#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k5d s VAL 9 N 0.00 3.98 -0.00 1.69 1.01 -1.26 -4.97 120.40 120.85 1k5d s VAL 9 Ca 0.00 1.37 0.02 0.00 0.00 0.00 0.00 61.98 63.36 1k5d s VAL 9 Cb 0.00 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 1k5d s VAL 9 CO 0.00 -0.14 -0.06 -1.10 0.00 0.00 0.00 175.10 173.80 1k5d s GLN 10 N -2.85 0.48 -0.07 2.72 -0.21 -1.26 -1.69 119.66 116.78 1k5d s GLN 10 Ca 0.61 -0.24 0.01 0.00 0.02 0.00 0.00 55.36 55.76 1k5d s GLN 10 Cb -0.16 -0.45 0.02 0.00 1.00 0.00 0.00 33.01 33.41 1k5d s GLN 10 CO 0.21 0.12 -0.06 -0.06 -2.12 0.00 0.00 175.29 173.38 1k5d s PHE 11 N -0.20 1.02 -0.36 0.91 0.08 -0.17 -4.98 117.98 114.28 1k5d s PHE 11 Ca 0.02 -0.37 -0.26 0.00 0.12 0.00 0.00 56.93 56.44 1k5d s PHE 11 Cb -0.03 -0.89 0.01 0.00 -0.57 0.00 0.00 43.02 41.55 1k5d s PHE 11 CO -0.00 -0.30 0.93 0.21 -0.10 0.00 0.00 175.22 175.96 1k5d s LYS 12 N 1.22 3.86 -0.13 0.44 2.20 -1.26 -1.05 119.74 125.01 1k5d s LYS 12 Ca -0.06 0.61 -0.00 0.00 -0.36 0.00 0.00 55.97 56.16 1k5d s LYS 12 Cb -0.14 -3.80 -0.02 0.00 -1.51 0.00 0.00 37.83 32.37 1k5d s LYS 12 CO -0.02 -0.94 -0.13 -1.17 -0.36 0.00 0.00 175.35 172.74 1k5d s LEU 13 N 3.47 2.73 -0.22 5.43 2.96 -0.97 -0.92 118.68 131.17 1k5d s LEU 13 Ca 0.38 -0.32 -0.14 0.00 -0.22 0.00 0.00 54.13 53.83 1k5d s LEU 13 Cb -0.12 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 1k5d s LEU 13 CO 0.18 0.17 0.33 -0.69 -1.32 0.00 0.00 176.35 175.03 1k5d s VAL 14 N 0.32 5.24 -0.27 1.68 1.01 -0.97 -0.42 120.40 126.99 1k5d s VAL 14 Ca -0.10 0.55 -0.09 0.00 0.00 0.00 0.00 61.98 62.34 1k5d s VAL 14 Cb -0.16 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1k5d s VAL 14 CO 0.06 0.26 0.13 -0.22 0.00 0.00 0.00 175.10 175.32 1k5d s LEU 15 N 1.36 3.73 0.12 3.92 2.96 -0.48 -1.02 118.68 129.26 1k5d s LEU 15 Ca 0.15 -0.14 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1k5d s LEU 15 Cb -0.15 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 1k5d s LEU 15 CO 0.07 -0.05 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.27 1k5d s VAL 16 N 1.68 0.95 0.00 1.68 1.01 -0.11 -2.24 120.40 123.37 1k5d s VAL 16 Ca 0.07 -1.92 0.00 0.00 0.00 0.00 0.00 61.98 60.13 1k5d s VAL 16 Cb -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1k5d s VAL 16 CO 0.07 -0.74 0.00 0.61 0.00 0.00 0.00 175.10 175.03 1k5d n GLY 17 N 0.04 2.70 3.72 4.51 0.00 -1.26 -0.33 105.19 114.57 1k5d n GLY 17 Ca -0.12 -1.44 -0.31 0.00 0.00 0.00 0.00 46.02 44.15 1k5d n GLY 17 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k5d s ASP 18 N 0.00 3.75 0.34 1.61 1.11 -1.25 -4.12 116.67 118.11 1k5d s ASP 18 Ca 0.00 2.05 -0.29 0.00 0.18 0.00 0.00 52.55 54.49 1k5d s ASP 18 Cb 0.00 -2.55 -0.10 0.00 1.07 0.00 0.00 42.92 41.34 1k5d s ASP 18 CO 0.00 -2.55 1.34 -0.83 1.18 0.00 0.00 175.17 174.31 1k5d s GLY 19 N -2.90 2.99 0.00 0.21 0.00 -1.25 -2.97 107.32 103.40 1k5d s GLY 19 Ca 0.65 1.31 0.00 0.00 0.00 0.00 0.00 44.72 46.68 1k5d s GLY 19 CO 0.55 1.97 0.00 0.61 0.00 0.00 0.00 173.10 176.23 1k5d n GLY 20 N 0.74 0.56 0.16 0.20 0.00 -1.26 -4.93 105.19 100.66 1k5d n GLY 20 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1k5d n GLY 20 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1k5d h THR 21 N 0.00 0.48 0.00 2.61 1.35 -1.91 -3.48 112.91 111.96 1k5d h THR 21 Ca 0.00 -1.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.15 1k5d h THR 21 Cb 0.00 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 1k5d h THR 21 CO 0.00 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 176.15 1k5d n GLY 22 N 1.20 1.41 0.26 5.82 0.00 -1.26 -4.68 105.19 107.94 1k5d n GLY 22 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1k5d n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k5d h LYS 23 N 0.29 -0.25 -0.38 1.61 1.57 -1.92 -0.53 116.57 116.97 1k5d h LYS 23 Ca 0.00 0.02 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1k5d h LYS 23 Cb 0.00 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1k5d h LYS 23 CO 0.00 -0.16 -0.31 1.15 -0.57 0.00 0.00 179.45 179.55 1k5d h THR 24 N -0.26 1.28 -0.23 -0.16 2.02 -1.96 -2.53 112.91 111.07 1k5d h THR 24 Ca 0.12 -1.48 -0.02 0.00 0.77 0.00 0.00 66.41 65.80 1k5d h THR 24 Cb 0.43 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 1k5d h THR 24 CO -0.33 0.49 0.06 0.74 0.37 0.00 0.00 175.52 176.86 1k5d h THR 25 N 0.69 1.11 0.08 3.16 2.02 -1.88 -0.02 112.91 118.07 1k5d h THR 25 Ca 0.07 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 1k5d h THR 25 Cb 0.90 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1k5d h THR 25 CO 0.08 0.14 -0.04 0.15 0.37 0.00 0.00 175.52 176.22 1k5d h PHE 26 N 0.32 -0.10 -0.80 3.16 3.57 -0.86 -2.64 116.94 119.59 1k5d h PHE 26 Ca 0.08 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1k5d h PHE 26 Cb 0.12 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 1k5d h PHE 26 CO 0.00 0.28 0.45 0.28 -2.23 0.00 0.00 178.31 177.09 1k5d h VAL 27 N -0.49 1.23 -0.52 1.41 2.07 -1.06 -2.95 116.25 115.95 1k5d h VAL 27 Ca -0.01 -0.57 0.06 0.00 0.82 0.00 0.00 66.70 67.01 1k5d h VAL 27 Cb 0.42 0.16 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 1k5d h VAL 27 CO 0.02 0.26 0.22 0.50 0.02 0.00 0.00 177.57 178.58 1k5d h LYS 28 N 1.10 0.40 -0.97 1.57 1.63 -0.97 -1.94 116.57 117.39 1k5d h LYS 28 Ca 0.28 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 60.06 1k5d h LYS 28 Cb 0.01 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 31.51 1k5d h LYS 28 CO -0.05 0.27 0.63 -0.09 -3.45 0.00 0.00 179.45 176.76 1k5d h ARG 29 N 0.42 1.29 0.00 1.90 2.43 -1.30 -1.70 114.38 117.41 1k5d h ARG 29 Ca 0.24 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 1k5d h ARG 29 Cb 0.22 -0.29 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1k5d h ARG 29 CO -0.22 0.86 -0.43 0.45 -1.51 0.00 0.00 179.97 179.12 1k5d h HIS 30 N 1.32 0.00 -0.43 2.20 3.86 -1.23 0.34 115.15 121.21 1k5d h HIS 30 Ca 0.35 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 1k5d h HIS 30 Cb -0.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.33 1k5d h HIS 30 CO 0.00 0.43 0.00 1.47 0.86 0.00 0.00 177.93 180.69 1k5d n LEU 31 N -3.73 3.53 0.00 2.43 -0.00 -0.88 -4.74 117.00 113.61 1k5d n LEU 31 Ca -0.01 -2.26 0.00 0.00 -0.00 0.00 0.00 56.01 53.74 1k5d n LEU 31 Cb 0.50 -0.38 0.00 0.00 -0.00 0.00 0.00 43.42 43.55 1k5d n LEU 31 CO 0.38 0.77 0.00 0.41 -0.00 0.00 0.00 177.39 178.95 1k5d n THR 32 N 0.57 0.00 0.00 1.47 -1.04 -0.67 -5.02 114.28 109.58 1k5d n THR 32 Ca 0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 1k5d n THR 32 Cb 0.61 -0.10 0.00 0.00 -1.82 0.00 0.00 70.33 69.02 1k5d n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1k5d n GLY 33 N 0.16 1.51 3.85 3.41 0.00 0.10 -5.03 105.19 109.19 1k5d n GLY 33 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1k5d n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1k5d s GLU 34 N -0.74 2.29 -0.37 1.61 -1.05 -1.26 -4.91 118.70 114.27 1k5d s GLU 34 Ca 0.00 0.46 0.02 0.00 -0.15 0.00 0.00 54.97 55.30 1k5d s GLU 34 Cb 0.00 -1.96 0.11 0.00 -0.44 0.00 0.00 34.13 31.84 1k5d s GLU 34 CO 0.00 -1.44 0.13 0.12 0.95 0.00 0.00 175.26 175.02 1k5d s PHE 35 N -3.31 2.69 -0.08 4.83 5.36 -1.26 -3.64 117.98 122.57 1k5d s PHE 35 Ca 0.60 -2.50 -0.30 0.00 -0.96 0.00 0.00 56.93 53.77 1k5d s PHE 35 Cb -0.13 -2.33 -0.04 0.00 -0.34 0.00 0.00 43.02 40.19 1k5d s PHE 35 CO 0.52 -0.87 1.53 -2.00 -1.46 0.00 0.00 175.22 172.95 1k5d s GLU 36 N 0.89 4.20 0.00 10.12 2.56 -1.26 -4.91 118.70 130.30 1k5d s GLU 36 Ca 0.13 2.03 0.24 0.00 0.00 0.00 0.00 54.97 57.37 1k5d s GLU 36 Cb -0.20 -3.90 0.24 0.00 2.00 0.00 0.00 34.13 32.26 1k5d s GLU 36 CO -0.11 -0.79 1.28 0.36 -0.56 0.00 0.00 175.26 175.43 1k5d n LYS 37 N 6.88 2.13 -3.71 4.30 2.85 -1.26 -4.90 118.16 124.46 1k5d n LYS 37 Ca 0.16 -1.74 -0.36 0.00 -1.05 0.00 0.00 58.31 55.33 1k5d n LYS 37 Cb 0.43 -1.46 -0.09 0.00 -0.65 0.00 0.00 35.03 33.26 1k5d n LYS 37 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1k5d s LYS 38 N -2.06 4.12 -0.34 -1.58 -0.14 -1.26 -5.05 119.74 113.42 1k5d s LYS 38 Ca 0.28 -0.25 -0.27 0.00 -1.36 0.00 0.00 55.97 54.36 1k5d s LYS 38 Cb 0.20 -3.47 0.01 0.00 -1.68 0.00 0.00 37.83 32.89 1k5d s LYS 38 CO 0.34 0.18 0.97 -0.47 -0.76 0.00 0.00 175.35 175.61 1k5d s TYR 39 N 0.72 3.12 -0.37 3.18 5.04 -1.26 -4.97 117.35 122.80 1k5d s TYR 39 Ca 0.08 0.96 0.01 0.00 -2.44 0.00 0.00 57.07 55.68 1k5d s TYR 39 Cb -0.12 -3.62 0.12 0.00 0.35 0.00 0.00 41.96 38.68 1k5d s TYR 39 CO 0.01 -0.77 0.15 0.08 -1.34 0.00 0.00 175.55 173.68 1k5d s VAL 40 N 3.50 1.30 0.37 3.14 1.01 -1.26 -5.11 120.40 123.34 1k5d s VAL 40 Ca 0.41 -2.04 -0.23 0.00 0.00 0.00 0.00 61.98 60.12 1k5d s VAL 40 Cb -0.12 -1.94 -0.15 0.00 0.00 0.00 0.00 36.38 34.17 1k5d s VAL 40 CO 0.17 -0.76 0.37 0.00 0.00 0.00 0.00 175.10 174.87 1k5d n ALA 41 N 4.19 -2.32 -2.71 5.51 0.00 -1.26 -4.96 120.51 118.96 1k5d n ALA 41 Ca 0.03 0.20 -0.37 0.00 0.00 0.00 0.00 53.44 53.31 1k5d n ALA 41 Cb 0.39 -1.63 -0.07 0.00 0.00 0.00 0.00 19.45 18.14 1k5d n ALA 41 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1k5d s THR 42 N -1.45 5.27 -0.30 0.00 2.01 -1.26 -5.07 115.64 114.84 1k5d s THR 42 Ca 0.62 0.61 -0.11 0.00 0.31 0.00 0.00 61.69 63.11 1k5d s THR 42 Cb -0.68 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.15 1k5d s THR 42 CO 0.60 0.41 0.19 -0.76 -0.69 0.00 0.00 174.62 174.37 1k5d s LEU 43 N 0.25 4.13 0.00 4.42 1.02 -1.26 -4.50 118.68 122.74 1k5d s LEU 43 Ca 0.18 -0.25 0.00 0.00 0.02 0.00 0.00 54.13 54.08 1k5d s LEU 43 Cb -0.14 -2.08 0.00 0.00 0.02 0.00 0.00 46.19 43.99 1k5d s LEU 43 CO 0.06 -0.13 0.00 0.61 0.02 0.00 0.00 176.35 176.90 1k5d n GLY 44 N 5.05 1.66 3.36 -3.19 0.00 -1.26 -4.75 105.19 106.06 1k5d n GLY 44 Ca -0.14 -0.11 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 1k5d n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k5d s VAL 45 N 0.00 0.02 -0.14 1.61 0.11 -1.26 -1.56 120.40 119.18 1k5d s VAL 45 Ca 0.00 -0.17 -0.01 0.00 -2.93 0.00 0.00 61.98 58.87 1k5d s VAL 45 Cb 0.00 -0.72 0.03 0.00 -1.53 0.00 0.00 36.38 34.16 1k5d s VAL 45 CO 0.00 -0.10 -0.06 -1.61 -3.33 0.00 0.00 175.10 170.00 1k5d s GLU 46 N -0.64 1.46 -0.18 1.54 2.02 -0.41 -4.99 118.70 117.50 1k5d s GLU 46 Ca -0.07 -0.39 -0.25 0.00 0.02 0.00 0.00 54.97 54.27 1k5d s GLU 46 Cb -0.03 -1.81 -0.01 0.00 0.10 0.00 0.00 34.13 32.37 1k5d s GLU 46 CO 0.04 -0.36 0.82 0.08 0.02 0.00 0.00 175.26 175.86 1k5d s VAL 47 N 1.67 4.88 -0.12 2.63 1.01 -1.26 -2.06 120.40 127.15 1k5d s VAL 47 Ca 0.03 1.60 0.01 0.00 0.00 0.00 0.00 61.98 63.62 1k5d s VAL 47 Cb -0.14 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.13 1k5d s VAL 47 CO -0.08 0.02 -0.13 -1.00 0.00 0.00 0.00 175.10 173.91 1k5d s HIS 48 N 2.23 1.90 -0.00 5.22 3.76 0.11 -4.97 115.29 123.54 1k5d s HIS 48 Ca 0.37 -0.96 -0.25 0.00 -0.15 0.00 0.00 55.06 54.07 1k5d s HIS 48 Cb -0.16 -1.42 -0.04 0.00 1.11 0.00 0.00 32.58 32.06 1k5d s HIS 48 CO 0.11 -0.54 0.77 -1.25 -0.85 0.00 0.00 174.74 172.99 1k5d s PRO 49 N 1.29 4.48 -0.08 8.40 0.04 -1.26 -1.06 135.00 146.82 1k5d s PRO 49 Ca -0.01 1.05 0.01 0.00 0.04 0.00 0.00 61.00 62.09 1k5d s PRO 49 Cb -0.14 -3.41 0.02 0.00 0.04 0.00 0.00 34.50 31.01 1k5d s PRO 49 CO -0.06 0.16 -0.09 -0.51 0.04 0.00 0.00 177.00 176.54 1k5d s LEU 50 N 0.41 1.37 0.14 -3.56 1.43 -0.29 -4.98 118.68 113.21 1k5d s LEU 50 Ca 0.40 -0.26 0.08 0.00 -1.03 0.00 0.00 54.13 53.32 1k5d s LEU 50 Cb -0.20 -0.74 -0.04 0.00 0.03 0.00 0.00 46.19 45.24 1k5d s LEU 50 CO 0.22 -0.05 -0.09 0.68 0.23 0.00 0.00 176.35 177.34 1k5d s VAL 51 N 1.13 3.33 0.02 -1.59 -7.23 -1.26 0.03 120.40 114.82 1k5d s VAL 51 Ca -0.06 -1.44 0.01 0.00 -1.81 0.00 0.00 61.98 58.68 1k5d s VAL 51 Cb -0.14 -2.60 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 1k5d s VAL 51 CO -0.01 0.00 -0.05 -0.36 -0.31 0.00 0.00 175.10 174.37 1k5d s PHE 52 N -1.45 0.43 -0.20 2.82 0.08 -0.38 -4.99 117.98 114.30 1k5d s PHE 52 Ca 0.23 -0.31 -0.09 0.00 0.12 0.00 0.00 56.93 56.89 1k5d s PHE 52 Cb -0.10 -0.27 -0.04 0.00 -0.57 0.00 0.00 43.02 42.04 1k5d s PHE 52 CO 0.15 -0.07 0.10 -1.01 -0.10 0.00 0.00 175.22 174.28 1k5d s HIS 53 N -0.81 3.30 0.38 0.36 3.76 -1.26 -1.05 115.29 119.96 1k5d s HIS 53 Ca -0.06 0.14 0.06 0.00 -0.15 0.00 0.00 55.06 55.05 1k5d s HIS 53 Cb -0.06 -2.14 -0.07 0.00 1.11 0.00 0.00 32.58 31.42 1k5d s HIS 53 CO -0.00 0.15 0.03 0.95 -0.85 0.00 0.00 174.74 175.02 1k5d s THR 54 N 0.53 1.65 -1.19 1.30 -4.23 -0.49 -0.39 115.64 112.83 1k5d s THR 54 Ca 0.05 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.62 1k5d s THR 54 Cb -0.12 -2.91 0.07 0.00 1.34 0.00 0.00 72.50 70.88 1k5d s THR 54 CO 0.00 0.00 1.11 -0.46 -0.54 0.00 0.00 174.62 174.73 1k5d n ASN 55 N -0.86 0.00 -0.40 3.99 6.94 -1.13 -0.85 115.26 122.96 1k5d n ASN 55 Ca -0.04 0.37 0.09 0.00 -0.02 0.00 0.00 54.58 54.98 1k5d n ASN 55 Cb 0.67 -0.40 0.19 0.00 -2.36 0.00 0.00 39.78 37.87 1k5d n ASN 55 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1k5d n ARG 56 N -1.40 1.99 0.00 -3.83 1.74 -1.26 -5.09 116.66 108.80 1k5d n ARG 56 Ca 0.02 -2.66 0.00 0.00 -0.77 0.00 0.00 57.85 54.44 1k5d n ARG 56 Cb 0.06 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 1k5d n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k5d n GLY 57 N -1.03 1.12 3.75 -0.13 0.00 -0.03 -5.01 105.19 103.87 1k5d n GLY 57 Ca 0.18 -2.12 -0.40 0.00 0.00 0.00 0.00 46.02 43.67 1k5d n GLY 57 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1k5d s PRO 58 N -1.47 4.68 0.06 1.61 0.04 -1.26 -1.39 135.00 137.26 1k5d s PRO 58 Ca 0.00 1.32 0.06 0.00 0.04 0.00 0.00 61.00 62.43 1k5d s PRO 58 Cb 0.00 -3.32 -0.03 0.00 0.04 0.00 0.00 34.50 31.20 1k5d s PRO 58 CO 0.00 0.41 -0.17 0.96 0.04 0.00 0.00 177.00 178.24 1k5d s ILE 59 N -0.66 1.40 -0.11 0.56 -4.36 -0.21 -4.12 121.20 113.68 1k5d s ILE 59 Ca 0.41 -1.20 0.02 0.00 -0.26 0.00 0.00 60.65 59.62 1k5d s ILE 59 Cb -0.24 -1.26 -0.00 0.00 1.25 0.00 0.00 42.46 42.21 1k5d s ILE 59 CO 0.28 0.03 -0.20 -0.75 0.24 0.00 0.00 174.94 174.54 1k5d s LYS 60 N -1.37 3.17 -0.29 0.37 2.20 -0.68 -1.24 119.74 121.89 1k5d s LYS 60 Ca 0.04 -0.81 -0.10 0.00 -0.36 0.00 0.00 55.97 54.74 1k5d s LYS 60 Cb -0.09 -2.43 -0.03 0.00 -1.51 0.00 0.00 37.83 33.78 1k5d s LYS 60 CO 0.02 0.18 0.15 -0.06 -0.36 0.00 0.00 175.35 175.28 1k5d s PHE 61 N 0.38 3.17 -0.78 4.03 0.40 0.10 -1.00 117.98 124.28 1k5d s PHE 61 Ca -0.15 -0.30 -0.20 0.00 -0.60 0.00 0.00 56.93 55.68 1k5d s PHE 61 Cb -0.17 -2.34 0.11 0.00 0.51 0.00 0.00 43.02 41.13 1k5d s PHE 61 CO 0.07 -0.33 0.98 -0.80 0.70 0.00 0.00 175.22 175.84 1k5d s ASN 62 N 1.67 6.42 0.00 1.36 0.01 -0.21 -1.13 114.94 123.06 1k5d s ASN 62 Ca 0.06 -1.68 -0.30 0.00 -0.71 0.00 0.00 52.86 50.23 1k5d s ASN 62 Cb -0.16 -2.37 -0.04 0.00 0.41 0.00 0.00 41.25 39.08 1k5d s ASN 62 CO 0.07 -1.15 1.13 -0.69 -1.51 0.00 0.00 177.10 174.96 1k5d s VAL 63 N 2.91 4.35 -0.74 1.60 1.01 -0.22 -2.28 120.40 127.02 1k5d s VAL 63 Ca 0.25 1.68 -0.11 0.00 0.00 0.00 0.00 61.98 63.79 1k5d s VAL 63 Cb -0.12 -4.08 0.19 0.00 0.00 0.00 0.00 36.38 32.38 1k5d s VAL 63 CO -0.01 0.09 0.64 0.26 0.00 0.00 0.00 175.10 176.08 1k5d s TRP 64 N 1.42 3.62 -0.32 5.22 0.52 0.44 -0.72 118.94 129.13 1k5d s TRP 64 Ca 0.56 -2.15 -0.29 0.00 0.02 0.00 0.00 56.10 54.24 1k5d s TRP 64 Cb -0.25 -3.63 -0.00 0.00 -1.15 0.00 0.00 33.47 28.43 1k5d s TRP 64 CO 0.26 -0.95 1.38 0.34 0.02 0.00 0.00 176.95 178.00 1k5d s ASP 65 N 1.85 6.54 0.38 2.95 -1.08 -0.88 -1.38 116.67 125.05 1k5d s ASP 65 Ca 0.16 1.17 0.07 0.00 -0.52 0.00 0.00 52.55 53.43 1k5d s ASP 65 Cb -0.15 -2.54 -0.00 0.00 -1.46 0.00 0.00 42.92 38.77 1k5d s ASP 65 CO -0.06 -1.20 0.48 0.42 0.52 0.00 0.00 175.17 175.33 1k5d s THR 66 N 4.79 3.34 0.00 1.71 -4.23 -0.95 -1.29 115.64 119.01 1k5d s THR 66 Ca 0.60 -1.09 -0.21 0.00 -1.18 0.00 0.00 61.69 59.81 1k5d s THR 66 Cb -0.17 -3.15 -0.05 0.00 1.34 0.00 0.00 72.50 70.47 1k5d s THR 66 CO 0.26 -0.07 0.62 0.00 -0.54 0.00 0.00 174.62 174.90 1k5d s ALA 67 N -2.31 3.46 -2.17 3.99 0.00 -0.60 -4.89 121.76 119.23 1k5d s ALA 67 Ca 0.49 0.07 0.20 0.00 0.00 0.00 0.00 51.96 52.72 1k5d s ALA 67 Cb -0.08 -2.79 0.87 0.00 0.00 0.00 0.00 23.12 21.12 1k5d s ALA 67 CO 0.31 0.14 1.60 0.41 0.00 0.00 0.00 175.76 178.22 1k5d n GLY 68 N 2.46 -0.18 0.07 0.00 0.00 -1.26 -3.78 105.19 102.50 1k5d n GLY 68 Ca -0.06 -0.31 0.06 0.00 0.00 0.00 0.00 46.02 45.71 1k5d n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1k5d n GLN 69 N -0.08 0.64 -2.06 1.61 3.00 -1.26 -3.83 117.38 115.40 1k5d n GLN 69 Ca 0.15 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.00 56.72 1k5d n GLN 69 Cb 0.23 -1.65 -0.03 0.00 0.00 0.00 0.00 30.24 28.79 1k5d n GLN 69 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1k5d s GLU 70 N -3.21 4.26 0.64 -1.09 2.02 -1.25 -4.98 118.70 115.10 1k5d s GLU 70 Ca -0.05 2.20 -0.17 0.00 0.02 0.00 0.00 54.97 56.96 1k5d s GLU 70 Cb 0.11 -3.27 -0.01 0.00 0.10 0.00 0.00 34.13 31.05 1k5d s GLU 70 CO 0.85 -0.54 1.22 0.15 0.02 0.00 0.00 175.26 176.95 1k5d s LYS 71 N 1.37 2.66 0.42 1.61 1.02 -1.26 -4.95 119.74 120.62 1k5d s LYS 71 Ca 0.68 1.83 -0.26 0.00 0.02 0.00 0.00 55.97 58.24 1k5d s LYS 71 Cb -0.39 -1.89 -0.08 0.00 -0.52 0.00 0.00 37.83 34.94 1k5d s LYS 71 CO 0.31 -1.45 1.33 -0.06 -0.92 0.00 0.00 175.35 174.55 1k5d s PHE 72 N -1.71 2.72 0.00 3.18 0.40 -1.26 -4.83 117.98 116.49 1k5d s PHE 72 Ca 0.77 1.38 0.00 0.00 -0.60 0.00 0.00 56.93 58.48 1k5d s PHE 72 Cb -0.31 -3.72 0.00 0.00 0.51 0.00 0.00 43.02 39.51 1k5d s PHE 72 CO 0.38 -2.28 0.00 0.41 0.70 0.00 0.00 175.22 174.43 1k5d n GLY 73 N 0.64 -0.21 0.23 4.36 0.00 -1.26 -4.95 105.19 104.00 1k5d n GLY 73 Ca 0.04 -1.22 0.16 0.00 0.00 0.00 0.00 46.02 45.00 1k5d n GLY 73 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1k5d h GLY 74 N 0.00 0.00 2.00 -0.02 0.00 -2.00 -2.44 103.07 100.61 1k5d h GLY 74 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1k5d h GLY 74 CO 0.00 0.00 -0.16 1.41 0.00 0.00 0.00 176.54 177.79 1k5d h LEU 75 N 0.00 0.00 -4.16 3.11 3.38 -1.92 -2.86 115.31 112.86 1k5d h LEU 75 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 1k5d h LEU 75 Cb 0.42 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 40.83 1k5d h LEU 75 CO 0.00 0.16 0.27 -2.11 0.09 0.00 0.00 178.44 176.85 1k5d n ARG 76 N -3.63 3.03 0.06 1.13 1.85 -0.92 -4.57 116.66 113.61 1k5d n ARG 76 Ca -0.01 -3.70 -0.10 0.00 -1.00 0.00 0.00 57.85 53.03 1k5d n ARG 76 Cb 0.28 -2.28 -0.13 0.00 -1.05 0.00 0.00 32.46 29.29 1k5d n ARG 76 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1k5d h ASP 77 N 2.28 0.12 -0.76 2.89 3.45 -1.67 -3.32 116.42 119.42 1k5d h ASP 77 Ca 0.50 -0.15 0.13 0.00 0.43 0.00 0.00 57.03 57.95 1k5d h ASP 77 Cb 0.89 -0.04 -0.05 0.00 -0.56 0.00 0.00 39.33 39.56 1k5d h ASP 77 CO 1.26 1.12 0.50 1.23 -1.57 0.00 0.00 179.24 181.78 1k5d h GLY 78 N 2.66 0.86 1.05 2.75 0.00 -1.85 0.24 103.07 108.77 1k5d h GLY 78 Ca -0.10 -0.23 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 1k5d h GLY 78 CO 0.14 0.10 -0.09 -0.97 0.00 0.00 0.00 176.54 175.73 1k5d h TYR 79 N 0.54 1.04 0.08 5.60 0.05 -1.93 -3.30 116.97 119.06 1k5d h TYR 79 Ca 0.37 -0.21 -0.22 0.00 0.05 0.00 0.00 58.73 58.72 1k5d h TYR 79 Cb 0.68 -0.26 0.02 0.00 1.01 0.00 0.00 36.73 38.18 1k5d h TYR 79 CO -0.00 0.99 -0.89 1.88 -1.05 0.00 0.00 178.16 179.09 1k5d h TYR 80 N 0.79 0.74 -1.05 4.88 0.99 -1.31 -3.44 116.97 118.58 1k5d h TYR 80 Ca 0.13 -0.46 -0.77 0.00 2.00 0.00 0.00 58.73 59.63 1k5d h TYR 80 Cb 0.63 -0.06 0.06 0.00 1.00 0.00 0.00 36.73 38.36 1k5d h TYR 80 CO 0.05 1.31 0.02 1.51 -0.00 0.00 0.00 178.16 181.05 1k5d n ILE 81 N -4.04 0.23 -1.76 -2.88 0.00 0.69 -0.76 119.36 110.84 1k5d n ILE 81 Ca -0.13 -0.06 -0.18 0.00 0.00 0.00 0.00 62.75 62.39 1k5d n ILE 81 Cb 0.83 -0.05 -0.06 0.00 0.00 0.00 0.00 39.64 40.36 1k5d n ILE 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1k5d n GLN 82 N 1.50 -1.52 -1.26 9.51 6.02 -1.26 -4.98 117.38 125.38 1k5d n GLN 82 Ca 0.20 1.02 -0.30 0.00 -0.01 0.00 0.00 57.00 57.90 1k5d n GLN 82 Cb 0.11 -5.43 0.13 0.00 1.02 0.00 0.00 30.24 26.06 1k5d n GLN 82 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1k5d s ALA 83 N -2.63 1.66 0.00 -1.58 0.00 0.06 -4.79 121.76 114.49 1k5d s ALA 83 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1k5d s ALA 83 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1k5d s ALA 83 CO 0.00 -2.26 0.11 1.04 0.00 0.00 0.00 175.76 174.66 1k5d n GLN 84 N -3.81 1.29 -3.77 0.00 6.02 -0.09 -4.96 117.38 112.05 1k5d n GLN 84 Ca 0.07 -0.11 -0.01 0.00 -0.01 0.00 0.00 57.00 56.94 1k5d n GLN 84 Cb 0.55 -0.48 0.00 0.00 1.02 0.00 0.00 30.24 31.33 1k5d n GLN 84 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1k5d s ALA 86 N -2.57 -1.64 -0.06 0.00 0.00 -0.99 -2.29 121.76 114.21 1k5d s ALA 86 Ca 0.17 0.54 0.01 0.00 0.00 0.00 0.00 51.96 52.69 1k5d s ALA 86 Cb 0.01 0.68 0.02 0.00 0.00 0.00 0.00 23.12 23.83 1k5d s ALA 86 CO 0.01 -0.80 -0.05 0.42 0.00 0.00 0.00 175.76 175.33 1k5d s ILE 87 N -3.48 0.67 -0.21 0.00 1.01 -0.19 -2.51 121.20 116.48 1k5d s ILE 87 Ca 0.05 -0.17 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 1k5d s ILE 87 Cb -0.02 -0.69 -0.02 0.00 0.01 0.00 0.00 42.46 41.74 1k5d s ILE 87 CO -0.07 0.27 0.01 -0.63 0.00 0.00 0.00 174.94 174.51 1k5d s ILE 88 N 1.10 3.97 0.11 2.92 1.01 -0.75 -0.93 121.20 128.63 1k5d s ILE 88 Ca -0.08 -0.30 0.07 0.00 0.00 0.00 0.00 60.65 60.34 1k5d s ILE 88 Cb -0.14 -2.81 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 1k5d s ILE 88 CO -0.01 0.41 -0.10 -0.32 0.00 0.00 0.00 174.94 174.92 1k5d s MET 89 N 1.16 2.10 0.13 2.79 1.75 0.56 -1.43 119.30 126.36 1k5d s MET 89 Ca 0.03 -1.04 -0.11 0.00 -1.25 0.00 0.00 55.69 53.32 1k5d s MET 89 Cb -0.14 -2.29 0.01 0.00 2.84 0.00 0.00 34.83 35.24 1k5d s MET 89 CO 0.02 0.51 0.31 -0.59 -0.65 0.00 0.00 175.02 174.61 1k5d s PHE 90 N -1.21 0.12 -0.30 4.11 -0.12 -0.92 -3.88 117.98 115.78 1k5d s PHE 90 Ca 0.21 -0.49 -0.09 0.00 -0.05 0.00 0.00 56.93 56.51 1k5d s PHE 90 Cb -0.11 0.07 -0.01 0.00 -0.63 0.00 0.00 43.02 42.33 1k5d s PHE 90 CO 0.14 -0.68 0.14 0.34 -0.05 0.00 0.00 175.22 175.10 1k5d s ASP 91 N -2.88 5.49 0.27 1.98 3.68 -1.26 -0.91 116.67 123.04 1k5d s ASP 91 Ca 0.09 -0.43 0.14 0.00 2.13 0.00 0.00 52.55 54.48 1k5d s ASP 91 Cb 0.03 -1.99 0.78 0.00 -1.45 0.00 0.00 42.92 40.29 1k5d s ASP 91 CO -0.07 -0.15 1.38 0.52 0.13 0.00 0.00 175.17 176.98 1k5d n VAL 92 N 4.97 0.95 0.21 1.11 0.31 -0.68 -0.48 118.33 124.72 1k5d n VAL 92 Ca -0.14 0.70 0.12 0.00 -0.01 0.00 0.00 64.34 65.01 1k5d n VAL 92 Cb 0.50 -1.70 0.23 0.00 -0.91 0.00 0.00 33.84 31.95 1k5d n VAL 92 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1k5d n THR 93 N -2.03 0.57 -3.73 2.52 -2.24 -1.26 -1.84 114.28 106.27 1k5d n THR 93 Ca -0.01 -0.79 -0.29 0.00 -2.27 0.00 0.00 64.05 60.70 1k5d n THR 93 Cb 0.17 0.92 -0.16 0.00 -2.10 0.00 0.00 70.33 69.16 1k5d n THR 93 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1k5d s SER 94 N -1.41 3.36 0.29 3.42 0.15 0.37 -4.76 113.70 115.12 1k5d s SER 94 Ca 0.40 -1.12 -0.01 0.00 0.70 0.00 0.00 55.95 55.91 1k5d s SER 94 Cb 0.23 -0.70 0.44 0.00 -1.71 0.00 0.00 66.02 64.28 1k5d s SER 94 CO 0.32 -0.34 1.91 -0.09 1.20 0.00 0.00 173.24 176.23 1k5d h ARG 95 N 8.19 0.96 -0.88 5.44 2.43 -1.87 -2.06 114.38 126.60 1k5d h ARG 95 Ca -0.16 -0.11 0.06 0.00 -0.81 0.00 0.00 59.98 58.96 1k5d h ARG 95 Cb 1.08 -0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 30.37 1k5d h ARG 95 CO 0.39 0.72 0.54 0.28 -1.51 0.00 0.00 179.97 180.40 1k5d h VAL 96 N 0.97 1.04 -0.65 0.20 2.07 -1.94 0.25 116.25 118.18 1k5d h VAL 96 Ca 0.24 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1k5d h VAL 96 Cb 0.05 -0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 29.75 1k5d h VAL 96 CO -0.04 0.18 0.43 0.00 0.02 0.00 0.00 177.57 178.16 1k5d h THR 97 N 0.99 1.14 -0.03 2.57 1.03 -1.70 -2.57 112.91 114.34 1k5d h THR 97 Ca 0.38 -0.29 -0.11 0.00 -0.01 0.00 0.00 66.41 66.39 1k5d h THR 97 Cb 0.18 0.22 0.01 0.00 -1.07 0.00 0.00 68.15 67.49 1k5d h THR 97 CO -0.18 0.15 -0.40 0.22 -0.01 0.00 0.00 175.52 175.31 1k5d h TYR 98 N 0.84 0.46 -0.04 0.00 3.20 -0.96 -3.17 116.97 117.30 1k5d h TYR 98 Ca 0.25 -0.23 0.01 0.00 3.14 0.00 0.00 58.73 61.90 1k5d h TYR 98 Cb -0.03 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 1k5d h TYR 98 CO -0.00 1.01 0.23 0.87 -1.64 0.00 0.00 178.16 178.63 1k5d h LYS 99 N -0.22 0.00 0.00 1.82 6.56 -0.67 0.04 116.57 124.10 1k5d h LYS 99 Ca -0.04 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 1k5d h LYS 99 Cb 1.10 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.76 1k5d h LYS 99 CO 0.08 0.00 -0.42 0.09 -2.06 0.00 0.00 179.45 177.14 1k5d n ASN 100 N -3.06 0.68 -0.18 0.86 4.13 -1.00 -4.31 115.26 112.38 1k5d n ASN 100 Ca -0.02 0.23 -0.02 0.00 1.68 0.00 0.00 54.58 56.45 1k5d n ASN 100 Cb 0.30 -0.12 0.04 0.00 -1.54 0.00 0.00 39.78 38.46 1k5d n ASN 100 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1k5d h VAL 101 N 0.00 0.42 -0.76 2.41 2.07 -1.09 0.29 116.25 119.58 1k5d h VAL 101 Ca 0.00 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.71 1k5d h VAL 101 Cb 0.71 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1k5d h VAL 101 CO 0.00 0.00 0.52 -0.65 0.02 0.00 0.00 177.57 177.46 1k5d h PRO 102 N -0.03 0.19 -0.05 1.57 0.11 -1.78 0.28 132.00 132.29 1k5d h PRO 102 Ca 0.26 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 66.13 1k5d h PRO 102 Cb 0.42 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 31.50 1k5d h PRO 102 CO -0.58 0.12 -0.89 -0.91 -0.21 0.00 0.00 178.00 175.54 1k5d h ASN 103 N 0.19 0.70 -0.26 -2.05 2.35 -1.22 -3.20 115.58 112.08 1k5d h ASN 103 Ca 0.37 -0.52 -0.12 0.00 -0.55 0.00 0.00 56.30 55.48 1k5d h ASN 103 Cb 1.18 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 39.33 1k5d h ASN 103 CO -0.07 1.30 -0.31 -0.50 -1.65 0.00 0.00 177.43 176.20 1k5d h TRP 104 N 0.34 0.82 -1.92 1.19 4.06 -0.72 -2.94 115.95 116.78 1k5d h TRP 104 Ca -0.08 -0.26 -0.67 0.00 2.06 0.00 0.00 58.89 59.95 1k5d h TRP 104 Cb 1.52 -0.17 -0.15 0.00 -1.00 0.00 0.00 29.16 29.36 1k5d h TRP 104 CO 0.07 1.00 1.14 -1.58 -3.56 0.00 0.00 178.44 175.51 1k5d s HIS 105 N -4.29 2.95 0.00 0.49 2.46 0.83 -2.14 115.29 115.60 1k5d s HIS 105 Ca -0.12 -1.29 0.00 0.00 0.47 0.00 0.00 55.06 54.12 1k5d s HIS 105 Cb 0.08 -4.43 0.00 0.00 -0.13 0.00 0.00 32.58 28.10 1k5d s HIS 105 CO 0.83 -1.63 0.00 -2.13 -2.47 0.00 0.00 174.74 169.33 1k5d n ARG 106 N 7.28 0.00 -0.22 2.88 0.63 -1.25 -4.69 116.66 121.29 1k5d n ARG 106 Ca 0.29 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 57.15 1k5d n ARG 106 Cb 0.49 0.00 0.03 0.00 0.45 0.00 0.00 32.46 33.43 1k5d n ARG 106 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 1k5d h ASP 107 N 0.00 0.83 0.66 6.15 3.58 -1.39 -0.01 116.42 126.24 1k5d h ASP 107 Ca 0.00 -0.16 -0.03 0.00 0.42 0.00 0.00 57.03 57.26 1k5d h ASP 107 Cb 0.00 -0.21 0.01 0.00 1.72 0.00 0.00 39.33 40.84 1k5d h ASP 107 CO 0.00 0.76 -0.32 -0.07 -2.88 0.00 0.00 179.24 176.73 1k5d h LEU 108 N 0.84 -0.75 -1.68 2.28 3.38 -1.70 -2.99 115.31 114.70 1k5d h LEU 108 Ca 0.20 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1k5d h LEU 108 Cb 0.18 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1k5d h LEU 108 CO -0.02 -0.53 0.00 -0.37 0.09 0.00 0.00 178.44 177.61 1k5d h VAL 109 N -0.90 0.00 -0.15 1.22 -1.51 -1.83 -1.39 116.25 111.69 1k5d h VAL 109 Ca -0.09 -0.08 -0.02 0.00 -1.23 0.00 0.00 66.70 65.28 1k5d h VAL 109 Cb 0.68 0.76 -0.01 0.00 -2.13 0.00 0.00 31.29 30.59 1k5d h VAL 109 CO 0.15 0.00 0.01 -0.09 -1.23 0.00 0.00 177.57 176.41 1k5d h ARG 110 N 0.00 0.20 0.00 5.19 2.43 -0.83 -1.54 114.38 119.84 1k5d h ARG 110 Ca 0.00 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1k5d h ARG 110 Cb 0.10 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1k5d h ARG 110 CO 0.00 0.22 -1.12 1.33 -1.51 0.00 0.00 179.97 178.90 1k5d n VAL 111 N -4.42 0.01 -0.06 0.20 0.24 -0.79 -4.74 118.33 108.78 1k5d n VAL 111 Ca -0.01 -0.06 -0.05 0.00 -2.04 0.00 0.00 64.34 62.18 1k5d n VAL 111 Cb 0.15 0.36 -0.15 0.00 -1.47 0.00 0.00 33.84 32.74 1k5d n VAL 111 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1k5d n GLU 113 N -2.73 0.00 -2.85 0.00 1.02 -0.58 -4.50 120.64 110.99 1k5d n GLU 113 Ca -0.23 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.48 1k5d n GLU 113 Cb 1.01 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 32.39 1k5d n GLU 113 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1k5d s ASN 114 N -4.00 6.22 -0.02 1.62 3.84 -1.26 -4.70 114.94 116.64 1k5d s ASN 114 Ca 0.00 -0.78 -0.12 0.00 0.21 0.00 0.00 52.86 52.18 1k5d s ASN 114 Cb 0.00 -2.42 0.02 0.00 -0.55 0.00 0.00 41.25 38.29 1k5d s ASN 114 CO 0.00 -1.37 0.26 0.27 -2.79 0.00 0.00 177.10 173.47 1k5d s ILE 115 N 4.02 0.05 0.18 -5.21 -4.36 -1.26 -5.11 121.20 109.51 1k5d s ILE 115 Ca 0.25 -0.45 -0.33 0.00 -0.26 0.00 0.00 60.65 59.85 1k5d s ILE 115 Cb -0.15 -0.52 -0.13 0.00 1.25 0.00 0.00 42.46 42.90 1k5d s ILE 115 CO 0.13 -0.25 1.66 -2.65 0.24 0.00 0.00 174.94 174.07 1k5d n PRO 116 N 1.61 2.46 -3.87 0.37 -0.02 -1.26 -4.91 135.00 129.37 1k5d n PRO 116 Ca -0.20 0.89 -0.15 0.00 -2.02 0.00 0.00 63.50 62.01 1k5d n PRO 116 Cb 0.56 -2.70 -0.16 0.00 -0.02 0.00 0.00 33.50 31.19 1k5d n PRO 116 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1k5d s ILE 117 N 1.16 0.07 -0.05 4.25 1.01 -1.26 -2.33 121.20 124.05 1k5d s ILE 117 Ca 0.78 0.10 0.06 0.00 0.00 0.00 0.00 60.65 61.59 1k5d s ILE 117 Cb -0.59 -0.16 -0.02 0.00 0.01 0.00 0.00 42.46 41.70 1k5d s ILE 117 CO 0.36 0.10 -0.24 0.54 0.00 0.00 0.00 174.94 175.70 1k5d s VAL 118 N 0.82 2.21 -0.21 2.92 0.11 -1.05 -2.41 120.40 122.80 1k5d s VAL 118 Ca -0.08 -1.03 -0.09 0.00 -2.93 0.00 0.00 61.98 57.85 1k5d s VAL 118 Cb -0.11 -1.80 -0.05 0.00 -1.53 0.00 0.00 36.38 32.90 1k5d s VAL 118 CO -0.02 0.57 0.12 -0.22 -3.33 0.00 0.00 175.10 172.23 1k5d s LEU 119 N -0.38 4.02 -0.15 2.54 2.96 0.90 -1.80 118.68 126.77 1k5d s LEU 119 Ca 0.03 0.12 -0.00 0.00 -0.22 0.00 0.00 54.13 54.06 1k5d s LEU 119 Cb -0.12 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.51 1k5d s LEU 119 CO 0.02 0.12 -0.14 0.00 -1.32 0.00 0.00 176.35 175.03 1k5d s GLY 121 N 0.73 1.88 0.53 0.00 0.00 -0.13 -2.16 107.32 108.17 1k5d s GLY 121 Ca -0.06 -2.08 -0.03 0.00 0.00 0.00 0.00 44.72 42.54 1k5d s GLY 121 CO 0.01 1.37 0.81 0.21 0.00 0.00 0.00 173.10 175.50 1k5d s ASN 122 N 3.08 5.71 -0.65 1.64 2.47 -0.09 -0.92 114.94 126.18 1k5d s ASN 122 Ca 0.10 0.55 -0.00 0.00 0.42 0.00 0.00 52.86 53.93 1k5d s ASN 122 Cb -0.23 -1.65 0.00 0.00 -1.45 0.00 0.00 41.25 37.92 1k5d s ASN 122 CO 0.08 -0.91 0.00 0.29 -3.72 0.00 0.00 177.10 172.84 1k5d n LYS 123 N -2.38 -0.61 0.00 0.43 5.02 -1.05 -1.69 118.16 117.89 1k5d n LYS 123 Ca 0.03 0.37 0.04 0.00 -2.02 0.00 0.00 58.31 56.73 1k5d n LYS 123 Cb 0.58 -4.29 0.22 0.00 -0.02 0.00 0.00 35.03 31.51 1k5d n LYS 123 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1k5d n VAL 124 N -4.01 1.01 0.14 -0.18 0.24 -1.12 -1.50 118.33 112.92 1k5d n VAL 124 Ca -0.09 0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.47 1k5d n VAL 124 Cb 0.57 -1.10 0.14 0.00 -1.47 0.00 0.00 33.84 31.98 1k5d n VAL 124 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1k5d h ASP 125 N 0.00 0.00 -3.48 -1.34 2.03 -1.91 -3.45 116.42 108.28 1k5d h ASP 125 Ca 0.00 0.00 -0.52 0.00 -0.73 0.00 0.00 57.03 55.78 1k5d h ASP 125 Cb 0.11 0.00 0.05 0.00 -0.83 0.00 0.00 39.33 38.66 1k5d h ASP 125 CO 0.00 0.61 0.70 -0.63 -1.03 0.00 0.00 179.24 178.88 1k5d s ILE 126 N -3.33 2.87 0.07 4.15 1.09 -0.56 -4.97 121.20 120.51 1k5d s ILE 126 Ca 0.00 0.75 -0.32 0.00 -1.10 0.00 0.00 60.65 59.98 1k5d s ILE 126 Cb 0.11 -3.48 -0.19 0.00 -1.06 0.00 0.00 42.46 37.84 1k5d s ILE 126 CO 0.75 0.13 1.61 0.50 -0.10 0.00 0.00 174.94 177.83 1k5d h LYS 127 N 4.84 -0.82 -4.15 2.79 3.64 -1.89 -3.36 116.57 117.62 1k5d h LYS 127 Ca -0.46 0.06 -0.66 0.00 -1.27 0.00 0.00 60.65 58.31 1k5d h LYS 127 Cb 1.22 0.19 0.01 0.00 -0.41 0.00 0.00 32.23 33.23 1k5d h LYS 127 CO 0.75 -0.54 2.76 -0.25 -2.27 0.00 0.00 179.45 179.89 1k5d n ASP 128 N -5.45 3.50 -4.76 4.20 9.92 -1.26 -4.95 116.55 117.75 1k5d n ASP 128 Ca -0.13 -2.73 -0.40 0.00 -0.53 0.00 0.00 54.79 51.00 1k5d n ASP 128 Cb 0.35 -1.37 -0.04 0.00 -0.64 0.00 0.00 41.12 39.42 1k5d n ASP 128 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1k5d s ARG 129 N 4.00 4.60 -0.19 -1.24 3.52 -1.26 -4.82 118.95 123.56 1k5d s ARG 129 Ca 0.52 1.84 -0.08 0.00 -0.13 0.00 0.00 55.73 57.89 1k5d s ARG 129 Cb 0.14 -3.19 -0.09 0.00 -1.56 0.00 0.00 34.95 30.25 1k5d s ARG 129 CO 0.01 0.13 -0.23 1.63 -0.81 0.00 0.00 175.30 176.03 1k5d n LYS 130 N 1.40 0.42 -3.12 5.12 5.02 -0.76 -4.86 118.16 121.37 1k5d n LYS 130 Ca -0.00 0.17 -0.45 0.00 -2.02 0.00 0.00 58.31 56.01 1k5d n LYS 130 Cb 0.45 -1.22 -0.04 0.00 -0.02 0.00 0.00 35.03 34.20 1k5d n LYS 130 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1k5d s VAL 131 N -2.35 4.90 0.41 -0.18 1.01 -0.83 -5.02 120.40 118.33 1k5d s VAL 131 Ca -0.26 -1.20 -0.23 0.00 0.00 0.00 0.00 61.98 60.28 1k5d s VAL 131 Cb 0.10 -4.51 -0.09 0.00 0.00 0.00 0.00 36.38 31.87 1k5d s VAL 131 CO 0.35 -1.15 1.03 -0.54 0.00 0.00 0.00 175.10 174.80 1k5d s LYS 132 N 2.42 4.15 0.56 2.72 1.02 -1.26 -4.90 119.74 124.45 1k5d s LYS 132 Ca 0.14 1.45 0.31 0.00 0.02 0.00 0.00 55.97 57.89 1k5d s LYS 132 Cb -0.21 -2.48 1.46 0.00 -0.52 0.00 0.00 37.83 36.08 1k5d s LYS 132 CO 0.03 -0.14 1.85 0.00 -0.92 0.00 0.00 175.35 176.18 1k5d h ALA 133 N 2.39 2.65 0.93 5.17 0.00 -1.97 -1.54 119.26 126.90 1k5d h ALA 133 Ca -0.48 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 1k5d h ALA 133 Cb 1.21 0.06 0.01 0.00 0.00 0.00 0.00 17.79 19.07 1k5d h ALA 133 CO 0.62 -1.04 -0.45 0.87 0.00 0.00 0.00 179.25 179.25 1k5d h LYS 134 N 0.00 -1.21 -0.97 0.00 1.79 -2.02 -3.16 116.57 110.99 1k5d h LYS 134 Ca 0.37 0.08 0.32 0.00 -2.18 0.00 0.00 60.65 59.25 1k5d h LYS 134 Cb 1.65 0.27 -0.16 0.00 -1.58 0.00 0.00 32.23 32.42 1k5d h LYS 134 CO -0.00 -0.81 0.44 0.77 -1.08 0.00 0.00 179.45 178.77 1k5d h SER 135 N -1.32 0.27 -1.81 0.86 0.02 -1.66 -3.41 113.55 106.49 1k5d h SER 135 Ca -0.13 0.22 -0.64 0.00 -0.84 0.00 0.00 61.79 60.40 1k5d h SER 135 Cb 0.96 0.23 0.01 0.00 0.14 0.00 0.00 62.40 63.74 1k5d h SER 135 CO 0.21 -0.23 1.13 -0.38 -1.14 0.00 0.00 176.83 176.42 1k5d n ILE 136 N -5.18 0.47 0.00 3.27 2.08 -1.20 -4.75 119.36 114.05 1k5d n ILE 136 Ca 0.30 -0.14 0.00 0.00 0.56 0.00 0.00 62.75 63.48 1k5d n ILE 136 Cb 0.97 -1.77 0.00 0.00 -0.75 0.00 0.00 39.64 38.09 1k5d n ILE 136 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1k5d n VAL 137 N 5.49 0.00 -0.34 1.39 0.31 -1.26 -4.87 118.33 119.05 1k5d n VAL 137 Ca 0.26 0.00 0.27 0.00 -0.01 0.00 0.00 64.34 64.86 1k5d n VAL 137 Cb 0.26 0.02 0.51 0.00 -0.91 0.00 0.00 33.84 33.73 1k5d n VAL 137 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1k5d h PHE 138 N 0.00 0.88 0.00 3.52 3.57 -1.99 0.66 116.94 123.58 1k5d h PHE 138 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1k5d h PHE 138 Cb 0.02 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.54 1k5d h PHE 138 CO 0.00 -0.24 0.00 1.12 -2.23 0.00 0.00 178.31 176.96 1k5d h HIS 139 N 0.24 0.00 -0.04 0.41 2.07 -1.89 -1.63 115.15 114.30 1k5d h HIS 139 Ca 0.76 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 58.15 1k5d h HIS 139 Cb 1.87 0.00 0.01 0.00 2.57 0.00 0.00 27.41 31.86 1k5d h HIS 139 CO -0.01 0.00 -0.51 0.00 -3.07 0.00 0.00 177.93 174.34 1k5d h ARG 140 N 0.00 0.41 -0.14 5.12 -0.00 0.07 -1.55 114.38 118.29 1k5d h ARG 140 Ca 0.00 -0.40 -0.15 0.00 -0.50 0.00 0.00 59.98 58.93 1k5d h ARG 140 Cb 0.17 0.10 -0.01 0.00 0.00 0.00 0.00 29.97 30.23 1k5d h ARG 140 CO 0.00 1.05 -0.55 -0.22 0.00 0.00 0.00 179.97 180.25 1k5d h LYS 141 N -0.08 0.42 -0.60 0.04 3.11 -1.45 -3.30 116.57 114.71 1k5d h LYS 141 Ca -0.05 -0.26 0.00 0.00 -2.81 0.00 0.00 60.65 57.52 1k5d h LYS 141 Cb 1.20 0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.46 1k5d h LYS 141 CO 0.10 0.86 0.00 1.63 -2.81 0.00 0.00 179.45 179.23 1k5d n LYS 142 N -3.94 3.18 -3.72 1.90 4.01 -0.66 -4.99 118.16 113.93 1k5d n LYS 142 Ca -0.03 -2.66 -0.24 0.00 -0.51 0.00 0.00 58.31 54.87 1k5d n LYS 142 Cb 0.59 -1.66 0.03 0.00 -0.51 0.00 0.00 35.03 33.47 1k5d n LYS 142 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1k5d n ASN 143 N 1.11 -2.29 -4.56 4.39 5.15 -0.78 -5.00 115.26 113.27 1k5d n ASN 143 Ca 0.23 -0.90 -0.24 0.00 -0.60 0.00 0.00 54.58 53.07 1k5d n ASN 143 Cb 0.71 -3.74 -0.09 0.00 -0.53 0.00 0.00 39.78 36.13 1k5d n ASN 143 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1k5d s LEU 144 N -6.61 2.88 0.01 1.20 1.43 -0.66 -4.79 118.68 112.15 1k5d s LEU 144 Ca 0.14 -0.88 -0.04 0.00 -1.03 0.00 0.00 54.13 52.32 1k5d s LEU 144 Cb -0.04 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.76 1k5d s LEU 144 CO 0.84 -0.02 0.23 -1.58 0.23 0.00 0.00 176.35 176.05 1k5d s GLN 145 N -3.60 3.51 0.12 1.70 2.00 -1.01 -4.71 119.66 117.67 1k5d s GLN 145 Ca 0.31 -0.21 0.10 0.00 -2.00 0.00 0.00 55.36 53.56 1k5d s GLN 145 Cb -0.05 -3.07 -0.04 0.00 0.80 0.00 0.00 33.01 30.66 1k5d s GLN 145 CO 0.18 0.64 -0.24 -0.47 -0.50 0.00 0.00 175.29 174.90 1k5d s TYR 146 N -1.35 2.09 -0.17 1.67 5.04 -1.26 -0.07 117.35 123.30 1k5d s TYR 146 Ca 0.29 -0.40 -0.14 0.00 -2.44 0.00 0.00 57.07 54.39 1k5d s TYR 146 Cb -0.13 -1.13 0.05 0.00 0.35 0.00 0.00 41.96 41.10 1k5d s TYR 146 CO 0.19 0.29 0.44 0.71 -1.34 0.00 0.00 175.55 175.84 1k5d s TYR 147 N -1.13 -0.55 0.08 4.97 2.02 -0.50 -4.94 117.35 117.30 1k5d s TYR 147 Ca 0.11 1.26 -0.24 0.00 -0.37 0.00 0.00 57.07 57.83 1k5d s TYR 147 Cb -0.10 0.22 -0.06 0.00 -0.40 0.00 0.00 41.96 41.61 1k5d s TYR 147 CO 0.05 -0.28 0.72 -0.51 -1.57 0.00 0.00 175.55 173.96 1k5d s ASP 148 N 0.65 7.22 0.21 2.29 1.11 -1.26 -0.96 116.67 125.93 1k5d s ASP 148 Ca -0.03 1.45 -0.07 0.00 0.18 0.00 0.00 52.55 54.08 1k5d s ASP 148 Cb -0.05 -2.45 -0.02 0.00 1.07 0.00 0.00 42.92 41.47 1k5d s ASP 148 CO -0.04 0.13 0.28 0.27 1.18 0.00 0.00 175.17 176.99 1k5d s ILE 149 N -0.61 0.02 -0.29 0.77 -4.36 -0.09 -4.60 121.20 112.04 1k5d s ILE 149 Ca 0.35 -1.67 0.01 0.00 -0.26 0.00 0.00 60.65 59.08 1k5d s ILE 149 Cb -0.21 -2.24 0.16 0.00 1.25 0.00 0.00 42.46 41.41 1k5d s ILE 149 CO 0.23 -0.09 0.39 -0.55 0.24 0.00 0.00 174.94 175.16 1k5d s SER 150 N -3.07 0.55 0.60 4.36 0.15 -1.02 -2.52 113.70 112.75 1k5d s SER 150 Ca 0.28 -0.39 0.30 0.00 0.70 0.00 0.00 55.95 56.84 1k5d s SER 150 Cb 0.04 1.03 1.72 0.00 -1.71 0.00 0.00 66.02 67.09 1k5d s SER 150 CO 0.08 -0.36 2.12 0.00 1.20 0.00 0.00 173.24 176.29 1k5d h ALA 151 N 8.18 1.71 0.11 5.45 0.00 -1.93 0.93 119.26 133.71 1k5d h ALA 151 Ca -0.10 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.52 1k5d h ALA 151 Cb 1.12 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.94 1k5d h ALA 151 CO 0.27 -0.25 -1.22 -0.22 0.00 0.00 0.00 179.25 177.83 1k5d h LYS 152 N 0.00 0.56 0.00 0.00 3.64 -1.96 -3.34 116.57 115.47 1k5d h LYS 152 Ca 0.07 -0.75 0.00 0.00 -1.27 0.00 0.00 60.65 58.70 1k5d h LYS 152 Cb 0.43 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1k5d h LYS 152 CO -0.00 1.33 -0.95 -1.13 -2.27 0.00 0.00 179.45 176.43 1k5d n SER 153 N -3.75 0.83 0.00 4.20 3.41 -0.88 -4.97 113.62 112.46 1k5d n SER 153 Ca -0.12 -0.78 0.00 0.00 -0.26 0.00 0.00 58.87 57.71 1k5d n SER 153 Cb 0.98 1.11 0.00 0.00 -0.26 0.00 0.00 64.21 66.04 1k5d n SER 153 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1k5d n ASN 154 N -1.50 -0.21 -4.56 4.04 3.02 0.32 -4.97 115.26 111.39 1k5d n ASN 154 Ca 0.02 0.00 -0.56 0.00 -0.03 0.00 0.00 54.58 54.01 1k5d n ASN 154 Cb 0.29 -0.03 -0.08 0.00 -0.61 0.00 0.00 39.78 39.35 1k5d n ASN 154 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k5d n TYR 155 N -2.07 1.78 -1.27 3.10 9.36 -1.19 -0.15 117.16 126.72 1k5d n TYR 155 Ca 0.00 0.49 -0.10 0.00 3.32 0.00 0.00 57.90 61.61 1k5d n TYR 155 Cb 0.00 -2.46 -0.04 0.00 -0.63 0.00 0.00 39.34 36.21 1k5d n TYR 155 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1k5d n ASN 156 N 7.14 -5.61 0.31 2.98 5.03 -1.26 -2.43 115.26 121.42 1k5d n ASN 156 Ca 0.35 0.25 0.18 0.00 0.87 0.00 0.00 54.58 56.23 1k5d n ASN 156 Cb 0.13 -4.07 0.94 0.00 -1.02 0.00 0.00 39.78 35.77 1k5d n ASN 156 CO 0.00 0.00 0.00 2.19 -1.83 0.00 0.00 177.26 177.62 1k5d h PHE 157 N 0.00 0.00 -0.02 3.10 -0.00 -0.86 -1.40 116.94 117.76 1k5d h PHE 157 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.77 1k5d h PHE 157 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.10 1k5d h PHE 157 CO 0.59 0.00 -0.44 -0.85 -0.00 0.00 0.00 178.31 177.61 1k5d n GLU 158 N -3.12 1.31 0.07 6.09 -0.00 -1.26 -4.58 120.64 119.15 1k5d n GLU 158 Ca -0.01 -1.05 -0.13 0.00 -0.00 0.00 0.00 57.16 55.97 1k5d n GLU 158 Cb 0.29 -1.46 -0.08 0.00 -0.00 0.00 0.00 31.44 30.19 1k5d n GLU 158 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 1k5d h LYS 159 N 2.55 -0.11 -0.63 3.44 1.79 -1.65 -2.80 116.57 119.16 1k5d h LYS 159 Ca 0.00 0.01 0.13 0.00 -2.18 0.00 0.00 60.65 58.60 1k5d h LYS 159 Cb 0.76 0.02 -0.12 0.00 -1.58 0.00 0.00 32.23 31.31 1k5d h LYS 159 CO 0.00 -0.02 -0.18 -1.35 -1.08 0.00 0.00 179.45 176.82 1k5d h PRO 160 N -0.17 -0.02 -0.26 3.15 0.11 -1.81 0.62 132.00 133.62 1k5d h PRO 160 Ca -0.01 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 1k5d h PRO 160 Cb 0.14 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.24 1k5d h PRO 160 CO 0.02 -0.02 -0.25 0.74 -0.21 0.00 0.00 178.00 178.28 1k5d h PHE 161 N -0.02 0.55 -0.01 0.65 0.04 -1.87 -2.12 116.94 114.16 1k5d h PHE 161 Ca 0.30 -0.12 -0.00 0.00 2.80 0.00 0.00 57.97 60.95 1k5d h PHE 161 Cb 0.48 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.50 1k5d h PHE 161 CO -0.54 0.70 -0.00 1.25 -0.60 0.00 0.00 178.31 179.12 1k5d h LEU 162 N 0.44 0.02 0.30 1.54 5.85 -0.96 -2.06 115.31 120.43 1k5d h LEU 162 Ca 0.06 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1k5d h LEU 162 Cb 0.67 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 1k5d h LEU 162 CO 0.05 0.46 -0.30 -0.25 -0.34 0.00 0.00 178.44 178.06 1k5d h TRP 163 N -0.42 -0.81 -0.89 1.25 7.01 -0.91 -2.05 115.95 119.14 1k5d h TRP 163 Ca 0.00 0.01 0.18 0.00 2.11 0.00 0.00 58.89 61.18 1k5d h TRP 163 Cb 0.45 0.31 -0.11 0.00 -2.10 0.00 0.00 29.16 27.72 1k5d h TRP 163 CO 0.08 -0.43 0.45 -0.07 -2.79 0.00 0.00 178.44 175.67 1k5d h LEU 164 N -0.63 0.50 -0.63 0.65 3.38 -1.44 -1.29 115.31 115.85 1k5d h LEU 164 Ca -0.01 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1k5d h LEU 164 Cb 0.58 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1k5d h LEU 164 CO -0.06 0.15 0.35 0.00 0.09 0.00 0.00 178.44 178.97 1k5d h ALA 165 N 1.62 0.81 -0.79 1.53 0.00 -0.83 -0.51 119.26 121.09 1k5d h ALA 165 Ca 0.51 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 1k5d h ALA 165 Cb 0.83 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1k5d h ALA 165 CO -0.42 0.32 0.34 0.00 0.00 0.00 0.00 179.25 179.49 1k5d h ARG 166 N 0.86 1.16 -0.16 0.00 3.08 -0.57 0.20 114.38 118.94 1k5d h ARG 166 Ca 0.22 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 59.98 1k5d h ARG 166 Cb 0.04 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1k5d h ARG 166 CO -0.04 0.93 -0.26 0.87 -1.07 0.00 0.00 179.97 180.40 1k5d h LYS 167 N 1.14 0.46 -0.12 0.04 1.79 -1.11 0.98 116.57 119.75 1k5d h LYS 167 Ca 0.27 -0.28 -0.03 0.00 -2.18 0.00 0.00 60.65 58.42 1k5d h LYS 167 Cb 0.18 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.85 1k5d h LYS 167 CO -0.03 0.88 -0.05 -0.07 -1.08 0.00 0.00 179.45 179.11 1k5d h LEU 168 N 0.10 0.26 -0.50 2.94 3.38 -0.97 -3.24 115.31 117.27 1k5d h LEU 168 Ca 0.01 -0.40 -0.17 0.00 0.09 0.00 0.00 57.88 57.42 1k5d h LEU 168 Cb 0.84 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1k5d h LEU 168 CO 0.06 0.60 -0.71 0.40 0.09 0.00 0.00 178.44 178.88 1k5d h ILE 169 N -0.08 1.42 0.00 1.22 1.08 -0.69 -3.48 117.51 116.98 1k5d h ILE 169 Ca 0.03 -2.22 0.00 0.00 -0.39 0.00 0.00 64.86 62.28 1k5d h ILE 169 Cb 0.49 2.17 0.00 0.00 -3.07 0.00 0.00 36.82 36.41 1k5d h ILE 169 CO 0.02 0.65 0.00 0.61 -0.69 0.00 0.00 178.15 178.74 1k5d n GLY 170 N 0.50 0.97 2.90 5.37 0.00 0.31 -5.06 105.19 110.18 1k5d n GLY 170 Ca -0.03 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1k5d n GLY 170 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k5d s ASP 171 N -2.49 4.32 0.32 1.61 -1.08 -1.00 -4.98 116.67 113.36 1k5d s ASP 171 Ca 0.00 -1.76 0.19 0.00 -0.52 0.00 0.00 52.55 50.45 1k5d s ASP 171 Cb 0.00 -1.27 1.03 0.00 -1.46 0.00 0.00 42.92 41.22 1k5d s ASP 171 CO 0.00 -0.36 1.55 -2.65 0.52 0.00 0.00 175.17 174.23 1k5d n PRO 172 N 4.55 0.12 -0.27 4.34 -0.02 -1.26 -1.73 135.00 140.73 1k5d n PRO 172 Ca -0.02 0.62 0.09 0.00 -2.02 0.00 0.00 63.50 62.17 1k5d n PRO 172 Cb 0.42 -1.99 0.20 0.00 -0.02 0.00 0.00 33.50 32.12 1k5d n PRO 172 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1k5d n ASN 173 N -2.19 3.16 -4.77 2.55 4.13 -1.26 -5.03 115.26 111.86 1k5d n ASN 173 Ca -0.01 -3.01 -0.39 0.00 1.68 0.00 0.00 54.58 52.84 1k5d n ASN 173 Cb 0.11 -0.48 0.00 0.00 -1.54 0.00 0.00 39.78 37.87 1k5d n ASN 173 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1k5d s LEU 174 N -2.78 4.17 0.04 3.41 2.96 -0.71 -5.02 118.68 120.75 1k5d s LEU 174 Ca 0.37 2.68 -0.06 0.00 -0.22 0.00 0.00 54.13 56.90 1k5d s LEU 174 Cb 0.30 -3.95 -0.01 0.00 0.50 0.00 0.00 46.19 43.04 1k5d s LEU 174 CO 0.06 -0.94 0.11 -1.83 -1.32 0.00 0.00 176.35 172.43 1k5d s GLU 175 N -2.34 0.63 0.37 1.98 -1.05 -1.26 -4.96 118.70 112.07 1k5d s GLU 175 Ca 0.59 -0.78 -0.25 0.00 -0.15 0.00 0.00 54.97 54.37 1k5d s GLU 175 Cb -0.38 0.25 -0.09 0.00 -0.44 0.00 0.00 34.13 33.46 1k5d s GLU 175 CO 0.49 -0.16 1.07 -0.06 0.95 0.00 0.00 175.26 177.55 1k5d s PHE 176 N -2.78 3.32 -0.02 4.83 0.08 -1.26 -2.82 117.98 119.34 1k5d s PHE 176 Ca -0.04 1.65 -0.06 0.00 0.12 0.00 0.00 56.93 58.60 1k5d s PHE 176 Cb -0.00 -3.19 0.00 0.00 -0.57 0.00 0.00 43.02 39.26 1k5d s PHE 176 CO -0.05 -0.68 0.13 0.14 -0.10 0.00 0.00 175.22 174.66 1k5d s VAL 177 N -1.51 0.06 0.00 -0.44 -7.23 0.48 -4.91 120.40 106.84 1k5d s VAL 177 Ca 0.54 -0.49 0.00 0.00 -1.81 0.00 0.00 61.98 60.23 1k5d s VAL 177 Cb -0.25 -0.36 0.00 0.00 0.56 0.00 0.00 36.38 36.33 1k5d s VAL 177 CO 0.32 -0.27 0.00 0.00 -0.31 0.00 0.00 175.10 174.84 1k5d n ALA 178 N 1.94 0.00 0.00 1.32 0.00 -1.26 -4.54 120.51 117.97 1k5d n ALA 178 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1k5d n ALA 178 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1k5d n ALA 178 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1k5d n MET 179 N 0.21 0.00 -1.62 0.00 1.56 -1.26 -4.91 117.12 111.10 1k5d n MET 179 Ca 0.00 0.00 -0.51 0.00 -0.27 0.00 0.00 57.70 56.92 1k5d n MET 179 Cb 0.00 0.00 -0.06 0.00 2.15 0.00 0.00 33.22 35.31 1k5d n MET 179 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1k5d n PRO 180 N 0.00 1.37 -3.20 2.12 -0.02 -1.26 -4.88 135.00 129.13 1k5d n PRO 180 Ca 0.00 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 1k5d n PRO 180 Cb 0.00 -2.17 -0.01 0.00 -0.02 0.00 0.00 33.50 31.30 1k5d n PRO 180 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k5d n ALA 181 N 3.11 4.67 -0.79 3.55 0.00 -1.26 -5.05 120.51 124.74 1k5d n ALA 181 Ca 0.19 -4.74 -0.33 0.00 0.00 0.00 0.00 53.44 48.56 1k5d n ALA 181 Cb 0.21 -2.21 0.12 0.00 0.00 0.00 0.00 19.45 17.57 1k5d n ALA 181 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1k5d n LEU 182 N 1.80 -0.74 -4.74 0.00 4.32 -1.26 -4.93 117.00 111.45 1k5d n LEU 182 Ca 0.25 0.26 -0.41 0.00 -0.02 0.00 0.00 56.01 56.09 1k5d n LEU 182 Cb 0.36 -1.15 -0.05 0.00 -1.62 0.00 0.00 43.42 40.96 1k5d n LEU 182 CO 0.59 -3.65 0.72 0.00 -1.22 0.00 0.00 177.39 173.83 1k5d s ALA 183 N -2.36 3.34 0.85 -1.18 0.00 -1.26 -5.04 121.76 116.11 1k5d s ALA 183 Ca 0.56 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 53.13 1k5d s ALA 183 Cb -0.20 -3.29 0.10 0.00 0.00 0.00 0.00 23.12 19.74 1k5d s ALA 183 CO 0.68 -0.04 1.09 -2.14 0.00 0.00 0.00 175.76 175.35 1k5d s PRO 184 N -0.70 1.63 0.88 0.00 0.02 -1.26 -5.02 135.00 130.54 1k5d s PRO 184 Ca 0.46 0.87 -0.11 0.00 0.02 0.00 0.00 61.00 62.24 1k5d s PRO 184 Cb -0.27 -1.85 0.12 0.00 0.02 0.00 0.00 34.50 32.52 1k5d s PRO 184 CO 0.34 -2.00 1.10 -2.14 -0.33 0.00 0.00 177.00 173.97 1k5d s PRO 185 N -4.96 1.40 0.00 5.54 0.02 -1.26 -4.98 135.00 130.75 1k5d s PRO 185 Ca 0.62 1.16 0.00 0.00 0.02 0.00 0.00 61.00 62.81 1k5d s PRO 185 Cb -0.17 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1k5d s PRO 185 CO 0.56 -2.24 0.69 -0.85 -0.33 0.00 0.00 177.00 174.83 1k5d n GLU 186 N -3.93 0.00 -1.54 5.54 -0.00 -1.26 -4.99 120.64 114.46 1k5d n GLU 186 Ca 0.09 0.69 -0.00 0.00 -0.00 0.00 0.00 57.16 57.94 1k5d n GLU 186 Cb 0.53 -1.16 0.00 0.00 -0.00 0.00 0.00 31.44 30.81 1k5d n GLU 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1k5d n VAL 187 N -1.86 -2.29 0.00 3.84 0.31 -1.26 -5.11 118.33 111.95 1k5d n VAL 187 Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1k5d n VAL 187 Cb 0.00 -4.10 0.00 0.00 -0.91 0.00 0.00 33.84 28.83 1k5d n VAL 187 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1k5d n VAL 188 N -0.27 0.00 0.00 2.52 0.31 -1.26 -5.12 118.33 114.50 1k5d n VAL 188 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1k5d n VAL 188 Cb 0.01 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 1k5d n VAL 188 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1k5d n MET 189 N 0.00 0.00 0.00 5.55 0.00 -1.26 -5.02 117.12 116.40 1k5d n MET 189 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1k5d n MET 189 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1k5d n MET 189 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1k5d n ASP 190 N -4.14 0.00 0.00 3.17 4.64 -1.26 -5.02 116.55 113.94 1k5d n ASP 190 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 1k5d n ASP 190 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 1k5d n ASP 190 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 1k5d n PRO 191 N 0.00 0.00 0.03 -0.67 -0.02 -1.26 -0.47 135.00 132.61 1k5d n PRO 191 Ca 0.00 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.56 1k5d n PRO 191 Cb 0.00 0.00 0.34 0.00 -0.02 0.00 0.00 33.50 33.82 1k5d n PRO 191 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k5d n ALA 192 N -2.61 1.62 0.04 3.55 0.00 -1.26 -2.75 120.51 119.10 1k5d n ALA 192 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 53.44 53.29 1k5d n ALA 192 Cb 0.00 -1.26 -0.04 0.00 0.00 0.00 0.00 19.45 18.15 1k5d n ALA 192 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1k5d h LEU 193 N 0.00 0.64 0.00 0.00 4.07 -1.98 -3.46 115.31 114.58 1k5d h LEU 193 Ca 0.00 -0.47 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1k5d h LEU 193 Cb 0.26 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.81 1k5d h LEU 193 CO 0.00 1.26 0.00 0.00 -1.08 0.00 0.00 178.44 178.62 1k5d n ALA 194 N -2.56 0.00 -0.52 1.53 0.00 0.37 -4.61 120.51 114.73 1k5d n ALA 194 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1k5d n ALA 194 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.24 1k5d n ALA 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k5d n ALA 195 N -3.00 0.00 0.00 0.00 0.00 -1.26 -4.25 120.51 112.00 1k5d n ALA 195 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1k5d n ALA 195 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1k5d n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k5d n GLN 196 N 0.00 0.00 0.14 0.00 -0.00 -1.26 -1.85 117.38 114.41 1k5d n GLN 196 Ca 0.00 0.05 -0.10 0.00 -0.00 0.00 0.00 57.00 56.95 1k5d n GLN 196 Cb 0.00 -1.58 -0.06 0.00 -0.00 0.00 0.00 30.24 28.60 1k5d n GLN 196 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 1k5d h TYR 197 N 0.00 -0.38 -0.47 2.61 0.05 -1.82 -3.18 116.97 113.78 1k5d h TYR 197 Ca 0.00 -0.01 0.14 0.00 0.05 0.00 0.00 58.73 58.91 1k5d h TYR 197 Cb 0.16 0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 1k5d h TYR 197 CO 0.00 -0.07 0.59 0.93 -1.05 0.00 0.00 178.16 178.56 1k5d h GLU 198 N -0.99 0.00 -0.74 4.88 5.08 -1.75 0.14 114.58 121.20 1k5d h GLU 198 Ca -0.04 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1k5d h GLU 198 Cb 0.49 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 1k5d h GLU 198 CO 0.07 0.00 0.45 1.25 -1.00 0.00 0.00 179.01 179.78 1k5d h HIS 199 N 0.00 0.84 0.12 4.33 2.76 -1.70 -2.70 115.15 118.79 1k5d h HIS 199 Ca 0.22 0.02 -0.17 0.00 -2.20 0.00 0.00 60.37 58.25 1k5d h HIS 199 Cb 1.40 -0.27 0.02 0.00 1.55 0.00 0.00 27.41 30.11 1k5d h HIS 199 CO 0.00 0.45 -0.75 -0.44 -1.30 0.00 0.00 177.93 175.88 1k5d h ASP 200 N 0.85 0.45 -1.03 3.26 5.19 -0.86 -3.27 116.42 121.01 1k5d h ASP 200 Ca 0.31 -0.94 0.30 0.00 -0.62 0.00 0.00 57.03 56.08 1k5d h ASP 200 Cb 0.10 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.42 1k5d h ASP 200 CO -0.14 1.36 0.84 0.25 -3.12 0.00 0.00 179.24 178.42 1k5d h LEU 201 N -0.38 0.00 0.08 1.55 5.85 -1.32 0.26 115.31 121.35 1k5d h LEU 201 Ca -0.13 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.48 1k5d h LEU 201 Cb 1.58 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.62 1k5d h LEU 201 CO 0.14 0.00 -0.51 -0.33 -0.34 0.00 0.00 178.44 177.40 1k5d h GLU 202 N 0.00 0.18 0.00 1.25 5.08 -1.57 -2.05 114.58 117.46 1k5d h GLU 202 Ca 0.49 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1k5d h GLU 202 Cb 2.17 0.11 0.00 0.00 0.50 0.00 0.00 28.75 31.53 1k5d h GLU 202 CO -0.01 1.14 0.03 0.28 -1.00 0.00 0.00 179.01 179.46 1k5d n VAL 203 N -4.32 0.86 -0.05 3.13 0.31 0.85 -1.46 118.33 117.65 1k5d n VAL 203 Ca -0.13 0.25 -0.08 0.00 -0.01 0.00 0.00 64.34 64.37 1k5d n VAL 203 Cb 0.69 -1.25 -0.05 0.00 -0.91 0.00 0.00 33.84 32.32 1k5d n VAL 203 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k5d n ALA 204 N -1.18 1.83 1.00 3.52 0.00 -0.83 -4.01 120.51 120.83 1k5d n ALA 204 Ca 0.00 -0.46 0.09 0.00 0.00 0.00 0.00 53.44 53.06 1k5d n ALA 204 Cb 0.03 0.26 0.49 0.00 0.00 0.00 0.00 19.45 20.24 1k5d n ALA 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k5d n GLN 205 N -2.91 0.44 -0.11 0.00 10.64 -0.53 -2.96 117.38 121.95 1k5d n GLN 205 Ca -0.20 0.05 -0.19 0.00 -1.83 0.00 0.00 57.00 54.83 1k5d n GLN 205 Cb 0.70 -1.50 -0.08 0.00 -0.86 0.00 0.00 30.24 28.49 1k5d n GLN 205 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1k5d n THR 206 N -1.10 1.18 -1.78 -0.39 -2.24 -0.86 -4.92 114.28 104.17 1k5d n THR 206 Ca 0.11 -0.37 -0.43 0.00 -2.27 0.00 0.00 64.05 61.10 1k5d n THR 206 Cb 0.09 -1.54 -0.03 0.00 -2.10 0.00 0.00 70.33 66.75 1k5d n THR 206 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1k5d s THR 207 N -2.40 3.21 0.97 4.28 2.01 -1.15 -4.95 115.64 117.61 1k5d s THR 207 Ca -0.29 0.21 -0.12 0.00 0.31 0.00 0.00 61.69 61.80 1k5d s THR 207 Cb 0.10 -3.28 0.12 0.00 0.01 0.00 0.00 72.50 69.44 1k5d s THR 207 CO 0.42 -0.18 0.79 0.00 -0.69 0.00 0.00 174.62 174.96 1k5d n ALA 208 N 11.15 -1.91 -2.81 7.40 0.00 -1.26 -4.95 120.51 128.13 1k5d n ALA 208 Ca 0.27 -0.69 -0.36 0.00 0.00 0.00 0.00 53.44 52.66 1k5d n ALA 208 Cb 0.46 -1.99 -0.07 0.00 0.00 0.00 0.00 19.45 17.85 1k5d n ALA 208 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1k5d s LEU 209 N -4.32 4.17 -0.69 0.00 2.01 -1.26 -5.01 118.68 113.58 1k5d s LEU 209 Ca 0.63 0.32 -0.26 0.00 0.01 0.00 0.00 54.13 54.82 1k5d s LEU 209 Cb -0.22 -2.03 -0.13 0.00 0.01 0.00 0.00 46.19 43.82 1k5d s LEU 209 CO 0.63 0.32 2.48 -2.65 1.01 0.00 0.00 176.35 178.14 1k5d n PRO 210 N 2.57 0.64 -1.97 1.29 -0.02 -1.26 -4.84 135.00 131.42 1k5d n PRO 210 Ca -0.18 -0.10 -0.28 0.00 -2.02 0.00 0.00 63.50 60.92 1k5d n PRO 210 Cb 0.54 -2.80 -0.05 0.00 -0.02 0.00 0.00 33.50 31.17 1k5d n PRO 210 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1k5d s ASP 211 N 10.56 4.98 -0.01 2.55 -4.77 -1.26 -4.63 116.67 124.09 1k5d s ASP 211 Ca 1.10 -0.29 0.10 0.00 -3.30 0.00 0.00 52.55 50.17 1k5d s ASP 211 Cb -0.51 -2.55 -0.14 0.00 -1.09 0.00 0.00 42.92 38.63 1k5d s ASP 211 CO 0.32 -2.81 0.33 -0.62 0.70 0.00 0.00 175.17 173.09 1k5d n GLU 212 N 8.93 1.99 0.00 2.11 1.02 -1.26 -5.34 120.64 128.09 1k5d n GLU 212 Ca 0.36 -0.05 0.15 0.00 -0.02 0.00 0.00 57.16 57.61 1k5d n GLU 212 Cb 0.48 -1.12 0.91 0.00 -0.02 0.00 0.00 31.44 31.70 1k5d n GLU 212 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06