#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n5m s LYS 2 N 0.00 0.62 0.40 0.00 -0.14 -1.26 -5.16 119.74 114.21 3n5m s LYS 2 Ca 0.00 -1.08 0.11 0.00 -1.36 0.00 0.00 55.97 53.65 3n5m s LYS 2 Cb 0.00 -0.04 0.93 0.00 -1.68 0.00 0.00 37.83 37.04 3n5m s LYS 2 CO 0.00 -0.04 1.95 1.15 -0.76 0.00 0.00 175.35 177.65 3n5m h THR 3 N 3.58 0.91 -0.36 2.17 2.02 -1.99 -1.14 112.91 118.09 3n5m h THR 3 Ca -0.34 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 3n5m h THR 3 Cb 1.17 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 3n5m h THR 3 CO 0.57 0.10 0.18 0.50 0.37 0.00 0.00 175.52 177.24 3n5m h LYS 4 N 0.53 0.51 -0.50 6.66 1.63 -2.03 -1.35 116.57 122.02 3n5m h LYS 4 Ca 0.32 -0.07 -0.12 0.00 -0.85 0.00 0.00 60.65 59.94 3n5m h LYS 4 Cb 0.54 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.06 3n5m h LYS 4 CO -0.11 0.44 -0.15 1.96 -3.45 0.00 0.00 179.45 178.14 3n5m h GLN 5 N 0.45 0.96 -0.74 1.90 7.50 -1.66 -2.34 115.11 121.17 3n5m h GLN 5 Ca 0.12 -0.37 -0.05 0.00 0.50 0.00 0.00 58.65 58.86 3n5m h GLN 5 Cb 0.09 -0.05 -0.03 0.00 0.05 0.00 0.00 27.48 27.54 3n5m h GLN 5 CO -0.02 1.04 0.28 1.79 -1.50 0.00 0.00 178.83 180.42 3n5m h THR 6 N 0.85 1.25 -0.74 -0.54 1.35 -1.36 -2.02 112.91 111.69 3n5m h THR 6 Ca 0.12 -0.81 -0.03 0.00 -0.55 0.00 0.00 66.41 65.15 3n5m h THR 6 Cb 0.71 0.39 -0.03 0.00 -1.73 0.00 0.00 68.15 67.48 3n5m h THR 6 CO 0.05 0.33 0.37 0.44 -0.25 0.00 0.00 175.52 176.46 3n5m h ASP 7 N 1.08 0.96 -0.59 5.36 3.32 -1.05 -0.48 116.42 125.02 3n5m h ASP 7 Ca 0.25 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 3n5m h ASP 7 Cb 0.23 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 3n5m h ASP 7 CO -0.02 0.82 0.25 -0.08 -1.72 0.00 0.00 179.24 178.50 3n5m h GLU 8 N 1.04 0.86 -0.62 3.56 4.57 -1.16 -0.41 114.58 122.42 3n5m h GLU 8 Ca 0.26 -0.14 -0.05 0.00 -1.18 0.00 0.00 59.36 58.24 3n5m h GLU 8 Cb 0.10 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 3n5m h GLU 8 CO -0.03 0.72 0.18 1.25 -1.18 0.00 0.00 179.01 179.95 3n5m h LEU 9 N 0.80 0.92 -0.82 1.64 5.85 -0.95 -1.17 115.31 121.57 3n5m h LEU 9 Ca 0.20 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 3n5m h LEU 9 Cb 0.17 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 3n5m h LEU 9 CO -0.02 0.89 0.25 -0.07 -0.34 0.00 0.00 178.44 179.16 3n5m h LEU 10 N 0.90 1.05 -0.68 2.25 3.38 -0.88 -2.05 115.31 119.27 3n5m h LEU 10 Ca 0.20 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3n5m h LEU 10 Cb 0.31 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3n5m h LEU 10 CO -0.00 0.96 0.21 0.00 0.09 0.00 0.00 178.44 179.69 3n5m h ALA 11 N 1.18 0.89 -0.78 1.53 0.00 -0.62 -1.97 119.26 119.48 3n5m h ALA 11 Ca 0.24 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3n5m h ALA 11 Cb 0.27 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3n5m h ALA 11 CO -0.01 0.56 0.29 0.87 0.00 0.00 0.00 179.25 180.96 3n5m h LYS 12 N 0.99 1.19 -0.10 0.00 1.57 -0.99 -2.11 116.57 117.12 3n5m h LYS 12 Ca 0.22 -0.23 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 3n5m h LYS 12 Cb 0.30 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3n5m h LYS 12 CO -0.01 0.98 -0.05 0.22 -0.57 0.00 0.00 179.45 180.02 3n5m h ASP 13 N 1.15 -0.17 -0.57 0.86 3.58 -1.16 -1.34 116.42 118.76 3n5m h ASP 13 Ca 0.26 0.04 0.08 0.00 0.42 0.00 0.00 57.03 57.83 3n5m h ASP 13 Cb 0.26 0.09 -0.06 0.00 1.72 0.00 0.00 39.33 41.34 3n5m h ASP 13 CO -0.02 -0.07 0.23 -0.08 -2.88 0.00 0.00 179.24 176.42 3n5m h GLU 14 N -0.05 0.41 -0.32 0.28 4.81 -1.05 -0.34 114.58 118.33 3n5m h GLU 14 Ca 0.06 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 3n5m h GLU 14 Cb 0.13 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 3n5m h GLU 14 CO -0.13 0.27 -0.45 1.96 -0.73 0.00 0.00 179.01 179.93 3n5m h GLN 15 N 0.42 0.83 0.00 1.92 7.50 -1.19 -3.39 115.11 121.20 3n5m h GLN 15 Ca 0.28 -0.47 0.00 0.00 0.50 0.00 0.00 58.65 58.97 3n5m h GLN 15 Cb 0.31 0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.87 3n5m h GLN 15 CO -0.27 1.10 -0.90 0.66 -1.50 0.00 0.00 178.83 177.92 3n5m n TYR 16 N -4.03 0.00 -4.27 2.96 4.01 -0.52 -5.02 117.16 110.29 3n5m n TYR 16 Ca -0.03 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.37 3n5m n TYR 16 Cb 0.57 -0.07 -0.12 0.00 -0.31 0.00 0.00 39.34 39.41 3n5m n TYR 16 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3n5m s VAL 17 N -2.02 3.96 -0.30 -0.72 1.01 -0.15 -5.05 120.40 117.11 3n5m s VAL 17 Ca -0.01 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.51 3n5m s VAL 17 Cb 0.03 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3n5m s VAL 17 CO 0.17 0.47 0.32 0.86 0.00 0.00 0.00 175.10 176.92 3n5m s TRP 18 N 0.58 3.22 -0.05 5.22 -0.11 -1.26 -4.79 118.94 121.76 3n5m s TRP 18 Ca -0.02 0.14 -0.16 0.00 1.22 0.00 0.00 56.10 57.29 3n5m s TRP 18 Cb -0.14 -2.57 -0.05 0.00 -1.50 0.00 0.00 33.47 29.21 3n5m s TRP 18 CO 0.02 -0.30 0.41 -1.01 -4.62 0.00 0.00 176.95 171.45 3n5m s HIS 19 N 1.97 3.64 -0.62 5.86 3.76 -1.26 -5.17 115.29 123.48 3n5m s HIS 19 Ca 0.12 0.93 -0.20 0.00 -0.15 0.00 0.00 55.06 55.75 3n5m s HIS 19 Cb -0.16 -2.37 -0.17 0.00 1.11 0.00 0.00 32.58 30.99 3n5m s HIS 19 CO 0.11 0.47 1.85 0.41 -0.85 0.00 0.00 174.74 176.73 3n5m n GLY 20 N 2.37 2.26 0.00 -2.22 0.00 -1.26 -5.01 105.19 101.33 3n5m n GLY 20 Ca -0.12 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.82 3n5m n GLY 20 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3n5m n ARG 22 N 6.62 0.00 -1.47 1.61 1.85 -1.26 -5.20 116.66 118.81 3n5m n ARG 22 Ca 0.46 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.93 3n5m n ARG 22 Cb 0.34 0.00 0.05 0.00 -1.05 0.00 0.00 32.46 31.80 3n5m n ARG 22 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 3n5m n PRO 23 N 0.83 0.55 -2.48 2.89 -0.02 -1.26 -4.82 135.00 130.69 3n5m n PRO 23 Ca 0.00 0.22 -0.42 0.00 -2.02 0.00 0.00 63.50 61.28 3n5m n PRO 23 Cb 0.00 -1.82 -0.02 0.00 -0.02 0.00 0.00 33.50 31.63 3n5m n PRO 23 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3n5m s PHE 24 N -1.71 2.49 -0.40 6.00 5.36 -1.26 -4.84 117.98 123.61 3n5m s PHE 24 Ca 0.70 0.53 0.07 0.00 -0.96 0.00 0.00 56.93 57.26 3n5m s PHE 24 Cb -0.42 -4.43 0.22 0.00 -0.34 0.00 0.00 43.02 38.05 3n5m s PHE 24 CO 0.53 -1.75 0.49 -1.13 -1.46 0.00 0.00 175.22 171.90 3n5m n SER 25 N 8.82 -0.28 -0.21 6.13 3.41 -1.26 -5.02 113.62 125.21 3n5m n SER 25 Ca 0.12 -2.63 -0.02 0.00 -0.26 0.00 0.00 58.87 56.07 3n5m n SER 25 Cb 0.49 -0.43 0.18 0.00 -0.26 0.00 0.00 64.21 64.19 3n5m n SER 25 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3n5m h PRO 26 N 4.51 1.00 -0.69 4.33 0.13 -2.00 -0.84 132.00 138.45 3n5m h PRO 26 Ca 0.12 -0.14 -0.02 0.00 -0.87 0.00 0.00 66.00 65.09 3n5m h PRO 26 Cb 0.90 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 31.81 3n5m h PRO 26 CO 0.42 0.77 0.33 -0.91 -0.23 0.00 0.00 178.00 178.38 3n5m h ASN 27 N 1.00 0.89 0.50 1.44 2.35 -1.96 -2.58 115.58 117.21 3n5m h ASN 27 Ca 0.24 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3n5m h ASN 27 Cb 0.11 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.25 3n5m h ASN 27 CO -0.03 0.75 0.00 -1.20 -1.65 0.00 0.00 177.43 175.30 3n5m n SER 28 N -4.34 0.41 -4.74 5.81 7.64 -0.33 -4.87 113.62 113.22 3n5m n SER 28 Ca 0.07 0.62 -0.42 0.00 1.01 0.00 0.00 58.87 60.15 3n5m n SER 28 Cb 0.13 -0.70 -0.02 0.00 -1.01 0.00 0.00 64.21 62.61 3n5m n SER 28 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3n5m s THR 29 N -3.24 2.30 -0.33 0.44 2.01 -0.97 -4.99 115.64 110.86 3n5m s THR 29 Ca 0.04 0.25 -0.10 0.00 0.31 0.00 0.00 61.69 62.18 3n5m s THR 29 Cb 0.08 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.44 3n5m s THR 29 CO 0.30 0.03 0.17 -0.89 -0.69 0.00 0.00 174.62 173.54 3n5m s THR 30 N 0.29 4.59 -0.48 -0.82 2.01 -1.26 -5.06 115.64 114.91 3n5m s THR 30 Ca 0.64 -0.53 -0.20 0.00 0.31 0.00 0.00 61.69 61.92 3n5m s THR 30 Cb -0.46 -3.40 0.04 0.00 0.01 0.00 0.00 72.50 68.70 3n5m s THR 30 CO 0.42 -0.01 0.63 -0.69 -0.69 0.00 0.00 174.62 174.29 3n5m s VAL 31 N 1.60 4.85 0.37 3.82 1.01 -1.26 -5.04 120.40 125.75 3n5m s VAL 31 Ca 0.04 -0.22 -0.28 0.00 0.00 0.00 0.00 61.98 61.52 3n5m s VAL 31 Cb -0.18 -4.26 -0.10 0.00 0.00 0.00 0.00 36.38 31.85 3n5m s VAL 31 CO 0.06 -0.72 1.36 -0.83 0.00 0.00 0.00 175.10 174.97 3n5m s GLY 32 N 2.37 2.96 -0.03 4.51 0.00 -1.26 -1.18 107.32 114.70 3n5m s GLY 32 Ca 0.18 1.34 -0.01 0.00 0.00 0.00 0.00 44.72 46.24 3n5m s GLY 32 CO 0.15 1.98 -0.03 0.00 0.00 0.00 0.00 173.10 175.20 3n5m n ALA 33 N 0.49 2.51 -3.84 3.20 0.00 0.23 -4.72 120.51 118.39 3n5m n ALA 33 Ca 0.01 -0.12 -0.07 0.00 0.00 0.00 0.00 53.44 53.26 3n5m n ALA 33 Cb 0.42 0.45 -0.00 0.00 0.00 0.00 0.00 19.45 20.31 3n5m n ALA 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3n5m s LYS 34 N -2.06 1.87 -0.02 0.00 -2.85 -1.01 -5.03 119.74 110.65 3n5m s LYS 34 Ca -0.04 -1.10 -0.28 0.00 -1.00 0.00 0.00 55.97 53.54 3n5m s LYS 34 Cb 0.01 0.59 0.10 0.00 -2.06 0.00 0.00 37.83 36.48 3n5m s LYS 34 CO 0.06 -0.87 0.84 0.00 0.10 0.00 0.00 175.35 175.48 3n5m s ALA 35 N -3.33 -1.81 -0.29 0.59 0.00 -1.26 -0.88 121.76 114.79 3n5m s ALA 35 Ca 0.13 1.11 -0.14 0.00 0.00 0.00 0.00 51.96 53.05 3n5m s ALA 35 Cb -0.05 0.17 0.10 0.00 0.00 0.00 0.00 23.12 23.34 3n5m s ALA 35 CO 0.08 -0.57 0.71 -2.00 0.00 0.00 0.00 175.76 173.98 3n5m s GLU 36 N -2.49 0.64 7.22 0.00 2.56 -0.44 -3.96 118.70 122.22 3n5m s GLU 36 Ca 0.01 1.22 0.00 0.00 0.00 0.00 0.00 54.97 56.20 3n5m s GLU 36 Cb -0.01 0.33 0.00 0.00 2.00 0.00 0.00 34.13 36.45 3n5m s GLU 36 CO -0.05 -0.16 0.00 0.41 -0.56 0.00 0.00 175.26 174.91 3n5m n GLY 37 N 4.58 2.77 0.79 -1.50 0.00 -0.33 -2.03 105.19 109.46 3n5m n GLY 37 Ca -0.18 0.02 0.09 0.00 0.00 0.00 0.00 46.02 45.96 3n5m n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5m s TRP 39 N -1.40 2.92 0.27 0.00 0.52 -0.86 -0.18 118.94 120.21 3n5m s TRP 39 Ca 0.25 -0.20 0.11 0.00 0.02 0.00 0.00 56.10 56.27 3n5m s TRP 39 Cb 0.16 -1.80 -0.05 0.00 -1.15 0.00 0.00 33.47 30.64 3n5m s TRP 39 CO 0.23 0.12 -0.11 0.14 0.02 0.00 0.00 176.95 177.35 3n5m s VAL 40 N -0.26 2.91 -0.01 4.03 -7.23 -0.16 -1.33 120.40 118.35 3n5m s VAL 40 Ca 0.03 -2.17 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 3n5m s VAL 40 Cb -0.13 -2.54 0.01 0.00 0.56 0.00 0.00 36.38 34.28 3n5m s VAL 40 CO 0.03 -0.37 -0.00 -0.70 -0.31 0.00 0.00 175.10 173.74 3n5m s GLU 41 N -3.54 0.13 0.76 4.82 2.12 -0.05 -0.74 118.70 122.20 3n5m s GLU 41 Ca 0.30 0.01 -0.01 0.00 0.36 0.00 0.00 54.97 55.63 3n5m s GLU 41 Cb -0.06 -0.21 0.15 0.00 0.26 0.00 0.00 34.13 34.28 3n5m s GLU 41 CO 0.17 -0.03 1.05 -0.40 -0.54 0.00 0.00 175.26 175.51 3n5m n ASP 42 N 3.43 1.32 0.26 -1.70 5.68 -0.66 -0.60 116.55 124.28 3n5m n ASP 42 Ca -0.18 -2.14 0.13 0.00 -0.50 0.00 0.00 54.79 52.10 3n5m n ASP 42 Cb 0.56 -0.69 0.68 0.00 -1.14 0.00 0.00 41.12 40.53 3n5m n ASP 42 CO 0.00 0.00 0.00 0.16 -1.33 0.00 0.00 177.20 176.03 3n5m h ILE 43 N -0.68 0.51 -0.00 2.12 3.07 -1.43 -1.18 117.51 119.92 3n5m h ILE 43 Ca -0.35 -0.66 0.00 0.00 1.55 0.00 0.00 64.86 65.41 3n5m h ILE 43 Cb 1.26 1.44 0.00 0.00 -0.27 0.00 0.00 36.82 39.25 3n5m h ILE 43 CO 0.36 0.13 -0.07 0.00 -1.05 0.00 0.00 178.15 177.53 3n5m n GLN 44 N -3.53 0.47 -0.27 0.16 3.00 -1.26 -4.92 117.38 111.02 3n5m n GLN 44 Ca -0.01 -0.09 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 3n5m n GLN 44 Cb 0.28 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.02 3n5m n GLN 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3n5m n GLY 45 N 1.31 0.67 3.76 1.08 0.00 -0.45 -5.00 105.19 106.57 3n5m n GLY 45 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 3n5m n GLY 45 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n5m s LYS 46 N -0.73 4.52 0.08 1.61 2.20 -1.26 -4.77 119.74 121.40 3n5m s LYS 46 Ca 0.00 1.74 0.06 0.00 -0.36 0.00 0.00 55.97 57.42 3n5m s LYS 46 Cb 0.00 -3.04 -0.04 0.00 -1.51 0.00 0.00 37.83 33.24 3n5m s LYS 46 CO 0.00 0.12 -0.10 -0.98 -0.36 0.00 0.00 175.35 174.04 3n5m s ARG 47 N -1.69 2.20 -0.01 4.03 1.70 -1.26 -1.65 118.95 122.27 3n5m s ARG 47 Ca 0.48 -0.97 0.01 0.00 -0.47 0.00 0.00 55.73 54.78 3n5m s ARG 47 Cb -0.30 -2.34 0.00 0.00 -0.57 0.00 0.00 34.95 31.75 3n5m s ARG 47 CO 0.38 0.53 -0.04 0.71 -1.08 0.00 0.00 175.30 175.80 3n5m s TYR 48 N -1.17 0.39 -0.20 5.89 2.02 0.08 -4.57 117.35 119.80 3n5m s TYR 48 Ca 0.20 -0.07 -0.29 0.00 -0.37 0.00 0.00 57.07 56.54 3n5m s TYR 48 Cb -0.11 -0.28 -0.01 0.00 -0.40 0.00 0.00 41.96 41.15 3n5m s TYR 48 CO 0.12 -0.03 1.32 -1.17 -1.57 0.00 0.00 175.55 174.23 3n5m s LEU 49 N 0.06 4.09 -1.01 -1.29 2.96 0.40 -0.99 118.68 122.91 3n5m s LEU 49 Ca -0.00 1.59 -0.22 0.00 -0.22 0.00 0.00 54.13 55.28 3n5m s LEU 49 Cb -0.04 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.19 3n5m s LEU 49 CO -0.00 -0.89 1.39 -0.62 -1.32 0.00 0.00 176.35 174.91 3n5m s ASP 50 N 2.42 6.54 0.00 3.68 -1.08 0.75 -0.94 116.67 128.05 3n5m s ASP 50 Ca 0.57 -1.62 -0.02 0.00 -0.52 0.00 0.00 52.55 50.96 3n5m s ASP 50 Cb -0.21 -2.53 -0.11 0.00 -1.46 0.00 0.00 42.92 38.61 3n5m s ASP 50 CO 0.19 -1.40 2.14 0.61 0.52 0.00 0.00 175.17 177.23 3n5m n GLY 51 N 6.52 2.20 2.65 2.66 0.00 -0.39 -4.32 105.19 114.51 3n5m n GLY 51 Ca 0.32 -0.48 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 3n5m n GLY 51 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3n5m n SER 53 N 2.20 -1.43 0.00 1.61 7.64 -1.03 -0.43 113.62 122.18 3n5m n SER 53 Ca 0.17 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 58.08 3n5m n SER 53 Cb 0.52 0.98 0.00 0.00 -1.01 0.00 0.00 64.21 64.70 3n5m n SER 53 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3n5m n GLY 54 N -0.56 1.78 2.36 0.23 0.00 -1.26 -1.05 105.19 106.70 3n5m n GLY 54 Ca -0.17 0.13 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 3n5m n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n5m n LEU 55 N 0.00 0.70 -1.98 0.99 4.77 -1.26 -4.91 117.00 115.31 3n5m n LEU 55 Ca 0.00 -4.73 -0.17 0.00 -0.03 0.00 0.00 56.01 51.08 3n5m n LEU 55 Cb 0.00 0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.35 3n5m n LEU 55 CO 0.00 1.96 -0.19 0.79 -1.33 0.00 0.00 177.39 178.62 3n5m n TRP 56 N 1.88 -0.73 0.00 -1.77 7.02 -1.21 -4.82 117.44 117.82 3n5m n TRP 56 Ca 0.25 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.73 3n5m n TRP 56 Cb 0.48 -3.21 0.00 0.00 -2.42 0.00 0.00 31.31 26.15 3n5m n TRP 56 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3n5m n VAL 58 N -0.92 4.29 -0.16 0.00 0.31 -0.21 -3.59 118.33 118.05 3n5m n VAL 58 Ca 0.00 -3.62 -0.06 0.00 -0.01 0.00 0.00 64.34 60.66 3n5m n VAL 58 Cb 0.12 -2.42 0.11 0.00 -0.91 0.00 0.00 33.84 30.74 3n5m n VAL 58 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 3n5m h ASN 59 N 5.41 0.89 -0.02 4.52 4.21 -1.86 -2.25 115.58 126.47 3n5m h ASN 59 Ca 0.61 -0.21 0.00 0.00 1.21 0.00 0.00 56.30 57.91 3n5m h ASN 59 Cb 0.49 -0.24 0.00 0.00 -1.12 0.00 0.00 38.32 37.45 3n5m h ASN 59 CO 1.70 0.92 0.00 -1.20 -1.29 0.00 0.00 177.43 177.57 3n5m n SER 60 N -4.21 1.01 0.00 5.81 7.64 -1.26 -0.88 113.62 121.72 3n5m n SER 60 Ca 0.03 -1.35 0.00 0.00 1.01 0.00 0.00 58.87 58.56 3n5m n SER 60 Cb 0.30 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 3n5m n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3n5m n GLY 61 N 1.11 0.12 3.91 0.23 0.00 -0.85 -4.77 105.19 104.94 3n5m n GLY 61 Ca 0.20 -1.78 -0.27 0.00 0.00 0.00 0.00 46.02 44.17 3n5m n GLY 61 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n5m s TYR 62 N -2.26 3.41 0.00 1.61 1.51 0.43 -4.49 117.35 117.55 3n5m s TYR 62 Ca 0.00 0.69 0.00 0.00 -1.01 0.00 0.00 57.07 56.75 3n5m s TYR 62 Cb 0.00 -2.48 0.00 0.00 -0.11 0.00 0.00 41.96 39.37 3n5m s TYR 62 CO 0.00 -0.51 0.00 0.41 -1.11 0.00 0.00 175.55 174.34 3n5m n GLY 63 N -2.38 0.39 3.56 0.71 0.00 -1.25 -1.19 105.19 105.02 3n5m n GLY 63 Ca 0.02 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.56 3n5m n GLY 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n5m s ARG 64 N -1.95 3.11 0.35 1.61 1.81 -1.26 -4.86 118.95 117.75 3n5m s ARG 64 Ca 0.00 0.07 0.06 0.00 -1.72 0.00 0.00 55.73 54.15 3n5m s ARG 64 Cb 0.00 -4.21 0.64 0.00 -0.45 0.00 0.00 34.95 30.93 3n5m s ARG 64 CO 0.00 -2.22 1.85 0.87 -0.68 0.00 0.00 175.30 175.13 3n5m h LYS 65 N 11.20 0.37 -0.17 3.54 1.79 -1.99 -2.53 116.57 128.78 3n5m h LYS 65 Ca -0.27 -0.10 -0.02 0.00 -2.18 0.00 0.00 60.65 58.08 3n5m h LYS 65 Cb 1.08 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.68 3n5m h LYS 65 CO 1.25 0.51 0.03 0.93 -1.08 0.00 0.00 179.45 181.08 3n5m h GLU 66 N 0.35 0.24 0.01 3.15 5.08 -1.99 0.14 114.58 121.56 3n5m h GLU 66 Ca 0.07 -0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 58.25 3n5m h GLU 66 Cb 0.44 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.66 3n5m h GLU 66 CO 0.03 0.25 -0.60 -0.07 -1.00 0.00 0.00 179.01 177.61 3n5m h LEU 67 N 0.24 0.52 -0.67 1.33 3.38 -1.84 -2.21 115.31 116.07 3n5m h LEU 67 Ca 0.06 -0.77 0.09 0.00 0.09 0.00 0.00 57.88 57.35 3n5m h LEU 67 Cb 0.13 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.65 3n5m h LEU 67 CO -0.00 1.22 0.32 0.00 0.09 0.00 0.00 178.44 180.07 3n5m h ALA 68 N 0.31 0.91 -0.56 1.53 0.00 -1.20 -2.31 119.26 117.94 3n5m h ALA 68 Ca -0.08 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3n5m h ALA 68 Cb 1.32 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 3n5m h ALA 68 CO 0.12 -0.07 0.14 0.93 0.00 0.00 0.00 179.25 180.37 3n5m h GLU 69 N 0.56 0.90 -0.57 0.00 4.39 -0.98 -1.70 114.58 117.18 3n5m h GLU 69 Ca 0.33 -0.22 0.03 0.00 0.34 0.00 0.00 59.36 59.84 3n5m h GLU 69 Cb 0.33 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 28.83 3n5m h GLU 69 CO -0.26 0.84 0.33 0.00 -1.16 0.00 0.00 179.01 178.76 3n5m h ALA 70 N 1.02 0.73 -0.22 3.43 0.00 -1.07 0.06 119.26 123.21 3n5m h ALA 70 Ca 0.18 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3n5m h ALA 70 Cb 0.34 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3n5m h ALA 70 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.29 3n5m h ALA 71 N 1.26 0.30 -0.17 0.00 0.00 -1.29 -2.53 119.26 116.83 3n5m h ALA 71 Ca 0.23 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3n5m h ALA 71 Cb 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3n5m h ALA 71 CO -0.12 0.02 0.10 -0.92 0.00 0.00 0.00 179.25 178.33 3n5m h TYR 72 N 0.16 0.19 -0.81 0.00 3.20 -1.18 0.13 116.97 118.66 3n5m h TYR 72 Ca 0.06 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.99 3n5m h TYR 72 Cb 0.39 -0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.55 3n5m h TYR 72 CO 0.03 0.11 0.50 -0.22 -1.64 0.00 0.00 178.16 176.95 3n5m h LYS 73 N 0.21 0.90 -0.39 1.82 3.64 -0.96 -2.13 116.57 119.67 3n5m h LYS 73 Ca 0.07 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.23 3n5m h LYS 73 Cb -0.01 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 3n5m h LYS 73 CO -0.03 0.60 -0.37 0.37 -2.27 0.00 0.00 179.45 177.74 3n5m h GLN 74 N 0.93 0.94 -0.03 1.90 5.75 -1.06 -2.98 115.11 120.56 3n5m h GLN 74 Ca 0.35 -0.49 0.01 0.00 -0.15 0.00 0.00 58.65 58.37 3n5m h GLN 74 Cb 0.14 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.70 3n5m h GLN 74 CO -0.16 1.15 0.02 -0.07 -2.65 0.00 0.00 178.83 177.12 3n5m h LEU 75 N 0.77 0.00 0.00 -2.39 3.38 -0.63 -0.09 115.31 116.35 3n5m h LEU 75 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3n5m h LEU 75 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3n5m h LEU 75 CO 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 178.44 178.56 3n5m n GLN 76 N -4.45 0.25 -0.12 1.13 6.02 -0.83 -4.26 117.38 115.12 3n5m n GLN 76 Ca -0.02 0.19 -0.21 0.00 -0.01 0.00 0.00 57.00 56.94 3n5m n GLN 76 Cb 0.12 -1.77 -0.07 0.00 1.02 0.00 0.00 30.24 29.53 3n5m n GLN 76 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 3n5m n THR 77 N -2.19 1.52 -3.41 5.09 -1.04 -0.18 -4.99 114.28 109.07 3n5m n THR 77 Ca 0.05 -0.17 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 3n5m n THR 77 Cb 0.42 -2.08 -0.03 0.00 -1.82 0.00 0.00 70.33 66.82 3n5m n THR 77 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 3n5m s LEU 78 N -7.68 -1.18 0.01 -4.42 2.96 -0.40 -5.05 118.68 102.91 3n5m s LEU 78 Ca -0.35 1.15 0.08 0.00 -0.22 0.00 0.00 54.13 54.79 3n5m s LEU 78 Cb 0.10 2.10 -0.23 0.00 0.50 0.00 0.00 46.19 48.66 3n5m s LEU 78 CO 0.46 -0.24 0.87 0.77 -1.32 0.00 0.00 176.35 176.90 3n5m h SER 79 N 8.02 0.06 -3.83 3.68 4.64 -1.74 -3.41 113.55 120.97 3n5m h SER 79 Ca -0.20 -0.09 -0.16 0.00 -0.47 0.00 0.00 61.79 60.87 3n5m h SER 79 Cb 1.13 -0.02 -0.25 0.00 -0.31 0.00 0.00 62.40 62.95 3n5m h SER 79 CO 0.18 1.08 -0.40 -0.47 -0.87 0.00 0.00 176.83 176.35 3n5m s TYR 80 N -2.63 -0.30 -0.16 4.77 5.04 -1.26 -4.35 117.35 118.46 3n5m s TYR 80 Ca -0.04 0.73 -0.12 0.00 -2.44 0.00 0.00 57.07 55.20 3n5m s TYR 80 Cb 0.08 0.10 0.05 0.00 0.35 0.00 0.00 41.96 42.54 3n5m s TYR 80 CO 0.82 -0.14 0.41 0.12 -1.34 0.00 0.00 175.55 175.43 3n5m s PHE 81 N 0.16 -0.52 0.00 4.97 2.19 -1.26 -5.08 117.98 118.43 3n5m s PHE 81 Ca -0.00 1.19 0.00 0.00 0.33 0.00 0.00 56.93 58.45 3n5m s PHE 81 Cb -0.02 0.20 0.00 0.00 -1.31 0.00 0.00 43.02 41.89 3n5m s PHE 81 CO 0.00 -0.27 0.00 -0.35 1.83 0.00 0.00 175.22 176.43 3n5m n PRO 82 N 3.44 2.51 0.00 10.12 -0.04 -1.26 -4.89 135.00 144.88 3n5m n PRO 82 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 3n5m n PRO 82 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 3n5m n PRO 82 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3n5m n SER 84 N 0.00 0.00 -0.86 3.54 3.41 -1.26 -3.52 113.62 114.93 3n5m n SER 84 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3n5m n SER 84 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3n5m n SER 84 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3n5m n GLN 85 N 0.00 2.33 -4.14 4.33 1.13 -1.26 -5.16 117.38 114.60 3n5m n GLN 85 Ca 0.00 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.97 3n5m n GLN 85 Cb 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 30.24 30.25 3n5m n GLN 85 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3n5m s SER 86 N -1.00 0.33 0.08 1.08 0.15 -1.23 -5.13 113.70 107.97 3n5m s SER 86 Ca 0.00 -1.19 -0.02 0.00 0.70 0.00 0.00 55.95 55.44 3n5m s SER 86 Cb 0.00 0.29 -0.04 0.00 -1.71 0.00 0.00 66.02 64.56 3n5m s SER 86 CO 0.00 -0.72 0.02 -1.38 1.20 0.00 0.00 173.24 172.36 3n5m s HIS 87 N -4.04 0.57 0.17 3.44 -3.43 -1.26 -4.93 115.29 105.82 3n5m s HIS 87 Ca 0.23 -1.06 -0.11 0.00 -0.80 0.00 0.00 55.06 53.32 3n5m s HIS 87 Cb 0.08 -0.37 0.06 0.00 -1.43 0.00 0.00 32.58 30.92 3n5m s HIS 87 CO 0.01 -0.44 1.67 0.93 -2.00 0.00 0.00 174.74 174.90 3n5m h GLU 88 N 3.03 0.99 -0.96 -0.38 5.08 -2.00 -2.48 114.58 117.85 3n5m h GLU 88 Ca -0.34 -0.26 0.05 0.00 -1.00 0.00 0.00 59.36 57.81 3n5m h GLU 88 Cb 1.16 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 30.23 3n5m h GLU 88 CO 0.63 0.93 0.62 -1.35 -1.00 0.00 0.00 179.01 178.84 3n5m h PRO 89 N 0.89 1.12 -0.55 2.33 0.11 -1.95 0.03 132.00 133.98 3n5m h PRO 89 Ca 0.18 -0.07 -0.10 0.00 0.11 0.00 0.00 66.00 66.13 3n5m h PRO 89 Cb 0.42 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 3n5m h PRO 89 CO 0.01 0.74 -0.03 0.00 -0.21 0.00 0.00 178.00 178.51 3n5m h ALA 90 N 1.42 0.74 -0.09 -0.75 0.00 -1.81 -1.35 119.26 117.43 3n5m h ALA 90 Ca 0.40 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3n5m h ALA 90 Cb 0.11 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3n5m h ALA 90 CO -0.16 0.59 0.03 0.82 0.00 0.00 0.00 179.25 180.53 3n5m h ILE 91 N 0.86 1.18 -0.86 0.00 2.04 -0.98 -0.41 117.51 119.34 3n5m h ILE 91 Ca 0.15 -0.55 -0.03 0.00 1.00 0.00 0.00 64.86 65.43 3n5m h ILE 91 Cb 0.58 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 38.01 3n5m h ILE 91 CO 0.03 0.16 0.42 0.11 0.00 0.00 0.00 178.15 178.88 3n5m h LYS 92 N -0.05 1.23 -0.33 2.37 1.57 -1.00 -2.05 116.57 118.30 3n5m h LYS 92 Ca 0.03 -0.17 -0.09 0.00 -1.87 0.00 0.00 60.65 58.54 3n5m h LYS 92 Cb 0.23 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3n5m h LYS 92 CO -0.00 0.94 -0.16 1.25 -0.57 0.00 0.00 179.45 180.90 3n5m h LEU 93 N 1.22 0.72 -0.61 2.94 5.85 -1.11 -1.28 115.31 123.04 3n5m h LEU 93 Ca 0.30 -0.41 0.05 0.00 0.84 0.00 0.00 57.88 58.66 3n5m h LEU 93 Cb 0.10 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 3n5m h LEU 93 CO -0.04 0.97 0.33 0.00 -0.34 0.00 0.00 178.44 179.36 3n5m h ALA 94 N 0.78 0.80 -0.63 1.25 0.00 -0.89 0.40 119.26 120.97 3n5m h ALA 94 Ca 0.07 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3n5m h ALA 94 Cb 0.69 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3n5m h ALA 94 CO 0.05 0.00 0.22 1.49 0.00 0.00 0.00 179.25 181.01 3n5m h GLU 95 N 0.62 0.96 -0.50 0.00 4.81 -1.31 -1.55 114.58 117.61 3n5m h GLU 95 Ca 0.27 -0.19 -0.11 0.00 -0.13 0.00 0.00 59.36 59.20 3n5m h GLU 95 Cb 0.16 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 3n5m h GLU 95 CO -0.17 0.83 -0.11 -0.22 -0.73 0.00 0.00 179.01 178.61 3n5m h LYS 96 N 0.89 0.95 -0.42 1.92 1.63 -0.13 -2.28 116.57 119.14 3n5m h LYS 96 Ca 0.20 -0.36 -0.07 0.00 -0.85 0.00 0.00 60.65 59.57 3n5m h LYS 96 Cb 0.25 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.81 3n5m h LYS 96 CO -0.01 1.03 -0.03 -0.07 -3.45 0.00 0.00 179.45 176.91 3n5m h LEU 97 N 0.81 0.66 -0.72 5.20 3.38 -0.14 -1.28 115.31 123.23 3n5m h LEU 97 Ca 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3n5m h LEU 97 Cb 0.67 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3n5m h LEU 97 CO 0.05 0.76 0.42 -1.13 0.09 0.00 0.00 178.44 178.62 3n5m h ASN 98 N 0.65 0.88 -0.44 -0.43 -1.24 -0.98 -0.51 115.58 113.51 3n5m h ASN 98 Ca 0.13 -0.08 -0.03 0.00 0.71 0.00 0.00 56.30 57.03 3n5m h ASN 98 Cb 0.45 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.26 3n5m h ASN 98 CO 0.02 0.70 0.17 -0.33 -1.29 0.00 0.00 177.43 176.70 3n5m h GLU 99 N 0.98 0.65 -0.87 6.67 5.08 -0.96 -0.86 114.58 125.28 3n5m h GLU 99 Ca 0.25 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 3n5m h GLU 99 Cb -0.00 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 3n5m h GLU 99 CO -0.04 0.61 0.57 -1.49 -1.00 0.00 0.00 179.01 177.66 3n5m h TRP 100 N 0.56 1.10 0.00 4.33 4.06 -0.93 -2.49 115.95 122.59 3n5m h TRP 100 Ca 0.14 0.02 -0.05 0.00 2.06 0.00 0.00 58.89 61.07 3n5m h TRP 100 Cb 0.20 -0.37 -0.01 0.00 -1.00 0.00 0.00 29.16 27.98 3n5m h TRP 100 CO 0.00 0.70 -0.24 -0.07 -3.56 0.00 0.00 178.44 175.28 3n5m h LEU 101 N 1.19 0.00 0.00 -4.49 3.38 -0.96 -3.48 115.31 110.95 3n5m h LEU 101 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3n5m h LEU 101 Cb -0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3n5m h LEU 101 CO -0.07 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.31 3n5m n GLY 102 N -0.06 0.66 0.12 0.83 0.00 -0.80 -4.97 105.19 100.97 3n5m n GLY 102 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3n5m n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n5m n GLY 103 N -2.04 -1.97 3.35 -0.02 0.00 -0.39 -4.99 105.19 99.13 3n5m n GLY 103 Ca 0.00 -1.47 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 3n5m n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n5m s GLU 104 N -2.06 3.41 0.10 1.61 0.41 -1.26 -5.09 118.70 115.81 3n5m s GLU 104 Ca 0.00 -0.62 0.04 0.00 -0.41 0.00 0.00 54.97 53.98 3n5m s GLU 104 Cb 0.00 -3.16 -0.04 0.00 -1.78 0.00 0.00 34.13 29.16 3n5m s GLU 104 CO 0.00 -0.23 -0.11 0.71 -0.49 0.00 0.00 175.26 175.14 3n5m s TYR 105 N 1.52 1.09 -0.09 1.61 2.02 -1.26 -2.47 117.35 119.77 3n5m s TYR 105 Ca 0.05 -0.63 0.02 0.00 -0.37 0.00 0.00 57.07 56.14 3n5m s TYR 105 Cb -0.15 -0.60 -0.02 0.00 -0.40 0.00 0.00 41.96 40.79 3n5m s TYR 105 CO -0.00 0.02 -0.14 0.08 -1.57 0.00 0.00 175.55 173.93 3n5m s VAL 106 N -2.31 3.03 -0.19 0.71 1.01 0.36 -4.87 120.40 118.14 3n5m s VAL 106 Ca 0.05 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 3n5m s VAL 106 Cb -0.04 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 3n5m s VAL 106 CO 0.00 0.56 0.01 -0.63 0.00 0.00 0.00 175.10 175.04 3n5m s ILE 107 N -0.16 4.09 -0.22 2.22 -1.09 -1.26 -0.99 121.20 123.80 3n5m s ILE 107 Ca -0.01 -0.27 -0.08 0.00 -2.23 0.00 0.00 60.65 58.07 3n5m s ILE 107 Cb -0.13 -2.85 -0.04 0.00 -1.58 0.00 0.00 42.46 37.86 3n5m s ILE 107 CO 0.03 0.43 0.08 0.12 -1.23 0.00 0.00 174.94 174.38 3n5m s PHE 108 N 0.86 3.18 -0.04 3.97 2.19 -0.33 -4.95 117.98 122.86 3n5m s PHE 108 Ca 0.01 -0.11 -0.16 0.00 0.33 0.00 0.00 56.93 57.00 3n5m s PHE 108 Cb -0.14 -2.17 -0.05 0.00 -1.31 0.00 0.00 43.02 39.34 3n5m s PHE 108 CO 0.02 -0.08 0.44 -0.06 1.83 0.00 0.00 175.22 177.37 3n5m s PHE 109 N 1.01 3.65 0.11 10.12 0.08 -1.26 -0.68 117.98 131.01 3n5m s PHE 109 Ca 0.04 0.96 0.01 0.00 0.12 0.00 0.00 56.93 58.06 3n5m s PHE 109 Cb -0.14 -2.39 -0.00 0.00 -0.57 0.00 0.00 43.02 39.91 3n5m s PHE 109 CO 0.03 0.46 0.04 0.43 -0.10 0.00 0.00 175.22 176.08 3n5m n SER 110 N 2.51 1.07 -0.13 1.36 7.64 0.05 -4.27 113.62 121.86 3n5m n SER 110 Ca -0.11 -1.57 -0.22 0.00 1.01 0.00 0.00 58.87 57.98 3n5m n SER 110 Cb 0.52 0.26 -0.11 0.00 -1.01 0.00 0.00 64.21 63.87 3n5m n SER 110 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3n5m n ASN 111 N -1.88 1.99 -4.58 6.43 3.02 -1.26 -0.24 115.26 118.74 3n5m n ASN 111 Ca -0.02 0.03 -0.26 0.00 -0.03 0.00 0.00 54.58 54.30 3n5m n ASN 111 Cb 0.16 -0.54 -0.10 0.00 -0.61 0.00 0.00 39.78 38.69 3n5m n ASN 111 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3n5m s SER 112 N -6.79 3.86 0.27 6.41 1.04 -1.26 -2.16 113.70 115.06 3n5m s SER 112 Ca -0.35 -1.21 -0.01 0.00 0.48 0.00 0.00 55.95 54.85 3n5m s SER 112 Cb 0.11 -0.39 0.35 0.00 0.10 0.00 0.00 66.02 66.19 3n5m s SER 112 CO 0.55 -0.28 1.76 1.23 0.98 0.00 0.00 173.24 177.47 3n5m h GLY 113 N 1.91 0.81 0.97 7.32 0.00 -1.96 -1.72 103.07 110.40 3n5m h GLY 113 Ca -0.43 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 46.35 3n5m h GLY 113 CO 0.73 0.51 0.23 1.76 0.00 0.00 0.00 176.54 179.76 3n5m h SER 114 N 0.70 0.52 -0.67 0.19 0.02 -1.96 -1.54 113.55 110.80 3n5m h SER 114 Ca 0.13 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3n5m h SER 114 Cb 0.47 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 3n5m h SER 114 CO 0.02 0.45 0.33 -0.33 -1.14 0.00 0.00 176.83 176.17 3n5m h GLU 115 N 0.54 0.98 -0.73 3.45 5.08 -1.90 -1.43 114.58 120.57 3n5m h GLU 115 Ca 0.15 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3n5m h GLU 115 Cb 0.05 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 3n5m h GLU 115 CO -0.02 0.75 0.21 0.00 -1.00 0.00 0.00 179.01 178.95 3n5m h ALA 116 N 1.39 0.99 -0.27 3.43 0.00 -0.85 -0.59 119.26 123.36 3n5m h ALA 116 Ca 0.24 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3n5m h ALA 116 Cb 0.10 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3n5m h ALA 116 CO -0.03 0.67 -0.48 -0.91 0.00 0.00 0.00 179.25 178.50 3n5m h ASN 117 N 1.09 0.88 -0.67 0.00 2.35 -1.09 -2.30 115.58 115.84 3n5m h ASN 117 Ca 0.23 -0.53 0.07 0.00 -0.55 0.00 0.00 56.30 55.52 3n5m h ASN 117 Cb 0.33 -0.25 -0.06 0.00 0.05 0.00 0.00 38.32 38.39 3n5m h ASN 117 CO -0.00 1.24 0.36 -0.33 -1.65 0.00 0.00 177.43 177.05 3n5m h GLU 118 N 0.54 0.63 -0.66 0.81 4.39 -1.08 -1.84 114.58 117.37 3n5m h GLU 118 Ca 0.02 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 3n5m h GLU 118 Cb 1.08 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.56 3n5m h GLU 118 CO 0.11 0.41 0.35 1.15 -1.16 0.00 0.00 179.01 179.88 3n5m h THR 119 N 0.64 1.21 -0.84 1.13 2.02 -1.01 -2.36 112.91 113.70 3n5m h THR 119 Ca 0.31 -0.54 0.04 0.00 0.77 0.00 0.00 66.41 67.00 3n5m h THR 119 Cb 0.24 0.36 -0.05 0.00 -1.74 0.00 0.00 68.15 66.96 3n5m h THR 119 CO -0.21 0.23 0.53 0.00 0.37 0.00 0.00 175.52 176.44 3n5m h ALA 120 N 1.17 1.12 -0.32 6.16 0.00 -0.98 -1.25 119.26 125.17 3n5m h ALA 120 Ca 0.23 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3n5m h ALA 120 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3n5m h ALA 120 CO -0.04 0.33 0.18 0.74 0.00 0.00 0.00 179.25 180.46 3n5m h PHE 121 N 1.01 0.43 -0.47 0.00 0.04 -0.99 -1.20 116.94 115.76 3n5m h PHE 121 Ca 0.35 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 61.06 3n5m h PHE 121 Cb 0.07 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 3n5m h PHE 121 CO -0.03 0.35 0.10 0.87 -0.60 0.00 0.00 178.31 178.99 3n5m h LYS 122 N 0.40 0.77 -0.52 1.51 1.57 -1.21 -1.84 116.57 117.25 3n5m h LYS 122 Ca 0.11 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 3n5m h LYS 122 Cb 0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3n5m h LYS 122 CO -0.02 0.77 0.24 0.82 -0.57 0.00 0.00 179.45 180.69 3n5m h ILE 123 N 0.65 1.20 -0.26 1.86 2.04 -1.21 -0.77 117.51 121.02 3n5m h ILE 123 Ca 0.15 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 65.44 3n5m h ILE 123 Cb 0.36 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 3n5m h ILE 123 CO 0.01 0.23 0.14 0.00 0.00 0.00 0.00 178.15 178.52 3n5m h ALA 124 N 1.08 0.32 -0.44 1.87 0.00 -1.01 0.25 119.26 121.33 3n5m h ALA 124 Ca 0.18 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3n5m h ALA 124 Cb 0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3n5m h ALA 124 CO -0.02 -0.25 0.18 0.00 0.00 0.00 0.00 179.25 179.16 3n5m h ARG 125 N 0.29 0.64 -0.15 0.00 3.08 -1.20 -2.34 114.38 114.70 3n5m h ARG 125 Ca 0.10 -0.11 -0.16 0.00 0.07 0.00 0.00 59.98 59.88 3n5m h ARG 125 Cb 0.01 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 3n5m h ARG 125 CO -0.06 0.58 -0.59 0.37 -1.07 0.00 0.00 179.97 179.21 3n5m h GLN 126 N 0.56 0.50 -0.17 0.04 4.15 -0.94 -1.89 115.11 117.36 3n5m h GLN 126 Ca 0.15 -0.34 0.05 0.00 0.77 0.00 0.00 58.65 59.28 3n5m h GLN 126 Cb 0.17 0.05 -0.06 0.00 0.21 0.00 0.00 27.48 27.85 3n5m h GLN 126 CO -0.01 0.95 -0.20 -0.92 -1.93 0.00 0.00 178.83 176.72 3n5m h TYR 127 N 0.38 -0.51 -0.58 3.99 3.20 -0.38 -1.25 116.97 121.82 3n5m h TYR 127 Ca -0.00 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 3n5m h TYR 127 Cb 1.14 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.64 3n5m h TYR 127 CO 0.04 -0.27 0.03 1.88 -1.64 0.00 0.00 178.16 178.20 3n5m h TYR 128 N -0.23 1.05 -0.43 -3.82 0.05 -1.32 -2.03 116.97 110.24 3n5m h TYR 128 Ca 0.11 -0.16 0.04 0.00 0.05 0.00 0.00 58.73 58.77 3n5m h TYR 128 Cb 0.40 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.83 3n5m h TYR 128 CO -0.33 0.92 0.29 0.00 -1.05 0.00 0.00 178.16 177.99 3n5m h ALA 129 N 1.12 1.85 -0.01 3.88 0.00 -0.98 -0.63 119.26 124.49 3n5m h ALA 129 Ca 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3n5m h ALA 129 Cb 0.48 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3n5m h ALA 129 CO 0.02 0.10 -0.15 1.04 0.00 0.00 0.00 179.25 180.26 3n5m n GLN 130 N -4.48 1.25 -0.40 0.00 6.02 -0.50 -3.86 117.38 115.41 3n5m n GLN 130 Ca 0.05 -0.76 0.08 0.00 -0.01 0.00 0.00 57.00 56.36 3n5m n GLN 130 Cb 0.17 -1.48 0.25 0.00 1.02 0.00 0.00 30.24 30.20 3n5m n GLN 130 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3n5m n LYS 131 N -0.21 3.16 -0.90 -1.09 4.76 -0.50 -4.96 118.16 118.41 3n5m n LYS 131 Ca 0.15 -2.56 0.00 0.00 -2.87 0.00 0.00 58.31 53.03 3n5m n LYS 131 Cb 0.36 -1.64 0.00 0.00 -1.84 0.00 0.00 35.03 31.91 3n5m n LYS 131 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3n5m n GLY 132 N 0.39 0.53 2.37 0.72 0.00 -1.14 -4.98 105.19 103.08 3n5m n GLY 132 Ca 0.19 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 3n5m n GLY 132 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3n5m n GLU 133 N -2.90 1.78 0.29 1.61 1.02 -0.36 -4.92 120.64 117.15 3n5m n GLU 133 Ca 0.00 -4.03 0.16 0.00 -0.02 0.00 0.00 57.16 53.28 3n5m n GLU 133 Cb 0.00 -1.81 0.84 0.00 -0.02 0.00 0.00 31.44 30.45 3n5m n GLU 133 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3n5m h PRO 134 N 3.86 0.00 0.00 3.49 0.13 -1.82 -2.70 132.00 134.96 3n5m h PRO 134 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3n5m h PRO 134 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 3n5m h PRO 134 CO 0.66 0.06 0.00 1.12 -0.23 0.00 0.00 178.00 179.61 3n5m h HIS 135 N 0.00 0.00 -2.58 1.56 2.07 -1.91 -3.42 115.15 110.86 3n5m h HIS 135 Ca -0.00 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.95 3n5m h HIS 135 Cb 0.30 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 30.18 3n5m h HIS 135 CO 0.00 0.00 0.89 1.03 -3.07 0.00 0.00 177.93 176.78 3n5m s ARG 136 N -3.71 3.22 0.00 5.12 0.52 -1.02 -4.29 118.95 118.78 3n5m s ARG 136 Ca 0.00 -0.33 0.00 0.00 -0.52 0.00 0.00 55.73 54.88 3n5m s ARG 136 Cb 0.10 -4.16 0.00 0.00 0.52 0.00 0.00 34.95 31.40 3n5m s ARG 136 CO 0.47 -1.97 0.00 2.48 0.02 0.00 0.00 175.30 176.29 3n5m n TYR 137 N 8.74 0.00 -2.83 -0.53 0.18 -0.65 -4.53 117.16 117.54 3n5m n TYR 137 Ca 0.02 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.45 3n5m n TYR 137 Cb 0.48 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.37 3n5m n TYR 137 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 3n5m s LYS 138 N -0.55 4.41 0.41 -3.48 1.02 -0.22 -4.71 119.74 116.62 3n5m s LYS 138 Ca 0.00 1.20 0.01 0.00 0.02 0.00 0.00 55.97 57.19 3n5m s LYS 138 Cb 0.00 -2.57 -0.00 0.00 -0.52 0.00 0.00 37.83 34.73 3n5m s LYS 138 CO 0.00 0.17 0.03 1.19 -0.92 0.00 0.00 175.35 175.82 3n5m n PHE 139 N 0.11 0.79 0.00 3.18 3.72 0.02 0.15 117.46 125.44 3n5m n PHE 139 Ca 0.03 -2.12 0.00 0.00 -0.05 0.00 0.00 57.45 55.31 3n5m n PHE 139 Cb 0.52 -0.22 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 3n5m n PHE 139 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3n5m n SER 141 N -1.34 0.00 -4.85 4.37 3.41 -0.35 -0.89 113.62 113.97 3n5m n SER 141 Ca -0.15 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.10 3n5m n SER 141 Cb 0.53 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.42 3n5m n SER 141 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3n5m s ARG 142 N -1.89 3.35 0.48 4.33 3.00 -1.26 -0.95 118.95 126.01 3n5m s ARG 142 Ca 0.00 -0.23 -0.24 0.00 0.00 0.00 0.00 55.73 55.26 3n5m s ARG 142 Cb 0.00 -3.09 -0.07 0.00 0.00 0.00 0.00 34.95 31.79 3n5m s ARG 142 CO 0.00 0.74 1.34 0.71 0.00 0.00 0.00 175.30 178.09 3n5m s TYR 143 N -1.08 2.52 0.00 -0.53 2.02 -0.32 -2.10 117.35 117.86 3n5m s TYR 143 Ca 0.18 1.37 0.00 0.00 -0.37 0.00 0.00 57.07 58.24 3n5m s TYR 143 Cb -0.12 -3.76 0.00 0.00 -0.40 0.00 0.00 41.96 37.68 3n5m s TYR 143 CO 0.07 -2.57 0.00 0.54 -1.57 0.00 0.00 175.55 172.03 3n5m n ARG 144 N -0.46 -0.09 -3.75 -0.62 1.74 -0.04 -4.18 116.66 109.26 3n5m n ARG 144 Ca 0.07 0.02 -0.22 0.00 -0.77 0.00 0.00 57.85 56.95 3n5m n ARG 144 Cb 0.44 -3.07 -0.02 0.00 -1.02 0.00 0.00 32.46 28.80 3n5m n ARG 144 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3n5m s GLY 145 N -2.00 1.28 -0.02 -0.13 0.00 -0.89 -4.28 107.32 101.28 3n5m s GLY 145 Ca 0.00 -1.15 0.03 0.00 0.00 0.00 0.00 44.72 43.60 3n5m s GLY 145 CO 0.00 -1.14 -0.09 -0.47 0.00 0.00 0.00 173.10 171.40 3n5m s TYR 146 N -2.10 0.95 0.00 1.90 6.14 -1.26 0.37 117.35 123.34 3n5m s TYR 146 Ca 0.37 -0.22 0.00 0.00 0.64 0.00 0.00 57.07 57.86 3n5m s TYR 146 Cb -0.09 -0.66 0.00 0.00 0.42 0.00 0.00 41.96 41.63 3n5m s TYR 146 CO 0.31 -0.08 0.25 0.72 0.64 0.00 0.00 175.55 177.40 3n5m n HIS 147 N 3.15 0.00 0.00 4.97 8.25 -1.26 -4.94 115.22 125.40 3n5m n HIS 147 Ca -0.17 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 3n5m n HIS 147 Cb 0.55 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.66 3n5m n HIS 147 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n5m n GLY 148 N -0.03 0.46 0.55 -1.41 0.00 -1.26 -4.51 105.19 98.99 3n5m n GLY 148 Ca 0.00 -1.49 0.05 0.00 0.00 0.00 0.00 46.02 44.58 3n5m n GLY 148 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3n5m n ASN 149 N 0.00 2.56 0.00 1.61 0.23 -1.26 -4.78 115.26 113.62 3n5m n ASN 149 Ca 0.00 -1.82 0.00 0.00 -0.53 0.00 0.00 54.58 52.23 3n5m n ASN 149 Cb 0.00 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 37.55 3n5m n ASN 149 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3n5m n THR 150 N 0.50 0.00 0.00 5.53 -2.24 -1.26 -5.00 114.28 111.81 3n5m n THR 150 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 3n5m n THR 150 Cb 0.37 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 3n5m n THR 150 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n5m n ALA 152 N -3.00 0.00 0.09 6.98 0.00 -1.26 -4.42 120.51 118.89 3n5m n ALA 152 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3n5m n ALA 152 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3n5m n ALA 152 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3n5m n THR 153 N 0.00 1.20 0.00 0.00 -2.24 -1.26 -1.77 114.28 110.20 3n5m n THR 153 Ca 0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3n5m n THR 153 Cb 0.00 -1.17 0.00 0.00 -2.10 0.00 0.00 70.33 67.06 3n5m n THR 153 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n5m n ALA 155 N 1.21 0.00 0.89 6.98 0.00 -1.26 -1.40 120.51 126.93 3n5m n ALA 155 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3n5m n ALA 155 Cb 0.38 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.38 3n5m n ALA 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n5m n ALA 156 N 0.00 2.27 -1.96 0.00 0.00 -0.73 -4.85 120.51 115.24 3n5m n ALA 156 Ca 0.00 -0.08 -0.38 0.00 0.00 0.00 0.00 53.44 52.98 3n5m n ALA 156 Cb 0.00 -1.46 -0.06 0.00 0.00 0.00 0.00 19.45 17.93 3n5m n ALA 156 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3n5m s THR 157 N -3.03 4.37 -0.64 0.00 2.01 -0.49 -4.71 115.64 113.15 3n5m s THR 157 Ca 0.13 1.64 0.15 0.00 0.31 0.00 0.00 61.69 63.92 3n5m s THR 157 Cb 0.17 -4.06 0.52 0.00 0.01 0.00 0.00 72.50 69.14 3n5m s THR 157 CO 0.53 0.38 1.44 0.61 -0.69 0.00 0.00 174.62 176.89 3n5m n GLY 158 N 1.21 3.29 3.22 4.40 0.00 0.16 -4.84 105.19 112.63 3n5m n GLY 158 Ca -0.03 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.79 3n5m n GLY 158 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n5m s GLN 159 N -2.02 2.62 0.57 1.61 -0.21 -1.15 -0.86 119.66 120.22 3n5m s GLN 159 Ca 0.39 -1.85 0.30 0.00 0.02 0.00 0.00 55.36 54.22 3n5m s GLN 159 Cb 0.27 -4.00 1.75 0.00 1.00 0.00 0.00 33.01 32.04 3n5m s GLN 159 CO 0.15 -1.22 2.20 0.00 -2.12 0.00 0.00 175.29 174.31 3n5m h ALA 160 N 8.38 1.39 0.00 6.09 0.00 -1.81 -1.58 119.26 131.74 3n5m h ALA 160 Ca -0.19 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3n5m h ALA 160 Cb 1.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3n5m h ALA 160 CO 0.87 0.05 0.00 1.04 0.00 0.00 0.00 179.25 181.21 3n5m n GLN 161 N -3.71 0.18 0.00 0.00 6.02 -1.07 -1.24 117.38 117.57 3n5m n GLN 161 Ca -0.03 0.27 0.12 0.00 -0.01 0.00 0.00 57.00 57.35 3n5m n GLN 161 Cb 0.13 -1.76 0.24 0.00 1.02 0.00 0.00 30.24 29.87 3n5m n GLN 161 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3n5m n ARG 162 N -2.09 0.42 -0.05 -1.09 5.12 -0.60 -4.40 116.66 113.98 3n5m n ARG 162 Ca 0.04 -0.27 -0.05 0.00 -1.93 0.00 0.00 57.85 55.64 3n5m n ARG 162 Cb 0.32 -1.49 -0.08 0.00 -1.16 0.00 0.00 32.46 30.05 3n5m n ARG 162 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3n5m n ARG 163 N -1.05 2.41 -1.89 5.56 1.74 -0.77 -4.96 116.66 117.69 3n5m n ARG 163 Ca 0.08 -0.01 -0.42 0.00 -0.77 0.00 0.00 57.85 56.74 3n5m n ARG 163 Cb 0.35 -1.25 -0.03 0.00 -1.02 0.00 0.00 32.46 30.51 3n5m n ARG 163 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3n5m s TYR 164 N -2.24 2.99 -0.00 -1.55 5.04 -0.37 -1.37 117.35 119.84 3n5m s TYR 164 Ca -0.05 0.64 0.00 0.00 -2.44 0.00 0.00 57.07 55.22 3n5m s TYR 164 Cb 0.03 -3.97 0.00 0.00 0.35 0.00 0.00 41.96 38.37 3n5m s TYR 164 CO 0.40 -3.51 0.00 1.04 -1.34 0.00 0.00 175.55 172.13 3n5m n GLN 165 N 3.55 -0.06 0.00 4.97 6.02 -1.26 -4.80 117.38 125.80 3n5m n GLN 165 Ca 0.13 0.03 0.04 0.00 -0.01 0.00 0.00 57.00 57.18 3n5m n GLN 165 Cb 0.38 -3.09 0.01 0.00 1.02 0.00 0.00 30.24 28.56 3n5m n GLN 165 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3n5m n TYR 166 N -2.97 0.00 -1.41 1.08 4.01 -0.47 -5.02 117.16 112.38 3n5m n TYR 166 Ca -0.00 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.44 3n5m n TYR 166 Cb 0.02 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.15 3n5m n TYR 166 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 3n5m s GLU 167 N -0.98 1.77 0.47 -0.72 1.03 -1.23 -4.76 118.70 114.29 3n5m s GLU 167 Ca 0.07 0.73 -0.19 0.00 0.03 0.00 0.00 54.97 55.61 3n5m s GLU 167 Cb 0.06 -1.88 -0.09 0.00 -0.80 0.00 0.00 34.13 31.42 3n5m s GLU 167 CO 0.16 -1.86 0.99 -1.25 -1.33 0.00 0.00 175.26 171.96 3n5m s PRO 168 N -5.06 4.00 0.52 -4.83 0.04 -1.26 -5.14 135.00 123.27 3n5m s PRO 168 Ca 0.62 1.15 0.06 0.00 0.04 0.00 0.00 61.00 62.87 3n5m s PRO 168 Cb -0.16 -2.14 0.03 0.00 0.04 0.00 0.00 34.50 32.27 3n5m s PRO 168 CO 0.55 -0.23 0.44 -0.06 0.04 0.00 0.00 177.00 177.74 3n5m s PHE 169 N -2.25 1.83 0.60 0.56 2.99 -1.26 -5.12 117.98 115.33 3n5m s PHE 169 Ca 0.63 -0.75 -0.14 0.00 0.00 0.00 0.00 56.93 56.66 3n5m s PHE 169 Cb -0.11 -2.00 -0.04 0.00 0.00 0.00 0.00 43.02 40.87 3n5m s PHE 169 CO 0.20 -0.47 1.04 0.00 -0.00 0.00 0.00 175.22 175.99 3n5m s ALA 170 N -2.70 2.86 0.83 5.36 0.00 -1.26 -5.06 121.76 121.80 3n5m s ALA 170 Ca 0.40 0.20 -0.13 0.00 0.00 0.00 0.00 51.96 52.43 3n5m s ALA 170 Cb -0.03 -3.17 0.10 0.00 0.00 0.00 0.00 23.12 20.03 3n5m s ALA 170 CO 0.25 -0.74 1.20 -1.54 0.00 0.00 0.00 175.76 174.93 3n5m s SER 171 N -3.29 4.28 0.00 0.00 1.04 -1.26 -4.48 113.70 109.99 3n5m s SER 171 Ca 0.60 0.72 0.00 0.00 0.48 0.00 0.00 55.95 57.74 3n5m s SER 171 Cb -0.13 -1.15 0.00 0.00 0.10 0.00 0.00 66.02 64.84 3n5m s SER 171 CO 0.42 -2.05 0.00 0.61 0.98 0.00 0.00 173.24 173.20 3n5m n GLY 172 N -3.34 0.83 3.35 7.32 0.00 -1.26 -5.01 105.19 107.07 3n5m n GLY 172 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 3n5m n GLY 172 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n5m s PHE 173 N -2.03 2.98 0.16 1.61 0.40 -1.26 -0.80 117.98 119.04 3n5m s PHE 173 Ca 0.00 -0.79 0.10 0.00 -0.60 0.00 0.00 56.93 55.64 3n5m s PHE 173 Cb 0.00 -2.12 -0.04 0.00 0.51 0.00 0.00 43.02 41.37 3n5m s PHE 173 CO 0.00 -0.48 -0.19 -0.51 0.70 0.00 0.00 175.22 174.74 3n5m s LEU 174 N 1.43 2.62 0.06 -0.37 1.43 -0.07 -4.99 118.68 118.79 3n5m s LEU 174 Ca 0.05 -0.70 0.04 0.00 -1.03 0.00 0.00 54.13 52.49 3n5m s LEU 174 Cb -0.14 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.65 3n5m s LEU 174 CO -0.01 0.14 -0.11 -1.00 0.23 0.00 0.00 176.35 175.59 3n5m s HIS 175 N -1.46 1.00 0.27 0.29 3.76 -1.25 -1.21 115.29 116.68 3n5m s HIS 175 Ca 0.20 -0.49 0.05 0.00 -0.15 0.00 0.00 55.06 54.67 3n5m s HIS 175 Cb -0.09 -0.57 -0.06 0.00 1.11 0.00 0.00 32.58 32.97 3n5m s HIS 175 CO 0.11 -0.00 -0.01 0.14 -0.85 0.00 0.00 174.74 174.13 3n5m s VAL 176 N -1.42 1.30 0.30 -0.90 -7.23 -0.12 -4.89 120.40 107.44 3n5m s VAL 176 Ca -0.04 -2.06 -0.30 0.00 -1.81 0.00 0.00 61.98 57.77 3n5m s VAL 176 Cb -0.09 -2.49 -0.12 0.00 0.56 0.00 0.00 36.38 34.24 3n5m s VAL 176 CO 0.01 -0.24 1.59 0.41 -0.31 0.00 0.00 175.10 176.56 3n5m n THR 177 N -0.54 1.09 -2.89 5.32 -1.04 -1.26 -1.18 114.28 113.78 3n5m n THR 177 Ca -0.05 -0.27 -0.40 0.00 -2.04 0.00 0.00 64.05 61.30 3n5m n THR 177 Cb 0.64 -1.96 -0.06 0.00 -1.82 0.00 0.00 70.33 67.13 3n5m n THR 177 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3n5m s PRO 178 N -0.62 4.68 0.13 -2.82 0.04 -1.26 -4.82 135.00 130.33 3n5m s PRO 178 Ca 0.63 1.28 -0.31 0.00 0.04 0.00 0.00 61.00 62.64 3n5m s PRO 178 Cb -0.50 -3.27 -0.08 0.00 0.04 0.00 0.00 34.50 30.69 3n5m s PRO 178 CO 0.50 0.55 1.40 -1.25 0.04 0.00 0.00 177.00 178.23 3n5m s PRO 179 N -1.14 4.32 -0.30 0.56 0.04 -1.26 -5.00 135.00 132.21 3n5m s PRO 179 Ca 0.38 2.10 -0.00 0.00 0.04 0.00 0.00 61.00 63.52 3n5m s PRO 179 Cb -0.24 -3.23 0.14 0.00 0.04 0.00 0.00 34.50 31.20 3n5m s PRO 179 CO 0.28 -0.43 0.29 0.34 0.04 0.00 0.00 177.00 177.52 3n5m s ASP 180 N 1.02 1.81 0.00 6.66 -1.08 -1.26 -4.29 116.67 119.52 3n5m s ASP 180 Ca 0.64 -0.98 0.10 0.00 -0.52 0.00 0.00 52.55 51.80 3n5m s ASP 180 Cb -0.37 0.41 0.46 0.00 -1.46 0.00 0.00 42.92 41.96 3n5m s ASP 180 CO 0.31 -0.37 1.31 0.00 0.52 0.00 0.00 175.17 176.94 3n5m h TYR 182 N 0.00 0.09 -0.42 0.00 3.20 -2.00 -3.34 116.97 114.50 3n5m h TYR 182 Ca 0.00 -0.07 -0.27 0.00 3.14 0.00 0.00 58.73 61.53 3n5m h TYR 182 Cb 0.16 -0.00 -0.10 0.00 1.54 0.00 0.00 36.73 38.32 3n5m h TYR 182 CO 0.00 1.29 0.13 0.54 -1.64 0.00 0.00 178.16 178.48 3n5m n ARG 183 N -4.41 1.85 -3.63 1.82 1.74 -1.04 -5.03 116.66 107.96 3n5m n ARG 183 Ca -0.21 -1.32 -0.10 0.00 -0.77 0.00 0.00 57.85 55.45 3n5m n ARG 183 Cb 0.64 -1.73 -0.07 0.00 -1.02 0.00 0.00 32.46 30.28 3n5m n ARG 183 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3n5m s PRO 185 N -0.73 0.58 0.00 5.56 0.04 -1.25 -5.07 135.00 134.13 3n5m s PRO 185 Ca 0.41 0.63 0.00 0.00 0.04 0.00 0.00 61.00 62.08 3n5m s PRO 185 Cb 0.25 0.28 0.00 0.00 0.04 0.00 0.00 34.50 35.07 3n5m s PRO 185 CO -0.06 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.31 3n5m n GLY 186 N 2.16 1.27 0.24 0.56 0.00 -1.26 -4.88 105.19 103.28 3n5m n GLY 186 Ca -0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.99 3n5m n GLY 186 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 3n5m h ILE 187 N 0.00 0.79 0.00 -0.61 3.07 -1.96 -2.69 117.51 116.10 3n5m h ILE 187 Ca 0.00 -0.67 0.00 0.00 1.55 0.00 0.00 64.86 65.74 3n5m h ILE 187 Cb 0.00 1.40 0.00 0.00 -0.27 0.00 0.00 36.82 37.95 3n5m h ILE 187 CO 0.00 0.17 0.00 1.05 -1.05 0.00 0.00 178.15 178.32 3n5m h GLU 188 N 0.00 0.00 0.00 0.16 9.09 -1.92 -3.07 114.58 118.84 3n5m h GLU 188 Ca -0.00 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.25 3n5m h GLU 188 Cb 0.39 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.46 3n5m h GLU 188 CO 0.02 0.00 -1.50 0.54 0.05 0.00 0.00 179.01 178.12 3n5m n ARG 189 N -2.95 0.63 -1.12 1.06 5.12 -1.04 -4.83 116.66 113.52 3n5m n ARG 189 Ca 0.01 0.16 -0.31 0.00 -1.93 0.00 0.00 57.85 55.78 3n5m n ARG 189 Cb 0.29 -1.76 0.11 0.00 -1.16 0.00 0.00 32.46 29.93 3n5m n ARG 189 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3n5m s GLU 190 N -2.98 1.94 0.08 5.56 2.02 -1.07 -4.97 118.70 119.28 3n5m s GLU 190 Ca -0.04 1.28 -0.31 0.00 0.02 0.00 0.00 54.97 55.92 3n5m s GLU 190 Cb 0.09 -1.85 -0.08 0.00 0.10 0.00 0.00 34.13 32.39 3n5m s GLU 190 CO 0.82 -1.90 1.47 1.21 0.02 0.00 0.00 175.26 176.88 3n5m s ASN 191 N -3.19 6.76 0.33 -0.19 3.84 -1.26 -4.89 114.94 116.34 3n5m s ASN 191 Ca 0.63 2.34 0.07 0.00 0.21 0.00 0.00 52.86 56.11 3n5m s ASN 191 Cb -0.19 -2.58 0.75 0.00 -0.55 0.00 0.00 41.25 38.69 3n5m s ASN 191 CO 0.56 -0.74 1.84 -0.29 -2.79 0.00 0.00 177.10 175.68 3n5m h ILE 192 N 4.49 0.81 0.00 -5.21 6.09 -1.93 0.14 117.51 121.91 3n5m h ILE 192 Ca -0.41 -0.26 0.00 0.00 -1.37 0.00 0.00 64.86 62.81 3n5m h ILE 192 Cb 1.20 -0.02 0.00 0.00 0.47 0.00 0.00 36.82 38.47 3n5m h ILE 192 CO 0.89 0.14 0.00 -1.22 -3.07 0.00 0.00 178.15 174.89 3n5m n TYR 193 N -4.62 0.00 1.06 2.19 4.01 -1.26 -1.47 117.16 117.07 3n5m n TYR 193 Ca 0.19 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.05 3n5m n TYR 193 Cb 0.48 -0.03 0.09 0.00 -0.31 0.00 0.00 39.34 39.57 3n5m n TYR 193 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3n5m n ASP 194 N -1.03 1.75 -4.70 7.72 8.00 0.49 -4.72 116.55 124.07 3n5m n ASP 194 Ca 0.22 -1.35 -0.42 0.00 0.71 0.00 0.00 54.79 53.95 3n5m n ASP 194 Cb 0.12 0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 41.60 3n5m n ASP 194 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3n5m s VAL 195 N -2.50 4.04 0.19 2.53 1.01 -0.54 -4.94 120.40 120.18 3n5m s VAL 195 Ca 0.20 1.43 -0.12 0.00 0.00 0.00 0.00 61.98 63.48 3n5m s VAL 195 Cb 0.18 -3.92 0.10 0.00 0.00 0.00 0.00 36.38 32.75 3n5m s VAL 195 CO 0.57 0.05 1.83 -0.08 0.00 0.00 0.00 175.10 177.48 3n5m h GLU 196 N 7.19 0.86 0.00 2.72 4.57 -1.91 -0.45 114.58 127.55 3n5m h GLU 196 Ca -0.38 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 3n5m h GLU 196 Cb 1.19 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.60 3n5m h GLU 196 CO 0.85 0.60 0.00 0.00 -1.18 0.00 0.00 179.01 179.28 3n5m h VAL 198 N 0.00 1.12 -0.66 0.00 2.07 -1.60 -3.30 116.25 113.88 3n5m h VAL 198 Ca 0.00 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.09 3n5m h VAL 198 Cb 0.38 2.81 -0.03 0.00 -1.52 0.00 0.00 31.29 32.93 3n5m h VAL 198 CO 0.00 0.71 0.42 0.11 0.02 0.00 0.00 177.57 178.84 3n5m h LYS 199 N -0.29 0.88 -0.95 1.57 1.57 -0.80 -2.69 116.57 115.85 3n5m h LYS 199 Ca -0.27 -0.06 0.10 0.00 -1.87 0.00 0.00 60.65 58.55 3n5m h LYS 199 Cb 1.76 -0.19 -0.08 0.00 0.08 0.00 0.00 32.23 33.80 3n5m h LYS 199 CO 0.08 0.59 0.59 1.49 -0.57 0.00 0.00 179.45 181.63 3n5m h GLU 200 N 0.90 0.94 -0.15 3.15 4.81 -1.04 0.01 114.58 123.20 3n5m h GLU 200 Ca 0.24 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.43 3n5m h GLU 200 Cb -0.08 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.07 3n5m h GLU 200 CO -0.05 0.62 0.06 0.28 -0.73 0.00 0.00 179.01 179.19 3n5m h VAL 201 N 0.97 0.98 -0.26 0.32 2.07 -1.56 -0.47 116.25 118.31 3n5m h VAL 201 Ca 0.45 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.91 3n5m h VAL 201 Cb 0.38 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3n5m h VAL 201 CO -0.24 0.02 0.08 -0.78 0.02 0.00 0.00 177.57 176.67 3n5m h ASP 202 N 0.13 0.38 -0.18 0.57 3.58 -1.43 -3.18 116.42 116.28 3n5m h ASP 202 Ca 0.06 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.30 3n5m h ASP 202 Cb 0.03 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 3n5m h ASP 202 CO -0.06 0.49 0.12 0.03 -2.88 0.00 0.00 179.24 176.94 3n5m h ARG 203 N 0.24 0.25 -1.79 0.28 3.08 -0.89 -1.82 114.38 113.73 3n5m h ARG 203 Ca 0.08 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3n5m h ARG 203 Cb 0.25 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3n5m h ARG 203 CO -0.00 0.18 0.00 0.28 -1.07 0.00 0.00 179.97 179.36 3n5m n VAL 204 N -4.95 0.27 0.00 2.04 0.31 -0.19 -0.47 118.33 115.34 3n5m n VAL 204 Ca -0.04 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 3n5m n VAL 204 Cb 0.04 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 3n5m n VAL 204 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3n5m n THR 206 N 1.02 0.00 0.19 2.52 -1.04 -0.69 -0.95 114.28 115.34 3n5m n THR 206 Ca 0.00 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.08 3n5m n THR 206 Cb 0.12 0.00 0.30 0.00 -1.82 0.00 0.00 70.33 68.93 3n5m n THR 206 CO 0.00 0.00 0.00 -0.50 -0.64 0.00 0.00 175.07 173.93 3n5m h TRP 207 N 0.00 0.00 0.00 -1.42 6.55 -1.04 -2.46 115.95 117.58 3n5m h TRP 207 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3n5m h TRP 207 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.30 3n5m h TRP 207 CO 0.00 0.33 -0.48 0.39 -1.05 0.00 0.00 178.44 177.63 3n5m n GLU 208 N -3.37 0.04 -0.66 0.49 -0.58 -0.12 -5.04 120.64 111.40 3n5m n GLU 208 Ca 0.01 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 3n5m n GLU 208 Cb 0.53 -1.53 0.00 0.00 -0.57 0.00 0.00 31.44 29.88 3n5m n GLU 208 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3n5m n LEU 209 N -1.59 -1.65 -0.34 -4.62 7.94 -0.93 -4.65 117.00 111.17 3n5m n LEU 209 Ca 0.05 0.00 0.23 0.00 -1.11 0.00 0.00 56.01 55.18 3n5m n LEU 209 Cb 0.35 -0.83 0.46 0.00 0.53 0.00 0.00 43.42 43.93 3n5m n LEU 209 CO 0.35 0.00 1.13 0.28 -1.11 0.00 0.00 177.39 178.04 3n5m h SER 210 N 0.00 0.55 0.31 1.96 0.02 -1.88 -0.37 113.55 114.14 3n5m h SER 210 Ca 0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 3n5m h SER 210 Cb 0.00 0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.65 3n5m h SER 210 CO 0.00 -0.07 0.00 -0.62 -1.14 0.00 0.00 176.83 175.00 3n5m n GLU 211 N -4.99 0.06 0.00 3.45 4.71 -1.26 -1.97 120.64 120.63 3n5m n GLU 211 Ca 0.31 0.27 0.08 0.00 -0.01 0.00 0.00 57.16 57.80 3n5m n GLU 211 Cb 0.93 -1.50 0.01 0.00 -1.01 0.00 0.00 31.44 29.88 3n5m n GLU 211 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3n5m n THR 212 N -1.42 0.00 -3.32 2.62 -2.24 -0.15 -2.98 114.28 106.80 3n5m n THR 212 Ca 0.04 -0.36 -0.39 0.00 -2.27 0.00 0.00 64.05 61.06 3n5m n THR 212 Cb 0.11 1.22 -0.08 0.00 -2.10 0.00 0.00 70.33 69.49 3n5m n THR 212 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3n5m s ILE 213 N -1.80 5.14 -0.18 2.28 -1.09 -0.83 -1.06 121.20 123.65 3n5m s ILE 213 Ca 0.15 0.78 -0.16 0.00 -2.23 0.00 0.00 60.65 59.19 3n5m s ILE 213 Cb 0.13 -3.77 -0.21 0.00 -1.58 0.00 0.00 42.46 37.03 3n5m s ILE 213 CO 0.37 0.17 0.23 0.00 -1.23 0.00 0.00 174.94 174.48 3n5m n ALA 214 N 5.01 0.84 -3.50 9.38 0.00 0.12 -4.53 120.51 127.84 3n5m n ALA 214 Ca -0.06 -0.55 -0.15 0.00 0.00 0.00 0.00 53.44 52.68 3n5m n ALA 214 Cb 0.50 -0.57 -0.04 0.00 0.00 0.00 0.00 19.45 19.34 3n5m n ALA 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n5m s ALA 215 N -2.44 -1.75 -0.19 0.00 0.00 -1.05 -1.55 121.76 114.79 3n5m s ALA 215 Ca -0.27 1.10 -0.05 0.00 0.00 0.00 0.00 51.96 52.74 3n5m s ALA 215 Cb 0.07 0.19 -0.03 0.00 0.00 0.00 0.00 23.12 23.35 3n5m s ALA 215 CO 0.65 -0.50 0.01 0.12 0.00 0.00 0.00 175.76 176.04 3n5m s PHE 216 N -2.04 3.08 0.29 0.00 5.36 0.20 -4.27 117.98 120.61 3n5m s PHE 216 Ca -0.05 -0.29 0.09 0.00 -0.96 0.00 0.00 56.93 55.72 3n5m s PHE 216 Cb -0.00 -2.06 -0.04 0.00 -0.34 0.00 0.00 43.02 40.57 3n5m s PHE 216 CO 0.01 -0.11 0.01 -1.50 -1.46 0.00 0.00 175.22 172.18 3n5m s ILE 217 N 0.73 3.25 0.05 3.12 2.07 -1.26 -0.88 121.20 128.28 3n5m s ILE 217 Ca 0.00 -1.90 -0.11 0.00 -1.41 0.00 0.00 60.65 57.23 3n5m s ILE 217 Cb -0.14 -2.84 -0.06 0.00 0.13 0.00 0.00 42.46 39.55 3n5m s ILE 217 CO 0.02 -0.32 0.39 -1.61 -1.91 0.00 0.00 174.94 171.51 3n5m s GLU 219 N -3.70 3.79 0.37 3.50 2.02 -1.26 -4.36 118.70 119.06 3n5m s GLU 219 Ca 0.33 0.22 0.04 0.00 0.02 0.00 0.00 54.97 55.58 3n5m s GLU 219 Cb -0.05 -3.05 0.72 0.00 0.10 0.00 0.00 34.13 31.85 3n5m s GLU 219 CO 0.20 0.60 2.03 -1.35 0.02 0.00 0.00 175.26 176.76 3n5m h PRO 220 N 3.98 0.72 -4.81 0.39 0.11 -1.92 -3.39 132.00 127.07 3n5m h PRO 220 Ca -0.50 -0.04 -0.54 0.00 0.11 0.00 0.00 66.00 65.03 3n5m h PRO 220 Cb 1.20 -0.16 -0.33 0.00 0.11 0.00 0.00 31.00 31.82 3n5m h PRO 220 CO 0.65 0.48 -0.83 0.42 -0.21 0.00 0.00 178.00 178.51 3n5m s ILE 221 N -5.64 1.30 -0.66 4.15 1.01 -1.26 -4.72 121.20 115.39 3n5m s ILE 221 Ca -0.09 -0.59 -0.27 0.00 0.00 0.00 0.00 60.65 59.69 3n5m s ILE 221 Cb 0.18 -1.16 0.01 0.00 0.01 0.00 0.00 42.46 41.49 3n5m s ILE 221 CO 0.75 0.39 1.53 -0.63 0.00 0.00 0.00 174.94 176.98 3n5m s ILE 222 N 0.47 3.59 -0.12 2.92 1.01 -0.78 -4.85 121.20 123.43 3n5m s ILE 222 Ca -0.12 0.37 -0.04 0.00 0.00 0.00 0.00 60.65 60.86 3n5m s ILE 222 Cb -0.15 -4.46 -0.02 0.00 0.01 0.00 0.00 42.46 37.85 3n5m s ILE 222 CO 0.04 -1.37 -0.05 0.71 0.00 0.00 0.00 174.94 174.27 3n5m h THR 223 N 6.42 0.04 -0.47 2.92 1.35 -1.93 0.26 112.91 121.50 3n5m h THR 223 Ca -0.27 -1.03 -0.03 0.00 -0.55 0.00 0.00 66.41 64.53 3n5m h THR 223 Cb 1.10 0.08 -0.02 0.00 -1.73 0.00 0.00 68.15 67.58 3n5m h THR 223 CO 1.24 0.01 0.18 1.23 -0.25 0.00 0.00 175.52 177.93 3n5m h GLY 224 N -1.00 0.73 2.00 5.82 0.00 -1.94 -1.27 103.07 107.41 3n5m h GLY 224 Ca -0.00 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 3n5m h GLY 224 CO -0.00 0.34 -0.02 -1.33 0.00 0.00 0.00 176.54 175.54 3n5m h GLY 225 N 0.83 0.00 0.00 4.60 0.00 -1.75 -3.43 103.07 103.33 3n5m h GLY 225 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3n5m h GLY 225 CO -0.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.14 3n5m n GLY 226 N -0.86 0.52 3.84 4.60 0.00 -0.68 -4.86 105.19 107.75 3n5m n GLY 226 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 3n5m n GLY 226 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3n5m n ILE 227 N 0.00 -3.42 -1.98 -0.61 2.08 0.07 -4.89 119.36 110.62 3n5m n ILE 227 Ca 0.00 -0.38 -0.28 0.00 0.56 0.00 0.00 62.75 62.64 3n5m n ILE 227 Cb 0.00 -3.16 0.08 0.00 -0.75 0.00 0.00 39.64 35.82 3n5m n ILE 227 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 3n5m s LEU 228 N -6.91 2.61 0.18 1.39 1.43 0.70 -4.85 118.68 113.24 3n5m s LEU 228 Ca 0.16 0.73 -0.15 0.00 -1.03 0.00 0.00 54.13 53.84 3n5m s LEU 228 Cb -0.08 -3.28 0.02 0.00 0.03 0.00 0.00 46.19 42.87 3n5m s LEU 228 CO 0.84 -1.78 0.45 0.00 0.23 0.00 0.00 176.35 176.09 3n5m s ALA 230 N -3.48 -0.64 0.78 4.21 0.00 -1.26 -1.87 121.76 119.50 3n5m s ALA 230 Ca 0.61 -0.44 -0.15 0.00 0.00 0.00 0.00 51.96 51.99 3n5m s ALA 230 Cb -0.11 0.85 0.04 0.00 0.00 0.00 0.00 23.12 23.90 3n5m s ALA 230 CO 0.48 -0.75 0.99 -2.30 0.00 0.00 0.00 175.76 174.18 3n5m n PRO 231 N -0.30 0.30 -0.32 0.00 -0.02 -1.26 -4.90 135.00 128.50 3n5m n PRO 231 Ca -0.09 0.16 0.10 0.00 -2.02 0.00 0.00 63.50 61.65 3n5m n PRO 231 Cb 0.63 -2.25 0.31 0.00 -0.02 0.00 0.00 33.50 32.16 3n5m n PRO 231 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3n5m h GLN 232 N -0.63 0.82 -0.49 -0.52 5.75 -1.94 -2.18 115.11 115.91 3n5m h GLN 232 Ca -0.46 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 57.99 3n5m h GLN 232 Cb 1.32 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 29.68 3n5m h GLN 232 CO 0.45 0.54 0.00 -0.25 -2.65 0.00 0.00 178.83 176.92 3n5m n ASP 233 N -4.60 2.94 -0.53 -0.69 8.00 -1.26 -4.73 116.55 115.68 3n5m n ASP 233 Ca 0.18 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.72 3n5m n ASP 233 Cb 0.42 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 3n5m n ASP 233 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n5m n TYR 234 N 1.11 0.00 0.00 1.24 9.36 -0.83 -1.57 117.16 126.48 3n5m n TYR 234 Ca 0.19 -0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.40 3n5m n TYR 234 Cb 0.48 -0.02 0.00 0.00 -0.63 0.00 0.00 39.34 39.17 3n5m n TYR 234 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 3n5m n LYS 236 N 0.45 0.00 -0.19 2.98 4.81 -1.26 -1.14 118.16 123.81 3n5m n LYS 236 Ca 0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.34 3n5m n LYS 236 Cb 0.04 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.11 3n5m n LYS 236 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3n5m h ALA 237 N 0.00 0.75 -0.50 3.14 0.00 -1.68 -1.17 119.26 119.79 3n5m h ALA 237 Ca 0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 3n5m h ALA 237 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3n5m h ALA 237 CO 0.00 0.62 0.22 0.28 0.00 0.00 0.00 179.25 180.37 3n5m h VAL 238 N 0.89 1.21 -0.47 0.00 2.07 -1.39 -0.73 116.25 117.83 3n5m h VAL 238 Ca 0.15 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 67.08 3n5m h VAL 238 Cb 0.62 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3n5m h VAL 238 CO 0.04 0.24 0.25 -0.74 0.02 0.00 0.00 177.57 177.38 3n5m h HIS 239 N 0.67 0.46 -0.58 1.57 6.17 -1.77 -0.21 115.15 121.46 3n5m h HIS 239 Ca 0.17 0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.26 3n5m h HIS 239 Cb 0.17 -0.14 -0.03 0.00 2.52 0.00 0.00 27.41 29.93 3n5m h HIS 239 CO 0.00 0.25 0.33 0.93 0.71 0.00 0.00 177.93 180.15 3n5m h GLU 240 N 0.50 0.79 -0.33 5.26 5.08 -1.01 -0.60 114.58 124.27 3n5m h GLU 240 Ca 0.20 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.36 3n5m h GLU 240 Cb 0.07 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3n5m h GLU 240 CO -0.12 0.57 -0.26 1.15 -1.00 0.00 0.00 179.01 179.36 3n5m h THR 241 N 0.81 1.29 -0.35 1.13 2.02 -0.58 -0.75 112.91 116.48 3n5m h THR 241 Ca 0.21 -1.41 0.04 0.00 0.77 0.00 0.00 66.41 66.02 3n5m h THR 241 Cb 0.00 1.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 3n5m h THR 241 CO -0.04 0.46 0.11 0.00 0.37 0.00 0.00 175.52 176.42 3n5m h GLN 243 N 0.25 0.65 -0.93 0.00 4.20 -1.02 0.16 115.11 118.41 3n5m h GLN 243 Ca 0.16 -0.09 0.18 0.00 0.06 0.00 0.00 58.65 58.97 3n5m h GLN 243 Cb 0.15 -0.12 -0.11 0.00 0.30 0.00 0.00 27.48 27.70 3n5m h GLN 243 CO -0.18 0.53 0.52 -0.22 -0.67 0.00 0.00 178.83 178.81 3n5m h LYS 244 N 0.60 0.63 -0.02 1.46 3.64 -0.88 -2.13 116.57 119.87 3n5m h LYS 244 Ca 0.16 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3n5m h LYS 244 Cb 0.08 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3n5m h LYS 244 CO -0.02 0.42 -0.02 0.72 -2.27 0.00 0.00 179.45 178.27 3n5m n HIS 245 N -4.85 0.00 -0.94 1.91 8.25 -0.81 -4.94 115.22 113.84 3n5m n HIS 245 Ca 0.21 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 3n5m n HIS 245 Cb 0.54 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.65 3n5m n HIS 245 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n5m n GLY 246 N 1.23 0.46 3.98 -1.41 0.00 -0.33 -4.65 105.19 104.47 3n5m n GLY 246 Ca 0.17 -0.62 -0.20 0.00 0.00 0.00 0.00 46.02 45.37 3n5m n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5m s ALA 247 N -2.00 4.05 0.26 4.61 0.00 0.41 -4.99 121.76 124.10 3n5m s ALA 247 Ca 0.00 -1.31 -0.04 0.00 0.00 0.00 0.00 51.96 50.61 3n5m s ALA 247 Cb 0.00 -1.74 -0.05 0.00 0.00 0.00 0.00 23.12 21.33 3n5m s ALA 247 CO 0.00 0.09 0.51 -0.51 0.00 0.00 0.00 175.76 175.86 3n5m s LEU 248 N -4.09 4.10 -0.21 0.00 1.43 -0.59 -3.97 118.68 115.34 3n5m s LEU 248 Ca 0.39 0.64 -0.05 0.00 -1.03 0.00 0.00 54.13 54.09 3n5m s LEU 248 Cb -0.09 -3.44 -0.02 0.00 0.03 0.00 0.00 46.19 42.67 3n5m s LEU 248 CO 0.30 -0.15 -0.01 -0.22 0.23 0.00 0.00 176.35 176.50 3n5m s LEU 249 N -3.46 3.12 -0.25 1.79 2.96 -1.26 -0.63 118.68 120.95 3n5m s LEU 249 Ca 0.43 -0.28 -0.08 0.00 -0.22 0.00 0.00 54.13 53.98 3n5m s LEU 249 Cb -0.11 -1.80 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 3n5m s LEU 249 CO 0.29 0.02 0.09 -0.63 -1.32 0.00 0.00 176.35 174.80 3n5m s ILE 250 N 1.24 4.50 -0.37 6.68 1.01 -0.06 -1.88 121.20 132.33 3n5m s ILE 250 Ca 0.03 -0.11 -0.18 0.00 0.00 0.00 0.00 60.65 60.40 3n5m s ILE 250 Cb -0.15 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.22 3n5m s ILE 250 CO 0.00 0.33 0.50 -0.55 0.00 0.00 0.00 174.94 175.22 3n5m s SER 251 N 1.56 6.29 -0.69 3.58 0.15 0.11 -4.38 113.70 120.31 3n5m s SER 251 Ca 0.06 -0.15 -0.27 0.00 0.70 0.00 0.00 55.95 56.29 3n5m s SER 251 Cb -0.15 -2.26 0.03 0.00 -1.71 0.00 0.00 66.02 61.93 3n5m s SER 251 CO 0.05 -0.50 1.25 -0.62 1.20 0.00 0.00 173.24 174.61 3n5m s ASP 252 N 1.79 6.24 -0.21 5.45 -1.08 -1.26 -2.02 116.67 125.57 3n5m s ASP 252 Ca 0.17 -0.31 0.15 0.00 -0.52 0.00 0.00 52.55 52.05 3n5m s ASP 252 Cb -0.16 -2.56 0.75 0.00 -1.46 0.00 0.00 42.92 39.50 3n5m s ASP 252 CO 0.14 -1.73 1.67 -0.62 0.52 0.00 0.00 175.17 175.14 3n5m n GLU 253 N 9.09 4.38 -0.14 4.34 -0.58 0.26 -4.24 120.64 133.75 3n5m n GLU 253 Ca 0.04 -3.07 -0.04 0.00 -0.42 0.00 0.00 57.16 53.67 3n5m n GLU 253 Cb 0.49 -2.14 0.05 0.00 -0.57 0.00 0.00 31.44 29.26 3n5m n GLU 253 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3n5m h VAL 254 N 3.50 0.80 0.09 2.62 2.07 -1.85 -0.12 116.25 123.35 3n5m h VAL 254 Ca 0.00 -0.09 -0.37 0.00 0.82 0.00 0.00 66.70 67.05 3n5m h VAL 254 Cb 1.82 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 3n5m h VAL 254 CO 0.41 0.05 -2.15 -0.38 0.02 0.00 0.00 177.57 175.52 3n5m n ILE 255 N -5.06 1.69 0.63 4.57 5.41 -1.26 -4.24 119.36 121.10 3n5m n ILE 255 Ca 0.04 -0.63 0.11 0.00 1.00 0.00 0.00 62.75 63.27 3n5m n ILE 255 Cb 0.19 -1.63 0.45 0.00 -0.71 0.00 0.00 39.64 37.94 3n5m n ILE 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3n5m s GLY 257 N -3.19 1.92 -0.79 0.00 0.00 -0.06 -3.52 107.32 101.68 3n5m s GLY 257 Ca 0.09 0.22 -0.00 0.00 0.00 0.00 0.00 44.72 45.03 3n5m s GLY 257 CO 0.41 0.52 0.66 0.69 0.00 0.00 0.00 173.10 175.38 3n5m n PHE 258 N -2.41 -1.44 -0.15 1.90 3.72 0.16 -3.78 117.46 115.46 3n5m n PHE 258 Ca 0.08 0.62 0.00 0.00 -0.05 0.00 0.00 57.45 58.09 3n5m n PHE 258 Cb 0.53 -4.02 0.00 0.00 -0.94 0.00 0.00 39.48 35.05 3n5m n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n5m n GLY 259 N -1.09 1.05 0.28 1.37 0.00 -0.83 -4.96 105.19 101.02 3n5m n GLY 259 Ca -0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.84 3n5m n GLY 259 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3n5m h ARG 260 N 3.53 0.71 -0.18 1.61 9.65 -1.66 -2.35 114.38 125.69 3n5m h ARG 260 Ca 0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 3n5m h ARG 260 Cb 0.00 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.42 3n5m h ARG 260 CO 0.00 0.47 0.00 0.25 2.80 0.00 0.00 179.97 183.49 3n5m n THR 261 N -4.77 0.21 -0.02 0.20 -2.24 -1.26 -2.05 114.28 104.35 3n5m n THR 261 Ca 0.11 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 3n5m n THR 261 Cb 0.23 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 3n5m n THR 261 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n5m n GLY 262 N 1.30 0.52 3.43 3.38 0.00 -0.89 -2.72 105.19 110.22 3n5m n GLY 262 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 3n5m n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n5m s LYS 263 N -0.98 1.57 0.22 1.61 -0.14 -1.26 -4.67 119.74 116.09 3n5m s LYS 263 Ca 0.00 -1.83 -0.08 0.00 -1.36 0.00 0.00 55.97 52.70 3n5m s LYS 263 Cb 0.00 -1.02 0.33 0.00 -1.68 0.00 0.00 37.83 35.46 3n5m s LYS 263 CO 0.00 -0.05 1.73 0.00 -0.76 0.00 0.00 175.35 176.27 3n5m h ALA 264 N 2.23 0.84 -2.79 5.17 0.00 -1.93 -2.98 119.26 119.80 3n5m h ALA 264 Ca -0.40 0.10 -0.24 0.00 0.00 0.00 0.00 54.91 54.37 3n5m h ALA 264 Cb 1.24 0.09 -0.19 0.00 0.00 0.00 0.00 17.79 18.92 3n5m h ALA 264 CO 0.68 -0.21 -0.72 -0.06 0.00 0.00 0.00 179.25 178.94 3n5m s PHE 265 N -6.08 0.71 0.25 0.00 0.08 -1.26 0.39 117.98 112.07 3n5m s PHE 265 Ca -0.13 -0.67 -0.05 0.00 0.12 0.00 0.00 56.93 56.20 3n5m s PHE 265 Cb 0.18 -0.43 0.33 0.00 -0.57 0.00 0.00 43.02 42.53 3n5m s PHE 265 CO 0.75 -0.13 1.88 0.78 -0.10 0.00 0.00 175.22 178.40 3n5m h GLY 266 N 3.92 1.39 -5.01 4.36 0.00 -1.83 -3.36 103.07 102.54 3n5m h GLY 266 Ca -0.35 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.52 3n5m h GLY 266 CO 0.50 0.36 0.50 1.97 0.00 0.00 0.00 176.54 179.87 3n5m n PHE 267 N -4.52 0.00 0.00 5.60 1.16 -1.26 -4.15 117.46 114.30 3n5m n PHE 267 Ca 0.13 -0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.71 3n5m n PHE 267 Cb 0.12 -0.40 0.00 0.00 -1.61 0.00 0.00 39.48 37.60 3n5m n PHE 267 CO 0.00 0.00 0.00 0.09 -1.87 0.00 0.00 176.76 174.98 3n5m n ASN 269 N 2.99 0.00 -0.51 5.98 3.02 -1.26 -3.30 115.26 122.18 3n5m n ASN 269 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 3n5m n ASN 269 Cb 0.00 0.00 0.15 0.00 -0.61 0.00 0.00 39.78 39.32 3n5m n ASN 269 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3n5m n TYR 270 N 0.00 0.45 -3.58 3.10 4.01 -1.26 -5.03 117.16 114.85 3n5m n TYR 270 Ca 0.00 -0.68 -0.22 0.00 -0.16 0.00 0.00 57.90 56.84 3n5m n TYR 270 Cb 0.00 -0.13 0.07 0.00 -0.31 0.00 0.00 39.34 38.97 3n5m n TYR 270 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3n5m n ASP 271 N -0.26 -4.20 -4.23 7.72 2.03 -1.21 -4.31 116.55 112.10 3n5m n ASP 271 Ca 0.13 -0.62 -0.17 0.00 0.52 0.00 0.00 54.79 54.65 3n5m n ASP 271 Cb 0.56 -4.86 -0.11 0.00 -0.72 0.00 0.00 41.12 35.99 3n5m n ASP 271 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3n5m s VAL 272 N -3.36 1.25 -0.34 5.18 -7.23 -1.25 -4.88 120.40 109.76 3n5m s VAL 272 Ca 0.33 -1.71 0.02 0.00 -1.81 0.00 0.00 61.98 58.82 3n5m s VAL 272 Cb -0.15 -1.50 0.09 0.00 0.56 0.00 0.00 36.38 35.38 3n5m s VAL 272 CO 0.75 -0.45 0.06 -0.75 -0.31 0.00 0.00 175.10 174.39 3n5m s LYS 273 N -2.71 1.77 0.49 4.82 2.47 -1.26 -5.01 119.74 120.31 3n5m s LYS 273 Ca 0.08 -1.75 -0.20 0.00 -1.56 0.00 0.00 55.97 52.54 3n5m s LYS 273 Cb -0.04 -3.24 -0.08 0.00 -1.46 0.00 0.00 37.83 33.01 3n5m s LYS 273 CO 0.02 -0.89 1.07 -2.14 0.16 0.00 0.00 175.35 173.57 3n5m s PRO 274 N 1.01 3.70 0.24 4.03 0.02 -1.26 -4.96 135.00 137.77 3n5m s PRO 274 Ca 0.06 1.47 -0.05 0.00 0.02 0.00 0.00 61.00 62.51 3n5m s PRO 274 Cb -0.20 -2.12 0.25 0.00 0.02 0.00 0.00 34.50 32.45 3n5m s PRO 274 CO -0.06 -0.54 1.76 -0.44 -0.33 0.00 0.00 177.00 177.39 3n5m h ASP 275 N 1.56 0.91 -3.66 2.53 3.32 -1.76 -3.45 116.42 115.87 3n5m h ASP 275 Ca -0.50 -0.20 -0.24 0.00 0.02 0.00 0.00 57.03 56.11 3n5m h ASP 275 Cb 1.23 -0.24 -0.30 0.00 0.22 0.00 0.00 39.33 40.25 3n5m h ASP 275 CO 0.59 0.91 -0.70 -0.63 -1.72 0.00 0.00 179.24 177.69 3n5m s ILE 276 N -5.18 -0.02 -0.07 0.35 1.01 -1.03 -1.45 121.20 114.80 3n5m s ILE 276 Ca -0.11 0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.64 3n5m s ILE 276 Cb 0.15 -0.06 0.01 0.00 0.01 0.00 0.00 42.46 42.56 3n5m s ILE 276 CO 0.83 0.03 -0.17 -0.63 0.00 0.00 0.00 174.94 175.00 3n5m s ILE 277 N 0.35 1.46 0.33 2.92 1.01 0.25 -0.71 121.20 126.82 3n5m s ILE 277 Ca -0.03 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.02 3n5m s ILE 277 Cb -0.04 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 3n5m s ILE 277 CO -0.01 0.42 0.16 0.42 0.00 0.00 0.00 174.94 175.93 3n5m s THR 278 N 0.44 3.17 0.00 2.92 -4.23 -0.86 -0.04 115.64 117.05 3n5m s THR 278 Ca -0.14 -1.65 0.00 0.00 -1.18 0.00 0.00 61.69 58.73 3n5m s THR 278 Cb -0.16 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.67 3n5m s THR 278 CO 0.05 -0.20 0.00 0.00 -0.54 0.00 0.00 174.62 173.93 3n5m n ALA 280 N -1.17 0.00 0.00 3.99 0.00 -1.26 -0.57 120.51 121.49 3n5m n ALA 280 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3n5m n ALA 280 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 3n5m n ALA 280 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3n5m n LYS 281 N 0.00 0.00 0.00 0.00 5.02 -1.26 -1.47 118.16 120.44 3n5m n LYS 281 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 3n5m n LYS 281 Cb 0.00 0.00 0.24 0.00 -0.02 0.00 0.00 35.03 35.25 3n5m n LYS 281 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3n5m n GLY 282 N 0.00 -0.79 0.34 0.72 0.00 -1.24 -2.62 105.19 101.60 3n5m n GLY 282 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 46.02 45.99 3n5m n GLY 282 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3n5m h ILE 283 N 0.00 1.05 -0.21 -0.61 2.10 -1.56 -1.79 117.51 116.50 3n5m h ILE 283 Ca 0.00 -0.35 0.00 0.00 1.08 0.00 0.00 64.86 65.59 3n5m h ILE 283 Cb 0.15 -0.06 0.00 0.00 -1.09 0.00 0.00 36.82 35.82 3n5m h ILE 283 CO 0.00 0.19 0.00 0.35 -1.08 0.00 0.00 178.15 177.61 3n5m n THR 284 N -4.59 0.39 -1.50 2.19 -2.24 -1.21 -4.56 114.28 102.77 3n5m n THR 284 Ca 0.13 -0.70 -0.17 0.00 -2.27 0.00 0.00 64.05 61.04 3n5m n THR 284 Cb 0.18 1.00 -0.07 0.00 -2.10 0.00 0.00 70.33 69.34 3n5m n THR 284 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3n5m n SER 285 N 0.92 -5.14 -0.10 3.42 7.64 -0.67 -2.01 113.62 117.68 3n5m n SER 285 Ca 0.12 0.43 -0.01 0.00 1.01 0.00 0.00 58.87 60.42 3n5m n SER 285 Cb 0.44 -4.16 -0.01 0.00 -1.01 0.00 0.00 64.21 59.47 3n5m n SER 285 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3n5m n ALA 286 N 1.32 -0.02 -0.17 -0.43 0.00 -1.08 -3.87 120.51 116.26 3n5m n ALA 286 Ca -0.17 0.02 -0.04 0.00 0.00 0.00 0.00 53.44 53.25 3n5m n ALA 286 Cb 0.58 -0.67 0.15 0.00 0.00 0.00 0.00 19.45 19.50 3n5m n ALA 286 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3n5m h TYR 287 N 0.00 0.96 -3.94 0.00 -1.99 -1.74 -3.45 116.97 106.81 3n5m h TYR 287 Ca -0.03 -0.09 -0.12 0.00 2.00 0.00 0.00 58.73 60.49 3n5m h TYR 287 Cb 0.42 -0.28 -0.17 0.00 2.00 0.00 0.00 36.73 38.70 3n5m h TYR 287 CO 0.25 0.79 -0.57 -0.51 -0.00 0.00 0.00 178.16 178.12 3n5m s LEU 288 N -9.41 2.00 0.07 3.88 1.43 -1.26 -5.14 118.68 110.25 3n5m s LEU 288 Ca -0.10 -0.68 -0.30 0.00 -1.03 0.00 0.00 54.13 52.02 3n5m s LEU 288 Cb 0.15 0.49 -0.05 0.00 0.03 0.00 0.00 46.19 46.81 3n5m s LEU 288 CO 0.81 -0.54 1.13 -2.84 0.23 0.00 0.00 176.35 175.14 3n5m s PRO 289 N -3.01 4.49 -0.25 1.29 0.02 -1.26 -4.72 135.00 131.56 3n5m s PRO 289 Ca -0.02 1.68 -0.26 0.00 0.02 0.00 0.00 61.00 62.42 3n5m s PRO 289 Cb 0.01 -3.36 0.12 0.00 0.02 0.00 0.00 34.50 31.30 3n5m s PRO 289 CO -0.06 -0.14 1.03 -1.17 -0.33 0.00 0.00 177.00 176.33 3n5m s LEU 290 N 0.78 -0.42 0.22 -5.54 2.96 -0.92 -4.76 118.68 111.00 3n5m s LEU 290 Ca 0.55 0.74 -0.07 0.00 -0.22 0.00 0.00 54.13 55.13 3n5m s LEU 290 Cb -0.27 1.86 -0.02 0.00 0.50 0.00 0.00 46.19 48.25 3n5m s LEU 290 CO 0.30 -0.19 0.31 -0.94 -1.32 0.00 0.00 176.35 174.50 3n5m s SER 291 N -0.09 0.03 -0.04 3.68 1.04 0.67 -4.37 113.70 114.62 3n5m s SER 291 Ca 0.02 -1.13 -0.13 0.00 0.48 0.00 0.00 55.95 55.19 3n5m s SER 291 Cb -0.04 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.58 3n5m s SER 291 CO -0.05 -0.99 0.28 0.00 0.98 0.00 0.00 173.24 173.47 3n5m s ALA 292 N -4.08 -0.71 -0.27 5.32 0.00 -1.26 -0.77 121.76 119.99 3n5m s ALA 292 Ca 0.29 0.42 0.02 0.00 0.00 0.00 0.00 51.96 52.69 3n5m s ALA 292 Cb 0.03 -0.09 0.06 0.00 0.00 0.00 0.00 23.12 23.11 3n5m s ALA 292 CO 0.10 -0.22 -0.09 0.99 0.00 0.00 0.00 175.76 176.54 3n5m s THR 293 N -0.89 2.38 -0.19 0.00 2.01 0.14 -4.37 115.64 114.72 3n5m s THR 293 Ca -0.10 -1.54 -0.13 0.00 0.31 0.00 0.00 61.69 60.23 3n5m s THR 293 Cb -0.05 -2.37 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 3n5m s THR 293 CO 0.03 -0.02 0.26 0.00 -0.69 0.00 0.00 174.62 174.20 3n5m s ALA 294 N 1.15 3.60 -0.05 7.40 0.00 0.94 -1.19 121.76 133.62 3n5m s ALA 294 Ca -0.07 -0.58 0.04 0.00 0.00 0.00 0.00 51.96 51.34 3n5m s ALA 294 Cb -0.20 -2.39 0.00 0.00 0.00 0.00 0.00 23.12 20.53 3n5m s ALA 294 CO -0.04 -0.03 -0.16 0.08 0.00 0.00 0.00 175.76 175.61 3n5m s VAL 295 N 0.73 1.37 0.37 0.00 1.01 -0.16 -0.58 120.40 123.13 3n5m s VAL 295 Ca 0.14 -0.66 -0.26 0.00 0.00 0.00 0.00 61.98 61.19 3n5m s VAL 295 Cb -0.13 -1.19 -0.12 0.00 0.00 0.00 0.00 36.38 34.94 3n5m s VAL 295 CO 0.04 0.40 1.11 0.29 0.00 0.00 0.00 175.10 176.94 3n5m n LYS 296 N 3.31 1.62 -0.31 2.72 5.02 -0.53 -0.48 118.16 129.51 3n5m n LYS 296 Ca -0.19 0.57 0.12 0.00 -2.02 0.00 0.00 58.31 56.79 3n5m n LYS 296 Cb 0.53 -2.10 0.29 0.00 -0.02 0.00 0.00 35.03 33.72 3n5m n LYS 296 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3n5m h ARG 297 N 1.98 0.49 0.00 1.97 2.43 -1.82 -0.98 114.38 118.44 3n5m h ARG 297 Ca -0.44 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 58.65 3n5m h ARG 297 Cb 1.32 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 3n5m h ARG 297 CO 0.60 0.32 -0.23 1.05 -1.51 0.00 0.00 179.97 180.20 3n5m h GLU 298 N 0.50 0.00 -0.06 0.20 9.09 -1.89 -1.95 114.58 120.46 3n5m h GLU 298 Ca 0.54 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.88 3n5m h GLU 298 Cb 0.95 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.05 3n5m h GLU 298 CO -0.47 0.23 -0.21 0.82 0.05 0.00 0.00 179.01 179.42 3n5m h ILE 299 N 0.00 1.43 -0.66 -1.06 2.04 -1.54 -3.24 117.51 114.49 3n5m h ILE 299 Ca -0.00 -1.61 0.12 0.00 1.00 0.00 0.00 64.86 64.38 3n5m h ILE 299 Cb 0.50 2.31 -0.04 0.00 -0.74 0.00 0.00 36.82 38.85 3n5m h ILE 299 CO 0.03 0.45 0.45 0.22 0.00 0.00 0.00 178.15 179.30 3n5m h TYR 300 N -0.25 0.42 -0.06 1.37 3.20 -1.13 -1.71 116.97 118.80 3n5m h TYR 300 Ca -0.01 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.89 3n5m h TYR 300 Cb 0.84 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.98 3n5m h TYR 300 CO 0.13 0.18 0.06 0.93 -1.64 0.00 0.00 178.16 177.82 3n5m h GLU 301 N 0.38 0.00 0.00 1.82 4.39 -1.39 -1.62 114.58 118.16 3n5m h GLU 301 Ca 0.32 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.02 3n5m h GLU 301 Cb 0.72 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 3n5m h GLU 301 CO -0.09 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.76 3n5m n ALA 302 N -2.38 1.90 -0.86 3.43 0.00 -0.64 -3.14 120.51 118.81 3n5m n ALA 302 Ca -0.01 -0.07 0.08 0.00 0.00 0.00 0.00 53.44 53.43 3n5m n ALA 302 Cb 0.16 -1.30 0.27 0.00 0.00 0.00 0.00 19.45 18.58 3n5m n ALA 302 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3n5m n PHE 303 N -1.42 1.06 0.89 0.00 3.72 -0.61 -4.59 117.46 116.50 3n5m n PHE 303 Ca 0.06 -0.80 0.10 0.00 -0.05 0.00 0.00 57.45 56.77 3n5m n PHE 303 Cb 0.19 -0.30 0.07 0.00 -0.94 0.00 0.00 39.48 38.50 3n5m n PHE 303 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3n5m n LYS 304 N -0.15 1.82 -1.09 -1.08 5.02 -1.19 -4.30 118.16 117.20 3n5m n LYS 304 Ca 0.21 -1.57 -0.29 0.00 -2.02 0.00 0.00 58.31 54.65 3n5m n LYS 304 Cb 0.87 -1.41 0.18 0.00 -0.02 0.00 0.00 35.03 34.66 3n5m n LYS 304 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3n5m s GLY 305 N -1.89 1.57 0.00 0.72 0.00 -1.26 -4.97 107.32 101.48 3n5m s GLY 305 Ca 0.23 -0.30 0.25 0.00 0.00 0.00 0.00 44.72 44.89 3n5m s GLY 305 CO 0.32 0.32 1.36 0.28 0.00 0.00 0.00 173.10 175.38 3n5m n LYS 306 N -4.26 0.03 -1.68 2.90 4.76 -1.26 -4.76 118.16 113.88 3n5m n LYS 306 Ca 0.05 -0.02 -0.37 0.00 -2.87 0.00 0.00 58.31 55.10 3n5m n LYS 306 Cb 0.57 -1.50 0.06 0.00 -1.84 0.00 0.00 35.03 32.32 3n5m n LYS 306 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3n5m n GLY 307 N 1.50 0.21 0.32 0.72 0.00 -1.26 -4.92 105.19 101.76 3n5m n GLY 307 Ca 0.06 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.04 3n5m n GLY 307 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3n5m h GLU 308 N 0.50 0.52 -0.30 1.61 4.81 -2.02 -2.67 114.58 117.03 3n5m h GLU 308 Ca -0.50 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 3n5m h GLU 308 Cb 1.35 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.61 3n5m h GLU 308 CO 0.52 0.34 0.00 0.66 -0.73 0.00 0.00 179.01 179.80 3n5m n TYR 309 N -4.94 0.60 0.45 0.92 4.01 -1.26 -4.68 117.16 112.26 3n5m n TYR 309 Ca 0.21 -0.63 0.13 0.00 -0.16 0.00 0.00 57.90 57.45 3n5m n TYR 309 Cb 0.58 -0.13 0.35 0.00 -0.31 0.00 0.00 39.34 39.84 3n5m n TYR 309 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 3n5m h GLU 310 N 1.85 0.00 -6.53 -0.72 5.08 -1.79 -3.45 114.58 109.01 3n5m h GLU 310 Ca 0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 3n5m h GLU 310 Cb 0.96 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.23 3n5m h GLU 310 CO 0.07 0.00 -0.20 -0.59 -1.00 0.00 0.00 179.01 177.29 3n5m s PHE 311 N -3.19 3.12 -0.57 4.33 -0.12 -1.26 -4.41 117.98 115.88 3n5m s PHE 311 Ca 0.08 -0.02 -0.28 0.00 -0.05 0.00 0.00 56.93 56.67 3n5m s PHE 311 Cb 0.09 -2.22 0.01 0.00 -0.63 0.00 0.00 43.02 40.27 3n5m s PHE 311 CO 0.60 -0.26 1.53 0.12 -0.05 0.00 0.00 175.22 177.16 3n5m s PHE 312 N -2.40 2.11 -1.32 3.49 5.36 -1.26 -4.89 117.98 119.07 3n5m s PHE 312 Ca 0.48 0.50 -0.10 0.00 -0.96 0.00 0.00 56.93 56.85 3n5m s PHE 312 Cb -0.10 -4.33 0.14 0.00 -0.34 0.00 0.00 43.02 38.39 3n5m s PHE 312 CO 0.35 -2.14 1.95 0.54 -1.46 0.00 0.00 175.22 174.46 3n5m n ARG 313 N 8.83 3.47 -3.70 10.12 1.74 -1.26 -4.86 116.66 131.00 3n5m n ARG 313 Ca 0.14 -3.34 -0.16 0.00 -0.77 0.00 0.00 57.85 53.72 3n5m n ARG 313 Cb 0.50 -3.00 -0.16 0.00 -1.02 0.00 0.00 32.46 28.78 3n5m n ARG 313 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3n5m s HIS 314 N 0.95 -0.10 -0.10 -1.55 2.46 -1.26 -5.14 115.29 110.55 3n5m s HIS 314 Ca 0.41 0.44 0.03 0.00 0.47 0.00 0.00 55.06 56.41 3n5m s HIS 314 Cb 0.11 -0.26 0.01 0.00 -0.13 0.00 0.00 32.58 32.30 3n5m s HIS 314 CO -0.01 -0.20 -0.20 -1.50 -2.47 0.00 0.00 174.74 170.35 3n5m s ILE 315 N 1.82 1.75 -0.31 0.89 1.10 -1.26 -5.04 121.20 120.14 3n5m s ILE 315 Ca -0.01 -0.83 0.01 0.00 -0.51 0.00 0.00 60.65 59.31 3n5m s ILE 315 Cb -0.12 -1.54 0.07 0.00 0.15 0.00 0.00 42.46 41.02 3n5m s ILE 315 CO -0.05 0.49 0.01 0.21 -2.11 0.00 0.00 174.94 173.49 3n5m s ASN 316 N 0.54 4.78 0.16 4.50 3.84 -1.26 -5.04 114.94 122.45 3n5m s ASN 316 Ca -0.15 -1.65 -0.22 0.00 0.21 0.00 0.00 52.86 51.04 3n5m s ASN 316 Cb -0.17 -1.66 0.05 0.00 -0.55 0.00 0.00 41.25 38.92 3n5m s ASN 316 CO 0.06 -0.31 1.62 0.74 -2.79 0.00 0.00 177.10 176.42 3n5m h THR 317 N 6.58 0.35 0.00 -5.21 2.02 -1.99 -3.07 112.91 111.60 3n5m h THR 317 Ca -0.15 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.03 3n5m h THR 317 Cb 1.04 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3n5m h THR 317 CO 0.53 0.00 -1.30 0.49 0.37 0.00 0.00 175.52 175.62 3n5m n PHE 318 N -5.39 0.67 -1.65 3.16 3.72 -1.26 -4.90 117.46 111.81 3n5m n PHE 318 Ca 0.00 0.20 -0.47 0.00 -0.05 0.00 0.00 57.45 57.13 3n5m n PHE 318 Cb 0.30 -0.82 -0.04 0.00 -0.94 0.00 0.00 39.48 37.99 3n5m n PHE 318 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n5m n GLY 319 N 1.21 0.86 1.78 1.37 0.00 -1.16 -2.02 105.19 107.22 3n5m n GLY 319 Ca -0.01 0.62 -0.02 0.00 0.00 0.00 0.00 46.02 46.61 3n5m n GLY 319 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n5m n GLY 320 N 2.87 0.67 3.69 -0.02 0.00 -1.25 -4.75 105.19 106.40 3n5m n GLY 320 Ca 0.16 -0.68 -0.44 0.00 0.00 0.00 0.00 46.02 45.06 3n5m n GLY 320 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3n5m n ASN 321 N 1.33 3.09 -0.05 1.61 2.85 -0.86 -4.80 115.26 118.43 3n5m n ASN 321 Ca -0.01 1.15 -0.08 0.00 -0.11 0.00 0.00 54.58 55.53 3n5m n ASN 321 Cb 0.51 -1.48 -0.02 0.00 1.24 0.00 0.00 39.78 40.03 3n5m n ASN 321 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3n5m h PRO 322 N 4.32 0.01 -0.94 1.20 0.11 -1.88 -0.75 132.00 134.09 3n5m h PRO 322 Ca -0.46 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 3n5m h PRO 322 Cb 1.26 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.32 3n5m h PRO 322 CO 0.76 0.01 0.58 0.00 -0.21 0.00 0.00 178.00 179.14 3n5m h ALA 323 N 1.22 1.19 -0.43 -0.75 0.00 -1.84 -0.99 119.26 117.67 3n5m h ALA 323 Ca 0.11 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 3n5m h ALA 323 Cb 0.16 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3n5m h ALA 323 CO -0.23 0.63 -0.17 0.00 0.00 0.00 0.00 179.25 179.48 3n5m h ALA 324 N 1.32 0.88 -0.31 0.00 0.00 -1.80 -0.42 119.26 118.94 3n5m h ALA 324 Ca 0.34 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3n5m h ALA 324 Cb -0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3n5m h ALA 324 CO -0.07 0.63 -0.12 0.00 0.00 0.00 0.00 179.25 179.70 3n5m h ALA 326 N 0.78 0.80 -0.56 0.00 0.00 -1.05 -1.11 119.26 118.12 3n5m h ALA 326 Ca 0.07 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3n5m h ALA 326 Cb 0.63 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3n5m h ALA 326 CO 0.04 0.36 0.17 1.25 0.00 0.00 0.00 179.25 181.07 3n5m h LEU 327 N 0.85 0.82 -0.74 0.00 6.46 -0.95 -2.85 115.31 118.90 3n5m h LEU 327 Ca 0.21 -0.21 0.02 0.00 -0.12 0.00 0.00 57.88 57.79 3n5m h LEU 327 Cb 0.11 -0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 39.78 3n5m h LEU 327 CO -0.03 0.81 0.48 0.00 -0.62 0.00 0.00 178.44 179.08 3n5m h ALA 328 N 1.04 0.96 -0.67 1.25 0.00 -0.25 0.10 119.26 121.68 3n5m h ALA 328 Ca 0.18 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.12 3n5m h ALA 328 Cb 0.29 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 3n5m h ALA 328 CO -0.00 0.30 0.37 -0.07 0.00 0.00 0.00 179.25 179.84 3n5m h LEU 329 N 0.95 0.54 -0.63 0.00 3.38 -1.09 0.04 115.31 118.50 3n5m h LEU 329 Ca 0.29 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.16 3n5m h LEU 329 Cb -0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3n5m h LEU 329 CO -0.09 0.35 -0.28 0.50 0.09 0.00 0.00 178.44 179.01 3n5m h LYS 330 N 0.68 0.78 -0.71 1.13 1.63 -1.17 -2.04 116.57 116.87 3n5m h LYS 330 Ca 0.30 -0.34 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 3n5m h LYS 330 Cb 0.20 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.78 3n5m h LYS 330 CO -0.19 0.96 0.46 -0.97 -3.45 0.00 0.00 179.45 176.26 3n5m h ASN 331 N 0.66 0.83 -0.43 4.20 -0.73 -0.35 -0.86 115.58 118.90 3n5m h ASN 331 Ca 0.08 -0.03 -0.10 0.00 1.87 0.00 0.00 56.30 58.12 3n5m h ASN 331 Cb 0.80 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 39.17 3n5m h ASN 331 CO 0.07 0.61 -0.10 -0.07 -0.37 0.00 0.00 177.43 177.57 3n5m h LEU 332 N 0.96 0.88 -0.88 0.34 3.38 -0.87 -1.74 115.31 117.39 3n5m h LEU 332 Ca 0.26 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 3n5m h LEU 332 Cb -0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.39 3n5m h LEU 332 CO -0.05 1.00 0.12 -0.08 0.09 0.00 0.00 178.44 179.51 3n5m h GLU 333 N 0.80 0.95 -0.21 1.13 4.81 -1.03 -2.20 114.58 118.83 3n5m h GLU 333 Ca 0.13 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 3n5m h GLU 333 Cb 0.61 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3n5m h GLU 333 CO 0.04 0.87 0.10 0.82 -0.73 0.00 0.00 179.01 180.11 3n5m h ILE 334 N 0.91 1.14 -0.81 2.32 2.04 -0.99 0.59 117.51 122.70 3n5m h ILE 334 Ca 0.19 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.68 3n5m h ILE 334 Cb 0.36 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 3n5m h ILE 334 CO 0.00 0.13 0.52 0.40 0.00 0.00 0.00 178.15 179.21 3n5m h ILE 335 N 0.22 1.15 0.23 -0.67 2.04 -1.17 -0.75 117.51 118.55 3n5m h ILE 335 Ca 0.07 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 3n5m h ILE 335 Cb 0.12 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 3n5m h ILE 335 CO -0.01 0.19 -0.11 -0.08 0.00 0.00 0.00 178.15 178.14 3n5m h GLU 336 N 1.04 -0.29 -0.70 2.37 4.81 -1.29 -1.21 114.58 119.30 3n5m h GLU 336 Ca 0.31 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 3n5m h GLU 336 Cb -0.04 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 3n5m h GLU 336 CO -0.10 0.08 0.37 -0.91 -0.73 0.00 0.00 179.01 177.71 3n5m h ASN 337 N -0.75 0.87 -0.14 1.04 2.35 -0.76 -2.41 115.58 115.78 3n5m h ASN 337 Ca -0.03 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 3n5m h ASN 337 Cb 0.50 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.65 3n5m h ASN 337 CO 0.05 0.72 0.00 -0.62 -1.65 0.00 0.00 177.43 175.93 3n5m n GLU 338 N -4.36 1.63 -3.08 0.81 1.02 -0.30 -4.92 120.64 111.45 3n5m n GLU 338 Ca 0.07 -0.95 -0.23 0.00 -0.02 0.00 0.00 57.16 56.03 3n5m n GLU 338 Cb 0.11 -1.39 0.04 0.00 -0.02 0.00 0.00 31.44 30.18 3n5m n GLU 338 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3n5m n ASN 339 N 0.17 -6.10 -0.09 1.62 5.15 -0.91 -4.89 115.26 110.22 3n5m n ASN 339 Ca 0.16 -0.31 -0.02 0.00 -0.60 0.00 0.00 54.58 53.81 3n5m n ASN 339 Cb 0.30 -4.92 0.24 0.00 -0.53 0.00 0.00 39.78 34.86 3n5m n ASN 339 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3n5m h LEU 340 N -1.48 0.68 -0.47 1.20 3.38 -1.48 -0.82 115.31 116.31 3n5m h LEU 340 Ca -0.53 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.31 3n5m h LEU 340 Cb 1.37 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 3n5m h LEU 340 CO 0.57 0.67 0.24 0.40 0.09 0.00 0.00 178.44 180.41 3n5m h ILE 341 N 0.71 1.18 -0.69 1.22 2.04 -1.86 0.10 117.51 120.21 3n5m h ILE 341 Ca 0.16 -0.49 -0.08 0.00 1.00 0.00 0.00 64.86 65.46 3n5m h ILE 341 Cb 0.27 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 3n5m h ILE 341 CO -0.00 0.19 0.14 -0.33 0.00 0.00 0.00 178.15 178.15 3n5m h GLU 342 N 0.61 1.13 -0.66 2.37 3.07 -1.77 -2.62 114.58 116.71 3n5m h GLU 342 Ca 0.16 -0.29 -0.04 0.00 -0.50 0.00 0.00 59.36 58.70 3n5m h GLU 342 Cb 0.09 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 27.83 3n5m h GLU 342 CO -0.02 1.01 0.26 0.00 -1.40 0.00 0.00 179.01 178.86 3n5m h ARG 343 N 1.06 0.96 -0.49 2.33 2.47 -0.68 -0.81 114.38 119.21 3n5m h ARG 343 Ca 0.21 -0.16 -0.02 0.00 -1.26 0.00 0.00 59.98 58.76 3n5m h ARG 343 Cb 0.41 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.55 3n5m h ARG 343 CO 0.01 0.78 0.25 1.03 0.56 0.00 0.00 179.97 182.60 3n5m h SER 344 N 0.94 0.64 -0.38 7.04 0.87 -0.55 -2.84 113.55 119.28 3n5m h SER 344 Ca 0.22 -0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.63 3n5m h SER 344 Cb 0.18 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 3n5m h SER 344 CO -0.02 0.58 0.13 0.00 -0.53 0.00 0.00 176.83 176.99 3n5m h ALA 345 N 1.09 0.49 0.00 6.23 0.00 -1.09 0.14 119.26 126.12 3n5m h ALA 345 Ca 0.17 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3n5m h ALA 345 Cb 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3n5m h ALA 345 CO -0.02 0.12 0.00 1.04 0.00 0.00 0.00 179.25 180.39 3n5m n GLN 346 N -4.63 0.44 0.00 0.00 6.02 -0.35 -1.71 117.38 117.15 3n5m n GLN 346 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 3n5m n GLN 346 Cb 0.17 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.24 3n5m n GLN 346 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3n5m n GLY 348 N 0.24 0.00 0.23 1.08 0.00 0.49 -2.11 105.19 105.12 3n5m n GLY 348 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3n5m n GLY 348 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3n5m h SER 349 N 0.00 0.71 -0.24 1.61 0.02 -1.54 -1.21 113.55 112.91 3n5m h SER 349 Ca 0.00 -0.18 0.01 0.00 -0.84 0.00 0.00 61.79 60.78 3n5m h SER 349 Cb 0.00 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 3n5m h SER 349 CO 0.00 0.70 0.13 0.25 -1.14 0.00 0.00 176.83 176.77 3n5m h LEU 350 N 0.68 0.21 -0.41 5.07 5.85 -1.69 -1.57 115.31 123.45 3n5m h LEU 350 Ca 0.17 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.90 3n5m h LEU 350 Cb 0.23 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3n5m h LEU 350 CO -0.01 0.15 0.25 0.25 -0.34 0.00 0.00 178.44 178.74 3n5m h LEU 351 N 0.27 0.41 -0.47 2.25 5.85 -1.77 -0.92 115.31 120.93 3n5m h LEU 351 Ca 0.09 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 3n5m h LEU 351 Cb 0.01 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 3n5m h LEU 351 CO -0.05 0.30 0.23 0.25 -0.34 0.00 0.00 178.44 178.83 3n5m h LEU 352 N 0.50 0.62 -0.13 2.25 5.85 -0.88 -1.77 115.31 121.74 3n5m h LEU 352 Ca 0.16 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 3n5m h LEU 352 Cb -0.01 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.86 3n5m h LEU 352 CO -0.06 0.57 -0.20 1.05 -0.34 0.00 0.00 178.44 179.46 3n5m h GLU 353 N 0.62 0.37 -0.56 1.25 4.11 -1.13 -2.58 114.58 116.65 3n5m h GLU 353 Ca 0.16 -0.22 -0.06 0.00 0.07 0.00 0.00 59.36 59.31 3n5m h GLU 353 Cb 0.11 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 3n5m h GLU 353 CO -0.02 0.80 0.12 1.96 0.07 0.00 0.00 179.01 181.94 3n5m h GLN 354 N -0.03 0.88 -0.66 1.06 1.08 -1.13 -2.10 115.11 114.21 3n5m h GLN 354 Ca 0.01 -0.19 -0.02 0.00 -1.45 0.00 0.00 58.65 57.00 3n5m h GLN 354 Cb 0.77 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 28.04 3n5m h GLN 354 CO 0.05 0.80 0.34 -0.07 -0.95 0.00 0.00 178.83 178.99 3n5m h LEU 355 N 0.84 0.84 -0.63 1.46 3.38 -1.23 0.11 115.31 120.09 3n5m h LEU 355 Ca 0.18 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 3n5m h LEU 355 Cb 0.33 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3n5m h LEU 355 CO 0.00 0.71 0.28 0.11 0.09 0.00 0.00 178.44 179.63 3n5m h LYS 356 N 0.90 0.92 -0.24 1.13 1.57 -1.07 0.14 116.57 119.92 3n5m h LYS 356 Ca 0.23 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 3n5m h LYS 356 Cb 0.08 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 3n5m h LYS 356 CO -0.03 0.75 0.06 1.49 -0.57 0.00 0.00 179.45 181.16 3n5m h GLU 357 N 0.87 0.38 -0.20 3.15 4.81 -1.01 0.96 114.58 123.54 3n5m h GLU 357 Ca 0.21 -0.09 -0.13 0.00 -0.13 0.00 0.00 59.36 59.22 3n5m h GLU 357 Cb 0.16 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.49 3n5m h GLU 357 CO -0.02 0.47 -0.38 0.93 -0.73 0.00 0.00 179.01 179.28 3n5m h GLU 358 N 0.21 0.62 0.00 1.92 4.39 -0.51 -3.41 114.58 117.80 3n5m h GLU 358 Ca 0.08 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.38 3n5m h GLU 358 Cb 0.26 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 3n5m h GLU 358 CO -0.00 1.01 0.00 0.44 -1.16 0.00 0.00 179.01 179.30 3n5m n ILE 359 N -4.26 0.00 -0.11 3.13 -5.35 0.46 -4.80 119.36 108.42 3n5m n ILE 359 Ca -0.06 -0.40 0.15 0.00 -0.27 0.00 0.00 62.75 62.17 3n5m n ILE 359 Cb 0.53 1.12 0.52 0.00 -1.74 0.00 0.00 39.64 40.07 3n5m n ILE 359 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3n5m h GLY 360 N 0.00 0.57 0.36 3.28 0.00 -0.61 -0.34 103.07 106.33 3n5m h GLY 360 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 3n5m h GLY 360 CO 0.00 0.07 -0.06 1.18 0.00 0.00 0.00 176.54 177.72 3n5m n GLU 361 N -4.46 1.12 -1.73 4.80 1.02 -1.26 -4.86 120.64 115.27 3n5m n GLU 361 Ca 0.12 -0.47 -0.42 0.00 -0.02 0.00 0.00 57.16 56.37 3n5m n GLU 361 Cb 0.48 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.38 3n5m n GLU 361 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 3n5m n HIS 362 N -0.53 2.78 0.24 -0.32 -0.00 -0.14 -4.87 115.22 112.39 3n5m n HIS 362 Ca 0.18 0.12 0.13 0.00 0.46 0.00 0.00 57.72 58.61 3n5m n HIS 362 Cb 0.28 -2.64 0.66 0.00 -0.12 0.00 0.00 29.99 28.16 3n5m n HIS 362 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3n5m h PRO 363 N 6.02 0.00 -0.37 1.57 0.13 -1.89 -2.26 132.00 135.20 3n5m h PRO 363 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3n5m h PRO 363 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3n5m h PRO 363 CO 0.90 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.95 3n5m n LEU 364 N -2.40 3.03 -4.43 1.56 4.77 -1.26 -4.50 117.00 113.76 3n5m n LEU 364 Ca -0.01 -1.80 -0.44 0.00 -0.03 0.00 0.00 56.01 53.73 3n5m n LEU 364 Cb 0.09 -0.25 -0.07 0.00 -2.33 0.00 0.00 43.42 40.87 3n5m n LEU 364 CO 0.14 0.73 0.18 -0.69 -1.33 0.00 0.00 177.39 176.41 3n5m s VAL 365 N -1.04 5.05 0.04 4.08 1.01 -0.85 -0.88 120.40 127.81 3n5m s VAL 365 Ca 0.28 -0.71 -0.15 0.00 0.00 0.00 0.00 61.98 61.40 3n5m s VAL 365 Cb 0.15 -4.19 -0.35 0.00 0.00 0.00 0.00 36.38 31.99 3n5m s VAL 365 CO 0.20 -0.66 1.02 1.23 0.00 0.00 0.00 175.10 176.90 3n5m h GLY 366 N 9.23 0.62 -4.74 4.51 0.00 -0.80 -3.46 103.07 108.43 3n5m h GLY 366 Ca -0.28 -1.53 -0.06 0.00 0.00 0.00 0.00 47.33 45.46 3n5m h GLY 366 CO 0.91 1.34 0.08 -0.35 0.00 0.00 0.00 176.54 178.52 3n5m s ASP 367 N -7.55 -0.66 -0.12 0.19 2.15 -1.12 -5.00 116.67 104.57 3n5m s ASP 367 Ca -0.09 1.11 0.01 0.00 0.43 0.00 0.00 52.55 54.02 3n5m s ASP 367 Cb 0.04 1.09 0.02 0.00 -0.30 0.00 0.00 42.92 43.77 3n5m s ASP 367 CO 0.94 -0.34 -0.16 -0.63 -0.17 0.00 0.00 175.17 174.81 3n5m s ILE 368 N -0.14 1.57 0.08 4.11 1.01 -1.26 -0.50 121.20 126.06 3n5m s ILE 368 Ca -0.04 -0.67 -0.10 0.00 0.00 0.00 0.00 60.65 59.84 3n5m s ILE 368 Cb -0.03 -1.43 0.00 0.00 0.01 0.00 0.00 42.46 41.01 3n5m s ILE 368 CO 0.04 0.46 0.22 0.00 0.00 0.00 0.00 174.94 175.65 3n5m s ARG 369 N 1.07 0.83 0.00 2.79 1.70 -0.56 -5.01 118.95 119.77 3n5m s ARG 369 Ca -0.04 -0.83 0.00 0.00 -0.47 0.00 0.00 55.73 54.38 3n5m s ARG 369 Cb -0.15 0.34 0.00 0.00 -0.57 0.00 0.00 34.95 34.58 3n5m s ARG 369 CO -0.03 -0.27 0.00 0.41 -1.08 0.00 0.00 175.30 174.33 3n5m n GLY 370 N 0.12 -0.79 3.44 3.88 0.00 -1.26 0.07 105.19 110.65 3n5m n GLY 370 Ca -0.16 -1.10 -0.06 0.00 0.00 0.00 0.00 46.02 44.69 3n5m n GLY 370 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n5m s LYS 371 N -2.00 0.47 3.15 1.61 2.20 -0.68 -5.00 119.74 119.50 3n5m s LYS 371 Ca 0.00 1.15 0.00 0.00 -0.36 0.00 0.00 55.97 56.76 3n5m s LYS 371 Cb 0.00 0.40 0.00 0.00 -1.51 0.00 0.00 37.83 36.72 3n5m s LYS 371 CO 0.00 -0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.20 3n5m n GLY 372 N 5.05 0.50 2.38 5.54 0.00 -1.10 -3.63 105.19 113.92 3n5m n GLY 372 Ca -0.14 -0.86 -0.39 0.00 0.00 0.00 0.00 46.02 44.63 3n5m n GLY 372 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n5m n LEU 373 N 0.00 8.49 -3.36 0.99 4.77 -0.87 -4.30 117.00 122.72 3n5m n LEU 373 Ca 0.00 -4.56 -0.12 0.00 -0.03 0.00 0.00 56.01 51.30 3n5m n LEU 373 Cb 0.00 -1.49 -0.08 0.00 -2.33 0.00 0.00 43.42 39.52 3n5m n LEU 373 CO 0.00 2.06 -0.10 -0.22 -1.33 0.00 0.00 177.39 177.80 3n5m s LEU 374 N -0.68 -0.54 -0.01 2.23 2.96 -1.24 -4.11 118.68 117.30 3n5m s LEU 374 Ca 0.64 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 54.29 3n5m s LEU 374 Cb 0.18 0.89 0.01 0.00 0.50 0.00 0.00 46.19 47.77 3n5m s LEU 374 CO -0.07 -0.34 -0.03 -0.69 -1.32 0.00 0.00 176.35 173.90 3n5m s VAL 375 N 2.48 0.26 -0.05 1.68 1.01 -0.24 -1.68 120.40 123.85 3n5m s VAL 375 Ca 0.10 -0.09 0.06 0.00 0.00 0.00 0.00 61.98 62.05 3n5m s VAL 375 Cb -0.14 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 3n5m s VAL 375 CO -0.25 0.10 -0.24 -0.83 0.00 0.00 0.00 175.10 173.88 3n5m s GLY 376 N 0.21 1.25 -0.30 4.51 0.00 0.11 -0.90 107.32 112.20 3n5m s GLY 376 Ca -0.02 -1.02 0.01 0.00 0.00 0.00 0.00 44.72 43.69 3n5m s GLY 376 CO -0.00 -0.65 -0.01 -0.42 0.00 0.00 0.00 173.10 172.02 3n5m s ILE 377 N -0.19 2.65 -0.26 0.90 1.09 -0.25 -1.49 121.20 123.64 3n5m s ILE 377 Ca -0.02 -1.67 -0.24 0.00 -1.10 0.00 0.00 60.65 57.62 3n5m s ILE 377 Cb -0.13 -2.62 -0.01 0.00 -1.06 0.00 0.00 42.46 38.64 3n5m s ILE 377 CO 0.03 -0.21 0.79 -0.70 -0.10 0.00 0.00 174.94 174.75 3n5m s GLU 378 N 1.14 4.13 -0.12 2.79 2.12 0.34 -1.48 118.70 127.62 3n5m s GLU 378 Ca -0.03 0.81 -0.10 0.00 0.36 0.00 0.00 54.97 56.01 3n5m s GLU 378 Cb -0.20 -3.66 -0.05 0.00 0.26 0.00 0.00 34.13 30.48 3n5m s GLU 378 CO -0.04 -0.53 0.21 -0.51 -0.54 0.00 0.00 175.26 173.85 3n5m s LEU 379 N 2.81 4.36 0.06 2.70 1.43 -0.18 -0.08 118.68 129.77 3n5m s LEU 379 Ca 0.33 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.98 3n5m s LEU 379 Cb -0.15 -2.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 3n5m s LEU 379 CO 0.09 0.31 -0.07 0.68 0.23 0.00 0.00 176.35 177.58 3n5m s VAL 380 N -0.61 0.59 0.08 -1.59 -7.23 -0.05 -1.83 120.40 109.75 3n5m s VAL 380 Ca 0.16 -1.33 0.17 0.00 -1.81 0.00 0.00 61.98 59.16 3n5m s VAL 380 Cb -0.13 -0.93 0.09 0.00 0.56 0.00 0.00 36.38 35.97 3n5m s VAL 380 CO 0.05 -0.53 1.62 0.78 -0.31 0.00 0.00 175.10 176.72 3n5m h ASN 381 N 4.05 0.00 -2.78 4.85 2.35 -0.91 -3.41 115.58 119.73 3n5m h ASN 381 Ca -0.36 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.27 3n5m h ASN 381 Cb 1.19 0.00 -0.28 0.00 0.05 0.00 0.00 38.32 39.28 3n5m h ASN 381 CO 0.48 0.46 -0.38 -0.62 -1.65 0.00 0.00 177.43 175.71 3n5m s ASP 382 N -6.47 -0.22 0.52 5.81 2.15 -1.26 -4.95 116.67 112.25 3n5m s ASP 382 Ca 0.01 0.89 0.29 0.00 0.43 0.00 0.00 52.55 54.16 3n5m s ASP 382 Cb 0.10 1.07 1.38 0.00 -0.30 0.00 0.00 42.92 45.16 3n5m s ASP 382 CO 0.71 -0.22 2.02 0.11 -0.17 0.00 0.00 175.17 177.62 3n5m h LYS 383 N 7.90 0.00 0.08 4.34 1.57 -1.87 0.87 116.57 129.45 3n5m h LYS 383 Ca -0.22 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.46 3n5m h LYS 383 Cb 1.13 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.45 3n5m h LYS 383 CO 0.17 0.12 -0.48 0.93 -0.57 0.00 0.00 179.45 179.63 3n5m h GLU 384 N 0.00 0.17 0.00 3.15 4.39 -1.97 -3.35 114.58 116.96 3n5m h GLU 384 Ca -0.00 -0.28 -0.07 0.00 0.34 0.00 0.00 59.36 59.34 3n5m h GLU 384 Cb 0.44 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 3n5m h GLU 384 CO 0.02 1.14 -0.59 1.79 -1.16 0.00 0.00 179.01 180.20 3n5m h THR 385 N -0.65 0.44 -0.61 1.13 1.35 -1.99 -3.47 112.91 109.11 3n5m h THR 385 Ca -0.09 -1.67 -0.25 0.00 -0.55 0.00 0.00 66.41 63.85 3n5m h THR 385 Cb 1.36 2.11 -0.10 0.00 -1.73 0.00 0.00 68.15 69.79 3n5m h THR 385 CO 0.08 0.25 -0.23 0.29 -0.25 0.00 0.00 175.52 175.66 3n5m n LYS 386 N -3.05 -0.87 -1.70 4.72 5.02 0.29 -4.96 118.16 117.62 3n5m n LYS 386 Ca 0.00 0.93 -0.42 0.00 -2.02 0.00 0.00 58.31 56.81 3n5m n LYS 386 Cb 0.67 -4.96 -0.03 0.00 -0.02 0.00 0.00 35.03 30.68 3n5m n LYS 386 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3n5m n GLU 387 N -2.63 2.80 -1.62 1.97 2.13 -1.23 -4.89 120.64 117.18 3n5m n GLU 387 Ca -0.12 1.02 -0.42 0.00 0.66 0.00 0.00 57.16 58.29 3n5m n GLU 387 Cb 0.41 -2.90 0.00 0.00 0.27 0.00 0.00 31.44 29.22 3n5m n GLU 387 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 3n5m n PRO 388 N 5.30 1.44 -1.44 5.31 -0.02 -1.26 -0.44 135.00 143.88 3n5m n PRO 388 Ca 0.18 0.51 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 3n5m n PRO 388 Cb 0.37 -2.03 0.08 0.00 -0.02 0.00 0.00 33.50 31.90 3n5m n PRO 388 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3n5m s ILE 389 N -1.22 2.83 0.46 4.25 2.07 -0.76 -4.15 121.20 124.69 3n5m s ILE 389 Ca 0.61 0.36 -0.25 0.00 -1.41 0.00 0.00 60.65 59.96 3n5m s ILE 389 Cb -0.58 -2.82 -0.08 0.00 0.13 0.00 0.00 42.46 39.10 3n5m s ILE 389 CO 0.58 -0.27 1.37 0.47 -1.91 0.00 0.00 174.94 175.18 3n5m n ASP 390 N -2.93 2.94 -0.29 4.50 9.92 -1.26 -4.84 116.55 124.60 3n5m n ASP 390 Ca 0.11 1.08 -0.06 0.00 -0.53 0.00 0.00 54.79 55.40 3n5m n ASP 390 Cb 0.52 -1.57 0.07 0.00 -0.64 0.00 0.00 41.12 39.50 3n5m n ASP 390 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 3n5m h ASN 391 N 2.04 1.10 -0.62 -2.24 -0.73 -1.96 -2.50 115.58 110.67 3n5m h ASN 391 Ca -0.50 -0.18 -0.01 0.00 1.87 0.00 0.00 56.30 57.48 3n5m h ASN 391 Cb 1.28 -0.29 -0.03 0.00 0.27 0.00 0.00 38.32 39.56 3n5m h ASN 391 CO 0.60 0.98 0.35 0.44 -0.37 0.00 0.00 177.43 179.43 3n5m h ASP 392 N 1.15 0.78 0.11 1.15 5.19 -1.98 -1.93 116.42 120.90 3n5m h ASP 392 Ca 0.26 -0.06 -0.01 0.00 -0.62 0.00 0.00 57.03 56.61 3n5m h ASP 392 Cb 0.24 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.55 3n5m h ASP 392 CO -0.02 0.63 -0.05 0.11 -3.12 0.00 0.00 179.24 176.79 3n5m h LYS 393 N 0.89 -0.14 -0.52 3.56 1.57 -1.82 -0.46 116.57 119.65 3n5m h LYS 393 Ca 0.23 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 3n5m h LYS 393 Cb 0.02 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3n5m h LYS 393 CO -0.04 0.10 0.04 0.97 -0.57 0.00 0.00 179.45 179.96 3n5m h ILE 394 N -0.38 1.24 -0.65 1.86 2.10 -1.49 -2.58 117.51 117.61 3n5m h ILE 394 Ca -0.02 -0.96 -0.02 0.00 1.08 0.00 0.00 64.86 64.94 3n5m h ILE 394 Cb 0.32 0.80 -0.03 0.00 -1.09 0.00 0.00 36.82 36.81 3n5m h ILE 394 CO 0.03 0.35 0.32 0.00 -1.08 0.00 0.00 178.15 177.76 3n5m h ALA 395 N 1.25 1.33 -0.05 0.18 0.00 -1.18 -1.86 119.26 118.94 3n5m h ALA 395 Ca 0.16 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 3n5m h ALA 395 Cb 0.41 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3n5m h ALA 395 CO 0.01 0.52 -0.43 0.66 0.00 0.00 0.00 179.25 180.02 3n5m h SER 396 N 0.92 0.12 -0.28 0.00 4.64 -0.70 -1.34 113.55 116.92 3n5m h SER 396 Ca 0.23 -0.05 -0.10 0.00 -0.47 0.00 0.00 61.79 61.39 3n5m h SER 396 Cb 0.08 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3n5m h SER 396 CO -0.03 0.54 -0.23 0.58 -0.87 0.00 0.00 176.83 176.82 3n5m h VAL 397 N 0.10 1.30 -0.42 0.95 2.07 -1.14 -0.08 116.25 119.03 3n5m h VAL 397 Ca 0.01 -1.38 0.00 0.00 0.82 0.00 0.00 66.70 66.15 3n5m h VAL 397 Cb 0.80 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 3n5m h VAL 397 CO 0.06 0.44 0.27 0.58 0.02 0.00 0.00 177.57 178.94 3n5m h VAL 398 N 0.38 1.12 -0.60 2.57 2.07 -1.13 -1.80 116.25 118.85 3n5m h VAL 398 Ca 0.05 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.28 3n5m h VAL 398 Cb 0.78 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 3n5m h VAL 398 CO 0.06 0.12 0.17 0.78 0.02 0.00 0.00 177.57 178.72 3n5m h ASN 399 N 0.56 0.88 -0.69 0.57 2.35 -1.20 -2.44 115.58 115.62 3n5m h ASN 399 Ca 0.15 -0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.68 3n5m h ASN 399 Cb -0.04 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.06 3n5m h ASN 399 CO -0.03 0.87 0.42 0.00 -1.65 0.00 0.00 177.43 177.04 3n5m h ALA 400 N 1.05 0.87 -0.26 -0.83 0.00 -0.87 -1.87 119.26 117.36 3n5m h ALA 400 Ca 0.19 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3n5m h ALA 400 Cb 0.31 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3n5m h ALA 400 CO -0.00 0.34 0.09 0.00 0.00 0.00 0.00 179.25 179.67 3n5m h LYS 402 N 0.26 1.30 -0.49 0.00 3.64 -0.87 0.29 116.57 120.70 3n5m h LYS 402 Ca 0.08 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 3n5m h LYS 402 Cb 0.22 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 3n5m h LYS 402 CO -0.00 0.89 0.28 1.49 -2.27 0.00 0.00 179.45 179.84 3n5m h GLU 403 N 1.33 0.67 -0.62 1.90 4.81 -1.08 -1.11 114.58 120.48 3n5m h GLU 403 Ca 0.35 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 3n5m h GLU 403 Cb -0.09 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.15 3n5m h GLU 403 CO -0.07 0.48 0.00 1.63 -0.73 0.00 0.00 179.01 180.33 3n5m n LYS 404 N -4.42 3.02 -1.20 1.92 4.76 -0.52 -4.92 118.16 116.80 3n5m n LYS 404 Ca 0.04 -2.04 0.00 0.00 -2.87 0.00 0.00 58.31 53.44 3n5m n LYS 404 Cb 0.09 -1.74 0.00 0.00 -1.84 0.00 0.00 35.03 31.53 3n5m n LYS 404 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3n5m n GLY 405 N 0.84 0.63 3.01 0.72 0.00 -0.42 -5.01 105.19 104.96 3n5m n GLY 405 Ca 0.18 -0.77 -0.28 0.00 0.00 0.00 0.00 46.02 45.16 3n5m n GLY 405 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3n5m s LEU 406 N 0.00 1.57 -0.39 0.99 2.96 -0.02 -0.45 118.68 123.33 3n5m s LEU 406 Ca 0.00 -0.38 -0.22 0.00 -0.22 0.00 0.00 54.13 53.31 3n5m s LEU 406 Cb 0.00 -1.00 0.01 0.00 0.50 0.00 0.00 46.19 45.71 3n5m s LEU 406 CO 0.00 -0.03 0.71 -0.63 -1.32 0.00 0.00 176.35 175.08 3n5m s ILE 407 N 1.20 4.79 0.09 6.68 1.01 -0.12 -1.86 121.20 132.98 3n5m s ILE 407 Ca -0.03 0.56 0.10 0.00 0.00 0.00 0.00 60.65 61.27 3n5m s ILE 407 Cb -0.14 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 3n5m s ILE 407 CO -0.04 -0.47 -0.24 -0.51 0.00 0.00 0.00 174.94 173.68 3n5m s ILE 408 N 2.95 2.39 0.55 2.92 2.07 -1.26 -1.27 121.20 129.56 3n5m s ILE 408 Ca 0.27 -1.51 0.05 0.00 -1.41 0.00 0.00 60.65 58.05 3n5m s ILE 408 Cb -0.14 -2.02 0.06 0.00 0.13 0.00 0.00 42.46 40.50 3n5m s ILE 408 CO 0.18 0.22 0.76 -0.83 -1.91 0.00 0.00 174.94 173.36 3n5m s GLY 409 N -1.71 1.82 -0.02 1.50 0.00 -0.12 -4.93 107.32 103.86 3n5m s GLY 409 Ca 0.14 -1.73 -0.19 0.00 0.00 0.00 0.00 44.72 42.94 3n5m s GLY 409 CO 0.05 -1.37 0.41 -1.60 0.00 0.00 0.00 173.10 170.59 3n5m s ARG 410 N -4.69 0.77 -0.73 2.90 3.52 -1.26 -0.49 118.95 118.97 3n5m s ARG 410 Ca 0.60 -0.07 -0.06 0.00 -0.13 0.00 0.00 55.73 56.07 3n5m s ARG 410 Cb -0.08 0.35 -0.02 0.00 -1.56 0.00 0.00 34.95 33.63 3n5m s ARG 410 CO 0.38 -0.22 2.91 0.27 -0.81 0.00 0.00 175.30 177.83 3n5m n ASN 411 N 1.19 6.90 -4.31 -2.12 6.94 -0.55 -4.89 115.26 118.43 3n5m n ASN 411 Ca -0.21 -2.93 -0.36 0.00 -0.02 0.00 0.00 54.58 51.06 3n5m n ASN 411 Cb 0.56 -1.36 -0.04 0.00 -2.36 0.00 0.00 39.78 36.59 3n5m n ASN 411 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3n5m n GLY 412 N 1.85 2.04 0.00 4.83 0.00 -1.26 -4.58 105.19 108.07 3n5m n GLY 412 Ca 0.55 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 45.49 3n5m n GLY 412 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3n5m n THR 414 N 6.84 0.00 -4.68 2.61 -2.24 -1.26 -5.07 114.28 110.48 3n5m n THR 414 Ca 0.48 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.97 3n5m n THR 414 Cb 0.45 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.51 3n5m n THR 414 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3n5m s THR 415 N 0.00 1.52 0.26 4.28 2.01 -1.26 -2.49 115.64 119.96 3n5m s THR 415 Ca 0.00 -0.68 -0.30 0.00 0.31 0.00 0.00 61.69 61.02 3n5m s THR 415 Cb 0.00 -1.36 -0.11 0.00 0.01 0.00 0.00 72.50 71.04 3n5m s THR 415 CO 0.00 0.44 1.50 0.00 -0.69 0.00 0.00 174.62 175.87 3n5m s ALA 416 N 0.73 3.67 0.00 7.40 0.00 -1.26 -1.15 121.76 131.15 3n5m s ALA 416 Ca -0.12 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.26 3n5m s ALA 416 Cb -0.16 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.37 3n5m s ALA 416 CO 0.03 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.37 3n5m n GLY 417 N 2.20 0.95 2.49 0.00 0.00 -1.26 -4.87 105.19 104.70 3n5m n GLY 417 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 3n5m n GLY 417 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3n5m n TYR 418 N -2.04 1.96 -0.80 1.61 4.02 -0.30 -4.68 117.16 116.93 3n5m n TYR 418 Ca 0.00 -2.30 -0.10 0.00 -0.01 0.00 0.00 57.90 55.48 3n5m n TYR 418 Cb 0.00 -0.27 0.23 0.00 -0.02 0.00 0.00 39.34 39.28 3n5m n TYR 418 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3n5m n ASN 419 N -0.58 4.19 -1.27 7.72 4.13 -1.25 -4.61 115.26 123.59 3n5m n ASN 419 Ca 0.23 -3.16 0.11 0.00 1.68 0.00 0.00 54.58 53.44 3n5m n ASN 419 Cb 0.85 -0.74 0.30 0.00 -1.54 0.00 0.00 39.78 38.65 3n5m n ASN 419 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 3n5m n ASN 420 N -0.36 3.68 -4.33 6.41 6.94 -1.26 -4.53 115.26 121.81 3n5m n ASN 420 Ca 0.41 -2.04 -0.36 0.00 -0.02 0.00 0.00 54.58 52.57 3n5m n ASN 420 Cb 1.34 -0.46 -0.14 0.00 -2.36 0.00 0.00 39.78 38.17 3n5m n ASN 420 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3n5m s ILE 421 N -1.17 3.60 0.33 1.53 1.01 -1.26 -1.01 121.20 124.22 3n5m s ILE 421 Ca 0.45 -0.52 -0.28 0.00 0.00 0.00 0.00 60.65 60.31 3n5m s ILE 421 Cb 0.24 -2.70 -0.09 0.00 0.01 0.00 0.00 42.46 39.92 3n5m s ILE 421 CO 0.30 0.33 1.16 -0.76 0.00 0.00 0.00 174.94 175.97 3n5m s LEU 422 N 1.49 4.41 -0.06 2.97 1.43 -0.55 -1.48 118.68 126.90 3n5m s LEU 422 Ca 0.05 2.38 0.04 0.00 -1.03 0.00 0.00 54.13 55.57 3n5m s LEU 422 Cb -0.15 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 42.31 3n5m s LEU 422 CO -0.01 -0.39 -0.17 0.42 0.23 0.00 0.00 176.35 176.43 3n5m s THR 423 N -1.25 1.47 -0.14 5.49 -4.23 0.35 -1.09 115.64 116.25 3n5m s THR 423 Ca 0.49 -0.72 0.02 0.00 -1.18 0.00 0.00 61.69 60.31 3n5m s THR 423 Cb -0.33 -1.28 0.01 0.00 1.34 0.00 0.00 72.50 72.23 3n5m s THR 423 CO 0.43 0.43 -0.20 -0.76 -0.54 0.00 0.00 174.62 173.97 3n5m s LEU 424 N 0.23 2.22 -0.47 4.79 1.43 -0.07 -0.95 118.68 125.86 3n5m s LEU 424 Ca -0.09 -0.56 0.06 0.00 -1.03 0.00 0.00 54.13 52.51 3n5m s LEU 424 Cb -0.14 -1.48 0.21 0.00 0.03 0.00 0.00 46.19 44.82 3n5m s LEU 424 CO 0.04 0.08 0.49 0.00 0.23 0.00 0.00 176.35 177.19 3n5m n ALA 425 N 4.07 2.95 -1.47 4.21 0.00 0.43 -1.08 120.51 129.62 3n5m n ALA 425 Ca -0.20 -3.65 -0.30 0.00 0.00 0.00 0.00 53.44 49.29 3n5m n ALA 425 Cb 0.52 -0.83 0.09 0.00 0.00 0.00 0.00 19.45 19.22 3n5m n ALA 425 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3n5m s PRO 426 N -0.99 2.24 0.53 0.00 0.04 -1.06 -2.45 135.00 133.31 3n5m s PRO 426 Ca 0.34 0.83 -0.22 0.00 0.04 0.00 0.00 61.00 61.99 3n5m s PRO 426 Cb 0.10 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.66 3n5m s PRO 426 CO -0.13 -1.56 1.30 -2.14 0.04 0.00 0.00 177.00 174.50 3n5m s PRO 427 N -5.06 3.24 0.56 0.56 0.02 -1.26 -4.79 135.00 128.28 3n5m s PRO 427 Ca 0.60 2.08 0.33 0.00 0.02 0.00 0.00 61.00 64.04 3n5m s PRO 427 Cb -0.15 -2.24 1.66 0.00 0.02 0.00 0.00 34.50 33.78 3n5m s PRO 427 CO 0.55 -1.06 2.12 -0.07 -0.33 0.00 0.00 177.00 178.21 3n5m h LEU 428 N 1.51 0.00 -0.07 -5.54 3.38 -1.27 -0.84 115.31 112.48 3n5m h LEU 428 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3n5m h LEU 428 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3n5m h LEU 428 CO 0.58 0.06 0.00 1.33 0.09 0.00 0.00 178.44 180.50 3n5m n VAL 429 N -3.37 0.01 -1.69 1.22 0.24 -1.26 -4.50 118.33 108.98 3n5m n VAL 429 Ca -0.01 -0.02 -0.40 0.00 -2.04 0.00 0.00 64.34 61.87 3n5m n VAL 429 Cb 0.22 -0.32 0.02 0.00 -1.47 0.00 0.00 33.84 32.29 3n5m n VAL 429 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3n5m n ILE 430 N -0.80 2.99 -3.31 1.34 3.06 -0.32 -5.00 119.36 117.32 3n5m n ILE 430 Ca 0.18 -0.50 -0.18 0.00 -2.50 0.00 0.00 62.75 59.74 3n5m n ILE 430 Cb 0.10 -1.50 -0.00 0.00 0.54 0.00 0.00 39.64 38.78 3n5m n ILE 430 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3n5m s SER 431 N -0.73 5.71 0.30 9.51 1.04 -1.26 -4.98 113.70 123.29 3n5m s SER 431 Ca 0.66 -0.35 -0.00 0.00 0.48 0.00 0.00 55.95 56.73 3n5m s SER 431 Cb -0.48 -0.92 0.50 0.00 0.10 0.00 0.00 66.02 65.23 3n5m s SER 431 CO 0.54 -0.58 1.92 0.28 0.98 0.00 0.00 173.24 176.39 3n5m h SER 432 N 0.83 0.92 0.11 7.02 0.02 -1.99 -1.26 113.55 119.19 3n5m h SER 432 Ca -0.43 -0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.36 3n5m h SER 432 Cb 1.27 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 3n5m h SER 432 CO 0.50 0.61 -0.60 -0.08 -1.14 0.00 0.00 176.83 176.13 3n5m h GLU 433 N 1.06 0.49 -0.19 3.45 4.81 -1.99 -1.78 114.58 120.43 3n5m h GLU 433 Ca 0.37 -0.33 -0.14 0.00 -0.13 0.00 0.00 59.36 59.13 3n5m h GLU 433 Cb 0.12 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 3n5m h GLU 433 CO -0.13 0.94 -0.49 0.93 -0.73 0.00 0.00 179.01 179.54 3n5m h GLU 434 N 0.37 0.49 -0.93 1.92 5.08 -1.83 -2.22 114.58 117.45 3n5m h GLU 434 Ca -0.00 -0.28 0.02 0.00 -1.00 0.00 0.00 59.36 58.09 3n5m h GLU 434 Cb 1.14 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.36 3n5m h GLU 434 CO 0.11 0.87 0.61 0.82 -1.00 0.00 0.00 179.01 180.42 3n5m h ILE 435 N 0.39 1.21 -0.68 3.13 1.08 -1.04 -0.54 117.51 121.06 3n5m h ILE 435 Ca 0.02 -0.42 -0.00 0.00 -0.39 0.00 0.00 64.86 64.07 3n5m h ILE 435 Cb 1.00 -0.13 -0.03 0.00 -3.07 0.00 0.00 36.82 34.58 3n5m h ILE 435 CO 0.09 0.22 0.42 0.00 -0.69 0.00 0.00 178.15 178.20 3n5m h ALA 436 N 1.36 0.87 -0.27 1.87 0.00 -1.03 -1.43 119.26 120.62 3n5m h ALA 436 Ca 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3n5m h ALA 436 Cb -0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3n5m h ALA 436 CO -0.09 0.33 0.18 0.35 0.00 0.00 0.00 179.25 180.02 3n5m h PHE 437 N 0.93 0.35 0.13 0.00 3.57 -0.82 0.15 116.94 121.24 3n5m h PHE 437 Ca 0.25 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.77 3n5m h PHE 437 Cb -0.05 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.53 3n5m h PHE 437 CO -0.02 0.22 -0.39 0.28 -2.23 0.00 0.00 178.31 176.18 3n5m h VAL 438 N 0.37 0.20 -0.43 1.41 2.07 -0.86 -0.33 116.25 118.68 3n5m h VAL 438 Ca 0.10 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.56 3n5m h VAL 438 Cb -0.04 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 3n5m h VAL 438 CO -0.02 0.00 0.02 0.40 0.02 0.00 0.00 177.57 177.99 3n5m h ILE 439 N -0.63 1.26 -0.75 4.57 2.04 -1.18 -0.69 117.51 122.13 3n5m h ILE 439 Ca 0.02 -1.00 0.03 0.00 1.00 0.00 0.00 64.86 64.91 3n5m h ILE 439 Cb 0.65 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.75 3n5m h ILE 439 CO -0.22 0.34 0.48 1.23 0.00 0.00 0.00 178.15 179.98 3n5m h GLY 440 N 0.59 1.08 0.90 5.37 0.00 -0.62 0.16 103.07 110.55 3n5m h GLY 440 Ca 0.12 -0.37 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 3n5m h GLY 440 CO 0.02 0.32 -0.11 -0.84 0.00 0.00 0.00 176.54 175.93 3n5m h THR 441 N 0.94 1.29 -0.14 4.70 2.02 -0.79 -2.36 112.91 118.57 3n5m h THR 441 Ca 0.29 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.28 3n5m h THR 441 Cb -0.01 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 3n5m h THR 441 CO -0.10 0.38 0.05 0.25 0.37 0.00 0.00 175.52 176.47 3n5m h LEU 442 N 0.36 0.20 -0.67 2.58 5.85 -0.92 -1.57 115.31 121.14 3n5m h LEU 442 Ca 0.07 -0.18 0.13 0.00 0.84 0.00 0.00 57.88 58.74 3n5m h LEU 442 Cb 0.62 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.50 3n5m h LEU 442 CO 0.04 0.33 0.16 0.50 -0.34 0.00 0.00 178.44 179.13 3n5m h LYS 443 N 0.06 0.27 -0.59 1.25 3.64 -0.63 -1.33 116.57 119.23 3n5m h LYS 443 Ca 0.05 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 3n5m h LYS 443 Cb 0.20 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 3n5m h LYS 443 CO -0.00 0.18 -0.01 1.15 -2.27 0.00 0.00 179.45 178.50 3n5m h THR 444 N 0.28 1.26 0.00 1.00 2.02 -1.29 -3.04 112.91 113.15 3n5m h THR 444 Ca 0.36 -1.15 0.00 0.00 0.77 0.00 0.00 66.41 66.39 3n5m h THR 444 Cb 0.58 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3n5m h THR 444 CO -0.45 0.42 0.00 0.00 0.37 0.00 0.00 175.52 175.86 3n5m n ALA 445 N -2.48 1.76 0.00 6.16 0.00 -0.50 -4.13 120.51 121.31 3n5m n ALA 445 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3n5m n ALA 445 Cb 0.35 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.38 3n5m n ALA 445 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3n5m n GLU 447 N 1.42 0.00 0.02 0.00 4.07 -1.15 -4.40 120.64 120.60 3n5m n GLU 447 Ca 0.00 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.11 3n5m n GLU 447 Cb 0.07 -1.66 0.35 0.00 -0.06 0.00 0.00 31.44 30.15 3n5m n GLU 447 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3n5m h ARG 448 N 0.00 0.49 -0.01 5.31 3.08 -1.91 -3.55 114.38 117.79 3n5m h ARG 448 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3n5m h ARG 448 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3n5m h ARG 448 CO 0.00 0.47 0.00 0.44 -1.07 0.00 0.00 179.97 179.81