#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3nix s GLU 4 N 0.00 3.66 -0.09 -0.14 -1.05 -0.93 -4.94 118.70 115.20 3nix s GLU 4 Ca 0.00 0.03 0.03 0.00 -0.15 0.00 0.00 54.97 54.88 3nix s GLU 4 Cb 0.00 -2.68 0.01 0.00 -0.44 0.00 0.00 34.13 31.02 3nix s GLU 4 CO 0.00 0.27 -0.20 0.15 0.95 0.00 0.00 175.26 176.42 3nix s LYS 5 N -3.31 2.64 0.17 -4.83 3.01 -1.26 -0.96 119.74 115.19 3nix s LYS 5 Ca 0.44 -0.74 0.02 0.00 -1.01 0.00 0.00 55.97 54.69 3nix s LYS 5 Cb -0.11 -2.05 -0.05 0.00 -1.01 0.00 0.00 37.83 34.61 3nix s LYS 5 CO 0.28 0.11 -0.03 0.14 0.51 0.00 0.00 175.35 176.36 3nix s VAL 6 N 0.50 0.81 -0.10 3.17 -7.23 -0.45 -4.99 120.40 112.11 3nix s VAL 6 Ca -0.16 -1.99 -0.18 0.00 -1.81 0.00 0.00 61.98 57.83 3nix s VAL 6 Cb -0.17 -2.04 -0.16 0.00 0.56 0.00 0.00 36.38 34.57 3nix s VAL 6 CO 0.06 -0.56 0.59 0.44 -0.31 0.00 0.00 175.10 175.32 3nix h ASP 7 N 2.72 -0.05 -3.31 4.85 3.32 -1.01 -3.18 116.42 119.75 3nix h ASP 7 Ca -0.37 -0.52 -0.66 0.00 0.02 0.00 0.00 57.03 55.50 3nix h ASP 7 Cb 1.20 0.01 -0.29 0.00 0.22 0.00 0.00 39.33 40.47 3nix h ASP 7 CO 0.63 0.67 -0.80 -0.69 -1.72 0.00 0.00 179.24 177.33 3nix s VAL 8 N -2.40 2.71 -0.25 -1.35 1.01 0.17 -0.70 120.40 119.59 3nix s VAL 8 Ca -0.12 -0.78 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 3nix s VAL 8 Cb -0.01 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 3nix s VAL 8 CO 0.43 0.53 0.13 -0.22 0.00 0.00 0.00 175.10 175.97 3nix s LEU 9 N 0.48 3.80 -0.34 3.92 2.96 0.64 -2.44 118.68 127.70 3nix s LEU 9 Ca -0.11 -0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 53.67 3nix s LEU 9 Cb -0.16 -2.03 0.03 0.00 0.50 0.00 0.00 46.19 44.53 3nix s LEU 9 CO 0.05 -0.01 0.12 -0.69 -1.32 0.00 0.00 176.35 174.50 3nix s VAL 10 N 1.49 3.91 -0.65 1.68 1.01 -0.45 -0.89 120.40 126.50 3nix s VAL 10 Ca 0.06 -1.05 -0.20 0.00 0.00 0.00 0.00 61.98 60.80 3nix s VAL 10 Cb -0.15 -3.19 0.10 0.00 0.00 0.00 0.00 36.38 33.14 3nix s VAL 10 CO 0.07 -0.16 0.84 -0.63 0.00 0.00 0.00 175.10 175.22 3nix s ILE 11 N 1.43 4.63 0.00 2.22 1.01 -0.45 -2.29 121.20 127.76 3nix s ILE 11 Ca -0.01 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.82 3nix s ILE 11 Cb -0.19 -4.59 0.00 0.00 0.01 0.00 0.00 42.46 37.69 3nix s ILE 11 CO 0.03 -1.29 0.00 0.61 0.00 0.00 0.00 174.94 174.30 3nix n GLY 12 N 5.29 3.89 0.86 6.18 0.00 -0.77 -0.95 105.19 119.69 3nix n GLY 12 Ca -0.04 -0.93 0.08 0.00 0.00 0.00 0.00 46.02 45.12 3nix n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3nix n ALA 13 N 0.00 2.78 -1.16 4.61 0.00 -1.26 -3.94 120.51 121.54 3nix n ALA 13 Ca 0.00 -1.94 -0.05 0.00 0.00 0.00 0.00 53.44 51.46 3nix n ALA 13 Cb 0.00 -0.65 0.05 0.00 0.00 0.00 0.00 19.45 18.85 3nix n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3nix n GLY 14 N -0.14 -1.59 0.37 0.00 0.00 -1.26 -4.56 105.19 98.01 3nix n GLY 14 Ca 0.19 -1.62 0.19 0.00 0.00 0.00 0.00 46.02 44.78 3nix n GLY 14 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3nix h PRO 15 N 0.00 0.00 0.01 1.61 0.11 -1.93 -0.67 132.00 131.14 3nix h PRO 15 Ca -0.10 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.80 3nix h PRO 15 Cb 0.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 3nix h PRO 15 CO 0.07 0.00 -0.93 0.00 -0.21 0.00 0.00 178.00 176.92 3nix h ALA 16 N 1.59 0.43 0.17 -0.75 0.00 -1.87 -2.78 119.26 116.05 3nix h ALA 16 Ca 0.15 -0.74 -0.26 0.00 0.00 0.00 0.00 54.91 54.06 3nix h ALA 16 Cb 0.85 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.61 3nix h ALA 16 CO -0.00 0.90 -1.19 0.78 0.00 0.00 0.00 179.25 179.73 3nix h GLY 17 N 1.66 0.40 1.52 0.00 0.00 -1.29 -3.03 103.07 102.32 3nix h GLY 17 Ca -0.06 -1.02 -0.12 0.00 0.00 0.00 0.00 47.33 46.12 3nix h GLY 17 CO 0.15 0.90 -0.38 -0.91 0.00 0.00 0.00 176.54 176.30 3nix h THR 18 N -0.20 1.30 -0.13 4.70 1.35 -1.40 0.20 112.91 118.72 3nix h THR 18 Ca -0.23 -1.52 -0.05 0.00 -0.55 0.00 0.00 66.41 64.07 3nix h THR 18 Cb 1.83 1.52 -0.00 0.00 -1.73 0.00 0.00 68.15 69.77 3nix h THR 18 CO 0.16 0.48 -0.10 0.58 -0.25 0.00 0.00 175.52 176.39 3nix h VAL 19 N 0.45 1.33 0.54 6.82 2.07 -1.64 -1.35 116.25 124.48 3nix h VAL 19 Ca 0.04 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.35 3nix h VAL 19 Cb 0.86 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 3nix h VAL 19 CO 0.07 0.35 -0.45 0.00 0.02 0.00 0.00 177.57 177.56 3nix h ALA 20 N 0.63 -1.05 -0.20 1.67 0.00 -1.43 -1.67 119.26 117.22 3nix h ALA 20 Ca 0.03 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.80 3nix h ALA 20 Cb 0.60 0.62 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 3nix h ALA 20 CO 0.03 -1.12 -0.25 0.00 0.00 0.00 0.00 179.25 177.91 3nix h ALA 21 N -0.75 -0.18 -0.83 0.00 0.00 -0.67 0.11 119.26 116.94 3nix h ALA 21 Ca -0.06 0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.04 3nix h ALA 21 Cb 0.83 0.50 -0.14 0.00 0.00 0.00 0.00 17.79 18.98 3nix h ALA 21 CO -0.01 -0.69 -0.39 1.03 0.00 0.00 0.00 179.25 179.20 3nix h SER 22 N -0.28 -1.39 -0.63 0.00 0.87 -1.16 0.33 113.55 111.30 3nix h SER 22 Ca 0.12 0.28 -0.09 0.00 -1.23 0.00 0.00 61.79 60.87 3nix h SER 22 Cb 0.46 0.70 -0.02 0.00 -0.44 0.00 0.00 62.40 63.10 3nix h SER 22 CO -0.36 -0.30 0.04 -0.07 -0.53 0.00 0.00 176.83 175.62 3nix h LEU 23 N -0.07 1.06 -0.60 2.23 3.38 0.00 0.79 115.31 122.09 3nix h LEU 23 Ca 0.29 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 3nix h LEU 23 Cb 0.57 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3nix h LEU 23 CO -0.86 1.08 -0.13 0.58 0.09 0.00 0.00 178.44 179.20 3nix h VAL 24 N 1.00 1.27 -0.58 1.22 2.07 0.38 -2.74 116.25 118.87 3nix h VAL 24 Ca 0.19 -1.27 -0.10 0.00 0.82 0.00 0.00 66.70 66.33 3nix h VAL 24 Cb 0.51 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3nix h VAL 24 CO 0.02 0.45 -0.03 -1.13 0.02 0.00 0.00 177.57 176.90 3nix h ASN 25 N 0.87 1.02 -0.70 0.57 -0.00 -0.05 -2.85 115.58 114.43 3nix h ASN 25 Ca 0.13 -0.30 0.17 0.00 -0.00 0.00 0.00 56.30 56.30 3nix h ASN 25 Cb 0.68 -0.27 -0.04 0.00 -0.00 0.00 0.00 38.32 38.69 3nix h ASN 25 CO 0.05 1.09 0.48 0.50 -0.00 0.00 0.00 177.43 179.55 3nix h LYS 26 N 0.94 0.23 -0.19 6.67 3.64 -0.56 0.25 116.57 127.55 3nix h LYS 26 Ca 0.16 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3nix h LYS 26 Cb 0.59 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 3nix h LYS 26 CO 0.04 0.15 0.00 0.43 -2.27 0.00 0.00 179.45 177.80 3nix n SER 27 N -4.43 1.29 0.00 4.20 7.64 -1.08 -4.91 113.62 116.33 3nix n SER 27 Ca 0.14 -1.82 0.00 0.00 1.01 0.00 0.00 58.87 58.20 3nix n SER 27 Cb 0.61 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 3nix n SER 27 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3nix n GLY 28 N 0.97 1.07 3.88 0.23 0.00 0.89 -5.04 105.19 107.19 3nix n GLY 28 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3nix n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3nix s PHE 29 N -3.53 3.59 -0.30 1.61 0.40 -1.20 -5.02 117.98 113.53 3nix s PHE 29 Ca 0.00 1.12 -0.25 0.00 -0.60 0.00 0.00 56.93 57.20 3nix s PHE 29 Cb 0.00 -2.62 0.00 0.00 0.51 0.00 0.00 43.02 40.92 3nix s PHE 29 CO 0.00 -0.60 0.87 0.21 0.70 0.00 0.00 175.22 176.40 3nix s LYS 30 N -5.06 4.02 -0.05 0.44 2.20 -1.26 -4.30 119.74 115.73 3nix s LYS 30 Ca 0.53 0.76 0.04 0.00 -0.36 0.00 0.00 55.97 56.94 3nix s LYS 30 Cb -0.11 -3.72 0.00 0.00 -1.51 0.00 0.00 37.83 32.49 3nix s LYS 30 CO 0.51 -0.72 -0.16 0.54 -0.36 0.00 0.00 175.35 175.16 3nix s VAL 31 N 3.13 1.37 -0.04 4.02 0.11 -1.26 -0.40 120.40 127.32 3nix s VAL 31 Ca 0.36 -0.66 0.05 0.00 -2.93 0.00 0.00 61.98 58.81 3nix s VAL 31 Cb -0.14 -1.20 -0.01 0.00 -1.53 0.00 0.00 36.38 33.50 3nix s VAL 31 CO 0.12 0.40 -0.21 -0.75 -3.33 0.00 0.00 175.10 171.34 3nix s LYS 32 N 0.25 2.05 -0.21 1.54 2.20 -1.02 -3.54 119.74 121.01 3nix s LYS 32 Ca -0.08 -0.74 -0.04 0.00 -0.36 0.00 0.00 55.97 54.75 3nix s LYS 32 Cb -0.13 -1.79 -0.01 0.00 -1.51 0.00 0.00 37.83 34.38 3nix s LYS 32 CO 0.03 0.33 -0.04 0.42 -0.36 0.00 0.00 175.35 175.73 3nix s ILE 33 N -0.13 3.44 -0.25 5.43 1.01 -0.46 -1.35 121.20 128.89 3nix s ILE 33 Ca -0.02 -0.48 -0.10 0.00 0.00 0.00 0.00 60.65 60.05 3nix s ILE 33 Cb -0.12 -2.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.75 3nix s ILE 33 CO 0.02 0.43 0.16 0.68 0.00 0.00 0.00 174.94 176.24 3nix s VAL 34 N 1.31 5.30 -0.08 2.92 -7.23 -0.97 -0.40 120.40 121.25 3nix s VAL 34 Ca 0.04 0.16 0.01 0.00 -1.81 0.00 0.00 61.98 60.38 3nix s VAL 34 Cb -0.14 -3.48 0.02 0.00 0.56 0.00 0.00 36.38 33.33 3nix s VAL 34 CO -0.02 0.32 -0.09 -0.70 -0.31 0.00 0.00 175.10 174.30 3nix s GLU 35 N 1.25 1.50 0.18 4.82 2.56 -0.93 -1.85 118.70 126.23 3nix s GLU 35 Ca 0.07 -0.31 -0.02 0.00 0.00 0.00 0.00 54.97 54.71 3nix s GLU 35 Cb -0.14 -1.37 0.09 0.00 2.00 0.00 0.00 34.13 34.71 3nix s GLU 35 CO 0.06 -0.08 1.47 -0.22 -0.56 0.00 0.00 175.26 175.93 3nix h LYS 36 N 7.39 0.47 -7.33 4.30 3.64 -1.78 0.65 116.57 123.91 3nix h LYS 36 Ca -0.31 -0.34 -0.47 0.00 -1.27 0.00 0.00 60.65 58.26 3nix h LYS 36 Cb 1.16 0.06 0.11 0.00 -0.41 0.00 0.00 32.23 33.15 3nix h LYS 36 CO 0.45 0.96 0.20 -0.65 -2.27 0.00 0.00 179.45 178.14 3nix s GLN 37 N -3.80 1.23 -0.03 1.90 -0.21 -1.26 -3.34 119.66 114.15 3nix s GLN 37 Ca -0.06 -1.02 0.01 0.00 0.02 0.00 0.00 55.36 54.31 3nix s GLN 37 Cb 0.11 -2.19 -0.03 0.00 1.00 0.00 0.00 33.01 31.90 3nix s GLN 37 CO 0.84 -1.83 -0.01 0.21 -2.12 0.00 0.00 175.29 172.38 3nix s LYS 38 N -5.39 2.80 -0.07 2.91 2.20 -1.26 -1.94 119.74 119.00 3nix s LYS 38 Ca 0.70 -0.57 -0.04 0.00 -0.36 0.00 0.00 55.97 55.70 3nix s LYS 38 Cb -0.04 -2.67 -0.04 0.00 -1.51 0.00 0.00 37.83 33.57 3nix s LYS 38 CO 0.47 0.64 0.13 -0.06 -0.36 0.00 0.00 175.35 176.18 3nix s PHE 39 N -1.01 3.50 0.64 4.03 0.40 -1.26 -3.56 117.98 120.73 3nix s PHE 39 Ca 0.17 0.40 -0.15 0.00 -0.60 0.00 0.00 56.93 56.76 3nix s PHE 39 Cb -0.11 -1.86 -0.01 0.00 0.51 0.00 0.00 43.02 41.54 3nix s PHE 39 CO 0.07 0.66 1.08 -1.25 0.70 0.00 0.00 175.22 176.49 3nix s PRO 40 N -1.38 3.01 0.01 0.24 0.04 -1.26 -5.11 135.00 130.55 3nix s PRO 40 Ca 0.20 1.26 0.01 0.00 0.04 0.00 0.00 61.00 62.51 3nix s PRO 40 Cb -0.12 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 3nix s PRO 40 CO 0.10 -1.06 -0.04 0.50 0.04 0.00 0.00 177.00 176.53 3nix s ARG 41 N -4.20 0.32 0.24 4.56 3.52 -1.23 -5.03 118.95 117.13 3nix s ARG 41 Ca 0.64 -0.26 -0.29 0.00 -0.13 0.00 0.00 55.73 55.69 3nix s ARG 41 Cb -0.18 -0.25 -0.09 0.00 -1.56 0.00 0.00 34.95 32.87 3nix s ARG 41 CO 0.41 0.06 0.93 0.12 -0.81 0.00 0.00 175.30 176.02 3nix s PHE 42 N -0.39 3.97 0.07 5.12 5.36 -1.26 -2.82 117.98 128.02 3nix s PHE 42 Ca -0.02 1.90 -0.19 0.00 -0.96 0.00 0.00 56.93 57.66 3nix s PHE 42 Cb -0.03 -2.97 0.04 0.00 -0.34 0.00 0.00 43.02 39.72 3nix s PHE 42 CO -0.00 0.45 0.45 0.54 -1.46 0.00 0.00 175.22 175.19 3nix s VAL 43 N -1.21 0.05 0.54 3.12 0.11 -1.26 -4.95 120.40 116.80 3nix s VAL 43 Ca 0.41 -0.40 -0.01 0.00 -2.93 0.00 0.00 61.98 59.05 3nix s VAL 43 Cb -0.25 -1.01 0.02 0.00 -1.53 0.00 0.00 36.38 33.61 3nix s VAL 43 CO 0.31 -0.22 0.79 -0.51 -3.33 0.00 0.00 175.10 172.14 3nix s ILE 44 N -2.80 3.18 0.00 7.04 1.10 -1.26 -4.34 121.20 124.12 3nix s ILE 44 Ca -0.03 -0.47 0.00 0.00 -0.51 0.00 0.00 60.65 59.63 3nix s ILE 44 Cb -0.00 -3.22 0.00 0.00 0.15 0.00 0.00 42.46 39.39 3nix s ILE 44 CO -0.05 -0.17 0.00 0.61 -2.11 0.00 0.00 174.94 173.22 3nix n GLY 45 N -2.36 0.73 0.00 1.50 0.00 -1.26 -5.02 105.19 98.78 3nix n GLY 45 Ca 0.05 -0.73 0.05 0.00 0.00 0.00 0.00 46.02 45.39 3nix n GLY 45 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3nix n GLU 46 N 0.00 2.75 -3.91 1.61 1.02 -1.26 -4.74 120.64 116.11 3nix n GLU 46 Ca 0.00 -0.03 -0.36 0.00 -0.02 0.00 0.00 57.16 56.76 3nix n GLU 46 Cb 0.00 -1.04 -0.11 0.00 -0.02 0.00 0.00 31.44 30.27 3nix n GLU 46 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3nix s SER 47 N -2.28 5.31 0.64 1.62 0.15 -1.26 -0.46 113.70 117.42 3nix s SER 47 Ca 0.01 -0.09 0.02 0.00 0.70 0.00 0.00 55.95 56.59 3nix s SER 47 Cb 0.07 -1.93 0.09 0.00 -1.71 0.00 0.00 66.02 62.54 3nix s SER 47 CO 0.39 0.06 0.88 -0.76 1.20 0.00 0.00 173.24 175.02 3nix s LEU 48 N 1.07 3.11 -0.02 3.45 1.02 -0.88 -4.74 118.68 121.69 3nix s LEU 48 Ca 0.04 -0.33 0.05 0.00 0.02 0.00 0.00 54.13 53.91 3nix s LEU 48 Cb -0.14 -2.22 -0.01 0.00 0.02 0.00 0.00 46.19 43.84 3nix s LEU 48 CO 0.03 -1.54 -0.16 -0.76 0.02 0.00 0.00 176.35 173.95 3nix s LEU 49 N -4.93 2.01 0.52 1.79 1.43 -1.26 -4.80 118.68 113.43 3nix s LEU 49 Ca 0.63 -0.29 0.47 0.00 -1.03 0.00 0.00 54.13 53.90 3nix s LEU 49 Cb -0.07 -0.83 1.63 0.00 0.03 0.00 0.00 46.19 46.95 3nix s LEU 49 CO 0.41 0.19 1.48 -2.65 0.23 0.00 0.00 176.35 176.01 3nix n PRO 50 N 2.75 -0.00 -0.32 1.29 -0.02 -1.24 0.17 135.00 137.62 3nix n PRO 50 Ca -0.15 1.04 -0.04 0.00 -2.02 0.00 0.00 63.50 62.33 3nix n PRO 50 Cb 0.54 -2.37 0.09 0.00 -0.02 0.00 0.00 33.50 31.75 3nix n PRO 50 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3nix h ARG 51 N 0.00 1.23 -3.55 -0.52 9.65 -1.74 -3.39 114.38 116.06 3nix h ARG 51 Ca 0.89 -0.16 -0.05 0.00 -1.10 0.00 0.00 59.98 59.56 3nix h ARG 51 Cb 3.52 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 31.87 3nix h ARG 51 CO -0.04 0.92 1.00 0.00 2.80 0.00 0.00 179.97 184.64 3nix n GLU 54 N 4.20 0.00 0.05 0.00 1.02 -1.26 -1.59 120.64 123.06 3nix n GLU 54 Ca 0.07 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.07 3nix n GLU 54 Cb 0.05 -0.16 -0.14 0.00 -0.02 0.00 0.00 31.44 31.17 3nix n GLU 54 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3nix h HIS 55 N 0.00 0.34 0.13 -0.32 3.86 -1.96 -1.35 115.15 115.85 3nix h HIS 55 Ca 0.00 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 58.96 3nix h HIS 55 Cb 0.00 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3nix h HIS 55 CO 0.00 1.29 -0.06 -0.07 0.86 0.00 0.00 177.93 179.95 3nix h LEU 56 N 0.05 -0.15 0.05 2.43 4.07 -1.65 0.78 115.31 120.88 3nix h LEU 56 Ca -0.22 -0.05 0.03 0.00 0.08 0.00 0.00 57.88 57.72 3nix h LEU 56 Cb 1.98 0.04 -0.05 0.00 1.08 0.00 0.00 40.66 43.71 3nix h LEU 56 CO 0.15 -0.05 -0.34 -0.78 -1.08 0.00 0.00 178.44 176.33 3nix h ASP 57 N -0.24 -1.01 0.31 -0.43 1.82 -1.81 -0.33 116.42 114.73 3nix h ASP 57 Ca -0.02 0.12 -0.02 0.00 -0.39 0.00 0.00 57.03 56.72 3nix h ASP 57 Cb 0.19 0.40 -0.00 0.00 0.68 0.00 0.00 39.33 40.59 3nix h ASP 57 CO 0.03 -0.41 -0.11 -0.08 -1.61 0.00 0.00 179.24 177.06 3nix h GLU 58 N -0.53 0.00 -0.03 0.28 4.81 -1.03 -1.65 114.58 116.42 3nix h GLU 58 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3nix h GLU 58 Cb 0.59 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.97 3nix h GLU 58 CO -0.25 0.11 0.00 0.00 -0.73 0.00 0.00 179.01 178.14 3nix n ALA 59 N -2.30 2.56 -3.30 2.92 0.00 0.25 -4.93 120.51 115.71 3nix n ALA 59 Ca -0.02 -0.48 -0.17 0.00 0.00 0.00 0.00 53.44 52.77 3nix n ALA 59 Cb 0.22 -1.12 0.06 0.00 0.00 0.00 0.00 19.45 18.61 3nix n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3nix n GLY 60 N 1.19 -0.20 0.00 0.00 0.00 -0.62 -4.93 105.19 100.64 3nix n GLY 60 Ca 0.18 0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.29 3nix n GLY 60 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3nix n PHE 61 N -4.24 0.00 0.22 1.61 3.01 -0.17 -4.69 117.46 113.20 3nix n PHE 61 Ca -0.04 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.27 3nix n PHE 61 Cb 0.56 -0.20 -0.07 0.00 -0.01 0.00 0.00 39.48 39.76 3nix n PHE 61 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 3nix h LEU 62 N 0.00 -0.90 -0.88 4.37 3.38 -1.85 0.11 115.31 119.54 3nix h LEU 62 Ca 0.00 0.08 0.18 0.00 0.09 0.00 0.00 57.88 58.23 3nix h LEU 62 Cb 0.46 0.30 -0.17 0.00 0.09 0.00 0.00 40.66 41.34 3nix h LEU 62 CO 0.00 -0.47 -0.18 0.44 0.09 0.00 0.00 178.44 178.31 3nix h ASP 63 N -0.70 -0.76 0.65 -0.43 3.32 -1.92 -0.79 116.42 115.79 3nix h ASP 63 Ca -0.02 0.26 -0.15 0.00 0.02 0.00 0.00 57.03 57.14 3nix h ASP 63 Cb 0.63 0.53 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 3nix h ASP 63 CO -0.05 -0.29 -0.69 0.00 -1.72 0.00 0.00 179.24 176.49 3nix h ALA 64 N 1.88 0.85 -0.22 3.45 0.00 -1.64 -2.70 119.26 120.87 3nix h ALA 64 Ca 0.44 -0.62 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 3nix h ALA 64 Cb 0.70 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3nix h ALA 64 CO -0.89 0.85 -0.48 0.28 0.00 0.00 0.00 179.25 179.01 3nix h VAL 65 N 0.02 1.31 -0.50 0.00 2.07 0.08 -3.11 116.25 116.11 3nix h VAL 65 Ca -0.01 -1.69 -0.00 0.00 0.82 0.00 0.00 66.70 65.82 3nix h VAL 65 Cb 1.22 1.65 -0.02 0.00 -1.52 0.00 0.00 31.29 32.62 3nix h VAL 65 CO 0.09 0.53 0.30 0.11 0.02 0.00 0.00 177.57 178.63 3nix h LYS 66 N 0.47 0.67 -0.21 1.57 1.57 -0.92 -2.95 116.57 116.77 3nix h LYS 66 Ca 0.02 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 3nix h LYS 66 Cb 1.01 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.16 3nix h LYS 66 CO 0.09 0.47 -0.11 0.00 -0.57 0.00 0.00 179.45 179.34 3nix h ALA 67 N 1.65 1.44 0.00 3.86 0.00 -1.41 -2.60 119.26 122.19 3nix h ALA 67 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3nix h ALA 67 Cb -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3nix h ALA 67 CO -0.03 0.39 0.00 1.04 0.00 0.00 0.00 179.25 180.65 3nix n GLN 68 N -4.26 0.16 -3.46 0.00 1.13 -1.11 -4.92 117.38 104.91 3nix n GLN 68 Ca -0.00 0.36 -0.19 0.00 -1.94 0.00 0.00 57.00 55.24 3nix n GLN 68 Cb 0.27 -1.80 0.07 0.00 0.11 0.00 0.00 30.24 28.89 3nix n GLN 68 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3nix n GLY 69 N 0.16 -0.64 3.78 1.08 0.00 -0.98 -4.96 105.19 103.63 3nix n GLY 69 Ca 0.03 0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.98 3nix n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3nix s PHE 70 N -3.45 2.91 0.17 1.61 0.08 -1.26 -4.80 117.98 113.23 3nix s PHE 70 Ca 0.18 1.57 -0.33 0.00 0.12 0.00 0.00 56.93 58.46 3nix s PHE 70 Cb -0.03 -3.21 -0.15 0.00 -0.57 0.00 0.00 43.02 39.06 3nix s PHE 70 CO 0.76 -1.17 1.35 0.94 -0.10 0.00 0.00 175.22 177.01 3nix n GLN 71 N -0.84 1.59 -3.21 0.44 -0.06 -1.25 -4.90 117.38 109.14 3nix n GLN 71 Ca 0.09 0.57 -0.34 0.00 -2.00 0.00 0.00 57.00 55.32 3nix n GLN 71 Cb 0.51 -2.20 -0.06 0.00 -4.06 0.00 0.00 30.24 24.43 3nix n GLN 71 CO 0.00 0.00 0.00 -0.65 -0.20 0.00 0.00 177.06 176.21 3nix s GLN 72 N 0.05 4.05 -0.13 3.69 -0.21 -1.26 -2.18 119.66 123.67 3nix s GLN 72 Ca 0.75 0.65 0.00 0.00 0.02 0.00 0.00 55.36 56.78 3nix s GLN 72 Cb -0.78 -2.72 -0.01 0.00 1.00 0.00 0.00 33.01 30.50 3nix s GLN 72 CO 0.48 0.33 -0.15 0.21 -2.12 0.00 0.00 175.29 174.03 3nix s LYS 73 N -2.40 3.31 0.00 2.91 2.20 0.27 -4.52 119.74 121.51 3nix s LYS 73 Ca 0.46 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 55.35 3nix s LYS 73 Cb -0.14 -2.59 0.00 0.00 -1.51 0.00 0.00 37.83 33.60 3nix s LYS 73 CO 0.19 0.17 0.45 1.19 -0.36 0.00 0.00 175.35 177.00 3nix n PHE 74 N 3.62 0.00 -3.33 4.03 3.72 0.21 -1.95 117.46 123.76 3nix n PHE 74 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 3nix n PHE 74 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 3nix n PHE 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3nix n GLY 75 N 0.01 -1.35 3.04 1.37 0.00 -1.17 0.32 105.19 107.41 3nix n GLY 75 Ca 0.00 -1.02 -0.21 0.00 0.00 0.00 0.00 46.02 44.79 3nix n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3nix s ALA 76 N -1.05 0.94 0.04 4.61 0.00 -0.38 -2.93 121.76 122.99 3nix s ALA 76 Ca 0.00 -0.43 0.07 0.00 0.00 0.00 0.00 51.96 51.60 3nix s ALA 76 Cb 0.00 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 3nix s ALA 76 CO 0.00 0.19 -0.20 0.21 0.00 0.00 0.00 175.76 175.96 3nix s LYS 77 N -0.05 2.03 -0.07 0.00 2.20 -0.47 -0.36 119.74 123.02 3nix s LYS 77 Ca 0.01 -1.00 0.03 0.00 -0.36 0.00 0.00 55.97 54.65 3nix s LYS 77 Cb -0.07 -2.14 0.00 0.00 -1.51 0.00 0.00 37.83 34.11 3nix s LYS 77 CO 0.00 0.54 -0.17 -0.06 -0.36 0.00 0.00 175.35 175.30 3nix s PHE 78 N -0.88 1.82 -0.11 4.03 0.08 0.45 -1.87 117.98 121.49 3nix s PHE 78 Ca 0.14 -0.64 0.03 0.00 0.12 0.00 0.00 56.93 56.58 3nix s PHE 78 Cb -0.10 -1.26 0.00 0.00 -0.57 0.00 0.00 43.02 41.09 3nix s PHE 78 CO 0.04 -0.27 -0.23 0.08 -0.10 0.00 0.00 175.22 174.74 3nix s VAL 79 N 0.36 2.09 -0.27 -0.44 1.01 -0.35 -1.75 120.40 121.04 3nix s VAL 79 Ca -0.12 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 60.86 3nix s VAL 79 Cb -0.15 -1.80 0.08 0.00 0.00 0.00 0.00 36.38 34.51 3nix s VAL 79 CO 0.04 0.56 0.04 -0.60 0.00 0.00 0.00 175.10 175.14 3nix s ARG 80 N 0.46 1.06 6.06 2.72 3.52 -0.38 -0.01 118.95 132.38 3nix s ARG 80 Ca -0.16 -1.03 0.00 0.00 -0.13 0.00 0.00 55.73 54.41 3nix s ARG 80 Cb -0.17 -2.33 0.00 0.00 -1.56 0.00 0.00 34.95 30.88 3nix s ARG 80 CO 0.06 -0.81 0.00 0.41 -0.81 0.00 0.00 175.30 174.15 3nix n GLY 81 N 4.76 2.25 0.33 8.12 0.00 -1.26 -1.03 105.19 118.36 3nix n GLY 81 Ca -0.05 0.35 0.08 0.00 0.00 0.00 0.00 46.02 46.40 3nix n GLY 81 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3nix n LYS 82 N 4.41 1.58 -2.75 1.61 4.76 -1.26 -4.82 118.16 121.69 3nix n LYS 82 Ca 0.00 -0.71 -0.41 0.00 -2.87 0.00 0.00 58.31 54.32 3nix n LYS 82 Cb 0.00 -1.31 -0.04 0.00 -1.84 0.00 0.00 35.03 31.84 3nix n LYS 82 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3nix s GLU 83 N -2.11 4.67 -0.05 1.97 2.02 -0.20 -5.05 118.70 119.95 3nix s GLU 83 Ca 0.13 1.42 0.03 0.00 0.02 0.00 0.00 54.97 56.57 3nix s GLU 83 Cb 0.14 -3.39 0.00 0.00 0.10 0.00 0.00 34.13 30.98 3nix s GLU 83 CO 0.48 0.19 -0.14 0.42 0.02 0.00 0.00 175.26 176.23 3nix s ILE 84 N 0.12 1.21 -0.26 -1.63 1.01 -1.26 -1.25 121.20 119.14 3nix s ILE 84 Ca 0.47 -0.57 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 3nix s ILE 84 Cb -0.23 -1.07 0.03 0.00 0.01 0.00 0.00 42.46 41.20 3nix s ILE 84 CO 0.29 0.36 -0.04 0.00 0.00 0.00 0.00 174.94 175.55 3nix s ALA 85 N 0.28 2.75 -0.12 9.38 0.00 -0.72 -4.96 121.76 128.37 3nix s ALA 85 Ca -0.07 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.41 3nix s ALA 85 Cb -0.12 -1.76 -0.02 0.00 0.00 0.00 0.00 23.12 21.22 3nix s ALA 85 CO 0.02 -0.85 -0.13 0.34 0.00 0.00 0.00 175.76 175.14 3nix s ASP 86 N 1.34 4.02 -0.20 0.00 2.15 -1.26 -0.41 116.67 122.31 3nix s ASP 86 Ca 0.00 -0.30 0.01 0.00 0.43 0.00 0.00 52.55 52.69 3nix s ASP 86 Cb -0.17 -1.48 0.03 0.00 -0.30 0.00 0.00 42.92 41.00 3nix s ASP 86 CO -0.03 0.20 -0.18 -0.36 -0.17 0.00 0.00 175.17 174.62 3nix s PHE 87 N 0.16 2.90 -0.33 -5.34 0.40 0.51 -5.01 117.98 111.27 3nix s PHE 87 Ca -0.07 -1.81 -0.14 0.00 -0.60 0.00 0.00 56.93 54.31 3nix s PHE 87 Cb -0.15 -1.92 -0.02 0.00 0.51 0.00 0.00 43.02 41.44 3nix s PHE 87 CO 0.05 -0.83 0.30 1.21 0.70 0.00 0.00 175.22 176.66 3nix s ASN 88 N 1.25 6.13 0.36 1.36 3.84 -1.26 -1.25 114.94 125.37 3nix s ASN 88 Ca 0.02 -0.25 0.24 0.00 0.21 0.00 0.00 52.86 53.08 3nix s ASN 88 Cb -0.15 -2.17 1.32 0.00 -0.55 0.00 0.00 41.25 39.71 3nix s ASN 88 CO -0.11 -0.27 1.75 -0.26 -2.79 0.00 0.00 177.10 175.42 3nix h PHE 89 N 8.45 0.00 0.00 0.43 0.04 -0.39 0.15 116.94 125.62 3nix h PHE 89 Ca -0.31 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.46 3nix h PHE 89 Cb 1.15 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.30 3nix h PHE 89 CO 0.69 0.00 0.00 0.77 -0.60 0.00 0.00 178.31 179.17 3nix h SER 90 N 0.00 0.00 -3.84 2.17 0.02 -1.75 -3.38 113.55 106.76 3nix h SER 90 Ca 0.00 0.00 -0.72 0.00 -0.84 0.00 0.00 61.79 60.23 3nix h SER 90 Cb 0.00 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 62.20 3nix h SER 90 CO 0.00 0.00 -0.18 -0.62 -1.14 0.00 0.00 176.83 174.89 3nix s ASP 91 N -6.14 5.76 0.26 3.07 2.15 0.53 -5.07 116.67 117.23 3nix s ASP 91 Ca 0.07 -3.15 0.01 0.00 0.43 0.00 0.00 52.55 49.91 3nix s ASP 91 Cb 0.05 -1.93 -0.04 0.00 -0.30 0.00 0.00 42.92 40.70 3nix s ASP 91 CO 0.66 -0.33 0.14 0.00 -0.17 0.00 0.00 175.17 175.47 3nix s GLN 92 N -0.50 1.41 -0.10 4.34 -2.07 -1.26 -4.72 119.66 116.75 3nix s GLN 92 Ca 0.21 -1.77 -0.18 0.00 -1.82 0.00 0.00 55.36 51.80 3nix s GLN 92 Cb -0.14 0.00 -0.15 0.00 -1.09 0.00 0.00 33.01 31.63 3nix s GLN 92 CO -0.07 -0.39 0.56 0.35 -1.32 0.00 0.00 175.29 174.42 3nix h PHE 93 N 2.40 -0.05 -4.36 9.60 3.57 -1.83 -3.46 116.94 122.80 3nix h PHE 93 Ca -0.35 -0.00 -0.50 0.00 3.53 0.00 0.00 57.97 60.65 3nix h PHE 93 Cb 1.25 0.02 0.07 0.00 2.79 0.00 0.00 35.95 40.07 3nix h PHE 93 CO 0.66 0.48 0.40 -1.12 -2.23 0.00 0.00 178.31 176.50 3nix s SER 94 N -5.81 5.82 0.00 0.41 0.01 -1.26 -5.08 113.70 107.79 3nix s SER 94 Ca -0.11 1.23 0.00 0.00 1.31 0.00 0.00 55.95 58.38 3nix s SER 94 Cb -0.01 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.05 3nix s SER 94 CO 0.42 -1.10 0.00 0.59 0.41 0.00 0.00 173.24 173.56 3nix n ASN 95 N -2.85 0.00 0.00 2.44 3.02 -1.26 -4.99 115.26 111.62 3nix n ASN 95 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 3nix n ASN 95 Cb 0.56 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 3nix n ASN 95 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3nix n GLY 96 N 5.00 -0.71 3.69 7.41 0.00 -1.26 -4.98 105.19 114.34 3nix n GLY 96 Ca 0.00 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 3nix n GLY 96 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3nix s TRP 97 N -1.31 1.94 -0.00 1.61 0.52 -1.26 -4.99 118.94 115.45 3nix s TRP 97 Ca 0.00 1.64 0.00 0.00 0.02 0.00 0.00 56.10 57.76 3nix s TRP 97 Cb 0.00 -3.22 0.01 0.00 -1.15 0.00 0.00 33.47 29.11 3nix s TRP 97 CO 0.00 -2.55 0.76 0.27 0.02 0.00 0.00 176.95 175.45 3nix n ASN 98 N -4.04 0.97 -3.69 2.95 2.04 -1.26 -4.82 115.26 107.41 3nix n ASN 98 Ca 0.10 -1.54 -0.09 0.00 -0.44 0.00 0.00 54.58 52.61 3nix n ASN 98 Cb 0.53 -0.02 -0.03 0.00 -2.53 0.00 0.00 39.78 37.73 3nix n ASN 98 CO 0.00 0.00 0.00 -1.66 -0.44 0.00 0.00 177.26 175.16 3nix s TRP 99 N -0.53 -0.26 0.00 -2.53 1.48 -1.26 -4.33 118.94 111.50 3nix s TRP 99 Ca 0.01 -0.08 0.00 0.00 -1.06 0.00 0.00 56.10 54.96 3nix s TRP 99 Cb 0.01 0.55 0.00 0.00 -1.16 0.00 0.00 33.47 32.87 3nix s TRP 99 CO 0.00 -1.01 0.00 -2.37 -4.06 0.00 0.00 176.95 169.51 3nix n THR 100 N -0.39 0.00 -4.32 0.66 5.66 -0.82 -4.43 114.28 110.63 3nix n THR 100 Ca -0.10 0.00 -0.23 0.00 -3.05 0.00 0.00 64.05 60.67 3nix n THR 100 Cb 0.62 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.28 3nix n THR 100 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 3nix s TRP 101 N -3.44 1.84 -0.13 1.09 0.51 -1.26 0.95 118.94 118.49 3nix s TRP 101 Ca 0.00 -0.44 -0.05 0.00 -2.12 0.00 0.00 56.10 53.49 3nix s TRP 101 Cb 0.00 -0.95 -0.04 0.00 -0.81 0.00 0.00 33.47 31.67 3nix s TRP 101 CO 0.00 0.29 0.06 -0.65 -0.51 0.00 0.00 176.95 176.14 3nix s GLN 102 N -2.43 3.49 -0.13 4.98 -0.21 -0.93 -2.08 119.66 122.36 3nix s GLN 102 Ca 0.12 -0.32 -0.09 0.00 0.02 0.00 0.00 55.36 55.09 3nix s GLN 102 Cb -0.08 -3.05 0.04 0.00 1.00 0.00 0.00 33.01 30.92 3nix s GLN 102 CO 0.06 0.54 0.32 0.14 -2.12 0.00 0.00 175.29 174.23 3nix s VAL 103 N -0.41 -0.02 0.11 1.09 -7.23 0.39 -3.89 120.40 110.45 3nix s VAL 103 Ca 0.09 0.06 -0.31 0.00 -1.81 0.00 0.00 61.98 60.01 3nix s VAL 103 Cb -0.12 -0.46 -0.08 0.00 0.56 0.00 0.00 36.38 36.28 3nix s VAL 103 CO 0.02 0.02 1.38 -2.84 -0.31 0.00 0.00 175.10 173.37 3nix s PRO 104 N 0.72 4.33 0.28 4.82 0.02 -1.26 -4.54 135.00 139.35 3nix s PRO 104 Ca -0.04 2.06 0.13 0.00 0.02 0.00 0.00 61.00 63.16 3nix s PRO 104 Cb -0.06 -3.25 0.32 0.00 0.02 0.00 0.00 34.50 31.53 3nix s PRO 104 CO -0.05 -0.43 1.57 0.00 -0.33 0.00 0.00 177.00 177.77 3nix h ARG 105 N 6.78 0.00 0.47 5.54 2.47 -1.89 -2.28 114.38 125.48 3nix h ARG 105 Ca -0.42 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.28 3nix h ARG 105 Cb 1.21 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.52 3nix h ARG 105 CO 0.86 0.61 -0.38 0.78 0.56 0.00 0.00 179.97 182.40 3nix h GLY 106 N 2.28 -1.12 0.59 0.04 0.00 -1.80 -0.07 103.07 102.99 3nix h GLY 106 Ca -0.01 0.49 0.01 0.00 0.00 0.00 0.00 47.33 47.83 3nix h GLY 106 CO 0.08 -0.36 -0.26 3.43 0.00 0.00 0.00 176.54 179.43 3nix h ASN 107 N -0.83 -0.73 -0.34 0.19 2.35 -1.82 -0.88 115.58 113.52 3nix h ASN 107 Ca -0.06 0.08 0.08 0.00 -0.55 0.00 0.00 56.30 55.84 3nix h ASN 107 Cb 0.69 0.27 -0.08 0.00 0.05 0.00 0.00 38.32 39.25 3nix h ASN 107 CO 0.00 -0.36 -0.24 0.15 -1.65 0.00 0.00 177.43 175.34 3nix h PHE 108 N -0.50 -0.63 -0.53 1.19 3.57 -1.38 0.45 116.94 119.11 3nix h PHE 108 Ca 0.02 0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.49 3nix h PHE 108 Cb 0.50 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.55 3nix h PHE 108 CO -0.22 -0.31 0.03 -0.44 -2.23 0.00 0.00 178.31 175.13 3nix h ASP 109 N -0.20 0.90 -0.47 0.41 5.19 -0.86 -0.67 116.42 120.72 3nix h ASP 109 Ca 0.17 -0.29 0.04 0.00 -0.62 0.00 0.00 57.03 56.33 3nix h ASP 109 Cb 0.46 -0.24 -0.04 0.00 0.18 0.00 0.00 39.33 39.69 3nix h ASP 109 CO -0.46 0.97 0.22 0.50 -3.12 0.00 0.00 179.24 177.35 3nix h LYS 110 N 0.80 0.43 -0.85 3.56 3.64 -0.64 0.11 116.57 123.62 3nix h LYS 110 Ca 0.15 -0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.63 3nix h LYS 110 Cb 0.49 -0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 32.13 3nix h LYS 110 CO 0.02 0.28 0.47 1.15 -2.27 0.00 0.00 179.45 179.10 3nix h THR 111 N 0.44 0.83 -0.17 1.00 2.02 0.46 -0.12 112.91 117.37 3nix h THR 111 Ca 0.21 -0.25 -0.10 0.00 0.77 0.00 0.00 66.41 67.04 3nix h THR 111 Cb 0.14 0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.58 3nix h THR 111 CO -0.16 0.13 -0.29 -0.07 0.37 0.00 0.00 175.52 175.50 3nix h LEU 112 N 0.73 0.55 -0.61 2.58 4.07 0.01 -2.49 115.31 120.15 3nix h LEU 112 Ca 0.43 -0.54 -0.12 0.00 0.08 0.00 0.00 57.88 57.73 3nix h LEU 112 Cb 0.50 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 3nix h LEU 112 CO -0.30 0.98 -0.25 0.00 -1.08 0.00 0.00 178.44 177.80 3nix h ALA 113 N 0.58 0.80 -0.11 1.53 0.00 -0.59 -1.02 119.26 120.46 3nix h ALA 113 Ca 0.01 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.54 3nix h ALA 113 Cb 0.88 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3nix h ALA 113 CO 0.07 0.65 0.03 -0.44 0.00 0.00 0.00 179.25 179.55 3nix h ASP 114 N 0.72 0.02 -1.00 0.00 3.32 -1.09 0.26 116.42 118.65 3nix h ASP 114 Ca 0.09 0.01 0.08 0.00 0.02 0.00 0.00 57.03 57.24 3nix h ASP 114 Cb 0.78 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 40.28 3nix h ASP 114 CO 0.06 0.03 0.64 -0.08 -1.72 0.00 0.00 179.24 178.17 3nix h GLU 115 N 0.07 1.09 -0.35 3.56 4.57 -1.26 0.15 114.58 122.41 3nix h GLU 115 Ca 0.05 -0.07 -0.11 0.00 -1.18 0.00 0.00 59.36 58.05 3nix h GLU 115 Cb 0.03 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.37 3nix h GLU 115 CO -0.06 0.72 -0.19 0.00 -1.18 0.00 0.00 179.01 178.30 3nix h ALA 116 N 1.48 0.49 -0.10 2.92 0.00 -0.60 -2.74 119.26 120.71 3nix h ALA 116 Ca 0.45 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 55.03 3nix h ALA 116 Cb 0.26 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3nix h ALA 116 CO -0.19 0.44 -0.09 0.00 0.00 0.00 0.00 179.25 179.41 3nix h ALA 117 N 0.78 -0.00 -0.28 0.00 0.00 0.52 -0.76 119.26 119.51 3nix h ALA 117 Ca 0.07 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.11 3nix h ALA 117 Cb 0.74 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3nix h ALA 117 CO 0.06 -0.55 0.34 -0.09 0.00 0.00 0.00 179.25 179.01 3nix h ARG 118 N -0.10 0.00 -0.00 0.00 2.43 -0.66 -0.64 114.38 115.41 3nix h ARG 118 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3nix h ARG 118 Cb 0.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 3nix h ARG 118 CO -0.16 0.00 -0.35 1.04 -1.51 0.00 0.00 179.97 178.98 3nix n GLN 119 N -3.64 0.32 0.00 0.20 6.02 -0.36 -4.91 117.38 115.00 3nix n GLN 119 Ca 0.04 -0.17 0.00 0.00 -0.01 0.00 0.00 57.00 56.86 3nix n GLN 119 Cb 0.48 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.24 3nix n GLN 119 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3nix n GLY 120 N 1.43 1.39 3.67 1.08 0.00 -0.25 -4.98 105.19 107.54 3nix n GLY 120 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 3nix n GLY 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3nix s VAL 121 N -2.00 3.84 -0.21 1.61 1.01 -0.78 -4.91 120.40 118.97 3nix s VAL 121 Ca 0.00 1.10 -0.21 0.00 0.00 0.00 0.00 61.98 62.87 3nix s VAL 121 Cb 0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3nix s VAL 121 CO 0.00 -0.06 0.65 1.51 0.00 0.00 0.00 175.10 177.20 3nix s ASP 122 N 2.42 6.69 -0.23 3.32 1.47 -1.23 -3.67 116.67 125.44 3nix s ASP 122 Ca 0.64 0.84 -0.03 0.00 1.18 0.00 0.00 52.55 55.18 3nix s ASP 122 Cb -0.29 -2.36 0.00 0.00 -0.34 0.00 0.00 42.92 39.93 3nix s ASP 122 CO 0.24 -0.31 -0.04 -0.69 0.68 0.00 0.00 175.17 175.04 3nix s VAL 123 N 2.08 3.26 -0.30 2.11 1.01 -1.26 -1.36 120.40 125.94 3nix s VAL 123 Ca 0.29 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 3nix s VAL 123 Cb -0.16 -2.52 0.04 0.00 0.00 0.00 0.00 36.38 33.74 3nix s VAL 123 CO 0.10 0.36 0.02 -0.70 0.00 0.00 0.00 175.10 174.88 3nix s GLU 124 N 1.44 2.55 0.71 2.72 2.12 0.46 -4.99 118.70 123.72 3nix s GLU 124 Ca 0.05 -1.20 -0.06 0.00 0.36 0.00 0.00 54.97 54.12 3nix s GLU 124 Cb -0.15 -3.24 0.07 0.00 0.26 0.00 0.00 34.13 31.08 3nix s GLU 124 CO -0.04 -0.60 1.01 0.71 -0.54 0.00 0.00 175.26 175.81 3nix s TYR 125 N 1.31 2.69 -1.46 5.30 2.02 -1.26 -2.19 117.35 123.76 3nix s TYR 125 Ca -0.04 0.32 0.00 0.00 -0.37 0.00 0.00 57.07 56.99 3nix s TYR 125 Cb -0.19 -3.20 0.00 0.00 -0.40 0.00 0.00 41.96 38.17 3nix s TYR 125 CO -0.00 -1.48 0.00 0.39 -1.57 0.00 0.00 175.55 172.89 3nix n GLU 126 N -2.92 -1.62 -4.71 -0.62 1.02 0.17 -4.87 120.64 107.10 3nix n GLU 126 Ca 0.09 0.81 -0.33 0.00 -0.02 0.00 0.00 57.16 57.71 3nix n GLU 126 Cb 0.60 -5.23 -0.12 0.00 -0.02 0.00 0.00 31.44 26.68 3nix n GLU 126 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3nix s VAL 127 N -2.45 3.45 -0.16 2.62 1.01 -0.90 -3.96 120.40 120.01 3nix s VAL 127 Ca 0.00 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.43 3nix s VAL 127 Cb 0.00 -2.41 0.01 0.00 0.00 0.00 0.00 36.38 33.98 3nix s VAL 127 CO 0.00 0.58 -0.19 -0.83 0.00 0.00 0.00 175.10 174.66 3nix s GLY 128 N -0.56 1.41 0.27 4.51 0.00 -0.40 -2.35 107.32 110.19 3nix s GLY 128 Ca 0.08 -1.12 -0.31 0.00 0.00 0.00 0.00 44.72 43.37 3nix s GLY 128 CO 0.02 0.11 1.52 -0.62 0.00 0.00 0.00 173.10 174.12 3nix n VAL 129 N 4.27 0.97 0.00 1.40 0.31 -1.26 -0.76 118.33 123.26 3nix n VAL 129 Ca -0.20 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 3nix n VAL 129 Cb 0.51 -1.76 0.00 0.00 -0.91 0.00 0.00 33.84 31.69 3nix n VAL 129 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3nix n THR 130 N 2.09 0.00 -3.61 2.52 -1.04 0.32 -4.89 114.28 109.67 3nix n THR 130 Ca 0.10 -0.17 -0.02 0.00 -2.04 0.00 0.00 64.05 61.93 3nix n THR 130 Cb 0.34 0.66 -0.01 0.00 -1.82 0.00 0.00 70.33 69.50 3nix n THR 130 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3nix s ASP 131 N -1.52 -0.07 -0.15 8.00 2.15 -1.13 -4.97 116.67 118.98 3nix s ASP 131 Ca 0.00 -0.03 -0.08 0.00 0.43 0.00 0.00 52.55 52.87 3nix s ASP 131 Cb 0.00 0.10 0.05 0.00 -0.30 0.00 0.00 42.92 42.78 3nix s ASP 131 CO 0.00 -0.17 0.36 -0.63 -0.17 0.00 0.00 175.17 174.55 3nix s ILE 132 N -2.28 -0.03 -0.14 4.11 1.01 -1.26 -1.24 121.20 121.36 3nix s ILE 132 Ca 0.12 0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.88 3nix s ILE 132 Cb 0.01 -0.53 0.02 0.00 0.01 0.00 0.00 42.46 41.97 3nix s ILE 132 CO -0.04 0.04 -0.15 -0.54 0.00 0.00 0.00 174.94 174.25 3nix s LYS 133 N 1.34 2.36 -0.11 2.79 3.01 -0.47 -4.99 119.74 123.67 3nix s LYS 133 Ca -0.09 -0.59 -0.13 0.00 -1.01 0.00 0.00 55.97 54.15 3nix s LYS 133 Cb -0.09 -2.11 -0.05 0.00 -1.01 0.00 0.00 37.83 34.57 3nix s LYS 133 CO -0.11 -0.19 0.30 -0.06 0.51 0.00 0.00 175.35 175.79 3nix s PHE 134 N 1.35 3.56 -0.33 3.18 0.08 -1.26 -1.66 117.98 122.90 3nix s PHE 134 Ca 0.02 0.69 0.01 0.00 0.12 0.00 0.00 56.93 57.78 3nix s PHE 134 Cb -0.13 -2.26 0.10 0.00 -0.57 0.00 0.00 43.02 40.16 3nix s PHE 134 CO -0.09 0.43 0.09 0.12 -0.10 0.00 0.00 175.22 175.68 3nix s PHE 135 N -0.20 2.47 0.00 0.36 5.36 -0.60 -5.01 117.98 120.35 3nix s PHE 135 Ca 0.18 -2.25 0.00 0.00 -0.96 0.00 0.00 56.93 53.90 3nix s PHE 135 Cb -0.14 -2.17 0.00 0.00 -0.34 0.00 0.00 43.02 40.37 3nix s PHE 135 CO 0.06 -0.89 0.00 0.41 -1.46 0.00 0.00 175.22 173.34 3nix n GLY 136 N 4.52 4.16 0.01 13.12 0.00 -1.26 -1.17 105.19 124.57 3nix n GLY 136 Ca 0.01 0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.22 3nix n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3nix n THR 137 N 0.00 0.06 -1.62 2.61 -2.24 -1.26 -4.60 114.28 107.23 3nix n THR 137 Ca 0.00 -0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.39 3nix n THR 137 Cb 0.00 0.40 0.05 0.00 -2.10 0.00 0.00 70.33 68.68 3nix n THR 137 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3nix s ASP 138 N -3.31 5.39 -0.10 3.42 1.01 -0.31 -4.15 116.67 118.60 3nix s ASP 138 Ca 0.08 1.54 -0.16 0.00 0.71 0.00 0.00 52.55 54.72 3nix s ASP 138 Cb 0.16 -2.42 0.04 0.00 1.01 0.00 0.00 42.92 41.71 3nix s ASP 138 CO 0.77 -1.43 0.40 -0.94 0.21 0.00 0.00 175.17 174.18 3nix s SER 139 N -3.87 -0.37 -0.21 0.27 1.04 -0.81 -1.56 113.70 108.18 3nix s SER 139 Ca 0.58 0.59 -0.03 0.00 0.48 0.00 0.00 55.95 57.57 3nix s SER 139 Cb -0.14 0.66 -0.01 0.00 0.10 0.00 0.00 66.02 66.63 3nix s SER 139 CO 0.55 -0.27 -0.05 -0.69 0.98 0.00 0.00 173.24 173.75 3nix s VAL 140 N -0.37 3.34 -0.18 5.02 1.01 -0.66 -0.65 120.40 127.91 3nix s VAL 140 Ca -0.05 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 3nix s VAL 140 Cb -0.03 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 3nix s VAL 140 CO 0.02 0.44 -0.06 -0.89 0.00 0.00 0.00 175.10 174.62 3nix s THR 141 N 1.29 3.50 -0.26 3.92 2.01 0.58 -1.37 115.64 125.32 3nix s THR 141 Ca 0.03 -0.48 -0.15 0.00 0.31 0.00 0.00 61.69 61.41 3nix s THR 141 Cb -0.14 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.78 3nix s THR 141 CO -0.02 0.47 0.37 -0.89 -0.69 0.00 0.00 174.62 173.86 3nix s THR 142 N 0.86 5.18 0.27 -0.82 2.01 -0.37 -0.84 115.64 121.93 3nix s THR 142 Ca -0.01 0.59 0.08 0.00 0.31 0.00 0.00 61.69 62.66 3nix s THR 142 Cb -0.15 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 3nix s THR 142 CO 0.01 0.18 0.09 0.27 -0.69 0.00 0.00 174.62 174.48 3nix s ILE 143 N 1.90 3.83 -0.04 1.82 -4.36 -0.74 0.12 121.20 123.73 3nix s ILE 143 Ca 0.16 -1.69 0.02 0.00 -0.26 0.00 0.00 60.65 58.87 3nix s ILE 143 Cb -0.15 -3.08 0.01 0.00 1.25 0.00 0.00 42.46 40.49 3nix s ILE 143 CO 0.09 -0.35 -0.07 -0.70 0.24 0.00 0.00 174.94 174.16 3nix s GLU 144 N -3.76 0.92 0.29 0.37 2.12 0.06 -2.37 118.70 116.34 3nix s GLU 144 Ca 0.32 -0.19 0.02 0.00 0.36 0.00 0.00 54.97 55.48 3nix s GLU 144 Cb -0.07 -0.87 0.05 0.00 0.26 0.00 0.00 34.13 33.50 3nix s GLU 144 CO 0.22 -0.00 0.40 -0.40 -0.54 0.00 0.00 175.26 174.94 3nix n ASP 145 N 3.73 0.76 0.21 -1.70 5.68 -0.44 -1.27 116.55 123.52 3nix n ASP 145 Ca -0.23 -1.59 0.15 0.00 -0.50 0.00 0.00 54.79 52.62 3nix n ASP 145 Cb 0.52 -0.24 0.72 0.00 -1.14 0.00 0.00 41.12 40.99 3nix n ASP 145 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 3nix h ILE 146 N -0.23 0.00 -0.49 2.12 2.04 -1.90 -2.01 117.51 117.04 3nix h ILE 146 Ca -0.13 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.62 3nix h ILE 146 Cb 0.54 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3nix h ILE 146 CO 0.16 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.90 3nix n ASN 147 N -2.53 3.34 0.00 1.72 3.02 -1.26 -4.94 115.26 114.61 3nix n ASN 147 Ca -0.01 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 3nix n ASN 147 Cb 0.11 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 3nix n ASN 147 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3nix n GLY 148 N 1.03 1.08 3.75 7.41 0.00 -0.76 -5.01 105.19 112.70 3nix n GLY 148 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3nix n GLY 148 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3nix s ASN 149 N -3.04 7.23 0.09 1.61 -0.87 -1.26 -4.78 114.94 113.92 3nix s ASN 149 Ca 0.00 2.21 0.06 0.00 -1.57 0.00 0.00 52.86 53.57 3nix s ASN 149 Cb 0.00 -2.62 -0.04 0.00 -0.02 0.00 0.00 41.25 38.57 3nix s ASN 149 CO 0.00 -0.21 -0.07 -0.54 -2.57 0.00 0.00 177.10 173.71 3nix s LYS 150 N -0.90 2.28 0.16 -0.60 1.02 -1.26 -1.32 119.74 119.12 3nix s LYS 150 Ca 0.48 -0.95 -0.10 0.00 0.02 0.00 0.00 55.97 55.41 3nix s LYS 150 Cb -0.31 -2.39 -0.00 0.00 -0.52 0.00 0.00 37.83 34.60 3nix s LYS 150 CO 0.39 0.52 0.32 -0.98 -0.92 0.00 0.00 175.35 174.68 3nix s ARG 151 N -2.20 1.17 0.14 1.68 1.70 -1.00 -5.01 118.95 115.44 3nix s ARG 151 Ca 0.23 -1.11 0.04 0.00 -0.47 0.00 0.00 55.73 54.42 3nix s ARG 151 Cb -0.11 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.63 3nix s ARG 151 CO 0.15 -0.44 0.14 -1.21 -1.08 0.00 0.00 175.30 172.86 3nix s GLU 152 N -3.95 2.97 -0.14 3.89 2.02 -1.26 -1.79 118.70 120.44 3nix s GLU 152 Ca 0.15 -0.80 -0.03 0.00 0.02 0.00 0.00 54.97 54.31 3nix s GLU 152 Cb 0.03 -2.70 0.05 0.00 0.10 0.00 0.00 34.13 31.60 3nix s GLU 152 CO -0.01 0.51 0.05 0.42 0.02 0.00 0.00 175.26 176.24 3nix s ILE 153 N -1.68 0.23 0.05 -1.63 1.01 -0.02 -2.19 121.20 116.97 3nix s ILE 153 Ca 0.31 -0.17 -0.27 0.00 0.00 0.00 0.00 60.65 60.53 3nix s ILE 153 Cb -0.11 -0.67 -0.05 0.00 0.01 0.00 0.00 42.46 41.64 3nix s ILE 153 CO 0.24 -0.08 0.83 -0.70 0.00 0.00 0.00 174.94 175.23 3nix s GLU 154 N 2.01 4.55 0.10 2.79 2.12 -0.14 -0.30 118.70 129.83 3nix s GLU 154 Ca 0.02 1.19 0.03 0.00 0.36 0.00 0.00 54.97 56.57 3nix s GLU 154 Cb -0.15 -3.38 -0.04 0.00 0.26 0.00 0.00 34.13 30.82 3nix s GLU 154 CO -0.07 0.23 -0.09 0.00 -0.54 0.00 0.00 175.26 174.79 3nix s ALA 155 N 0.09 1.07 -0.19 6.30 0.00 0.17 -1.34 121.76 127.86 3nix s ALA 155 Ca 0.42 -1.22 0.19 0.00 0.00 0.00 0.00 51.96 51.35 3nix s ALA 155 Cb -0.21 0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 3nix s ALA 155 CO 0.25 -0.09 1.07 0.00 0.00 0.00 0.00 175.76 176.99 3nix h ARG 156 N 3.42 0.00 -2.33 0.00 3.08 -0.89 -2.16 114.38 115.50 3nix h ARG 156 Ca -0.37 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.64 3nix h ARG 156 Cb 1.18 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 31.00 3nix h ARG 156 CO 0.56 0.20 -0.15 0.12 -1.07 0.00 0.00 179.97 179.63 3nix s PHE 157 N -3.10 -0.84 -0.21 3.04 5.36 -0.51 -4.45 117.98 117.27 3nix s PHE 157 Ca -0.00 1.71 -0.09 0.00 -0.96 0.00 0.00 56.93 57.59 3nix s PHE 157 Cb 0.08 0.45 -0.05 0.00 -0.34 0.00 0.00 43.02 43.17 3nix s PHE 157 CO 0.78 -0.44 0.11 0.42 -1.46 0.00 0.00 175.22 174.63 3nix s ILE 158 N 1.58 5.09 -0.30 3.12 1.01 0.22 -0.26 121.20 131.66 3nix s ILE 158 Ca -0.09 0.08 -0.09 0.00 0.00 0.00 0.00 60.65 60.55 3nix s ILE 158 Cb -0.07 -3.33 -0.01 0.00 0.01 0.00 0.00 42.46 39.06 3nix s ILE 158 CO -0.16 0.42 0.12 -0.63 0.00 0.00 0.00 174.94 174.69 3nix s ILE 159 N 0.60 4.44 -0.78 2.92 1.01 -0.06 -2.98 121.20 126.35 3nix s ILE 159 Ca 0.06 -0.41 -0.20 0.00 0.00 0.00 0.00 60.65 60.10 3nix s ILE 159 Cb -0.12 -3.23 0.11 0.00 0.01 0.00 0.00 42.46 39.23 3nix s ILE 159 CO 0.01 0.12 0.98 -0.62 0.00 0.00 0.00 174.94 175.43 3nix s ASP 160 N 1.60 6.41 -0.48 3.58 -1.08 -0.81 -1.34 116.67 124.55 3nix s ASP 160 Ca 0.05 -1.65 0.03 0.00 -0.52 0.00 0.00 52.55 50.46 3nix s ASP 160 Cb -0.17 -2.38 0.45 0.00 -1.46 0.00 0.00 42.92 39.36 3nix s ASP 160 CO 0.05 -1.16 1.55 0.00 0.52 0.00 0.00 175.17 176.13 3nix n ALA 161 N 6.72 5.61 1.84 3.66 0.00 -0.18 -2.03 120.51 136.13 3nix n ALA 161 Ca 0.09 -3.74 0.00 0.00 0.00 0.00 0.00 53.44 49.78 3nix n ALA 161 Cb 0.47 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 18.94 3nix n ALA 161 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3nix n SER 162 N -0.76 0.19 0.00 0.00 3.41 -0.12 -4.32 113.62 112.02 3nix n SER 162 Ca 0.51 -2.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.12 3nix n SER 162 Cb 0.78 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.67 3nix n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3nix n GLY 163 N 0.46 2.27 0.15 5.00 0.00 -1.26 -0.80 105.19 111.01 3nix n GLY 163 Ca 0.00 0.40 0.13 0.00 0.00 0.00 0.00 46.02 46.55 3nix n GLY 163 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3nix h TYR 164 N 0.00 0.00 0.00 1.61 -1.99 -1.93 -2.72 116.97 111.94 3nix h TYR 164 Ca 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 3nix h TYR 164 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 3nix h TYR 164 CO 0.00 0.00 -0.06 0.78 -0.00 0.00 0.00 178.16 178.88 3nix h GLY 165 N 2.00 0.00 -7.10 3.88 0.00 -1.31 -3.47 103.07 97.07 3nix h GLY 165 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 3nix h GLY 165 CO 0.00 0.00 -0.92 0.54 0.00 0.00 0.00 176.54 176.16 3nix n ARG 166 N -3.19 -1.11 -0.17 4.80 5.12 -1.04 -4.83 116.66 116.24 3nix n ARG 166 Ca 0.00 0.16 -0.04 0.00 -1.93 0.00 0.00 57.85 56.04 3nix n ARG 166 Cb 0.34 -4.39 0.05 0.00 -1.16 0.00 0.00 32.46 27.30 3nix n ARG 166 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 3nix h VAL 167 N -1.25 0.97 0.12 1.55 2.07 -1.89 0.60 116.25 118.42 3nix h VAL 167 Ca -0.62 -0.18 -0.20 0.00 0.82 0.00 0.00 66.70 66.52 3nix h VAL 167 Cb 1.39 0.39 0.01 0.00 -1.52 0.00 0.00 31.29 31.56 3nix h VAL 167 CO 0.82 0.10 -0.92 0.40 0.02 0.00 0.00 177.57 177.98 3nix h ILE 168 N 0.54 1.38 -0.84 4.57 2.04 -1.96 -3.34 117.51 119.90 3nix h ILE 168 Ca 0.23 -2.47 0.17 0.00 1.00 0.00 0.00 64.86 63.79 3nix h ILE 168 Cb 0.12 3.05 -0.06 0.00 -0.74 0.00 0.00 36.82 39.19 3nix h ILE 168 CO -0.15 0.69 0.55 -0.65 0.00 0.00 0.00 178.15 178.59 3nix h PRO 169 N -0.43 0.45 -1.13 2.37 0.11 -1.83 0.74 132.00 132.28 3nix h PRO 169 Ca -0.18 -0.03 -0.23 0.00 0.11 0.00 0.00 66.00 65.67 3nix h PRO 169 Cb 1.60 -0.10 -0.13 0.00 0.11 0.00 0.00 31.00 32.49 3nix h PRO 169 CO 0.10 0.30 0.29 0.54 -0.21 0.00 0.00 178.00 179.02 3nix n ARG 170 N -4.51 1.55 0.00 1.05 1.74 0.21 -0.22 116.66 116.49 3nix n ARG 170 Ca 0.17 -1.27 0.00 0.00 -0.77 0.00 0.00 57.85 55.98 3nix n ARG 170 Cb 0.58 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 3nix n ARG 170 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3nix n PHE 172 N -0.03 0.00 -1.81 -1.55 3.01 0.25 -4.89 117.46 112.44 3nix n PHE 172 Ca 0.25 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.70 3nix n PHE 172 Cb 0.89 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.36 3nix n PHE 172 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3nix n GLY 173 N 0.00 0.36 0.00 1.37 0.00 -0.65 -4.94 105.19 101.33 3nix n GLY 173 Ca 0.00 -0.90 0.14 0.00 0.00 0.00 0.00 46.02 45.26 3nix n GLY 173 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3nix n LEU 174 N -0.12 0.00 -4.75 0.99 4.77 0.70 -4.86 117.00 113.73 3nix n LEU 174 Ca -0.01 0.29 -0.35 0.00 -0.03 0.00 0.00 56.01 55.91 3nix n LEU 174 Cb 0.41 -0.29 0.05 0.00 -2.33 0.00 0.00 43.42 41.26 3nix n LEU 174 CO 0.01 -0.02 0.82 -1.81 -1.33 0.00 0.00 177.39 175.06 3nix s ASP 175 N -2.57 4.97 -0.14 -1.43 1.01 -1.22 0.54 116.67 117.83 3nix s ASP 175 Ca 0.26 2.33 -0.08 0.00 0.71 0.00 0.00 52.55 55.77 3nix s ASP 175 Cb 0.19 -2.59 0.05 0.00 1.01 0.00 0.00 42.92 41.57 3nix s ASP 175 CO 0.43 -1.74 0.33 -0.75 0.21 0.00 0.00 175.17 173.65 3nix s LYS 176 N -3.55 0.32 1.09 8.23 2.20 0.27 -4.27 119.74 124.03 3nix s LYS 176 Ca 0.75 0.62 -0.12 0.00 -0.36 0.00 0.00 55.97 56.87 3nix s LYS 176 Cb -0.29 -0.01 0.24 0.00 -1.51 0.00 0.00 37.83 36.26 3nix s LYS 176 CO 0.37 -0.13 1.06 -2.14 -0.36 0.00 0.00 175.35 174.14 3nix s PRO 177 N 1.08 -0.33 -0.10 4.03 0.02 -1.26 0.29 135.00 138.73 3nix s PRO 177 Ca -0.07 0.89 -0.08 0.00 0.02 0.00 0.00 61.00 61.76 3nix s PRO 177 Cb -0.08 -1.62 -0.03 0.00 0.02 0.00 0.00 34.50 32.80 3nix s PRO 177 CO -0.08 -3.34 -0.15 0.45 -0.33 0.00 0.00 177.00 173.55 3nix n SER 178 N -4.66 1.22 0.00 2.53 2.88 -1.26 -4.07 113.62 110.26 3nix n SER 178 Ca 0.05 0.43 0.00 0.00 -1.33 0.00 0.00 58.87 58.02 3nix n SER 178 Cb 0.54 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 63.28 3nix n SER 178 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3nix n GLY 179 N 1.61 2.95 3.76 0.46 0.00 -1.26 -4.97 105.19 107.74 3nix n GLY 179 Ca -0.06 -0.87 -0.38 0.00 0.00 0.00 0.00 46.02 44.71 3nix n GLY 179 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3nix s PHE 180 N -0.14 2.65 1.07 1.61 0.08 -1.26 -5.03 117.98 116.96 3nix s PHE 180 Ca 0.00 1.46 -0.15 0.00 0.12 0.00 0.00 56.93 58.36 3nix s PHE 180 Cb 0.00 -3.57 0.22 0.00 -0.57 0.00 0.00 43.02 39.10 3nix s PHE 180 CO 0.00 -2.09 1.11 -1.83 -0.10 0.00 0.00 175.22 172.31 3nix s GLU 181 N -2.71 -0.12 0.08 0.44 -1.05 -1.26 -4.98 118.70 109.09 3nix s GLU 181 Ca 0.65 0.22 -0.31 0.00 -0.15 0.00 0.00 54.97 55.39 3nix s GLU 181 Cb -0.34 -1.70 -0.07 0.00 -0.44 0.00 0.00 34.13 31.58 3nix s GLU 181 CO 0.41 -3.04 1.29 0.45 0.95 0.00 0.00 175.26 175.33 3nix s SER 182 N -3.75 6.96 0.18 0.83 0.15 -1.26 -4.95 113.70 111.85 3nix s SER 182 Ca 0.68 2.15 0.11 0.00 0.70 0.00 0.00 55.95 59.59 3nix s SER 182 Cb -0.14 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.54 3nix s SER 182 CO 0.56 -0.57 -0.25 -0.13 1.20 0.00 0.00 173.24 174.06 3nix s ARG 183 N 1.17 1.50 0.31 5.44 0.52 -1.26 -4.69 118.95 121.94 3nix s ARG 183 Ca 0.61 -1.49 0.09 0.00 -0.52 0.00 0.00 55.73 54.42 3nix s ARG 183 Cb -0.33 -1.86 -0.04 0.00 0.52 0.00 0.00 34.95 33.24 3nix s ARG 183 CO 0.29 0.41 0.09 0.50 0.02 0.00 0.00 175.30 176.62 3nix s ARG 184 N -2.54 2.38 -0.10 3.54 3.52 -0.23 -1.65 118.95 123.87 3nix s ARG 184 Ca 0.19 -1.47 -0.11 0.00 -0.13 0.00 0.00 55.73 54.21 3nix s ARG 184 Cb -0.08 -2.19 0.03 0.00 -1.56 0.00 0.00 34.95 31.14 3nix s ARG 184 CO 0.09 0.22 0.30 -0.08 -0.81 0.00 0.00 175.30 175.02 3nix s THR 185 N -2.37 0.01 -0.08 4.11 -1.32 -0.34 -1.43 115.64 114.21 3nix s THR 185 Ca 0.35 -0.09 0.01 0.00 -1.21 0.00 0.00 61.69 60.75 3nix s THR 185 Cb -0.04 -0.46 0.02 0.00 -1.51 0.00 0.00 72.50 70.51 3nix s THR 185 CO 0.22 -0.05 -0.08 -0.22 -2.21 0.00 0.00 174.62 172.28 3nix s LEU 186 N -0.10 1.35 0.04 9.08 0.20 -0.20 -1.93 118.68 127.12 3nix s LEU 186 Ca -0.02 -0.25 -0.15 0.00 0.69 0.00 0.00 54.13 54.40 3nix s LEU 186 Cb -0.03 -0.73 0.02 0.00 -0.43 0.00 0.00 46.19 45.03 3nix s LEU 186 CO 0.01 -0.05 0.33 0.72 -0.29 0.00 0.00 176.35 177.07 3nix s PHE 187 N 1.15 -0.14 0.23 5.38 -0.12 -0.95 -0.60 117.98 122.94 3nix s PHE 187 Ca -0.06 0.04 -0.11 0.00 -0.05 0.00 0.00 56.93 56.76 3nix s PHE 187 Cb -0.14 0.12 -0.01 0.00 -0.63 0.00 0.00 43.02 42.36 3nix s PHE 187 CO -0.02 -0.51 0.41 -0.08 -0.05 0.00 0.00 175.22 174.97 3nix s THR 188 N -2.45 0.00 -0.15 -4.49 -1.32 -0.74 -0.77 115.64 105.73 3nix s THR 188 Ca -0.06 -1.49 -0.11 0.00 -1.21 0.00 0.00 61.69 58.82 3nix s THR 188 Cb -0.01 -2.22 -0.05 0.00 -1.51 0.00 0.00 72.50 68.71 3nix s THR 188 CO -0.03 -0.02 0.22 -1.00 -2.21 0.00 0.00 174.62 171.59 3nix s HIS 189 N -4.04 3.50 -0.09 9.09 3.76 -1.26 -1.41 115.29 124.84 3nix s HIS 189 Ca 0.25 0.54 0.03 0.00 -0.15 0.00 0.00 55.06 55.73 3nix s HIS 189 Cb 0.01 -2.19 -0.01 0.00 1.11 0.00 0.00 32.58 31.49 3nix s HIS 189 CO 0.09 0.41 -0.20 0.42 -0.85 0.00 0.00 174.74 174.61 3nix s ILE 190 N -0.06 2.48 -0.47 0.60 1.01 -0.00 -0.75 121.20 124.01 3nix s ILE 190 Ca 0.14 -0.89 -0.28 0.00 0.00 0.00 0.00 60.65 59.63 3nix s ILE 190 Cb -0.13 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.36 3nix s ILE 190 CO 0.03 0.56 1.78 -0.75 0.00 0.00 0.00 174.94 176.56 3nix s LYS 191 N 0.08 3.03 -0.90 2.79 2.20 -0.78 -0.39 119.74 125.78 3nix s LYS 191 Ca -0.09 0.99 -0.07 0.00 -0.36 0.00 0.00 55.97 56.44 3nix s LYS 191 Cb -0.15 -4.27 -0.12 0.00 -1.51 0.00 0.00 37.83 31.78 3nix s LYS 191 CO 0.06 -2.23 3.12 -3.47 -0.36 0.00 0.00 175.35 172.47 3nix n ASP 192 N 11.26 7.21 -0.19 1.43 -0.08 0.06 -4.53 116.55 131.72 3nix n ASP 192 Ca 0.21 -2.66 -0.00 0.00 -1.51 0.00 0.00 54.79 50.82 3nix n ASP 192 Cb 0.49 -1.46 0.09 0.00 2.34 0.00 0.00 41.12 42.58 3nix n ASP 192 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 3nix h VAL 193 N 2.50 0.56 -0.45 5.18 2.07 -1.89 -2.08 116.25 122.14 3nix h VAL 193 Ca 0.57 -0.05 -0.23 0.00 0.82 0.00 0.00 66.70 67.81 3nix h VAL 193 Cb 0.77 0.41 -0.14 0.00 -1.52 0.00 0.00 31.29 30.81 3nix h VAL 193 CO 1.11 0.03 0.29 0.29 0.02 0.00 0.00 177.57 179.30 3nix n LYS 194 N -5.23 1.62 -2.17 1.57 4.01 -1.26 -4.94 118.16 111.75 3nix n LYS 194 Ca 0.08 -1.38 -0.42 0.00 -0.51 0.00 0.00 58.31 56.08 3nix n LYS 194 Cb 0.32 -1.55 -0.03 0.00 -0.51 0.00 0.00 35.03 33.26 3nix n LYS 194 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 3nix s ARG 195 N -1.52 4.33 0.83 1.97 3.52 -0.79 -4.88 118.95 122.41 3nix s ARG 195 Ca 0.26 2.08 -0.15 0.00 -0.13 0.00 0.00 55.73 57.79 3nix s ARG 195 Cb 0.22 -3.23 -0.03 0.00 -1.56 0.00 0.00 34.95 30.35 3nix s ARG 195 CO 0.05 -0.40 0.31 -2.30 -0.81 0.00 0.00 175.30 172.16 3nix n PRO 196 N 3.60 0.04 -1.01 5.12 -0.02 -1.26 -5.17 135.00 136.30 3nix n PRO 196 Ca 0.10 0.05 -0.17 0.00 -2.02 0.00 0.00 63.50 61.47 3nix n PRO 196 Cb 0.42 -1.72 -0.02 0.00 -0.02 0.00 0.00 33.50 32.17 3nix n PRO 196 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3nix n VAL 197 N -2.80 2.84 0.00 -1.45 0.31 -1.26 -5.14 118.33 110.83 3nix n VAL 197 Ca 0.07 -1.84 0.00 0.00 -0.01 0.00 0.00 64.34 62.57 3nix n VAL 197 Cb 0.52 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 31.93 3nix n VAL 197 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3nix n GLY 203 N 0.92 0.60 0.76 2.92 0.00 -1.26 -5.26 105.19 103.87 3nix n GLY 203 Ca 0.33 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.43 3nix n GLY 203 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3nix n ASN 204 N 0.00 3.56 -4.38 1.61 6.94 -1.26 -4.85 115.26 116.88 3nix n ASN 204 Ca 0.00 -2.86 -0.25 0.00 -0.02 0.00 0.00 54.58 51.46 3nix n ASN 204 Cb 0.00 -0.48 -0.12 0.00 -2.36 0.00 0.00 39.78 36.83 3nix n ASN 204 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 3nix s ARG 205 N -2.53 1.40 0.09 -3.83 1.81 -1.26 0.65 118.95 115.27 3nix s ARG 205 Ca 0.38 -1.46 -0.20 0.00 -1.72 0.00 0.00 55.73 52.73 3nix s ARG 205 Cb 0.30 -1.61 -0.07 0.00 -0.45 0.00 0.00 34.95 33.12 3nix s ARG 205 CO 0.09 0.34 0.60 -1.50 -0.68 0.00 0.00 175.30 174.15 3nix s ILE 206 N -1.81 4.69 -0.11 1.52 2.07 -1.15 -4.64 121.20 121.77 3nix s ILE 206 Ca 0.18 1.27 0.01 0.00 -1.41 0.00 0.00 60.65 60.70 3nix s ILE 206 Cb -0.07 -3.92 -0.02 0.00 0.13 0.00 0.00 42.46 38.58 3nix s ILE 206 CO 0.08 0.53 -0.14 -0.89 -1.91 0.00 0.00 174.94 172.62 3nix s THR 207 N -1.14 3.02 -0.13 4.00 2.01 -0.74 -1.37 115.64 121.29 3nix s THR 207 Ca 0.30 -0.69 -0.00 0.00 0.31 0.00 0.00 61.69 61.61 3nix s THR 207 Cb -0.20 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 70.06 3nix s THR 207 CO 0.20 0.54 -0.13 0.00 -0.69 0.00 0.00 174.62 174.54 3nix s ALA 208 N 0.09 2.60 -0.24 7.40 0.00 -0.78 -0.05 121.76 130.77 3nix s ALA 208 Ca -0.06 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 50.98 3nix s ALA 208 Cb -0.15 -1.21 0.02 0.00 0.00 0.00 0.00 23.12 21.79 3nix s ALA 208 CO 0.05 0.23 -0.06 0.08 0.00 0.00 0.00 175.76 176.06 3nix s VAL 209 N 0.38 2.94 -0.59 0.00 1.01 0.92 -1.21 120.40 123.85 3nix s VAL 209 Ca -0.11 -0.95 -0.26 0.00 0.00 0.00 0.00 61.98 60.66 3nix s VAL 209 Cb -0.16 -2.47 -0.09 0.00 0.00 0.00 0.00 36.38 33.66 3nix s VAL 209 CO 0.05 0.23 2.42 0.52 0.00 0.00 0.00 175.10 178.33 3nix n VAL 210 N 4.69 -0.06 -0.05 2.92 0.31 0.99 -2.04 118.33 125.09 3nix n VAL 210 Ca -0.17 -0.70 -0.21 0.00 -0.01 0.00 0.00 64.34 63.25 3nix n VAL 210 Cb 0.48 -2.53 -0.13 0.00 -0.91 0.00 0.00 33.84 30.75 3nix n VAL 210 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 3nix h HIS 211 N 17.34 0.22 -4.43 3.52 6.17 -1.62 -3.41 115.15 132.93 3nix h HIS 211 Ca -0.16 -0.16 -0.25 0.00 0.71 0.00 0.00 60.37 60.51 3nix h HIS 211 Cb 1.18 -0.01 -0.15 0.00 2.52 0.00 0.00 27.41 30.95 3nix h HIS 211 CO 1.03 1.48 -0.62 0.15 0.71 0.00 0.00 177.93 180.67 3nix s LYS 212 N -2.41 1.20 0.15 5.26 -0.14 0.07 -4.99 119.74 118.89 3nix s LYS 212 Ca -0.23 -1.63 -0.20 0.00 -1.36 0.00 0.00 55.97 52.54 3nix s LYS 212 Cb 0.04 0.18 0.03 0.00 -1.68 0.00 0.00 37.83 36.40 3nix s LYS 212 CO 0.69 -0.36 1.66 -1.00 -0.76 0.00 0.00 175.35 175.58 3nix h PRO 213 N 2.61 -0.13 -0.56 -1.68 0.13 -2.01 -2.56 132.00 127.80 3nix h PRO 213 Ca -0.36 0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.67 3nix h PRO 213 Cb 1.24 0.03 -0.06 0.00 0.13 0.00 0.00 31.00 32.34 3nix h PRO 213 CO 0.55 -0.09 0.11 1.63 -0.23 0.00 0.00 178.00 179.97 3nix n LYS 214 N -5.32 3.77 -3.73 0.86 5.02 -1.26 -4.92 118.16 112.58 3nix n LYS 214 Ca -0.00 -3.07 -0.17 0.00 -2.02 0.00 0.00 58.31 53.05 3nix n LYS 214 Cb 0.24 -2.13 -0.17 0.00 -0.02 0.00 0.00 35.03 32.95 3nix n LYS 214 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3nix s VAL 215 N -2.92 -0.08 0.30 -0.18 1.01 -0.97 -2.04 120.40 115.52 3nix s VAL 215 Ca 0.52 0.30 0.04 0.00 0.00 0.00 0.00 61.98 62.83 3nix s VAL 215 Cb 0.41 -0.12 -0.06 0.00 0.00 0.00 0.00 36.38 36.61 3nix s VAL 215 CO 0.12 0.12 0.05 -1.66 0.00 0.00 0.00 175.10 173.74 3nix s TRP 216 N 1.52 1.86 0.01 5.22 1.48 -0.13 -0.75 118.94 128.16 3nix s TRP 216 Ca -0.03 -0.97 0.03 0.00 -1.06 0.00 0.00 56.10 54.07 3nix s TRP 216 Cb -0.13 -1.18 -0.01 0.00 -1.16 0.00 0.00 33.47 30.99 3nix s TRP 216 CO -0.03 -0.03 -0.10 0.42 -4.06 0.00 0.00 176.95 173.15 3nix s ILE 217 N -3.35 0.81 -0.08 0.66 1.01 -0.87 -0.43 121.20 118.96 3nix s ILE 217 Ca 0.35 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.35 3nix s ILE 217 Cb 0.08 -0.72 -0.03 0.00 0.01 0.00 0.00 42.46 41.80 3nix s ILE 217 CO 0.14 0.07 -0.07 -1.66 0.00 0.00 0.00 174.94 173.42 3nix s TRP 218 N -0.55 2.93 -0.28 3.97 -2.14 -0.19 -0.06 118.94 122.61 3nix s TRP 218 Ca 0.01 -0.03 0.01 0.00 2.66 0.00 0.00 56.10 58.75 3nix s TRP 218 Cb -0.06 -1.73 0.08 0.00 -3.10 0.00 0.00 33.47 28.67 3nix s TRP 218 CO 0.00 0.28 0.01 0.08 -2.66 0.00 0.00 176.95 174.66 3nix s VAL 219 N -0.68 1.57 -0.29 -0.66 1.01 0.93 -2.29 120.40 120.00 3nix s VAL 219 Ca 0.10 -1.57 0.02 0.00 0.00 0.00 0.00 61.98 60.54 3nix s VAL 219 Cb -0.11 -2.01 0.07 0.00 0.00 0.00 0.00 36.38 34.33 3nix s VAL 219 CO 0.02 -0.38 -0.05 -0.63 0.00 0.00 0.00 175.10 174.06 3nix s ILE 220 N 1.32 2.33 -0.18 2.22 1.01 0.29 -1.79 121.20 126.39 3nix s ILE 220 Ca 0.03 -1.79 -0.23 0.00 0.00 0.00 0.00 60.65 58.65 3nix s ILE 220 Cb -0.18 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 3nix s ILE 220 CO -0.11 -0.20 0.75 -2.16 0.00 0.00 0.00 174.94 173.21 3nix s PRO 221 N 1.07 4.26 0.39 2.79 0.04 -1.26 0.63 135.00 142.92 3nix s PRO 221 Ca -0.03 0.84 0.07 0.00 0.04 0.00 0.00 61.00 61.92 3nix s PRO 221 Cb -0.20 -3.58 0.00 0.00 0.04 0.00 0.00 34.50 30.77 3nix s PRO 221 CO -0.05 -0.30 0.54 -0.06 0.04 0.00 0.00 177.00 177.17 3nix s PHE 222 N 2.07 2.98 -0.63 0.56 0.08 -0.18 -4.81 117.98 118.05 3nix s PHE 222 Ca 0.34 -0.26 0.25 0.00 0.12 0.00 0.00 56.93 57.38 3nix s PHE 222 Cb -0.16 -2.20 0.60 0.00 -0.57 0.00 0.00 43.02 40.68 3nix s PHE 222 CO 0.11 -0.24 1.64 0.66 -0.10 0.00 0.00 175.22 177.30 3nix h SER 223 N 0.72 0.00 0.00 1.36 4.64 -1.87 -3.28 113.55 115.13 3nix h SER 223 Ca -0.43 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3nix h SER 223 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3nix h SER 223 CO 0.50 0.01 0.00 -0.46 -0.87 0.00 0.00 176.83 176.01 3nix n ASN 224 N -2.46 0.92 0.00 4.97 0.23 -1.26 -4.83 115.26 112.83 3nix n ASN 224 Ca 0.05 -1.98 0.00 0.00 -0.53 0.00 0.00 54.58 52.11 3nix n ASN 224 Cb 0.46 -0.46 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 3nix n ASN 224 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3nix n GLY 225 N 0.04 3.05 3.93 4.83 0.00 -1.24 -5.00 105.19 110.80 3nix n GLY 225 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3nix n GLY 225 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3nix s ASN 226 N -1.18 6.21 -0.03 1.61 0.02 -1.26 -0.76 114.94 119.56 3nix s ASN 226 Ca 0.00 0.64 0.00 0.00 -1.02 0.00 0.00 52.86 52.48 3nix s ASN 226 Cb 0.00 -2.06 0.03 0.00 0.02 0.00 0.00 41.25 39.24 3nix s ASN 226 CO 0.00 -0.48 0.02 -0.89 0.02 0.00 0.00 177.10 175.77 3nix s THR 227 N -2.54 0.06 -0.02 1.60 2.01 0.48 -1.02 115.64 116.22 3nix s THR 227 Ca 0.44 0.16 -0.30 0.00 0.31 0.00 0.00 61.69 62.30 3nix s THR 227 Cb -0.10 -0.18 -0.04 0.00 0.01 0.00 0.00 72.50 72.19 3nix s THR 227 CO 0.40 0.12 1.12 -0.55 -0.69 0.00 0.00 174.62 175.02 3nix s SER 228 N 1.10 7.16 -0.07 3.53 0.15 0.21 -0.82 113.70 124.95 3nix s SER 228 Ca -0.09 1.79 0.04 0.00 0.70 0.00 0.00 55.95 58.39 3nix s SER 228 Cb -0.13 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 3nix s SER 228 CO -0.02 -0.46 -0.19 -0.69 1.20 0.00 0.00 173.24 173.08 3nix s VAL 229 N 1.58 1.61 -0.02 4.45 1.01 -0.50 -0.55 120.40 127.98 3nix s VAL 229 Ca 0.55 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.76 3nix s VAL 229 Cb -0.24 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.74 3nix s VAL 229 CO 0.25 0.46 -0.04 -0.83 0.00 0.00 0.00 175.10 174.94 3nix s GLY 230 N 0.34 0.34 -0.15 4.51 0.00 -0.97 -1.78 107.32 109.61 3nix s GLY 230 Ca -0.13 -0.09 -0.19 0.00 0.00 0.00 0.00 44.72 44.32 3nix s GLY 230 CO 0.05 0.19 0.51 -1.36 0.00 0.00 0.00 173.10 172.50 3nix s PHE 231 N 0.48 3.46 0.02 1.90 0.40 0.23 -1.02 117.98 123.45 3nix s PHE 231 Ca -0.06 0.86 0.06 0.00 -0.60 0.00 0.00 56.93 57.19 3nix s PHE 231 Cb -0.09 -2.62 -0.02 0.00 0.51 0.00 0.00 43.02 40.80 3nix s PHE 231 CO -0.00 0.05 -0.17 0.08 0.70 0.00 0.00 175.22 175.87 3nix s VAL 232 N 1.08 1.36 -4.12 -0.44 1.01 0.43 -1.03 120.40 118.70 3nix s VAL 232 Ca 0.26 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.30 3nix s VAL 232 Cb -0.15 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.05 3nix s VAL 232 CO 0.10 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.03 3nix n GLY 233 N 2.20 0.24 3.61 4.51 0.00 -0.52 -0.95 105.19 114.28 3nix n GLY 233 Ca -0.16 -1.23 -0.46 0.00 0.00 0.00 0.00 46.02 44.17 3nix n GLY 233 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3nix n GLU 234 N 0.00 2.02 -0.29 1.61 1.02 -0.87 -1.07 120.64 123.07 3nix n GLU 234 Ca 0.00 0.66 0.22 0.00 -0.02 0.00 0.00 57.16 58.02 3nix n GLU 234 Cb 0.00 -2.86 0.52 0.00 -0.02 0.00 0.00 31.44 29.08 3nix n GLU 234 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 3nix h PRO 235 N 11.89 0.38 0.00 3.49 0.10 -1.90 0.44 132.00 146.40 3nix h PRO 235 Ca -0.42 -0.02 -0.03 0.00 0.10 0.00 0.00 66.00 65.62 3nix h PRO 235 Cb 1.27 -0.08 -0.00 0.00 0.10 0.00 0.00 31.00 32.28 3nix h PRO 235 CO 0.96 0.25 -0.16 0.66 0.10 0.00 0.00 178.00 179.81 3nix h SER 236 N 0.39 0.00 0.21 -2.05 4.64 -1.98 -2.67 113.55 112.08 3nix h SER 236 Ca 0.54 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.85 3nix h SER 236 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3nix h SER 236 CO -0.23 0.16 -0.10 0.22 -0.87 0.00 0.00 176.83 176.01 3nix h TYR 237 N 0.00 -0.26 -1.02 4.77 3.20 -0.47 -2.70 116.97 120.50 3nix h TYR 237 Ca -0.00 -0.01 0.24 0.00 3.14 0.00 0.00 58.73 62.11 3nix h TYR 237 Cb 0.33 0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.58 3nix h TYR 237 CO 0.00 0.07 0.63 0.74 -1.64 0.00 0.00 178.16 177.97 3nix h PHE 238 N -0.61 0.82 0.00 -3.82 -1.00 -1.48 -0.42 116.94 110.43 3nix h PHE 238 Ca -0.03 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3nix h PHE 238 Cb 0.44 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 39.76 3nix h PHE 238 CO 0.03 0.10 0.00 -0.25 -1.61 0.00 0.00 178.31 176.57 3nix n ASP 239 N -4.72 0.50 0.07 2.17 8.00 -1.02 -1.06 116.55 120.49 3nix n ASP 239 Ca 0.25 0.61 0.11 0.00 0.71 0.00 0.00 54.79 56.47 3nix n ASP 239 Cb 0.78 -0.72 0.44 0.00 -0.02 0.00 0.00 41.12 41.60 3nix n ASP 239 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3nix n GLU 240 N -2.04 0.12 -4.47 -1.24 1.02 -0.17 -4.69 120.64 109.17 3nix n GLU 240 Ca 0.03 0.28 -0.34 0.00 -0.02 0.00 0.00 57.16 57.11 3nix n GLU 240 Cb 0.25 -1.70 -0.10 0.00 -0.02 0.00 0.00 31.44 29.87 3nix n GLU 240 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3nix s TYR 241 N -3.14 3.06 0.12 -0.32 1.51 -0.22 -5.11 117.35 113.24 3nix s TYR 241 Ca 0.07 0.07 0.09 0.00 -1.01 0.00 0.00 57.07 56.29 3nix s TYR 241 Cb 0.11 -1.78 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 3nix s TYR 241 CO 0.40 0.35 -0.22 0.99 -1.11 0.00 0.00 175.55 175.96 3nix s THR 242 N -0.69 1.89 0.00 -0.71 2.01 -1.26 -5.00 115.64 111.87 3nix s THR 242 Ca 0.11 -1.65 0.00 0.00 0.31 0.00 0.00 61.69 60.46 3nix s THR 242 Cb -0.12 -1.71 0.00 0.00 0.01 0.00 0.00 72.50 70.68 3nix s THR 242 CO 0.02 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.52 3nix n GLY 243 N 0.95 -0.37 3.73 4.40 0.00 -1.26 -4.54 105.19 108.10 3nix n GLY 243 Ca -0.18 -2.21 -0.36 0.00 0.00 0.00 0.00 46.02 43.26 3nix n GLY 243 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3nix s THR 244 N 0.00 2.17 0.27 2.61 2.01 -1.26 -4.73 115.64 116.71 3nix s THR 244 Ca 0.00 0.10 -0.02 0.00 0.31 0.00 0.00 61.69 62.08 3nix s THR 244 Cb 0.00 -2.96 0.30 0.00 0.01 0.00 0.00 72.50 69.85 3nix s THR 244 CO 0.00 -0.03 1.64 -0.65 -0.69 0.00 0.00 174.62 174.89 3nix h PRO 245 N 0.41 0.14 -0.48 4.92 0.11 -1.96 0.13 132.00 135.27 3nix h PRO 245 Ca -0.50 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 3nix h PRO 245 Cb 1.32 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 3nix h PRO 245 CO 0.53 0.10 0.17 1.49 -0.21 0.00 0.00 178.00 180.07 3nix h GLU 246 N 0.15 0.73 -0.60 1.05 4.81 -1.91 -3.09 114.58 115.73 3nix h GLU 246 Ca 0.49 -0.15 -0.08 0.00 -0.13 0.00 0.00 59.36 59.49 3nix h GLU 246 Cb 0.93 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.18 3nix h GLU 246 CO -0.68 0.68 0.06 0.93 -0.73 0.00 0.00 179.01 179.27 3nix h GLU 247 N 0.64 1.00 -0.79 1.92 5.08 -1.56 -1.07 114.58 119.80 3nix h GLU 247 Ca 0.16 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3nix h GLU 247 Cb 0.24 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3nix h GLU 247 CO -0.01 0.95 0.00 0.54 -1.00 0.00 0.00 179.01 179.49 3nix n ARG 248 N -4.21 0.58 0.00 2.33 1.74 0.31 -1.22 116.66 116.19 3nix n ARG 248 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 3nix n ARG 248 Cb 0.30 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 3nix n ARG 248 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3nix n ARG 250 N 0.34 0.00 0.00 5.56 1.74 -0.40 -4.60 116.66 119.29 3nix n ARG 250 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3nix n ARG 250 Cb 0.18 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.62 3nix n ARG 250 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3nix n ALA 251 N 0.00 1.85 0.00 7.54 0.00 -0.36 -1.54 120.51 127.99 3nix n ALA 251 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3nix n ALA 251 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 3nix n ALA 251 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3nix n ILE 253 N 0.56 0.00 0.04 0.00 5.41 -1.26 -3.08 119.36 121.02 3nix n ILE 253 Ca 0.00 0.00 0.02 0.00 1.00 0.00 0.00 62.75 63.77 3nix n ILE 253 Cb 0.18 0.00 0.12 0.00 -0.71 0.00 0.00 39.64 39.23 3nix n ILE 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3nix n ALA 254 N 0.00 0.90 0.23 -1.39 0.00 -0.59 0.10 120.51 119.76 3nix n ALA 254 Ca 0.00 0.04 0.09 0.00 0.00 0.00 0.00 53.44 53.57 3nix n ALA 254 Cb 0.00 -0.96 0.25 0.00 0.00 0.00 0.00 19.45 18.75 3nix n ALA 254 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3nix n ASN 255 N -1.61 3.00 -3.97 0.00 4.13 -1.18 -4.77 115.26 110.85 3nix n ASN 255 Ca -0.00 -1.99 -0.31 0.00 1.68 0.00 0.00 54.58 53.96 3nix n ASN 255 Cb 0.07 -0.37 -0.15 0.00 -1.54 0.00 0.00 39.78 37.79 3nix n ASN 255 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 3nix s GLU 256 N -1.27 1.57 0.32 3.52 2.56 0.11 -5.01 118.70 120.50 3nix s GLU 256 Ca 0.38 -1.45 0.04 0.00 0.00 0.00 0.00 54.97 53.94 3nix s GLU 256 Cb 0.20 -2.83 0.83 0.00 2.00 0.00 0.00 34.13 34.33 3nix s GLU 256 CO 0.26 -0.79 1.57 0.78 -0.56 0.00 0.00 175.26 176.52 3nix h GLY 257 N 7.79 1.38 2.00 -1.50 0.00 -1.86 0.28 103.07 111.16 3nix h GLY 257 Ca -0.12 0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3nix h GLY 257 CO 0.48 -0.55 -0.09 0.84 0.00 0.00 0.00 176.54 177.21 3nix h HIS 258 N 0.01 0.00 0.00 5.60 6.17 -1.94 -3.23 115.15 121.76 3nix h HIS 258 Ca 0.63 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.71 3nix h HIS 258 Cb 1.36 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.29 3nix h HIS 258 CO -0.43 0.09 0.00 0.44 0.71 0.00 0.00 177.93 178.74 3nix n ILE 259 N -3.66 0.00 -0.10 6.26 -5.35 -0.44 -4.85 119.36 111.22 3nix n ILE 259 Ca -0.02 -0.35 -0.12 0.00 -0.27 0.00 0.00 62.75 61.99 3nix n ILE 259 Cb 0.21 1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 39.08 3nix n ILE 259 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3nix h ALA 260 N 0.00 -0.60 0.00 -1.28 0.00 -0.52 -2.08 119.26 114.78 3nix h ALA 260 Ca 0.00 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 3nix h ALA 260 Cb 0.02 0.96 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3nix h ALA 260 CO 0.00 -0.95 -0.49 1.49 0.00 0.00 0.00 179.25 179.30 3nix h GLU 261 N -0.40 0.00 0.03 0.00 4.57 -1.86 -2.52 114.58 114.40 3nix h GLU 261 Ca 0.10 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 3nix h GLU 261 Cb 0.61 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 3nix h GLU 261 CO -0.54 0.49 -0.04 -0.09 -1.18 0.00 0.00 179.01 177.64 3nix h ARG 262 N 0.00 -0.09 -0.00 1.92 2.43 -1.71 -3.32 114.38 113.60 3nix h ARG 262 Ca -0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3nix h ARG 262 Cb 1.02 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 3nix h ARG 262 CO 0.06 -0.06 -0.61 1.19 -1.51 0.00 0.00 179.97 179.05 3nix n PHE 263 N -5.15 0.00 -1.67 2.20 3.72 -1.04 -4.34 117.46 111.17 3nix n PHE 263 Ca -0.07 0.00 -0.49 0.00 -0.05 0.00 0.00 57.45 56.84 3nix n PHE 263 Cb 0.08 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.57 3nix n PHE 263 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 3nix n LYS 264 N -0.92 2.07 -0.74 -1.08 4.81 -0.95 -1.72 118.16 119.64 3nix n LYS 264 Ca 0.04 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 3nix n LYS 264 Cb 0.29 -2.62 0.00 0.00 0.02 0.00 0.00 35.03 32.72 3nix n LYS 264 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 3nix n SER 265 N 6.84 0.00 -4.81 3.14 7.64 -1.26 -5.02 113.62 120.15 3nix n SER 265 Ca 0.24 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.77 3nix n SER 265 Cb 0.29 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.42 3nix n SER 265 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3nix s GLU 266 N -0.12 4.36 0.47 1.43 0.41 -0.70 -5.03 118.70 119.52 3nix s GLU 266 Ca 0.00 1.19 -0.23 0.00 -0.41 0.00 0.00 54.97 55.52 3nix s GLU 266 Cb 0.00 -2.41 -0.07 0.00 -1.78 0.00 0.00 34.13 29.87 3nix s GLU 266 CO 0.00 0.09 1.17 -2.00 -0.49 0.00 0.00 175.26 174.03 3nix s GLU 267 N -2.76 3.71 -0.15 1.61 2.12 -1.26 -4.87 118.70 117.10 3nix s GLU 267 Ca 0.58 1.79 -0.08 0.00 0.36 0.00 0.00 54.97 57.61 3nix s GLU 267 Cb -0.13 -2.38 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 3nix s GLU 267 CO 0.17 -0.59 0.14 -0.06 -0.54 0.00 0.00 175.26 174.37 3nix s PHE 268 N -1.55 3.53 0.25 5.30 0.08 -1.26 -1.86 117.98 122.46 3nix s PHE 268 Ca 0.64 0.45 0.11 0.00 0.12 0.00 0.00 56.93 58.25 3nix s PHE 268 Cb -0.29 -2.03 0.32 0.00 -0.57 0.00 0.00 43.02 40.45 3nix s PHE 268 CO 0.35 0.56 1.59 -0.07 -0.10 0.00 0.00 175.22 177.55 3nix h LEU 269 N 5.64 0.00 -7.49 -0.37 -0.00 -1.33 -3.46 115.31 108.31 3nix h LEU 269 Ca -0.50 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.32 3nix h LEU 269 Cb 1.20 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 41.72 3nix h LEU 269 CO 0.65 0.64 -0.15 0.72 -0.00 0.00 0.00 178.44 180.30 3nix s PHE 270 N -3.52 -0.14 0.10 1.13 -0.71 -1.26 -5.04 117.98 108.54 3nix s PHE 270 Ca -0.01 -0.15 -0.35 0.00 -1.04 0.00 0.00 56.93 55.39 3nix s PHE 270 Cb 0.12 0.18 -0.14 0.00 -1.21 0.00 0.00 43.02 41.97 3nix s PHE 270 CO 0.76 -0.63 1.57 -1.91 -1.34 0.00 0.00 175.22 173.67 3nix n GLU 271 N -0.01 1.91 -1.66 1.99 2.13 -1.26 -4.66 120.64 119.08 3nix n GLU 271 Ca -0.16 0.69 -0.43 0.00 0.66 0.00 0.00 57.16 57.92 3nix n GLU 271 Cb 0.62 -2.44 -0.01 0.00 0.27 0.00 0.00 31.44 29.89 3nix n GLU 271 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 3nix n PRO 272 N 3.64 1.86 -4.40 5.31 -0.02 -1.26 -4.93 135.00 135.20 3nix n PRO 272 Ca 0.18 0.65 -0.31 0.00 -2.02 0.00 0.00 63.50 62.00 3nix n PRO 272 Cb 0.26 -2.17 -0.10 0.00 -0.02 0.00 0.00 33.50 31.47 3nix n PRO 272 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3nix s ARG 273 N -1.79 2.35 -0.17 -0.52 0.52 0.05 -4.84 118.95 114.54 3nix s ARG 273 Ca 0.57 -0.86 -0.06 0.00 -0.52 0.00 0.00 55.73 54.86 3nix s ARG 273 Cb -0.61 -2.40 -0.04 0.00 0.52 0.00 0.00 34.95 32.43 3nix s ARG 273 CO 0.61 0.56 0.03 0.99 0.02 0.00 0.00 175.30 177.51 3nix s THR 274 N -1.07 4.48 0.02 0.02 2.01 -1.26 -2.24 115.64 117.60 3nix s THR 274 Ca 0.19 -0.15 0.08 0.00 0.31 0.00 0.00 61.69 62.12 3nix s THR 274 Cb -0.11 -3.00 -0.03 0.00 0.01 0.00 0.00 72.50 69.37 3nix s THR 274 CO 0.10 0.48 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.63 3nix s ILE 275 N 0.32 2.22 0.02 1.82 1.01 -0.81 -5.00 121.20 120.79 3nix s ILE 275 Ca 0.01 -1.23 0.03 0.00 0.00 0.00 0.00 60.65 59.45 3nix s ILE 275 Cb -0.13 -1.84 -0.02 0.00 0.01 0.00 0.00 42.46 40.49 3nix s ILE 275 CO 0.01 0.45 -0.08 -0.70 0.00 0.00 0.00 174.94 174.62 3nix s GLU 276 N -1.01 0.58 -1.49 2.79 2.12 -1.26 -1.20 118.70 119.23 3nix s GLU 276 Ca 0.11 -0.53 -0.08 0.00 0.36 0.00 0.00 54.97 54.84 3nix s GLU 276 Cb -0.10 -0.48 0.06 0.00 0.26 0.00 0.00 34.13 33.87 3nix s GLU 276 CO 0.01 0.11 0.68 0.41 -0.54 0.00 0.00 175.26 175.94 3nix n GLY 277 N 2.15 -0.35 0.29 -1.50 0.00 -0.66 -4.87 105.19 100.24 3nix n GLY 277 Ca -0.18 0.15 0.17 0.00 0.00 0.00 0.00 46.02 46.16 3nix n GLY 277 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3nix h TYR 278 N -1.82 0.00 -3.12 1.61 -0.00 -1.90 -3.43 116.97 108.30 3nix h TYR 278 Ca -0.61 0.00 -0.58 0.00 0.00 0.00 0.00 58.73 57.55 3nix h TYR 278 Cb 1.37 0.00 -0.06 0.00 0.00 0.00 0.00 36.73 38.05 3nix h TYR 278 CO 0.54 0.05 0.84 0.00 -0.00 0.00 0.00 178.16 179.59 3nix s ALA 279 N -3.94 3.61 0.03 0.10 0.00 -1.26 -4.83 121.76 115.46 3nix s ALA 279 Ca -0.02 0.15 -0.08 0.00 0.00 0.00 0.00 51.96 52.02 3nix s ALA 279 Cb 0.11 -3.61 -0.00 0.00 0.00 0.00 0.00 23.12 19.62 3nix s ALA 279 CO 0.53 -1.24 0.15 -1.50 0.00 0.00 0.00 175.76 173.69 3nix s ILE 280 N 3.46 0.11 0.48 0.00 1.10 -1.23 -4.49 121.20 120.62 3nix s ILE 280 Ca 0.47 -0.89 0.04 0.00 -0.51 0.00 0.00 60.65 59.77 3nix s ILE 280 Cb -0.15 -0.75 -0.03 0.00 0.15 0.00 0.00 42.46 41.68 3nix s ILE 280 CO 0.11 -0.49 0.10 -0.55 -2.11 0.00 0.00 174.94 172.00 3nix s SER 281 N -1.86 4.20 0.15 4.50 0.15 0.84 -2.42 113.70 119.26 3nix s SER 281 Ca -0.08 -1.43 0.07 0.00 0.70 0.00 0.00 55.95 55.21 3nix s SER 281 Cb -0.03 0.12 -0.04 0.00 -1.71 0.00 0.00 66.02 64.35 3nix s SER 281 CO -0.02 -0.74 -0.15 0.00 1.20 0.00 0.00 173.24 173.53 3nix s ALA 282 N -2.77 1.72 0.00 5.45 0.00 -1.20 0.95 121.76 125.90 3nix s ALA 282 Ca 0.23 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.77 3nix s ALA 282 Cb 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.05 3nix s ALA 282 CO 0.13 0.12 0.63 -1.13 0.00 0.00 0.00 175.76 175.51 3nix n SER 283 N 0.27 0.00 -4.72 0.00 3.41 2.12 -4.64 113.62 110.06 3nix n SER 283 Ca -0.13 0.72 -0.24 0.00 -0.26 0.00 0.00 58.87 58.95 3nix n SER 283 Cb 0.58 -0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 64.11 3nix n SER 283 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3nix s LYS 284 N -1.96 2.58 -0.00 4.33 -2.85 -1.26 -5.03 119.74 115.55 3nix s LYS 284 Ca 0.00 -1.13 0.18 0.00 -1.00 0.00 0.00 55.97 54.02 3nix s LYS 284 Cb 0.00 -2.41 -0.20 0.00 -2.06 0.00 0.00 37.83 33.16 3nix s LYS 284 CO 0.00 0.42 0.74 1.28 0.10 0.00 0.00 175.35 177.90 3nix n LEU 285 N -0.61 0.80 -4.07 2.77 4.32 -1.26 -4.93 117.00 114.02 3nix n LEU 285 Ca -0.08 -0.47 -0.14 0.00 -0.02 0.00 0.00 56.01 55.30 3nix n LEU 285 Cb 0.57 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.33 3nix n LEU 285 CO 0.41 0.20 0.16 -0.72 -1.22 0.00 0.00 177.39 176.22 3nix s TYR 286 N -2.73 0.99 0.00 -1.77 1.13 -1.26 0.51 117.35 114.22 3nix s TYR 286 Ca 0.06 -1.25 0.00 0.00 -1.41 0.00 0.00 57.07 54.47 3nix s TYR 286 Cb 0.13 -0.02 0.00 0.00 -1.10 0.00 0.00 41.96 40.97 3nix s TYR 286 CO 0.74 -1.16 0.00 0.41 -2.51 0.00 0.00 175.55 173.03 3nix n GLY 287 N -0.56 1.23 3.62 5.49 0.00 -0.34 -4.96 105.19 109.69 3nix n GLY 287 Ca 0.00 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 3nix n GLY 287 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3nix s ASP 288 N 0.77 6.46 0.00 1.61 1.01 -1.26 -3.31 116.67 121.95 3nix s ASP 288 Ca 0.00 1.25 0.00 0.00 0.71 0.00 0.00 52.55 54.51 3nix s ASP 288 Cb 0.00 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.39 3nix s ASP 288 CO 0.00 -1.25 0.00 0.61 0.21 0.00 0.00 175.17 174.74 3nix n GLY 289 N 4.66 0.72 3.45 0.21 0.00 -1.26 -4.67 105.19 108.31 3nix n GLY 289 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.04 3nix n GLY 289 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3nix s PHE 290 N -2.23 -0.55 -0.01 1.61 -0.71 -1.21 0.70 117.98 115.58 3nix s PHE 290 Ca 0.00 0.72 -0.04 0.00 -1.04 0.00 0.00 56.93 56.58 3nix s PHE 290 Cb 0.00 0.42 -0.00 0.00 -1.21 0.00 0.00 43.02 42.23 3nix s PHE 290 CO 0.00 -0.67 0.07 0.54 -1.34 0.00 0.00 175.22 173.82 3nix s VAL 291 N -2.19 0.05 0.03 -2.49 0.11 -1.16 -1.19 120.40 113.56 3nix s VAL 291 Ca -0.06 -0.42 -0.07 0.00 -2.93 0.00 0.00 61.98 58.50 3nix s VAL 291 Cb -0.01 -0.25 -0.05 0.00 -1.53 0.00 0.00 36.38 34.55 3nix s VAL 291 CO 0.01 -0.23 0.29 -0.76 -3.33 0.00 0.00 175.10 171.08 3nix s LEU 292 N -0.72 4.36 0.30 2.54 1.43 0.18 -1.92 118.68 124.85 3nix s LEU 292 Ca -0.08 0.59 0.02 0.00 -1.03 0.00 0.00 54.13 53.64 3nix s LEU 292 Cb -0.05 -2.75 -0.04 0.00 0.03 0.00 0.00 46.19 43.37 3nix s LEU 292 CO 0.00 0.23 0.12 0.42 0.23 0.00 0.00 176.35 177.35 3nix s THR 293 N -1.33 0.55 0.00 5.49 -4.23 -0.86 -4.82 115.64 110.43 3nix s THR 293 Ca 0.29 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 3nix s THR 293 Cb -0.13 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.13 3nix s THR 293 CO 0.17 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.86 3nix n GLY 294 N -0.58 2.88 1.27 3.99 0.00 -1.26 -2.29 105.19 109.20 3nix n GLY 294 Ca -0.00 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.05 3nix n GLY 294 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3nix n ASN 295 N 2.26 3.72 -0.42 1.61 5.03 -1.26 -2.52 115.26 123.68 3nix n ASN 295 Ca 0.00 -2.22 0.14 0.00 0.87 0.00 0.00 54.58 53.37 3nix n ASN 295 Cb 0.00 -0.48 0.50 0.00 -1.02 0.00 0.00 39.78 38.78 3nix n ASN 295 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3nix n ALA 296 N 1.07 2.69 -1.70 5.41 0.00 -0.97 -4.34 120.51 122.67 3nix n ALA 296 Ca 0.21 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.22 3nix n ALA 296 Cb 0.66 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3nix n ALA 296 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3nix n THR 297 N -0.04 0.00 -3.70 0.00 -1.04 -1.05 -4.79 114.28 103.66 3nix n THR 297 Ca 0.17 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 62.05 3nix n THR 297 Cb 0.35 -0.59 -0.13 0.00 -1.82 0.00 0.00 70.33 68.13 3nix n THR 297 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 3nix s GLU 298 N 0.00 0.16 0.02 -2.82 -6.30 -1.22 -3.26 118.70 105.28 3nix s GLU 298 Ca 0.00 0.60 0.08 0.00 -2.50 0.00 0.00 54.97 53.15 3nix s GLU 298 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 34.13 33.99 3nix s GLU 298 CO 0.00 -0.22 -0.24 0.12 0.02 0.00 0.00 175.26 174.93 3nix s PHE 299 N 1.78 2.38 0.00 5.30 5.36 -1.02 -4.79 117.98 127.00 3nix s PHE 299 Ca -0.04 -0.38 0.00 0.00 -0.96 0.00 0.00 56.93 55.54 3nix s PHE 299 Cb -0.11 -1.45 0.00 0.00 -0.34 0.00 0.00 43.02 41.11 3nix s PHE 299 CO -0.08 0.09 0.00 1.28 -1.46 0.00 0.00 175.22 175.05 3nix n LEU 300 N 2.01 0.00 -3.64 6.12 4.77 -1.26 -3.58 117.00 121.42 3nix n LEU 300 Ca -0.17 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.78 3nix n LEU 300 Cb 0.52 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.54 3nix n LEU 300 CO 0.24 0.00 0.84 -0.62 -1.33 0.00 0.00 177.39 176.52 3nix s ASP 301 N -0.86 -0.33 0.00 -1.43 2.15 -1.26 -4.57 116.67 110.37 3nix s ASP 301 Ca 0.00 0.58 0.05 0.00 0.43 0.00 0.00 52.55 53.61 3nix s ASP 301 Cb 0.00 0.87 0.30 0.00 -0.30 0.00 0.00 42.92 43.79 3nix s ASP 301 CO 0.00 -0.10 0.83 -0.81 -0.17 0.00 0.00 175.17 174.93 3nix n PRO 302 N 2.76 0.58 -2.21 4.34 -0.04 -1.26 -4.65 135.00 134.52 3nix n PRO 302 Ca -0.15 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.90 3nix n PRO 302 Cb 0.57 -1.14 -0.03 0.00 -0.04 0.00 0.00 33.50 32.86 3nix n PRO 302 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3nix s ILE 303 N -2.00 2.96 0.00 0.52 1.01 -1.26 -2.20 121.20 120.23 3nix s ILE 303 Ca 0.08 0.93 0.00 0.00 0.00 0.00 0.00 60.65 61.66 3nix s ILE 303 Cb 0.03 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.91 3nix s ILE 303 CO 0.06 0.21 0.00 0.49 0.00 0.00 0.00 174.94 175.70 3nix n PHE 304 N 1.20 0.00 -3.97 3.97 3.72 -1.26 -4.55 117.46 116.56 3nix n PHE 304 Ca 0.01 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.00 3nix n PHE 304 Cb 0.43 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.98 3nix n PHE 304 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3nix n SER 305 N 0.00 -4.44 -0.19 4.37 7.64 -0.93 -4.88 113.62 115.19 3nix n SER 305 Ca 0.00 -1.19 0.09 0.00 1.01 0.00 0.00 58.87 58.77 3nix n SER 305 Cb 0.00 -1.84 -0.06 0.00 -1.01 0.00 0.00 64.21 61.31 3nix n SER 305 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3nix n SER 306 N -2.29 1.28 0.23 6.43 3.41 -1.26 -4.58 113.62 116.83 3nix n SER 306 Ca -0.15 -1.14 -0.11 0.00 -0.26 0.00 0.00 58.87 57.21 3nix n SER 306 Cb 0.59 0.77 -0.06 0.00 -0.26 0.00 0.00 64.21 65.25 3nix n SER 306 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3nix h GLY 307 N 4.19 -0.93 0.33 5.00 0.00 -1.89 0.53 103.07 110.29 3nix h GLY 307 Ca 0.00 0.40 0.15 0.00 0.00 0.00 0.00 47.33 47.87 3nix h GLY 307 CO 0.00 -0.31 0.61 0.00 0.00 0.00 0.00 176.54 176.84 3nix h ALA 308 N -1.43 1.55 -0.36 3.60 0.00 -1.87 0.29 119.26 121.04 3nix h ALA 308 Ca -0.05 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3nix h ALA 308 Cb 0.54 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3nix h ALA 308 CO 0.04 0.10 0.15 1.15 0.00 0.00 0.00 179.25 180.69 3nix h THR 309 N 0.88 1.18 -0.57 0.00 2.02 -1.77 -2.27 112.91 112.39 3nix h THR 309 Ca 0.52 -0.55 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3nix h THR 309 Cb 0.65 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 3nix h THR 309 CO -0.32 0.20 0.29 -0.26 0.37 0.00 0.00 175.52 175.80 3nix h PHE 310 N 0.44 0.79 0.00 3.16 0.04 0.11 0.45 116.94 121.93 3nix h PHE 310 Ca 0.12 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.86 3nix h PHE 310 Cb 0.16 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.06 3nix h PHE 310 CO -0.01 0.59 0.00 0.00 -0.60 0.00 0.00 178.31 178.30 3nix n ALA 311 N -2.31 0.72 0.00 2.45 0.00 0.93 -0.18 120.51 122.12 3nix n ALA 311 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3nix n ALA 311 Cb 0.10 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 18.94 3nix n ALA 311 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3nix n GLU 313 N 0.08 0.00 0.11 0.00 4.07 0.16 -1.77 120.64 123.29 3nix n GLU 313 Ca 0.00 0.00 -0.20 0.00 -0.06 0.00 0.00 57.16 56.90 3nix n GLU 313 Cb 0.00 0.00 -0.15 0.00 -0.06 0.00 0.00 31.44 31.23 3nix n GLU 313 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 3nix h SER 314 N 0.00 0.60 -0.29 4.31 4.64 -0.82 -2.33 113.55 119.67 3nix h SER 314 Ca 0.00 -0.71 0.02 0.00 -0.47 0.00 0.00 61.79 60.63 3nix h SER 314 Cb 0.00 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 3nix h SER 314 CO 0.00 1.57 0.16 1.23 -0.87 0.00 0.00 176.83 178.92 3nix h GLY 315 N 0.95 0.40 0.61 -0.77 0.00 -1.54 0.52 103.07 103.24 3nix h GLY 315 Ca -0.23 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 3nix h GLY 315 CO 0.22 0.10 -0.37 0.23 0.00 0.00 0.00 176.54 176.72 3nix h SER 316 N 0.33 -1.01 0.01 0.19 0.87 -1.81 1.56 113.55 113.69 3nix h SER 316 Ca 0.12 0.09 -0.05 0.00 -1.23 0.00 0.00 61.79 60.71 3nix h SER 316 Cb 0.02 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 3nix h SER 316 CO -0.07 -0.52 -0.14 0.11 -0.53 0.00 0.00 176.83 175.68 3nix h LYS 317 N -0.77 0.27 -0.04 2.24 1.79 -1.30 -0.41 116.57 118.35 3nix h LYS 317 Ca -0.03 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.33 3nix h LYS 317 Cb 0.69 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 3nix h LYS 317 CO -0.06 0.42 -0.15 0.78 -1.08 0.00 0.00 179.45 179.35 3nix h GLY 318 N 0.79 0.18 -0.08 3.86 0.00 0.75 -2.00 103.07 106.57 3nix h GLY 318 Ca 0.05 -0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.16 3nix h GLY 318 CO 0.02 0.23 -0.51 -1.33 0.00 0.00 0.00 176.54 174.95 3nix h GLY 319 N -0.40 -0.97 0.64 4.60 0.00 0.23 -0.23 103.07 106.94 3nix h GLY 319 Ca -0.01 0.63 0.07 0.00 0.00 0.00 0.00 47.33 48.03 3nix h GLY 319 CO 0.03 -0.21 0.50 0.50 0.00 0.00 0.00 176.54 177.37 3nix h LYS 320 N -0.57 0.86 -0.21 4.80 1.57 -1.09 -1.62 116.57 120.32 3nix h LYS 320 Ca 0.05 -0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.57 3nix h LYS 320 Cb 0.67 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.79 3nix h LYS 320 CO -0.42 0.57 -0.66 -0.07 -0.57 0.00 0.00 179.45 178.31 3nix h LEU 321 N 0.89 0.90 -0.73 2.94 3.38 -1.29 -2.74 115.31 118.66 3nix h LEU 321 Ca 0.38 -0.53 0.15 0.00 0.09 0.00 0.00 57.88 57.97 3nix h LEU 321 Cb 0.25 -0.26 -0.10 0.00 0.09 0.00 0.00 40.66 40.64 3nix h LEU 321 CO -0.20 1.32 0.23 0.00 0.09 0.00 0.00 178.44 179.88 3nix h ALA 322 N 0.68 0.98 -0.24 1.53 0.00 -0.14 0.07 119.26 122.14 3nix h ALA 322 Ca -0.02 0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.05 3nix h ALA 322 Cb 1.26 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 3nix h ALA 322 CO 0.14 -0.28 0.10 0.28 0.00 0.00 0.00 179.25 179.49 3nix h VAL 323 N 0.35 0.96 -0.65 0.00 2.07 -1.18 0.20 116.25 118.01 3nix h VAL 323 Ca 0.40 -0.08 0.08 0.00 0.82 0.00 0.00 66.70 67.92 3nix h VAL 323 Cb 0.65 0.72 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 3nix h VAL 323 CO -0.45 0.04 0.32 1.56 0.02 0.00 0.00 177.57 179.06 3nix h GLN 324 N 0.22 0.56 -0.31 1.57 1.08 -0.92 -1.19 115.11 116.11 3nix h GLN 324 Ca 0.10 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3nix h GLN 324 Cb 0.05 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 3nix h GLN 324 CO -0.09 0.37 0.20 0.35 -0.95 0.00 0.00 178.83 178.71 3nix h PHE 325 N 0.57 0.40 -0.08 2.96 3.57 0.05 -1.74 116.94 122.68 3nix h PHE 325 Ca 0.31 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 3nix h PHE 325 Cb 0.28 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 3nix h PHE 325 CO -0.11 0.28 0.02 -0.07 -2.23 0.00 0.00 178.31 176.20 3nix h LEU 326 N 0.42 0.09 -0.14 0.59 3.38 0.28 -1.99 115.31 117.95 3nix h LEU 326 Ca 0.11 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3nix h LEU 326 Cb -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3nix h LEU 326 CO -0.02 0.10 0.00 0.11 0.09 0.00 0.00 178.44 178.71 3nix h LYS 327 N 0.11 0.00 0.00 1.13 1.57 -0.48 -3.46 116.57 115.43 3nix h LYS 327 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3nix h LYS 327 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3nix h LYS 327 CO -0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 3nix n GLY 328 N 1.07 0.67 3.81 3.86 0.00 -0.75 -5.09 105.19 108.76 3nix n GLY 328 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3nix n GLY 328 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3nix s GLU 329 N -0.85 3.77 -0.16 1.61 0.41 -0.73 -5.02 118.70 117.72 3nix s GLU 329 Ca 0.00 1.26 -0.22 0.00 -0.41 0.00 0.00 54.97 55.60 3nix s GLU 329 Cb 0.00 -2.10 -0.03 0.00 -1.78 0.00 0.00 34.13 30.23 3nix s GLU 329 CO 0.00 -0.45 0.67 -2.00 -0.49 0.00 0.00 175.26 172.99 3nix s GLU 330 N -3.48 4.28 -0.14 1.61 2.12 -1.26 -4.32 118.70 117.51 3nix s GLU 330 Ca 0.65 0.73 -0.04 0.00 0.36 0.00 0.00 54.97 56.67 3nix s GLU 330 Cb -0.15 -3.54 -0.03 0.00 0.26 0.00 0.00 34.13 30.67 3nix s GLU 330 CO 0.24 -0.17 -0.01 0.08 -0.54 0.00 0.00 175.26 174.86 3nix s VAL 331 N 1.64 4.20 -0.93 3.70 1.01 -1.26 -5.04 120.40 123.72 3nix s VAL 331 Ca 0.32 -0.26 -0.14 0.00 0.00 0.00 0.00 61.98 61.90 3nix s VAL 331 Cb -0.16 -2.83 0.21 0.00 0.00 0.00 0.00 36.38 33.60 3nix s VAL 331 CO 0.12 0.52 0.96 0.21 0.00 0.00 0.00 175.10 176.91 3nix s ASN 332 N -0.03 6.85 0.19 3.32 3.84 -1.26 -4.89 114.94 122.96 3nix s ASN 332 Ca 0.03 -2.72 -0.12 0.00 0.21 0.00 0.00 52.86 50.26 3nix s ASN 332 Cb -0.13 -2.27 0.15 0.00 -0.55 0.00 0.00 41.25 38.45 3nix s ASN 332 CO 0.02 -0.65 1.81 -0.50 -2.79 0.00 0.00 177.10 174.99 3nix h TRP 333 N 7.79 0.60 -0.82 0.43 4.06 -1.96 0.65 115.95 126.70 3nix h TRP 333 Ca 0.15 0.02 0.06 0.00 2.06 0.00 0.00 58.89 61.17 3nix h TRP 333 Cb 1.00 -0.19 -0.05 0.00 -1.00 0.00 0.00 29.16 28.92 3nix h TRP 333 CO 1.03 0.32 0.54 1.49 -3.56 0.00 0.00 178.44 178.26 3nix h GLU 334 N 0.63 0.91 0.00 0.49 4.57 -1.96 -0.78 114.58 118.44 3nix h GLU 334 Ca 0.24 -0.05 -0.16 0.00 -1.18 0.00 0.00 59.36 58.21 3nix h GLU 334 Cb 0.08 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.44 3nix h GLU 334 CO -0.13 0.60 -0.85 -0.22 -1.18 0.00 0.00 179.01 177.23 3nix h LYS 335 N 0.93 0.01 0.00 1.92 3.64 -1.82 -1.05 116.57 120.21 3nix h LYS 335 Ca 0.35 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 3nix h LYS 335 Cb 0.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3nix h LYS 335 CO -0.12 1.01 -0.39 -0.25 -2.27 0.00 0.00 179.45 177.43 3nix n ASP 336 N -4.47 0.66 0.06 4.20 9.92 0.22 -3.86 116.55 123.27 3nix n ASP 336 Ca -0.25 0.24 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 3nix n ASP 336 Cb 0.62 -0.15 0.00 0.00 -0.64 0.00 0.00 41.12 40.95 3nix n ASP 336 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 3nix n PHE 337 N -2.05 -0.33 0.38 1.24 7.35 -0.47 -4.65 117.46 118.93 3nix n PHE 337 Ca 0.04 0.06 -0.18 0.00 -0.76 0.00 0.00 57.45 56.61 3nix n PHE 337 Cb 0.42 0.08 -0.09 0.00 0.35 0.00 0.00 39.48 40.24 3nix n PHE 337 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3nix h VAL 338 N 0.00 0.28 -0.76 -2.13 2.07 -1.24 -2.85 116.25 111.62 3nix h VAL 338 Ca 0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 3nix h VAL 338 Cb 0.12 0.28 -0.08 0.00 -1.52 0.00 0.00 31.29 30.09 3nix h VAL 338 CO 0.00 0.00 0.38 -0.33 0.02 0.00 0.00 177.57 177.64 3nix h GLU 339 N -0.96 0.59 -4.90 1.57 5.08 -1.31 -3.42 114.58 111.23 3nix h GLU 339 Ca -0.09 -0.04 -0.50 0.00 -1.00 0.00 0.00 59.36 57.73 3nix h GLU 339 Cb 0.74 -0.13 0.13 0.00 0.50 0.00 0.00 28.75 29.99 3nix h GLU 339 CO 0.14 0.39 1.28 1.58 -1.00 0.00 0.00 179.01 181.41 3nix n HIS 340 N -4.86 0.00 0.00 4.33 -0.00 -1.08 -4.71 115.22 108.90 3nix n HIS 340 Ca 0.13 -0.47 0.00 0.00 0.46 0.00 0.00 57.72 57.84 3nix n HIS 340 Cb 0.32 -0.72 0.00 0.00 -0.12 0.00 0.00 29.99 29.47 3nix n HIS 340 CO 0.00 0.00 0.00 0.94 0.46 0.00 0.00 176.34 177.74 3nix n GLN 343 N 7.46 0.00 0.08 1.57 -0.06 -1.26 -4.75 117.38 120.42 3nix n GLN 343 Ca 0.40 0.00 -0.13 0.00 -2.00 0.00 0.00 57.00 55.27 3nix n GLN 343 Cb 0.37 0.00 -0.08 0.00 -4.06 0.00 0.00 30.24 26.47 3nix n GLN 343 CO 0.00 0.00 0.00 0.78 -0.20 0.00 0.00 177.06 177.64 3nix h GLY 344 N 0.00 -0.16 1.35 1.69 0.00 -1.84 -2.92 103.07 101.18 3nix h GLY 344 Ca 0.00 0.06 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 3nix h GLY 344 CO 0.00 -0.06 -0.09 -2.22 0.00 0.00 0.00 176.54 174.17 3nix h ILE 345 N -0.31 1.25 -0.75 2.60 1.08 -1.93 -2.38 117.51 117.07 3nix h ILE 345 Ca -0.02 -1.14 -0.02 0.00 -0.39 0.00 0.00 64.86 63.29 3nix h ILE 345 Cb 0.26 1.02 -0.04 0.00 -3.07 0.00 0.00 36.82 34.99 3nix h ILE 345 CO 0.03 0.39 0.39 0.44 -0.69 0.00 0.00 178.15 178.71 3nix h ASP 346 N 0.71 0.96 0.39 1.72 3.32 -1.97 -2.43 116.42 119.11 3nix h ASP 346 Ca 0.12 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 3nix h ASP 346 Cb 0.57 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.88 3nix h ASP 346 CO 0.04 0.79 -0.19 0.74 -1.72 0.00 0.00 179.24 178.90 3nix h THR 347 N 1.05 0.62 -0.65 0.35 2.02 -1.23 -2.15 112.91 112.91 3nix h THR 347 Ca 0.26 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.30 3nix h THR 347 Cb 0.07 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 3nix h THR 347 CO -0.04 0.03 0.39 -0.26 0.37 0.00 0.00 175.52 176.01 3nix h PHE 348 N -0.60 0.85 -0.37 3.16 0.04 -1.55 -2.43 116.94 116.04 3nix h PHE 348 Ca -0.05 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.76 3nix h PHE 348 Cb 0.45 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 38.28 3nix h PHE 348 CO -0.03 0.57 0.13 -0.09 -0.60 0.00 0.00 178.31 178.29 3nix h ARG 349 N 0.90 0.28 -0.86 1.51 2.43 -1.21 0.68 114.38 118.11 3nix h ARG 349 Ca 0.24 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.45 3nix h ARG 349 Cb -0.03 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.39 3nix h ARG 349 CO -0.04 0.19 0.54 0.77 -1.51 0.00 0.00 179.97 179.91 3nix h SER 350 N 0.29 0.84 0.20 -3.80 0.02 -1.05 0.99 113.55 111.03 3nix h SER 350 Ca 0.17 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 61.04 3nix h SER 350 Cb 0.14 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 3nix h SER 350 CO -0.17 0.54 -0.36 -0.26 -1.14 0.00 0.00 176.83 175.44 3nix h PHE 351 N 0.97 0.26 -0.09 3.45 -1.00 -0.37 0.71 116.94 120.88 3nix h PHE 351 Ca 0.38 -0.06 -0.01 0.00 2.81 0.00 0.00 57.97 61.08 3nix h PHE 351 Cb 0.17 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.67 3nix h PHE 351 CO -0.03 0.56 0.01 0.28 -1.61 0.00 0.00 178.31 177.52 3nix h VAL 352 N 0.20 1.24 -0.83 -0.55 2.07 0.85 0.11 116.25 119.35 3nix h VAL 352 Ca 0.02 -0.74 0.09 0.00 0.82 0.00 0.00 66.70 66.90 3nix h VAL 352 Cb 0.73 1.55 -0.07 0.00 -1.52 0.00 0.00 31.29 31.98 3nix h VAL 352 CO 0.06 0.21 0.47 0.74 0.02 0.00 0.00 177.57 179.07 3nix h THR 353 N -0.10 0.91 -0.43 2.57 2.02 -0.63 -1.77 112.91 115.48 3nix h THR 353 Ca 0.03 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 3nix h THR 353 Cb 0.32 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 3nix h THR 353 CO 0.00 0.14 0.03 1.23 0.37 0.00 0.00 175.52 177.30 3nix h GLY 354 N 0.79 0.73 0.81 2.16 0.00 -0.59 -2.74 103.07 104.24 3nix h GLY 354 Ca 0.40 -0.45 0.01 0.00 0.00 0.00 0.00 47.33 47.29 3nix h GLY 354 CO -0.25 0.42 -0.08 -0.25 0.00 0.00 0.00 176.54 176.38 3nix h TRP 355 N 0.65 -0.20 -0.07 5.60 2.91 0.11 -1.51 115.95 123.44 3nix h TRP 355 Ca 0.14 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.16 3nix h TRP 355 Cb 0.36 0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.10 3nix h TRP 355 CO 0.02 -0.12 0.00 0.66 -1.03 0.00 0.00 178.44 177.97 3nix n TYR 356 N -5.20 0.09 -0.87 2.65 4.01 -1.02 -3.77 117.16 113.05 3nix n TYR 356 Ca -0.06 -0.04 0.08 0.00 -0.16 0.00 0.00 57.90 57.71 3nix n TYR 356 Cb 0.12 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.26 3nix n TYR 356 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3nix n ASP 357 N -0.04 2.20 0.00 7.72 5.68 -1.05 -4.99 116.55 126.06 3nix n ASP 357 Ca 0.18 -2.82 0.00 0.00 -0.50 0.00 0.00 54.79 51.65 3nix n ASP 357 Cb 0.27 -0.33 0.00 0.00 -1.14 0.00 0.00 41.12 39.92 3nix n ASP 357 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3nix n GLY 358 N -1.19 2.79 0.47 6.12 0.00 -1.22 -4.85 105.19 107.30 3nix n GLY 358 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 3nix n GLY 358 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3nix h THR 359 N 0.00 0.08 -0.73 2.61 1.35 -1.87 -1.34 112.91 113.01 3nix h THR 359 Ca 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.83 3nix h THR 359 Cb 0.00 0.08 -0.03 0.00 -1.73 0.00 0.00 68.15 66.47 3nix h THR 359 CO 0.00 0.00 0.34 0.25 -0.25 0.00 0.00 175.52 175.86 3nix h LEU 360 N -0.97 0.96 -0.77 3.87 5.85 -1.57 -1.71 115.31 120.98 3nix h LEU 360 Ca -0.06 -0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.58 3nix h LEU 360 Cb 0.84 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.56 3nix h LEU 360 CO -0.04 0.83 0.45 0.45 -0.34 0.00 0.00 178.44 179.80 3nix h HIS 361 N 1.03 0.83 -0.12 1.25 3.86 -1.73 0.30 115.15 120.57 3nix h HIS 361 Ca 0.25 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.38 3nix h HIS 361 Cb 0.14 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 3nix h HIS 361 CO 0.01 0.41 -0.38 0.00 0.86 0.00 0.00 177.93 178.82 3nix h ALA 362 N 1.38 1.13 -0.28 2.45 0.00 -0.51 -0.27 119.26 123.17 3nix h ALA 362 Ca 0.34 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3nix h ALA 362 Cb 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3nix h ALA 362 CO -0.18 0.57 -0.04 0.28 0.00 0.00 0.00 179.25 179.88 3nix h VAL 363 N 0.21 1.27 -0.41 0.00 2.07 -0.58 -2.89 116.25 115.93 3nix h VAL 363 Ca 0.02 -1.04 -0.06 0.00 0.82 0.00 0.00 66.70 66.44 3nix h VAL 363 Cb 0.78 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 3nix h VAL 363 CO 0.06 0.33 -0.00 -0.26 0.02 0.00 0.00 177.57 177.72 3nix h PHE 364 N 0.29 0.70 -0.06 1.57 -1.00 0.41 -3.26 116.94 115.60 3nix h PHE 364 Ca 0.07 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 60.75 3nix h PHE 364 Cb 0.51 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.86 3nix h PHE 364 CO 0.05 0.67 -0.22 1.19 -1.61 0.00 0.00 178.31 178.39 3nix n PHE 365 N -4.24 0.21 -2.06 -0.55 3.72 -0.19 -4.49 117.46 109.87 3nix n PHE 365 Ca 0.02 -1.27 -0.34 0.00 -0.05 0.00 0.00 57.45 55.81 3nix n PHE 365 Cb 0.28 -0.25 0.02 0.00 -0.94 0.00 0.00 39.48 38.59 3nix n PHE 365 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3nix s ALA 366 N -3.07 2.63 0.19 4.37 0.00 -1.09 -4.95 121.76 119.83 3nix s ALA 366 Ca 0.37 0.63 -0.31 0.00 0.00 0.00 0.00 51.96 52.66 3nix s ALA 366 Cb 0.34 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 20.05 3nix s ALA 366 CO -0.01 -0.93 1.42 0.21 0.00 0.00 0.00 175.76 176.44 3nix s LYS 367 N -3.71 4.30 -0.61 0.00 2.20 -1.26 -3.76 119.74 116.90 3nix s LYS 367 Ca 0.69 2.20 -0.13 0.00 -0.36 0.00 0.00 55.97 58.37 3nix s LYS 367 Cb -0.21 -3.17 0.02 0.00 -1.51 0.00 0.00 37.83 32.96 3nix s LYS 367 CO 0.33 -0.41 0.64 0.09 -0.36 0.00 0.00 175.35 175.65 3nix n ASN 368 N 3.06 -6.81 -4.74 1.43 3.02 -1.26 -4.89 115.26 105.07 3nix n ASN 368 Ca 0.09 -0.08 -0.41 0.00 -0.03 0.00 0.00 54.58 54.14 3nix n ASN 368 Cb 0.41 -3.89 -0.03 0.00 -0.61 0.00 0.00 39.78 35.66 3nix n ASN 368 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3nix s PRO 369 N -3.16 4.38 0.06 3.52 0.04 -1.25 -4.91 135.00 133.68 3nix s PRO 369 Ca 0.15 2.08 -0.33 0.00 0.04 0.00 0.00 61.00 62.94 3nix s PRO 369 Cb -0.03 -3.18 -0.12 0.00 0.04 0.00 0.00 34.50 31.20 3nix s PRO 369 CO 0.81 -0.27 1.74 -3.47 0.04 0.00 0.00 177.00 175.85 3nix n ASP 370 N 2.57 3.42 0.21 6.66 -0.08 -1.26 -4.85 116.55 123.22 3nix n ASP 370 Ca 0.06 1.02 0.05 0.00 -1.51 0.00 0.00 54.79 54.41 3nix n ASP 370 Cb 0.42 -1.43 0.47 0.00 2.34 0.00 0.00 41.12 42.93 3nix n ASP 370 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3nix h PRO 371 N 7.65 0.00 0.04 -0.67 0.13 -1.99 -0.70 132.00 136.46 3nix h PRO 371 Ca -0.46 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 3nix h PRO 371 Cb 1.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.40 3nix h PRO 371 CO 0.92 0.24 -0.49 -0.44 -0.23 0.00 0.00 178.00 178.00 3nix h ASP 372 N 0.00 0.37 -0.34 1.44 3.32 -1.99 -2.12 116.42 117.10 3nix h ASP 372 Ca -0.00 -0.84 0.04 0.00 0.02 0.00 0.00 57.03 56.25 3nix h ASP 372 Cb 0.44 -0.12 -0.08 0.00 0.22 0.00 0.00 39.33 39.80 3nix h ASP 372 CO 0.03 1.17 -0.54 0.45 -1.72 0.00 0.00 179.24 178.62 3nix h HIS 373 N -0.38 -1.66 -1.03 4.55 3.86 -1.88 -0.67 115.15 117.94 3nix h HIS 373 Ca -0.07 0.08 0.27 0.00 -1.16 0.00 0.00 60.37 59.49 3nix h HIS 373 Cb 1.27 0.77 -0.12 0.00 1.06 0.00 0.00 27.41 30.39 3nix h HIS 373 CO 0.18 -0.49 0.63 -0.22 0.86 0.00 0.00 177.93 178.89 3nix h LYS 374 N -0.43 0.46 -0.53 2.45 1.63 -1.17 -0.54 116.57 118.44 3nix h LYS 374 Ca 0.06 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 3nix h LYS 374 Cb 0.60 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 3nix h LYS 374 CO -0.55 0.30 0.00 -2.13 -3.45 0.00 0.00 179.45 173.62 3nix n ARG 375 N -4.81 0.52 0.00 1.90 0.63 -0.26 -0.96 116.66 113.68 3nix n ARG 375 Ca 0.27 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.20 3nix n ARG 375 Cb 0.85 -1.26 0.00 0.00 0.45 0.00 0.00 32.46 32.49 3nix n ARG 375 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 3nix n ILE 377 N 0.24 0.00 0.18 5.15 5.41 -0.21 -1.86 119.36 128.28 3nix n ILE 377 Ca 0.00 0.00 0.13 0.00 1.00 0.00 0.00 62.75 63.88 3nix n ILE 377 Cb 0.13 0.00 0.70 0.00 -0.71 0.00 0.00 39.64 39.76 3nix n ILE 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3nix h SER 379 N 0.00 0.29 -0.13 0.00 0.02 -1.63 -2.69 113.55 109.41 3nix h SER 379 Ca 0.08 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.82 3nix h SER 379 Cb 0.33 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 3nix h SER 379 CO -0.00 0.83 -0.09 0.58 -1.14 0.00 0.00 176.83 177.02 3nix h VAL 380 N 0.19 1.33 -0.24 2.27 2.07 -0.88 -2.54 116.25 118.45 3nix h VAL 380 Ca -0.01 -1.17 0.07 0.00 0.82 0.00 0.00 66.70 66.41 3nix h VAL 380 Cb 1.13 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.71 3nix h VAL 380 CO 0.10 0.34 0.23 -0.07 0.02 0.00 0.00 177.57 178.19 3nix h LEU 381 N -0.07 0.00 -0.69 2.57 3.38 -1.07 0.63 115.31 120.06 3nix h LEU 381 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3nix h LEU 381 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3nix h LEU 381 CO 0.02 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.55 3nix n ALA 382 N -2.40 2.57 -0.62 1.53 0.00 -1.01 -4.91 120.51 115.66 3nix n ALA 382 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3nix n ALA 382 Cb 0.37 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.62 3nix n ALA 382 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3nix n GLY 383 N 1.04 0.73 2.61 0.00 0.00 0.21 -2.10 105.19 107.68 3nix n GLY 383 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3nix n GLY 383 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3nix n TYR 384 N -2.41 2.71 -0.29 1.61 4.01 -0.97 -4.65 117.16 117.18 3nix n TYR 384 Ca 0.00 -2.83 0.07 0.00 -0.16 0.00 0.00 57.90 54.98 3nix n TYR 384 Cb 0.00 -1.92 0.30 0.00 -0.31 0.00 0.00 39.34 37.41 3nix n TYR 384 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 3nix n VAL 385 N 2.44 1.73 0.43 -0.72 0.24 -1.26 -3.66 118.33 117.54 3nix n VAL 385 Ca 0.55 -1.00 0.05 0.00 -2.04 0.00 0.00 64.34 61.91 3nix n VAL 385 Cb 0.29 -0.10 0.03 0.00 -1.47 0.00 0.00 33.84 32.59 3nix n VAL 385 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 3nix n TRP 386 N 0.72 0.00 -2.75 6.34 8.01 -1.26 -4.20 117.44 124.30 3nix n TRP 386 Ca 0.21 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.98 3nix n TRP 386 Cb 0.84 0.00 -0.04 0.00 -2.01 0.00 0.00 31.31 30.10 3nix n TRP 386 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 3nix s ASP 387 N -0.97 6.27 0.00 -0.99 2.15 -1.24 -4.91 116.67 116.98 3nix s ASP 387 Ca 0.11 -0.49 0.29 0.00 0.43 0.00 0.00 52.55 52.89 3nix s ASP 387 Cb 0.09 -2.47 1.31 0.00 -0.30 0.00 0.00 42.92 41.55 3nix s ASP 387 CO 0.16 -1.44 1.95 0.29 -0.17 0.00 0.00 175.17 175.95 3nix n LYS 388 N 8.04 0.18 0.22 4.34 4.76 -1.26 -2.27 118.16 132.17 3nix n LYS 388 Ca 0.01 0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.58 3nix n LYS 388 Cb 0.47 -1.50 0.17 0.00 -1.84 0.00 0.00 35.03 32.34 3nix n LYS 388 CO 0.00 0.00 0.00 -0.91 -1.37 0.00 0.00 177.40 175.12 3nix h ASN 389 N 0.00 0.00 -3.10 4.39 2.35 -2.00 -3.40 115.58 113.82 3nix h ASN 389 Ca 0.00 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.19 3nix h ASN 389 Cb 0.39 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.71 3nix h ASN 389 CO 0.00 0.03 1.08 0.21 -1.65 0.00 0.00 177.43 177.10 3nix s ASN 390 N -6.21 6.25 0.30 5.81 3.84 -0.96 -4.89 114.94 119.06 3nix s ASN 390 Ca 0.07 0.57 0.05 0.00 0.21 0.00 0.00 52.86 53.76 3nix s ASN 390 Cb 0.05 -2.54 0.75 0.00 -0.55 0.00 0.00 41.25 38.96 3nix s ASN 390 CO 0.67 -1.56 1.71 -0.65 -2.79 0.00 0.00 177.10 174.49 3nix h PRO 391 N 10.86 0.46 0.00 0.43 0.11 -1.87 0.19 132.00 142.17 3nix h PRO 391 Ca -0.27 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.76 3nix h PRO 391 Cb 1.10 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 3nix h PRO 391 CO 1.13 0.30 -0.25 0.74 -0.21 0.00 0.00 178.00 179.71 3nix h PHE 392 N 0.47 0.00 0.02 0.65 0.04 -1.91 0.47 116.94 116.68 3nix h PHE 392 Ca 0.57 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.34 3nix h PHE 392 Cb 1.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.21 3nix h PHE 392 CO -0.10 0.25 -0.01 0.28 -0.60 0.00 0.00 178.31 178.14 3nix h VAL 393 N 0.00 1.50 -0.66 -0.55 2.07 -1.02 -2.77 116.25 114.82 3nix h VAL 393 Ca -0.00 -1.73 0.03 0.00 0.82 0.00 0.00 66.70 65.82 3nix h VAL 393 Cb 0.45 2.64 -0.04 0.00 -1.52 0.00 0.00 31.29 32.81 3nix h VAL 393 CO 0.03 0.43 0.41 0.50 0.02 0.00 0.00 177.57 178.96 3nix h LYS 394 N -0.79 0.77 -0.75 1.57 1.63 -0.53 -2.95 116.57 115.52 3nix h LYS 394 Ca -0.00 -0.05 -0.53 0.00 -0.85 0.00 0.00 60.65 59.22 3nix h LYS 394 Cb 0.73 -0.17 -0.36 0.00 -0.60 0.00 0.00 32.23 31.83 3nix h LYS 394 CO 0.00 0.51 -0.34 1.63 -3.45 0.00 0.00 179.45 177.81 3nix n LYS 395 N -4.70 3.18 -0.34 1.90 5.02 0.12 -4.87 118.16 118.47 3nix n LYS 395 Ca 0.07 -3.85 0.00 0.00 -2.02 0.00 0.00 58.31 52.51 3nix n LYS 395 Cb 0.09 -2.22 0.14 0.00 -0.02 0.00 0.00 35.03 33.01 3nix n LYS 395 CO 0.00 0.00 0.00 1.12 -0.52 0.00 0.00 177.40 178.00 3nix h HIS 396 N 2.00 1.11 0.00 2.13 2.07 -1.31 0.16 115.15 121.31 3nix h HIS 396 Ca 0.40 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.95 3nix h HIS 396 Cb 1.36 -0.37 0.00 0.00 2.57 0.00 0.00 27.41 30.97 3nix h HIS 396 CO 1.01 0.61 0.00 0.27 -3.07 0.00 0.00 177.93 176.75 3nix n ASN 397 N -4.53 0.00 0.00 3.10 0.23 -1.26 -3.70 115.26 109.10 3nix n ASN 397 Ca 0.13 -1.35 0.00 0.00 -0.53 0.00 0.00 54.58 52.83 3nix n ASN 397 Cb 0.13 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.83 3nix n ASN 397 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 3nix n THR 398 N -0.69 0.00 0.34 5.53 -1.04 -0.25 -4.90 114.28 113.27 3nix n THR 398 Ca 0.07 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.23 3nix n THR 398 Cb 0.03 -0.39 0.59 0.00 -1.82 0.00 0.00 70.33 68.74 3nix n THR 398 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 3nix h ILE 399 N 0.00 0.00 0.15 12.58 2.10 -0.85 -2.30 117.51 129.19 3nix h ILE 399 Ca 0.00 -0.39 -0.32 0.00 1.08 0.00 0.00 64.86 65.22 3nix h ILE 399 Cb 0.68 1.27 0.00 0.00 -1.09 0.00 0.00 36.82 37.69 3nix h ILE 399 CO 0.00 0.00 -1.61 -0.07 -1.08 0.00 0.00 178.15 175.39 3nix h LEU 400 N 0.00 0.49 0.12 2.19 3.38 -1.84 -1.36 115.31 118.28 3nix h LEU 400 Ca 0.00 -0.69 -0.01 0.00 0.09 0.00 0.00 57.88 57.28 3nix h LEU 400 Cb 0.46 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3nix h LEU 400 CO 0.00 1.57 -0.06 0.11 0.09 0.00 0.00 178.44 180.16 3nix h LYS 401 N 0.08 -0.15 -0.34 1.13 1.57 -1.83 -2.22 116.57 114.82 3nix h LYS 401 Ca -0.28 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 3nix h LYS 401 Cb 2.05 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 34.38 3nix h LYS 401 CO 0.17 -0.05 0.22 1.15 -0.57 0.00 0.00 179.45 180.37 3nix h THR 402 N -0.21 1.09 -0.48 -0.16 2.02 -1.50 -2.40 112.91 111.27 3nix h THR 402 Ca -0.02 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 66.95 3nix h THR 402 Cb 0.17 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 3nix h THR 402 CO 0.03 0.09 0.19 0.25 0.37 0.00 0.00 175.52 176.45 3nix h LEU 403 N 0.45 0.67 -1.12 2.58 7.12 -1.25 -0.97 115.31 122.78 3nix h LEU 403 Ca 0.12 -0.17 -0.05 0.00 0.13 0.00 0.00 57.88 57.91 3nix h LEU 403 Cb -0.04 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 39.90 3nix h LEU 403 CO -0.03 0.66 0.04 0.00 -0.13 0.00 0.00 178.44 178.99 3nix h ALA 404 N 1.04 1.29 0.00 1.25 0.00 -1.29 -1.25 119.26 120.29 3nix h ALA 404 Ca 0.16 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3nix h ALA 404 Cb 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3nix h ALA 404 CO -0.01 0.49 0.00 1.17 0.00 0.00 0.00 179.25 180.90 3nix n LYS 405 N -4.27 0.18 0.10 0.00 4.81 -0.91 -1.78 118.16 116.29 3nix n LYS 405 Ca 0.02 0.24 -0.24 0.00 -0.87 0.00 0.00 58.31 57.47 3nix n LYS 405 Cb 0.25 -1.75 -0.15 0.00 0.02 0.00 0.00 35.03 33.39 3nix n LYS 405 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 3nix h VAL 406 N 0.00 1.14 -0.74 3.15 2.07 -0.08 -3.36 116.25 118.44 3nix h VAL 406 Ca 0.00 -2.59 -0.02 0.00 0.82 0.00 0.00 66.70 64.91 3nix h VAL 406 Cb 0.56 2.92 -0.03 0.00 -1.52 0.00 0.00 31.29 33.22 3nix h VAL 406 CO 0.00 0.81 0.38 0.40 0.02 0.00 0.00 177.57 179.18 3nix h ILE 407 N 0.05 1.23 0.00 4.57 2.04 -0.97 -1.33 117.51 123.10 3nix h ILE 407 Ca -0.29 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 64.95 3nix h ILE 407 Cb 2.07 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 3nix h ILE 407 CO 0.21 0.27 0.00 1.67 0.00 0.00 0.00 178.15 180.30 3nix n GLN 408 N -4.43 0.03 0.00 2.37 7.27 -0.73 -1.60 117.38 120.29 3nix n GLN 408 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.13 3nix n GLN 408 Cb 0.11 -1.15 0.00 0.00 2.41 0.00 0.00 30.24 31.62 3nix n GLN 408 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3nix n GLY 410 N 0.63 0.00 0.10 1.69 0.00 -0.50 -0.39 105.19 106.71 3nix n GLY 410 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3nix n GLY 410 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3nix h GLU 411 N 0.00 0.12 0.00 1.61 5.08 -1.58 -3.21 114.58 116.60 3nix h GLU 411 Ca 0.00 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 3nix h GLU 411 Cb 0.00 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3nix h GLU 411 CO 0.00 0.83 0.00 0.39 -1.00 0.00 0.00 179.01 179.23 3nix n GLU 412 N -3.26 0.21 0.00 2.33 1.02 0.47 -5.25 120.64 116.17 3nix n GLU 412 Ca -0.19 0.13 0.13 0.00 -0.02 0.00 0.00 57.16 57.21 3nix n GLU 412 Cb 1.04 -1.50 0.79 0.00 -0.02 0.00 0.00 31.44 31.75 3nix n GLU 412 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31