55.48 1k5g n LYS 141 Cb 0.13 -1.52 0.03 0.00 -1.84 0.00 0.00 35.03 31.84 1k5g n LYS 141 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1k5g n LYS 142 N -1.54 1.29 -3.29 1.97 4.01 -0.92 -5.05 118.16 114.62 1k5g n LYS 142 Ca 0.07 -1.32 -0.15 0.00 -0.51 0.00 0.00 58.31 56.39 1k5g n LYS 142 Cb 0.34 -0.86 0.05 0.00 -0.51 0.00 0.00 35.03 34.06 1k5g n LYS 142 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1k5g n ASN 143 N -0.45 -6.61 -4.40 4.39 5.15 -0.78 -5.03 115.26 107.53 1k5g n ASN 143 Ca 0.03 -0.67 -0.21 0.00 -0.60 0.00 0.00 54.58 53.14 1k5g n ASN 143 Cb 0.47 -4.91 -0.10 0.00 -0.53 0.00 0.00 39.78 34.71 1k5g n ASN 143 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1k5g s LEU 144 N -5.34 2.57 0.07 1.20 1.43 -0.96 -4.71 118.68 112.95 1k5g s LEU 144 Ca 0.39 -1.02 -0.01 0.00 -1.03 0.00 0.00 54.13 52.45 1k5g s LEU 144 Cb -0.07 -0.84 -0.04 0.00 0.03 0.00 0.00 46.19 45.27 1k5g s LEU 144 CO 0.76 -0.09 0.24 -1.58 0.23 0.00 0.00 176.35 175.92 1k5g s GLN 145 N -3.59 3.48 0.03 1.70 2.00 -0.67 -4.73 119.66 117.88 1k5g s GLN 145 Ca 0.25 -0.35 0.05 0.00 -2.00 0.00 0.00 55.36 53.31 1k5g s GLN 145 Cb -0.02 -3.01 -0.02 0.00 0.80 0.00 0.00 33.01 30.76 1k5g s GLN 145 CO 0.10 0.59 -0.14 -0.47 -0.50 0.00 0.00 175.29 174.86 1k5g s TYR 146 N -1.52 1.25 -0.11 1.67 5.04 -1.26 0.24 117.35 122.66 1k5g s TYR 146 Ca 0.36 -0.32 -0.06 0.00 -2.44 0.00 0.00 57.07 54.60 1k5g s TYR 146 Cb -0.13 -0.76 0.05 0.00 0.35 0.00 0.00 41.96 41.47 1k5g s TYR 146 CO 0.26 0.02 0.26 0.71 -1.34 0.00 0.00 175.55 175.47 1k5g s TYR 147 N -0.71 -0.35 0.23 4.97 2.02 0.03 -4.94 117.35 118.61 1k5g s TYR 147 Ca 0.03 0.82 -0.30 0.00 -0.37 0.00 0.00 57.07 57.24 1k5g s TYR 147 Cb -0.07 0.07 -0.09 0.00 -0.40 0.00 0.00 41.96 41.47 1k5g s TYR 147 CO 0.01 -0.23 0.96 -0.51 -1.57 0.00 0.00 175.55 174.21 1k5g s ASP 148 N 1.16 7.59 0.21 2.29 1.11 -1.26 -1.85 116.67 125.92 1k5g s ASP 148 Ca -0.08 1.98 -0.10 0.00 0.18 0.00 0.00 52.55 54.52 1k5g s ASP 148 Cb -0.09 -2.61 -0.01 0.00 1.07 0.00 0.00 42.92 41.28 1k5g s ASP 148 CO -0.08 0.10 0.37 0.27 1.18 0.00 0.00 175.17 177.01 1k5g s ILE 149 N -1.07 0.02 -0.28 0.77 -4.36 -0.46 -4.60 121.20 111.21 1k5g s ILE 149 Ca 0.42 -1.46 0.00 0.00 -0.26 0.00 0.00 60.65 59.35 1k5g s ILE 149 Cb -0.27 -2.12 0.14 0.00 1.25 0.00 0.00 42.46 41.47 1k5g s ILE 149 CO 0.33 -0.09 0.33 -0.55 0.24 0.00 0.00 174.94 175.21 1k5g s SER 150 N -3.02 1.13 0.57 4.36 0.15 -1.03 -2.00 113.70 113.87 1k5g s SER 150 Ca 0.23 -0.53 0.29 0.00 0.70 0.00 0.00 55.95 56.63 1k5g s SER 150 Cb 0.02 0.74 1.48 0.00 -1.71 0.00 0.00 66.02 66.54 1k5g s SER 150 CO 0.06 -0.37 1.93 0.00 1.20 0.00 0.00 173.24 176.06 1k5g h ALA 151 N 8.23 2.33 0.03 5.45 0.00 -1.93 0.79 119.26 134.15 1k5g h ALA 151 Ca -0.12 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1k5g h ALA 151 Cb 1.10 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1k5g h ALA 151 CO 0.31 -0.74 -0.01 -0.22 0.00 0.00 0.00 179.25 178.58 1k5g h LYS 152 N 0.00 -0.04 -0.02 0.00 3.64 -1.97 -3.32 116.57 114.86 1k5g h LYS 152 Ca 0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1k5g h LYS 152 Cb 1.19 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1k5g h LYS 152 CO -0.00 0.64 -0.10 -1.13 -2.27 0.00 0.00 179.45 176.59 1k5g n SER 153 N -4.76 1.96 0.00 4.20 3.41 -0.82 -4.94 113.62 112.67 1k5g n SER 153 Ca -0.09 -1.56 0.00 0.00 -0.26 0.00 0.00 58.87 56.96 1k5g n SER 153 Cb 0.34 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1k5g n SER 153 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1k5g n ASN 154 N 0.39 -0.45 -4.57 4.04 3.02 0.27 -4.93 115.26 113.03 1k5g n ASN 154 Ca 0.15 0.00 -0.53 0.00 -0.03 0.00 0.00 54.58 54.17 1k5g n ASN 154 Cb 0.44 -1.37 -0.07 0.00 -0.61 0.00 0.00 39.78 38.18 1k5g n ASN 154 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k5g n TYR 155 N -2.05 1.87 -0.90 3.10 -0.00 -1.22 0.18 117.16 118.14 1k5g n TYR 155 Ca 0.00 0.33 0.00 0.00 -0.00 0.00 0.00 57.90 58.23 1k5g n TYR 155 Cb 0.03 -2.52 0.00 0.00 -0.00 0.00 0.00 39.34 36.84 1k5g n TYR 155 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 1k5g n ASN 156 N 7.70 -4.42 0.07 2.98 5.03 -1.26 -2.47 115.26 122.89 1k5g n ASN 156 Ca 0.33 0.00 0.03 0.00 0.87 0.00 0.00 54.58 55.81 1k5g n ASN 156 Cb 0.20 -2.97 0.15 0.00 -1.02 0.00 0.00 39.78 36.13 1k5g n ASN 156 CO 0.00 0.00 0.00 2.22 -1.83 0.00 0.00 177.26 177.65 1k5g n PHE 157 N -2.08 0.18 0.14 3.10 -1.74 0.13 -0.61 117.46 116.58 1k5g n PHE 157 Ca 0.00 0.10 0.02 0.00 -0.56 0.00 0.00 57.45 57.00 1k5g n PHE 157 Cb 0.35 -0.43 0.00 0.00 1.52 0.00 0.00 39.48 40.92 1k5g n PHE 157 CO 0.00 0.00 0.00 -0.85 -0.56 0.00 0.00 176.76 175.35 1k5g n GLU 158 N -1.61 2.34 0.04 3.97 -0.00 -1.26 -4.71 120.64 119.40 1k5g n GLU 158 Ca -0.00 -0.39 -0.12 0.00 -0.00 0.00 0.00 57.16 56.64 1k5g n GLU 158 Cb 0.28 -0.88 -0.08 0.00 -0.00 0.00 0.00 31.44 30.77 1k5g n GLU 158 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 1k5g h LYS 159 N 0.37 -0.03 -0.72 3.44 1.79 -1.26 -2.56 116.57 117.61 1k5g h LYS 159 Ca 0.00 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.58 1k5g h LYS 159 Cb 0.11 0.01 -0.12 0.00 -1.58 0.00 0.00 32.23 30.65 1k5g h LYS 159 CO 0.00 0.08 -0.43 -1.35 -1.08 0.00 0.00 179.45 176.66 1k5g h PRO 160 N -0.12 -0.14 -0.53 3.15 0.11 -1.85 0.47 132.00 133.09 1k5g h PRO 160 Ca -0.00 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 1k5g h PRO 160 Cb 0.12 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 1k5g h PRO 160 CO 0.00 -0.09 0.22 0.74 -0.21 0.00 0.00 178.00 178.66 1k5g h PHE 161 N -0.14 0.80 -0.69 0.65 0.04 -1.88 -2.64 116.94 113.08 1k5g h PHE 161 Ca 0.22 -0.06 0.08 0.00 2.80 0.00 0.00 57.97 61.01 1k5g h PHE 161 Cb 0.55 -0.24 -0.06 0.00 2.20 0.00 0.00 35.95 38.40 1k5g h PHE 161 CO -0.78 0.66 0.36 1.25 -0.60 0.00 0.00 178.31 179.19 1k5g h LEU 162 N 0.72 0.49 0.00 1.54 5.85 -0.56 -0.59 115.31 122.76 1k5g h LEU 162 Ca 0.18 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1k5g h LEU 162 Cb 0.19 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1k5g h LEU 162 CO -0.02 0.30 0.00 1.87 -0.34 0.00 0.00 178.44 180.25 1k5g n TRP 163 N -4.83 0.00 -0.16 1.25 -0.00 0.14 -1.92 117.44 111.91 1k5g n TRP 163 Ca 0.10 0.00 0.15 0.00 -0.00 0.00 0.00 57.50 57.75 1k5g n TRP 163 Cb 0.23 0.00 0.27 0.00 -0.00 0.00 0.00 31.31 31.81 1k5g n TRP 163 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1k5g n LEU 164 N -0.38 0.14 0.10 5.87 4.77 -1.06 0.24 117.00 126.68 1k5g n LEU 164 Ca 0.00 0.82 -0.13 0.00 -0.03 0.00 0.00 56.01 56.67 1k5g n LEU 164 Cb 0.00 -0.39 -0.08 0.00 -2.33 0.00 0.00 43.42 40.63 1k5g n LEU 164 CO 0.00 -0.91 0.80 0.00 -1.33 0.00 0.00 177.39 175.94 1k5g h ALA 165 N 0.99 -0.18 -0.52 -1.18 0.00 -1.04 0.65 119.26 117.99 1k5g h ALA 165 Ca 0.40 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.27 1k5g h ALA 165 Cb 1.05 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1k5g h ALA 165 CO -0.39 -0.57 0.31 0.00 0.00 0.00 0.00 179.25 178.60 1k5g h ARG 166 N -0.23 0.60 -0.31 0.00 3.08 0.38 0.30 114.38 118.19 1k5g h ARG 166 Ca -0.02 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1k5g h ARG 166 Cb 0.18 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1k5g h ARG 166 CO 0.03 0.40 0.10 0.87 -1.07 0.00 0.00 179.97 180.29 1k5g h LYS 167 N 0.62 0.49 -0.06 0.04 1.79 -0.89 0.40 116.57 118.96 1k5g h LYS 167 Ca 0.21 -0.11 -0.02 0.00 -2.18 0.00 0.00 60.65 58.55 1k5g h LYS 167 Cb 0.01 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.59 1k5g h LYS 167 CO -0.09 0.53 -0.03 -0.07 -1.08 0.00 0.00 179.45 178.71 1k5g h LEU 168 N 0.35 0.13 -1.29 2.94 3.38 0.60 -3.04 115.31 118.37 1k5g h LEU 168 Ca 0.10 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.61 1k5g h LEU 168 Cb 0.25 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1k5g h LEU 168 CO -0.00 0.51 -0.24 0.40 0.09 0.00 0.00 178.44 179.20 1k5g h ILE 169 N -0.26 0.67 -3.21 1.22 1.08 -0.43 -3.48 117.51 113.11 1k5g h ILE 169 Ca 0.01 -1.07 -0.13 0.00 -0.39 0.00 0.00 64.86 63.29 1k5g h ILE 169 Cb 0.46 1.69 0.06 0.00 -3.07 0.00 0.00 36.82 35.96 1k5g h ILE 169 CO 0.01 0.23 -0.27 0.61 -0.69 0.00 0.00 178.15 178.04 1k5g n GLY 170 N -0.08 0.21 2.44 5.37 0.00 0.13 -5.03 105.19 108.23 1k5g n GLY 170 Ca -0.01 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 1k5g n GLY 170 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k5g s ASP 171 N -3.41 1.03 0.22 1.61 2.15 -0.85 -5.00 116.67 112.43 1k5g s ASP 171 Ca 0.05 -2.89 0.17 0.00 0.43 0.00 0.00 52.55 50.31 1k5g s ASP 171 Cb -0.02 -0.13 0.76 0.00 -0.30 0.00 0.00 42.92 43.23 1k5g s ASP 171 CO 0.27 -0.16 0.78 -2.65 -0.17 0.00 0.00 175.17 173.24 1k5g n PRO 172 N 2.86 -0.02 -1.19 4.34 -0.02 -1.26 0.98 135.00 140.70 1k5g n PRO 172 Ca 0.28 0.62 -0.22 0.00 -2.02 0.00 0.00 63.50 62.17 1k5g n PRO 172 Cb 0.49 -1.24 0.16 0.00 -0.02 0.00 0.00 33.50 32.89 1k5g n PRO 172 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1k5g n ASN 173 N -3.61 4.18 -4.77 2.55 4.13 -1.26 -4.99 115.26 111.49 1k5g n ASN 173 Ca 0.20 -3.69 -0.38 0.00 1.68 0.00 0.00 54.58 52.39 1k5g n ASN 173 Cb 0.80 -0.80 -0.04 0.00 -1.54 0.00 0.00 39.78 38.20 1k5g n ASN 173 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1k5g s LEU 174 N -3.39 4.35 0.00 3.41 2.96 0.28 -5.03 118.68 121.25 1k5g s LEU 174 Ca 0.55 2.13 -0.12 0.00 -0.22 0.00 0.00 54.13 56.48 1k5g s LEU 174 Cb 0.47 -3.91 0.01 0.00 0.50 0.00 0.00 46.19 43.26 1k5g s LEU 174 CO 0.06 -0.30 0.24 -1.83 -1.32 0.00 0.00 176.35 173.20 1k5g s GLU 175 N -1.96 0.62 0.56 1.98 -1.05 -1.26 -4.93 118.70 112.65 1k5g s GLU 175 Ca 0.51 -0.33 -0.20 0.00 -0.15 0.00 0.00 54.97 54.80 1k5g s GLU 175 Cb -0.26 0.27 -0.05 0.00 -0.44 0.00 0.00 34.13 33.64 1k5g s GLU 175 CO 0.34 -0.17 1.20 -0.06 0.95 0.00 0.00 175.26 177.52 1k5g s PHE 176 N -1.55 2.51 -0.14 4.83 0.08 -1.26 -2.56 117.98 119.89 1k5g s PHE 176 Ca -0.13 1.51 -0.09 0.00 0.12 0.00 0.00 56.93 58.35 1k5g s PHE 176 Cb -0.05 -3.46 0.05 0.00 -0.57 0.00 0.00 43.02 38.99 1k5g s PHE 176 CO 0.02 -2.04 0.34 0.14 -0.10 0.00 0.00 175.22 173.57 1k5g s VAL 177 N -1.60 -0.02 0.00 -0.44 -7.23 0.14 -4.87 120.40 106.38 1k5g s VAL 177 Ca 0.74 0.09 0.00 0.00 -1.81 0.00 0.00 61.98 61.00 1k5g s VAL 177 Cb -0.30 -0.50 0.00 0.00 0.56 0.00 0.00 36.38 36.15 1k5g s VAL 177 CO 0.33 0.04 0.00 0.00 -0.31 0.00 0.00 175.10 175.16 1k5g n ALA 178 N 3.89 0.00 0.00 1.32 0.00 -1.26 -4.62 120.51 119.83 1k5g n ALA 178 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1k5g n ALA 178 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 1k5g n ALA 178 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1k5g n MET 179 N 6.48 0.00 -1.73 0.00 1.56 -1.26 -4.82 117.12 117.35 1k5g n MET 179 Ca 0.00 0.00 -0.61 0.00 -0.27 0.00 0.00 57.70 56.82 1k5g n MET 179 Cb 0.00 0.00 -0.08 0.00 2.15 0.00 0.00 33.22 35.29 1k5g n MET 179 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1k5g n PRO 180 N 0.00 0.77 -3.20 2.12 -0.02 -1.26 -4.86 135.00 128.54 1k5g n PRO 180 Ca 0.00 0.28 -0.46 0.00 -2.02 0.00 0.00 63.50 61.30 1k5g n PRO 180 Cb 0.00 -1.91 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 1k5g n PRO 180 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k5g s ALA 181 N 3.40 3.80 1.12 3.55 0.00 -1.26 -5.05 121.76 127.32 1k5g s ALA 181 Ca 1.01 -3.00 -0.13 0.00 0.00 0.00 0.00 51.96 49.84 1k5g s ALA 181 Cb -1.21 -3.63 0.26 0.00 0.00 0.00 0.00 23.12 18.53 1k5g s ALA 181 CO 0.71 -2.44 1.05 -0.51 0.00 0.00 0.00 175.76 174.57 1k5g s LEU 182 N 1.19 1.00 -0.18 0.00 1.02 -1.26 -4.94 118.68 115.51 1k5g s LEU 182 Ca 0.20 1.34 -0.29 0.00 0.02 0.00 0.00 54.13 55.40 1k5g s LEU 182 Cb -0.12 -3.32 -0.01 0.00 0.02 0.00 0.00 46.19 42.76 1k5g s LEU 182 CO -0.06 -3.88 1.20 0.00 0.02 0.00 0.00 176.35 173.62 1k5g s ALA 183 N -2.65 3.66 0.27 4.21 0.00 -1.26 -4.98 121.76 121.01 1k5g s ALA 183 Ca 0.67 0.38 -0.30 0.00 0.00 0.00 0.00 51.96 52.71 1k5g s ALA 183 Cb -0.23 -3.60 -0.12 0.00 0.00 0.00 0.00 23.12 19.18 1k5g s ALA 183 CO 0.62 -1.12 1.57 -2.30 0.00 0.00 0.00 175.76 174.53 1k5g n PRO 184 N 6.47 2.57 -0.78 0.00 -0.02 -1.26 -4.92 135.00 137.05 1k5g n PRO 184 Ca 0.13 0.91 -0.34 0.00 -2.02 0.00 0.00 63.50 62.19 1k5g n PRO 184 Cb 0.45 -2.68 0.13 0.00 -0.02 0.00 0.00 33.50 31.38 1k5g n PRO 184 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1k5g n PRO 185 N 2.29 -0.84 0.00 0.52 -0.02 -1.26 -4.89 135.00 130.81 1k5g n PRO 185 Ca 0.10 -0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1k5g n PRO 185 Cb 0.35 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 1k5g n PRO 185 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1k5g n GLU 186 N -0.93 0.00 -0.75 -0.52 -0.00 -1.26 -4.96 120.64 112.22 1k5g n GLU 186 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.18 1k5g n GLU 186 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 32.05 1k5g n GLU 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1k5g n VAL 187 N -0.05 -0.91 0.00 3.84 0.31 -1.26 -5.13 118.33 115.12 1k5g n VAL 187 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1k5g n VAL 187 Cb 0.00 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 30.98 1k5g n VAL 187 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1k5g n VAL 188 N -0.29 0.00 -0.20 2.52 0.31 -1.26 -5.13 118.33 114.27 1k5g n VAL 188 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 1k5g n VAL 188 Cb 0.04 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.97 1k5g n VAL 188 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1k5g n MET 189 N 0.00 -0.27 0.00 5.55 0.00 -1.26 -5.03 117.12 116.11 1k5g n MET 189 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 57.70 57.88 1k5g n MET 189 Cb 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 33.22 32.89 1k5g n MET 189 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1k5g n ASP 190 N -4.40 0.00 0.00 3.17 4.64 -1.26 -5.06 116.55 113.63 1k5g n ASP 190 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 1k5g n ASP 190 Cb 0.06 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.14 1k5g n ASP 190 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 1k5g n PRO 191 N 0.00 0.00 0.30 -0.67 -0.02 -1.26 -3.02 135.00 130.33 1k5g n PRO 191 Ca 0.00 0.00 0.19 0.00 -2.02 0.00 0.00 63.50 61.67 1k5g n PRO 191 Cb 0.00 0.00 0.95 0.00 -0.02 0.00 0.00 33.50 34.43 1k5g n PRO 191 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k5g h ALA 192 N -2.96 1.07 0.00 3.55 0.00 -2.05 -2.43 119.26 116.44 1k5g h ALA 192 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1k5g h ALA 192 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1k5g h ALA 192 CO 0.00 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.56 1k5g n LEU 193 N -3.22 1.21 0.00 0.00 4.32 -1.25 -4.74 117.00 113.32 1k5g n LEU 193 Ca -0.02 -0.61 0.00 0.00 -0.02 0.00 0.00 56.01 55.37 1k5g n LEU 193 Cb 0.18 -0.32 0.00 0.00 -1.62 0.00 0.00 43.42 41.66 1k5g n LEU 193 CO 0.25 0.23 0.00 0.00 -1.22 0.00 0.00 177.39 176.65 1k5g n ALA 194 N 0.41 0.00 0.00 -1.18 0.00 -0.91 -4.60 120.51 114.23 1k5g n ALA 194 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1k5g n ALA 194 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 1k5g n ALA 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k5g n ALA 195 N -3.00 0.00 1.19 0.00 0.00 -1.26 -4.54 120.51 112.90 1k5g n ALA 195 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1k5g n ALA 195 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.58 1k5g n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k5g n GLN 196 N 0.00 0.60 0.03 0.00 -0.00 -1.26 -2.34 117.38 114.40 1k5g n GLN 196 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.00 56.79 1k5g n GLN 196 Cb 0.00 -1.12 -0.14 0.00 -0.00 0.00 0.00 30.24 28.98 1k5g n GLN 196 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 1k5g h TYR 197 N 0.00 0.52 -0.16 2.61 0.05 -1.96 -3.28 116.97 114.75 1k5g h TYR 197 Ca 0.00 -0.38 0.05 0.00 0.05 0.00 0.00 58.73 58.45 1k5g h TYR 197 Cb 0.00 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 1k5g h TYR 197 CO 0.00 1.48 0.12 0.93 -1.05 0.00 0.00 178.16 179.64 1k5g h GLU 198 N -0.28 0.00 -0.64 4.88 5.08 -1.86 0.17 114.58 121.92 1k5g h GLU 198 Ca -0.25 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1k5g h GLU 198 Cb 1.76 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.98 1k5g h GLU 198 CO 0.11 0.00 0.37 1.25 -1.00 0.00 0.00 179.01 179.73 1k5g h HIS 199 N 0.00 0.86 0.09 4.33 2.76 -1.67 -2.35 115.15 119.17 1k5g h HIS 199 Ca 0.08 -0.01 -0.28 0.00 -2.20 0.00 0.00 60.37 57.95 1k5g h HIS 199 Cb 0.31 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 1k5g h HIS 199 CO 0.00 0.60 -1.39 -0.44 -1.30 0.00 0.00 177.93 175.40 1k5g h ASP 200 N 0.87 0.29 -0.38 3.26 5.19 -1.23 -2.98 116.42 121.45 1k5g h ASP 200 Ca 0.23 -0.38 0.11 0.00 -0.62 0.00 0.00 57.03 56.37 1k5g h ASP 200 Cb 0.01 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.41 1k5g h ASP 200 CO -0.04 1.31 0.29 0.25 -3.12 0.00 0.00 179.24 177.93 1k5g h LEU 201 N 0.05 0.00 0.12 1.55 5.85 -0.60 0.35 115.31 122.63 1k5g h LEU 201 Ca -0.18 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.23 1k5g h LEU 201 Cb 1.96 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.98 1k5g h LEU 201 CO 0.16 0.00 -1.59 -0.33 -0.34 0.00 0.00 178.44 176.34 1k5g h GLU 202 N 0.00 0.25 0.00 1.25 5.08 -1.46 -2.36 114.58 117.34 1k5g h GLU 202 Ca 0.18 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1k5g h GLU 202 Cb 0.76 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1k5g h GLU 202 CO -0.00 1.11 0.00 0.28 -1.00 0.00 0.00 179.01 179.40 1k5g n VAL 203 N -3.45 1.26 -0.06 3.13 0.31 -0.01 -2.35 118.33 117.17 1k5g n VAL 203 Ca -0.18 0.54 -0.05 0.00 -0.01 0.00 0.00 64.34 64.64 1k5g n VAL 203 Cb 1.05 -1.51 -0.02 0.00 -0.91 0.00 0.00 33.84 32.45 1k5g n VAL 203 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k5g n ALA 204 N -1.68 0.48 0.02 3.52 0.00 -0.49 -3.58 120.51 118.78 1k5g n ALA 204 Ca 0.00 -0.49 0.01 0.00 0.00 0.00 0.00 53.44 52.96 1k5g n ALA 204 Cb 0.07 0.02 0.03 0.00 0.00 0.00 0.00 19.45 19.57 1k5g n ALA 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k5g n GLN 205 N -4.00 0.01 -0.09 0.00 10.64 -0.89 -0.89 117.38 122.16 1k5g n GLN 205 Ca -0.08 0.31 -0.13 0.00 -1.83 0.00 0.00 57.00 55.27 1k5g n GLN 205 Cb 0.28 -1.75 -0.06 0.00 -0.86 0.00 0.00 30.24 27.85 1k5g n GLN 205 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1k5g n THR 206 N -1.36 1.48 -1.61 -0.39 -2.24 -0.99 -4.86 114.28 104.31 1k5g n THR 206 Ca -0.00 0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.42 1k5g n THR 206 Cb 0.23 -2.22 -0.03 0.00 -2.10 0.00 0.00 70.33 66.21 1k5g n THR 206 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1k5g n THR 207 N -4.51 0.40 -1.69 4.28 -1.04 -0.07 -4.92 114.28 106.74 1k5g n THR 207 Ca -0.21 -0.42 -0.39 0.00 -2.04 0.00 0.00 64.05 60.99 1k5g n THR 207 Cb 0.49 -2.54 0.04 0.00 -1.82 0.00 0.00 70.33 66.50 1k5g n THR 207 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1k5g n ALA 208 N 11.19 1.01 -2.15 2.41 0.00 -1.26 -4.93 120.51 126.78 1k5g n ALA 208 Ca 0.29 0.10 -0.41 0.00 0.00 0.00 0.00 53.44 53.42 1k5g n ALA 208 Cb 0.44 -2.26 -0.05 0.00 0.00 0.00 0.00 19.45 17.59 1k5g n ALA 208 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1k5g s LEU 209 N -2.79 4.53 -1.05 0.00 2.01 -1.26 -4.95 118.68 115.17 1k5g s LEU 209 Ca 0.73 1.77 -0.25 0.00 0.01 0.00 0.00 54.13 56.38 1k5g s LEU 209 Cb -0.43 -3.52 -0.16 0.00 0.01 0.00 0.00 46.19 42.08 1k5g s LEU 209 CO 0.49 0.01 2.10 -2.84 1.01 0.00 0.00 176.35 177.12 1k5g s PRO 210 N -0.35 1.70 -0.26 1.29 0.02 -1.26 -4.90 135.00 131.24 1k5g s PRO 210 Ca 0.44 -0.48 -0.29 0.00 0.02 0.00 0.00 61.00 60.69 1k5g s PRO 210 Cb -0.23 -5.03 -0.02 0.00 0.02 0.00 0.00 34.50 29.23 1k5g s PRO 210 CO 0.29 -4.78 1.66 0.16 -0.33 0.00 0.00 177.00 174.00 1k5g s ASP 211 N 8.29 6.24 -0.00 2.53 -4.77 -1.26 -4.80 116.67 122.89 1k5g s ASP 211 Ca 0.79 1.48 0.02 0.00 -3.30 0.00 0.00 52.55 51.54 1k5g s ASP 211 Cb -0.05 -2.53 -0.03 0.00 -1.09 0.00 0.00 42.92 39.22 1k5g s ASP 211 CO 0.14 -1.40 0.07 -0.62 0.70 0.00 0.00 175.17 174.06 1k5g n GLU 212 N 7.91 3.73 0.00 2.11 1.02 -1.26 -5.32 120.64 128.83 1k5g n GLU 212 Ca 0.20 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1k5g n GLU 212 Cb 0.46 -0.79 0.00 0.00 -0.02 0.00 0.00 31.44 31.09 1k5g n GLU 212 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06