#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i9l n ALA 5 N 0.00 2.49 0.17 0.00 0.00 -1.26 -3.70 120.51 118.21 2i9l n ALA 5 Ca 0.00 -0.85 0.11 0.00 0.00 0.00 0.00 53.44 52.70 2i9l n ALA 5 Cb 0.00 -0.97 0.10 0.00 0.00 0.00 0.00 19.45 18.58 2i9l n ALA 5 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2i9l h SER 6 N 2.73 0.00 -0.52 0.00 4.64 -2.04 -3.04 113.55 115.33 2i9l h SER 6 Ca 0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2i9l h SER 6 Cb 0.68 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 2i9l h SER 6 CO 0.02 0.05 0.34 0.40 -0.87 0.00 0.00 176.83 176.78 2i9l h ILE 7 N 0.00 1.03 0.05 0.95 5.03 -1.98 0.49 117.51 123.09 2i9l h ILE 7 Ca -0.01 -0.19 -0.26 0.00 -0.12 0.00 0.00 64.86 64.29 2i9l h ILE 7 Cb 1.05 0.44 0.01 0.00 -3.03 0.00 0.00 36.82 35.29 2i9l h ILE 7 CO 0.01 0.10 -1.09 -0.61 -0.68 0.00 0.00 178.15 175.88 2i9l h GLN 8 N 0.55 0.50 -0.53 2.37 5.75 -1.81 -2.04 115.11 119.91 2i9l h GLN 8 Ca 0.21 -0.61 0.08 0.00 -0.15 0.00 0.00 58.65 58.19 2i9l h GLN 8 Cb 0.16 0.19 -0.07 0.00 1.07 0.00 0.00 27.48 28.83 2i9l h GLN 8 CO -0.06 1.24 0.15 1.15 -2.65 0.00 0.00 178.83 178.66 2i9l h THR 9 N 0.25 0.76 0.47 2.39 2.02 -0.66 -1.11 112.91 117.03 2i9l h THR 9 Ca -0.13 -0.10 -0.02 0.00 0.77 0.00 0.00 66.41 66.93 2i9l h THR 9 Cb 1.75 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 2i9l h THR 9 CO 0.20 0.06 -0.22 0.74 0.37 0.00 0.00 175.52 176.66 2i9l h THR 10 N 0.31 0.48 -0.61 3.16 2.02 -0.11 -1.43 112.91 116.72 2i9l h THR 10 Ca 0.26 -0.36 0.17 0.00 0.77 0.00 0.00 66.41 67.26 2i9l h THR 10 Cb 0.33 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 2i9l h THR 10 CO -0.30 0.06 0.44 -0.37 0.37 0.00 0.00 175.52 175.71 2i9l h VAL 11 N -0.86 0.71 -0.03 3.16 -1.51 -1.14 0.19 116.25 116.77 2i9l h VAL 11 Ca -0.06 -0.01 -0.23 0.00 -1.23 0.00 0.00 66.70 65.17 2i9l h VAL 11 Cb 0.58 0.66 0.01 0.00 -2.13 0.00 0.00 31.29 30.41 2i9l h VAL 11 CO 0.11 0.01 -0.90 0.78 -1.23 0.00 0.00 177.57 176.33 2i9l h ASN 12 N 0.04 0.64 -0.35 4.19 -0.26 -1.04 0.47 115.58 119.27 2i9l h ASN 12 Ca 0.29 -0.48 -0.01 0.00 -0.56 0.00 0.00 56.30 55.54 2i9l h ASN 12 Cb 1.11 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 38.16 2i9l h ASN 12 CO -0.02 1.27 0.17 0.74 -1.06 0.00 0.00 177.43 178.53 2i9l h THR 13 N 0.31 1.16 0.46 2.81 2.02 0.37 -1.61 112.91 118.42 2i9l h THR 13 Ca -0.08 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 2i9l h THR 13 Cb 1.53 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.77 2i9l h THR 13 CO 0.16 0.17 -0.22 0.25 0.37 0.00 0.00 175.52 176.25 2i9l h LEU 14 N 0.42 -0.52 -1.11 2.58 5.85 -0.73 0.30 115.31 122.11 2i9l h LEU 14 Ca 0.12 0.01 0.18 0.00 0.84 0.00 0.00 57.88 59.03 2i9l h LEU 14 Cb 0.12 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.19 2i9l h LEU 14 CO -0.02 -0.36 0.61 -1.28 -0.34 0.00 0.00 178.44 177.06 2i9l h SER 15 N -0.62 0.74 0.04 1.25 0.87 -0.75 0.27 113.55 115.34 2i9l h SER 15 Ca -0.06 0.07 -0.17 0.00 -1.23 0.00 0.00 61.79 60.40 2i9l h SER 15 Cb 0.47 -0.06 0.02 0.00 -0.44 0.00 0.00 62.40 62.39 2i9l h SER 15 CO 0.10 0.30 -0.69 1.05 -0.53 0.00 0.00 176.83 177.06 2i9l h GLU 16 N 0.75 0.41 -0.49 2.24 -0.00 -1.05 -2.11 114.58 114.32 2i9l h GLU 16 Ca 0.54 -0.48 0.00 0.00 -0.00 0.00 0.00 59.36 59.42 2i9l h GLU 16 Cb 0.86 0.15 -0.02 0.00 -0.00 0.00 0.00 28.75 29.73 2i9l h GLU 16 CO -0.31 1.15 0.32 0.00 -0.00 0.00 0.00 179.01 180.17 2i9l h ARG 17 N -0.13 0.65 0.39 1.06 3.08 -0.02 0.28 114.38 119.70 2i9l h ARG 17 Ca -0.10 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 2i9l h ARG 17 Cb 1.42 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2i9l h ARG 17 CO 0.13 0.44 -0.19 0.82 -1.07 0.00 0.00 179.97 180.11 2i9l h ILE 18 N 0.67 0.00 -1.14 2.04 1.08 -0.55 -1.07 117.51 118.55 2i9l h ILE 18 Ca 0.18 -0.39 0.34 0.00 -0.39 0.00 0.00 64.86 64.59 2i9l h ILE 18 Cb -0.07 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 33.57 2i9l h ILE 18 CO -0.04 0.00 0.72 -1.28 -0.69 0.00 0.00 178.15 176.86 2i9l h SER 19 N -0.91 0.38 0.14 1.72 0.87 -1.16 -1.16 113.55 113.43 2i9l h SER 19 Ca -0.05 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2i9l h SER 19 Cb 0.40 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 2i9l h SER 19 CO 0.09 -0.04 -0.07 -1.28 -0.53 0.00 0.00 176.83 175.00 2i9l h SER 20 N 0.27 -0.16 -0.12 6.23 0.87 -0.41 -3.13 113.55 117.11 2i9l h SER 20 Ca 0.70 -0.38 -0.04 0.00 -1.23 0.00 0.00 61.79 60.84 2i9l h SER 20 Cb 1.92 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.90 2i9l h SER 20 CO -0.39 0.36 -0.03 0.11 -0.53 0.00 0.00 176.83 176.35 2i9l h LYS 21 N -0.76 0.36 -0.71 2.24 1.57 -0.20 -1.67 116.57 117.40 2i9l h LYS 21 Ca -0.02 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 2i9l h LYS 21 Cb 0.53 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 2i9l h LYS 21 CO 0.03 0.42 0.31 -0.07 -0.57 0.00 0.00 179.45 179.57 2i9l h LEU 22 N 0.35 0.94 -0.49 2.94 3.38 -1.34 0.80 115.31 121.89 2i9l h LEU 22 Ca 0.08 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2i9l h LEU 22 Cb 0.29 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2i9l h LEU 22 CO 0.01 0.82 -0.02 -0.08 0.09 0.00 0.00 178.44 179.26 2i9l h GLU 23 N 1.02 0.88 0.00 1.13 4.81 -1.33 -1.61 114.58 119.47 2i9l h GLU 23 Ca 0.24 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2i9l h GLU 23 Cb 0.16 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.47 2i9l h GLU 23 CO -0.03 0.93 0.00 1.04 -0.73 0.00 0.00 179.01 180.22 2i9l n GLN 24 N -4.31 0.00 0.00 1.92 6.02 -0.69 -2.74 117.38 117.58 2i9l n GLN 24 Ca 0.01 0.38 0.02 0.00 -0.01 0.00 0.00 57.00 57.39 2i9l n GLN 24 Cb 0.33 -0.90 0.09 0.00 1.02 0.00 0.00 30.24 30.79 2i9l n GLN 24 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2i9l n GLU 25 N -1.64 0.21 0.00 -1.09 1.02 0.27 -3.51 120.64 115.90 2i9l n GLU 25 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2i9l n GLU 25 Cb 0.00 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 2i9l n GLU 25 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i9l n ALA 26 N -0.74 0.88 -3.74 0.62 0.00 -0.87 -4.72 120.51 111.94 2i9l n ALA 26 Ca 0.02 -0.05 -0.26 0.00 0.00 0.00 0.00 53.44 53.15 2i9l n ALA 26 Cb 0.01 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.51 2i9l n ALA 26 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2i9l n ASN 27 N 0.00 -4.93 -4.87 0.00 3.02 -1.05 -4.73 115.26 102.70 2i9l n ASN 27 Ca 0.00 -0.68 -0.31 0.00 -0.03 0.00 0.00 54.58 53.56 2i9l n ASN 27 Cb 0.47 -4.43 -0.04 0.00 -0.61 0.00 0.00 39.78 35.17 2i9l n ASN 27 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2i9l s ALA 28 N -3.35 3.36 0.15 5.41 0.00 -0.66 -4.78 121.76 121.89 2i9l s ALA 28 Ca 0.53 -0.16 -0.17 0.00 0.00 0.00 0.00 51.96 52.16 2i9l s ALA 28 Cb -0.25 -2.69 0.04 0.00 0.00 0.00 0.00 23.12 20.21 2i9l s ALA 28 CO 0.78 0.10 0.46 0.45 0.00 0.00 0.00 175.76 177.55 2i9l s SER 29 N -2.91 -0.28 0.04 0.00 0.15 -1.12 -4.22 113.70 105.35 2i9l s SER 29 Ca 0.51 -0.32 0.15 0.00 0.70 0.00 0.00 55.95 56.99 2i9l s SER 29 Cb -0.10 0.52 0.64 0.00 -1.71 0.00 0.00 66.02 65.36 2i9l s SER 29 CO 0.27 -0.92 1.47 0.00 1.20 0.00 0.00 173.24 175.27 2i9l n ALA 30 N -0.28 1.62 -1.68 5.45 0.00 -1.26 -2.99 120.51 121.36 2i9l n ALA 30 Ca -0.14 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.33 2i9l n ALA 30 Cb 0.64 -1.24 0.14 0.00 0.00 0.00 0.00 19.45 18.99 2i9l n ALA 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2i9l n GLN 31 N -1.61 1.10 -3.78 0.00 6.02 -1.26 -4.92 117.38 112.92 2i9l n GLN 31 Ca 0.03 -2.72 -0.37 0.00 -0.01 0.00 0.00 57.00 53.93 2i9l n GLN 31 Cb 0.17 -1.20 -0.06 0.00 1.02 0.00 0.00 30.24 30.16 2i9l n GLN 31 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2i9l s THR 32 N -2.30 5.42 0.48 5.09 2.01 -1.16 -5.06 115.64 120.12 2i9l s THR 32 Ca 0.33 0.31 -0.20 0.00 0.31 0.00 0.00 61.69 62.44 2i9l s THR 32 Cb 0.32 -3.47 -0.13 0.00 0.01 0.00 0.00 72.50 69.24 2i9l s THR 32 CO -0.06 0.57 0.28 1.17 -0.69 0.00 0.00 174.62 175.89 2i9l n LYS 33 N 2.34 0.30 -4.33 4.92 3.00 -1.26 -4.51 118.16 118.62 2i9l n LYS 33 Ca -0.18 0.11 -0.31 0.00 -0.00 0.00 0.00 58.31 57.93 2i9l n LYS 33 Cb 0.54 -1.33 -0.16 0.00 0.00 0.00 0.00 35.03 34.08 2i9l n LYS 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2i9l h ASP 35 N 7.68 -0.28 -3.25 0.00 3.32 -1.89 -3.43 116.42 118.58 2i9l h ASP 35 Ca -0.37 0.01 -0.57 0.00 0.02 0.00 0.00 57.03 56.11 2i9l h ASP 35 Cb 1.16 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.73 2i9l h ASP 35 CO 0.56 -0.08 -0.05 -0.63 -1.72 0.00 0.00 179.24 177.33 2i9l s ILE 36 N -2.84 4.86 0.12 0.35 1.09 0.02 -4.84 121.20 119.95 2i9l s ILE 36 Ca -0.05 1.18 0.11 0.00 -1.10 0.00 0.00 60.65 60.78 2i9l s ILE 36 Cb 0.00 -3.89 -0.04 0.00 -1.06 0.00 0.00 42.46 37.48 2i9l s ILE 36 CO 0.15 0.49 -0.26 -1.61 -0.10 0.00 0.00 174.94 173.60 2i9l s GLU 37 N -0.66 1.42 0.08 2.79 2.02 -0.42 -4.39 118.70 119.54 2i9l s GLU 37 Ca 0.29 -1.31 -0.25 0.00 0.02 0.00 0.00 54.97 53.72 2i9l s GLU 37 Cb -0.18 -1.87 -0.06 0.00 0.10 0.00 0.00 34.13 32.12 2i9l s GLU 37 CO 0.17 0.45 0.77 0.42 0.02 0.00 0.00 175.26 177.09 2i9l s ILE 38 N -1.04 4.62 0.00 -1.63 1.01 -1.26 -0.83 121.20 122.07 2i9l s ILE 38 Ca 0.13 1.66 0.00 0.00 0.00 0.00 0.00 60.65 62.44 2i9l s ILE 38 Cb -0.10 -4.13 0.00 0.00 0.01 0.00 0.00 42.46 38.24 2i9l s ILE 38 CO 0.05 0.41 0.00 0.61 0.00 0.00 0.00 174.94 176.01 2i9l n GLY 39 N 2.16 0.38 3.71 6.18 0.00 0.94 -4.79 105.19 113.77 2i9l n GLY 39 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 2i9l n GLY 39 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2i9l s ASN 40 N -1.00 6.75 -0.25 1.61 0.01 -1.26 -4.92 114.94 115.88 2i9l s ASN 40 Ca 0.00 0.90 0.02 0.00 -0.71 0.00 0.00 52.86 53.07 2i9l s ASN 40 Cb 0.00 -2.33 0.06 0.00 0.41 0.00 0.00 41.25 39.39 2i9l s ASN 40 CO 0.00 -0.09 -0.08 0.12 -1.51 0.00 0.00 177.10 175.55 2i9l s PHE 41 N 0.95 2.80 0.29 2.20 5.36 -1.26 -0.90 117.98 127.42 2i9l s PHE 41 Ca 0.29 -2.03 -0.10 0.00 -0.96 0.00 0.00 56.93 54.13 2i9l s PHE 41 Cb -0.16 -1.76 0.00 0.00 -0.34 0.00 0.00 43.02 40.77 2i9l s PHE 41 CO 0.12 -0.82 0.51 1.52 -1.46 0.00 0.00 175.22 175.09 2i9l s TYR 42 N 1.26 0.55 -0.04 10.12 -0.85 -0.71 -4.99 117.35 122.68 2i9l s TYR 42 Ca -0.07 -0.91 0.06 0.00 -0.52 0.00 0.00 57.07 55.64 2i9l s TYR 42 Cb -0.19 0.18 -0.02 0.00 0.38 0.00 0.00 41.96 42.30 2i9l s TYR 42 CO -0.06 -1.10 -0.21 0.42 -1.52 0.00 0.00 175.55 173.08 2i9l s ILE 43 N -3.55 2.43 0.04 -3.49 1.01 -1.26 -2.56 121.20 113.82 2i9l s ILE 43 Ca 0.24 -0.96 -0.29 0.00 0.00 0.00 0.00 60.65 59.64 2i9l s ILE 43 Cb -0.01 -1.89 -0.16 0.00 0.01 0.00 0.00 42.46 40.41 2i9l s ILE 43 CO 0.13 0.58 1.35 0.03 0.00 0.00 0.00 174.94 177.03 2i9l h ARG 44 N 5.55 -1.01 -3.45 2.79 2.47 -1.65 -3.34 114.38 115.74 2i9l h ARG 44 Ca -0.42 0.07 -0.75 0.00 -1.26 0.00 0.00 59.98 57.62 2i9l h ARG 44 Cb 1.14 0.23 -0.32 0.00 -1.65 0.00 0.00 29.97 29.37 2i9l h ARG 44 CO 0.48 -0.67 0.16 -0.65 0.56 0.00 0.00 179.97 179.85 2i9l s GLN 45 N -5.15 3.71 -0.78 0.04 -0.21 -0.59 -4.97 119.66 111.71 2i9l s GLN 45 Ca -0.15 -3.22 -0.22 0.00 0.02 0.00 0.00 55.36 51.79 2i9l s GLN 45 Cb 0.02 -4.24 0.08 0.00 1.00 0.00 0.00 33.01 29.86 2i9l s GLN 45 CO 0.46 -1.25 1.09 1.21 -2.12 0.00 0.00 175.29 174.67 2i9l s ASN 46 N 0.61 6.33 -0.84 5.90 3.84 -1.25 -2.29 114.94 127.23 2i9l s ASN 46 Ca 0.29 -1.28 -0.01 0.00 0.21 0.00 0.00 52.86 52.07 2i9l s ASN 46 Cb -0.09 -2.44 0.35 0.00 -0.55 0.00 0.00 41.25 38.52 2i9l s ASN 46 CO -0.10 -1.38 1.89 1.41 -2.79 0.00 0.00 177.10 176.13 2i9l n HIS 47 N 7.67 3.00 0.00 0.43 8.25 -0.04 -4.74 115.22 129.79 2i9l n HIS 47 Ca 0.08 -2.47 0.00 0.00 -0.26 0.00 0.00 57.72 55.07 2i9l n HIS 47 Cb 0.47 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.50 2i9l n HIS 47 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2i9l n GLY 48 N -0.44 0.81 2.95 -1.41 0.00 -1.26 -1.73 105.19 104.11 2i9l n GLY 48 Ca 0.51 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.26 2i9l n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i9l s ASN 50 N 1.46 6.55 -0.00 0.00 0.01 0.27 -4.93 114.94 118.30 2i9l s ASN 50 Ca 0.01 0.66 0.01 0.00 -0.71 0.00 0.00 52.86 52.83 2i9l s ASN 50 Cb -0.13 -2.26 -0.04 0.00 0.41 0.00 0.00 41.25 39.23 2i9l s ASN 50 CO -0.06 -0.07 0.00 -0.76 -1.51 0.00 0.00 177.10 174.70 2i9l s LEU 51 N 1.15 3.52 -0.02 0.60 1.43 -1.26 -0.38 118.68 123.71 2i9l s LEU 51 Ca 0.23 -0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.23 2i9l s LEU 51 Cb -0.15 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.06 2i9l s LEU 51 CO 0.09 0.28 0.19 0.42 0.23 0.00 0.00 176.35 177.56 2i9l s THR 52 N -1.09 0.05 -0.10 5.49 -4.23 -0.48 -4.98 115.64 110.31 2i9l s THR 52 Ca 0.20 -0.45 0.01 0.00 -1.18 0.00 0.00 61.69 60.27 2i9l s THR 52 Cb -0.12 -0.42 -0.02 0.00 1.34 0.00 0.00 72.50 73.28 2i9l s THR 52 CO 0.10 -0.25 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.12 2i9l s VAL 53 N -0.92 3.12 -0.05 2.29 1.01 -1.26 -0.14 120.40 124.45 2i9l s VAL 53 Ca -0.10 -0.67 0.06 0.00 0.00 0.00 0.00 61.98 61.27 2i9l s VAL 53 Cb -0.05 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 2i9l s VAL 53 CO 0.02 0.55 -0.22 -0.75 0.00 0.00 0.00 175.10 174.70 2i9l s LYS 54 N -0.14 2.14 -0.17 2.72 2.20 0.90 -4.92 119.74 122.46 2i9l s LYS 54 Ca -0.01 -0.77 -0.17 0.00 -0.36 0.00 0.00 55.97 54.66 2i9l s LYS 54 Cb -0.13 -1.86 -0.04 0.00 -1.51 0.00 0.00 37.83 34.29 2i9l s LYS 54 CO 0.03 0.34 0.44 -0.80 -0.36 0.00 0.00 175.35 175.01 2i9l s ASN 55 N -0.14 6.55 -0.34 1.43 0.01 -1.26 0.93 114.94 122.12 2i9l s ASN 55 Ca -0.02 0.66 0.15 0.00 -0.71 0.00 0.00 52.86 52.94 2i9l s ASN 55 Cb -0.12 -2.26 0.42 0.00 0.41 0.00 0.00 41.25 39.70 2i9l s ASN 55 CO 0.02 -0.05 0.91 0.80 -1.51 0.00 0.00 177.10 177.27 2i9l n MET 56 N 4.15 1.09 -2.61 -0.60 1.56 -0.35 -4.24 117.12 116.12 2i9l n MET 56 Ca -0.07 -3.17 -0.33 0.00 -0.27 0.00 0.00 57.70 53.85 2i9l n MET 56 Cb 0.51 -1.32 -0.04 0.00 2.15 0.00 0.00 33.22 34.52 2i9l n MET 56 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2i9l s SER 58 N -2.15 -0.16 -0.02 0.00 1.04 -1.04 -2.80 113.70 108.57 2i9l s SER 58 Ca 0.65 -0.73 0.11 0.00 0.48 0.00 0.00 55.95 56.45 2i9l s SER 58 Cb -0.13 0.60 -0.23 0.00 0.10 0.00 0.00 66.02 66.35 2i9l s SER 58 CO 0.19 -1.13 0.76 0.00 0.98 0.00 0.00 173.24 174.03 2i9l h ALA 59 N 2.21 0.69 -1.06 5.32 0.00 -1.89 -3.44 119.26 121.09 2i9l h ALA 59 Ca -0.26 -1.37 -0.57 0.00 0.00 0.00 0.00 54.91 52.71 2i9l h ALA 59 Cb 1.25 0.39 -0.09 0.00 0.00 0.00 0.00 17.79 19.34 2i9l h ALA 59 CO 0.35 1.52 1.44 0.34 0.00 0.00 0.00 179.25 182.90 2i9l s ASP 60 N -6.24 6.37 0.35 0.00 -1.08 -1.26 -4.88 116.67 109.93 2i9l s ASP 60 Ca -0.04 -1.40 0.10 0.00 -0.52 0.00 0.00 52.55 50.69 2i9l s ASP 60 Cb 0.08 -2.57 0.86 0.00 -1.46 0.00 0.00 42.92 39.84 2i9l s ASP 60 CO 0.82 -1.63 1.82 0.00 0.52 0.00 0.00 175.17 176.71 2i9l h ALA 61 N 9.88 1.89 -0.04 3.66 0.00 -1.98 -1.56 119.26 131.11 2i9l h ALA 61 Ca 0.20 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.97 2i9l h ALA 61 Cb 1.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2i9l h ALA 61 CO 1.41 -0.20 -0.77 -0.44 0.00 0.00 0.00 179.25 179.25 2i9l h ASP 62 N 0.64 0.32 -0.43 0.00 5.19 -1.99 -0.85 116.42 119.31 2i9l h ASP 62 Ca 0.52 -0.23 -0.07 0.00 -0.62 0.00 0.00 57.03 56.62 2i9l h ASP 62 Cb 0.95 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.34 2i9l h ASP 62 CO -0.27 0.97 0.01 0.00 -3.12 0.00 0.00 179.24 176.83 2i9l h ALA 63 N 1.02 1.08 0.83 3.45 0.00 -1.63 -1.80 119.26 122.21 2i9l h ALA 63 Ca -0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2i9l h ALA 63 Cb 1.34 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.94 2i9l h ALA 63 CO 0.12 0.58 -0.40 1.96 0.00 0.00 0.00 179.25 181.51 2i9l h GLN 64 N 0.77 -1.07 -0.95 0.00 4.20 -1.11 -1.86 115.11 115.09 2i9l h GLN 64 Ca 0.15 0.07 0.23 0.00 0.06 0.00 0.00 58.65 59.16 2i9l h GLN 64 Cb 0.45 0.24 -0.07 0.00 0.30 0.00 0.00 27.48 28.41 2i9l h GLN 64 CO 0.02 -0.71 0.63 1.25 -0.67 0.00 0.00 178.83 179.35 2i9l h LEU 65 N -1.27 0.36 -0.14 1.46 6.46 -1.06 0.17 115.31 121.30 2i9l h LEU 65 Ca -0.11 0.05 -0.23 0.00 -0.12 0.00 0.00 57.88 57.47 2i9l h LEU 65 Cb 0.86 -0.02 0.01 0.00 -0.73 0.00 0.00 40.66 40.79 2i9l h LEU 65 CO 0.19 0.12 -0.80 0.44 -0.62 0.00 0.00 178.44 177.77 2i9l h ASP 66 N 0.35 0.94 -0.08 1.25 3.32 -1.19 -2.65 116.42 118.37 2i9l h ASP 66 Ca 0.50 -0.64 0.00 0.00 0.02 0.00 0.00 57.03 56.91 2i9l h ASP 66 Cb 1.36 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 2i9l h ASP 66 CO -0.19 1.43 0.05 0.00 -1.72 0.00 0.00 179.24 178.82 2i9l h ALA 67 N 0.53 0.10 0.38 3.45 0.00 0.12 -0.81 119.26 123.03 2i9l h ALA 67 Ca -0.06 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2i9l h ALA 67 Cb 1.44 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2i9l h ALA 67 CO 0.17 -0.40 -0.39 0.28 0.00 0.00 0.00 179.25 178.90 2i9l h VAL 68 N 0.09 0.20 -0.84 0.00 2.07 -1.12 0.59 116.25 117.24 2i9l h VAL 68 Ca 0.03 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.69 2i9l h VAL 68 Cb 0.01 0.20 -0.09 0.00 -1.52 0.00 0.00 31.29 29.89 2i9l h VAL 68 CO -0.01 0.00 0.43 -0.07 0.02 0.00 0.00 177.57 177.95 2i9l h LEU 69 N -0.80 0.53 0.33 2.57 3.38 -1.39 -0.62 115.31 119.31 2i9l h LEU 69 Ca -0.03 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2i9l h LEU 69 Cb 0.72 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2i9l h LEU 69 CO -0.07 0.23 -0.46 -1.28 0.09 0.00 0.00 178.44 176.95 2i9l h SER 70 N 0.63 -1.32 -0.41 -0.43 0.87 -0.33 -0.01 113.55 112.56 2i9l h SER 70 Ca 0.45 0.12 0.09 0.00 -1.23 0.00 0.00 61.79 61.22 2i9l h SER 70 Cb 0.62 0.45 -0.09 0.00 -0.44 0.00 0.00 62.40 62.95 2i9l h SER 70 CO -0.35 -0.57 -0.21 0.00 -0.53 0.00 0.00 176.83 175.18 2i9l h ALA 71 N -0.87 0.09 -0.94 6.23 0.00 -0.13 0.22 119.26 123.86 2i9l h ALA 71 Ca -0.04 0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.13 2i9l h ALA 71 Cb 0.75 0.50 -0.07 0.00 0.00 0.00 0.00 17.79 18.96 2i9l h ALA 71 CO -0.13 -0.57 0.60 0.00 0.00 0.00 0.00 179.25 179.15 2i9l h ALA 72 N 1.13 1.64 -0.18 0.00 0.00 -0.89 0.10 119.26 121.07 2i9l h ALA 72 Ca 0.20 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 2i9l h ALA 72 Cb 0.44 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2i9l h ALA 72 CO -0.49 0.13 -0.42 1.15 0.00 0.00 0.00 179.25 179.62 2i9l h THR 73 N 0.88 1.33 0.38 0.00 2.02 0.10 -1.50 112.91 116.13 2i9l h THR 73 Ca 0.46 -1.67 -0.01 0.00 0.77 0.00 0.00 66.41 65.95 2i9l h THR 73 Cb 0.52 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.86 2i9l h THR 73 CO -0.22 0.51 -0.25 -0.08 0.37 0.00 0.00 175.52 175.85 2i9l h GLU 74 N 0.26 -0.60 -0.32 6.66 4.81 0.24 -1.24 114.58 124.39 2i9l h GLU 74 Ca -0.00 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.34 2i9l h GLU 74 Cb 1.03 0.14 -0.08 0.00 0.63 0.00 0.00 28.75 30.47 2i9l h GLU 74 CO 0.09 -0.40 -0.27 1.15 -0.73 0.00 0.00 179.01 178.86 2i9l h THR 75 N -0.62 0.33 -0.74 0.32 2.02 -0.83 -1.04 112.91 112.35 2i9l h THR 75 Ca -0.04 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.19 2i9l h THR 75 Cb 0.52 0.33 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 2i9l h THR 75 CO 0.03 0.00 0.49 0.22 0.37 0.00 0.00 175.52 176.63 2i9l h TYR 76 N -0.24 0.84 0.00 3.16 3.20 -1.16 0.48 116.97 123.25 2i9l h TYR 76 Ca 0.16 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2i9l h TYR 76 Cb 0.49 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.48 2i9l h TYR 76 CO -0.46 0.47 0.00 0.77 -1.64 0.00 0.00 178.16 177.30 2i9l h SER 77 N 0.85 0.00 1.69 -2.11 0.02 0.04 -2.49 113.55 111.55 2i9l h SER 77 Ca 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 2i9l h SER 77 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2i9l h SER 77 CO -0.10 0.00 -0.08 1.23 -1.14 0.00 0.00 176.83 176.74 2i9l h GLY 78 N 2.07 0.00 -1.47 -3.77 0.00 -0.22 -3.46 103.07 96.22 2i9l h GLY 78 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 2i9l h GLY 78 CO 0.00 0.00 0.33 1.08 0.00 0.00 0.00 176.54 177.95 2i9l s LEU 79 N -5.43 3.15 0.39 3.11 1.43 -0.94 -5.02 118.68 115.37 2i9l s LEU 79 Ca 0.08 1.96 -0.11 0.00 -1.03 0.00 0.00 54.13 55.03 2i9l s LEU 79 Cb 0.08 -4.54 -0.07 0.00 0.03 0.00 0.00 46.19 41.70 2i9l s LEU 79 CO 0.65 -2.02 0.76 0.42 0.23 0.00 0.00 176.35 176.38 2i9l s THR 80 N -2.62 4.78 0.40 5.49 -4.23 -1.26 -4.80 115.64 113.40 2i9l s THR 80 Ca 0.65 0.65 0.21 0.00 -1.18 0.00 0.00 61.69 62.01 2i9l s THR 80 Cb -0.20 -3.71 0.41 0.00 1.34 0.00 0.00 72.50 70.33 2i9l s THR 80 CO 0.51 -0.47 1.73 -0.65 -0.54 0.00 0.00 174.62 175.20 2i9l h PRO 81 N 1.41 0.31 -0.15 3.99 0.11 -1.98 0.51 132.00 136.21 2i9l h PRO 81 Ca -0.47 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2i9l h PRO 81 Cb 1.19 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2i9l h PRO 81 CO 0.64 0.21 0.07 1.49 -0.21 0.00 0.00 178.00 180.20 2i9l h GLU 82 N 0.32 0.23 0.21 1.05 4.81 -2.02 -3.03 114.58 116.14 2i9l h GLU 82 Ca 0.66 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.84 2i9l h GLU 82 Cb 1.76 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 31.11 2i9l h GLU 82 CO -0.36 0.29 -0.10 1.96 -0.73 0.00 0.00 179.01 180.07 2i9l h GLN 83 N 0.11 -0.27 -0.97 1.92 4.20 -0.46 -3.24 115.11 116.40 2i9l h GLN 83 Ca 0.05 0.02 0.28 0.00 0.06 0.00 0.00 58.65 59.06 2i9l h GLN 83 Cb 0.14 0.06 -0.18 0.00 0.30 0.00 0.00 27.48 27.81 2i9l h GLN 83 CO -0.01 0.06 0.11 0.87 -0.67 0.00 0.00 178.83 179.19 2i9l h LYS 84 N -0.63 0.04 -1.10 1.46 1.57 -0.87 -0.47 116.57 116.57 2i9l h LYS 84 Ca -0.03 -0.00 0.32 0.00 -1.87 0.00 0.00 60.65 59.07 2i9l h LYS 84 Cb 0.45 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 2i9l h LYS 84 CO 0.05 0.02 0.95 0.00 -0.57 0.00 0.00 179.45 179.90 2i9l h ALA 85 N 1.95 2.98 0.00 3.86 0.00 -1.55 0.26 119.26 126.75 2i9l h ALA 85 Ca 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2i9l h ALA 85 Cb 1.30 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2i9l h ALA 85 CO -0.86 -1.52 -0.04 1.88 0.00 0.00 0.00 179.25 178.71 2i9l h TYR 86 N 0.00 0.00 -0.11 0.00 0.05 -1.28 -3.37 116.97 112.27 2i9l h TYR 86 Ca 0.52 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.30 2i9l h TYR 86 Cb 2.42 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 40.15 2i9l h TYR 86 CO 0.00 0.00 0.07 0.28 -1.05 0.00 0.00 178.16 177.46 2i9l h VAL 87 N 0.00 1.03 -1.04 -2.88 2.07 -0.63 -2.95 116.25 111.85 2i9l h VAL 87 Ca 0.00 -0.06 0.27 0.00 0.82 0.00 0.00 66.70 67.73 2i9l h VAL 87 Cb 0.93 0.88 -0.10 0.00 -1.52 0.00 0.00 31.29 31.48 2i9l h VAL 87 CO 0.00 0.03 0.67 -0.65 0.02 0.00 0.00 177.57 177.64 2i9l h PRO 88 N 0.14 0.39 -0.23 1.57 0.11 -1.74 0.94 132.00 133.18 2i9l h PRO 88 Ca 0.04 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.06 2i9l h PRO 88 Cb -0.01 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 2i9l h PRO 88 CO -0.01 0.26 -0.10 0.00 -0.21 0.00 0.00 178.00 177.94 2i9l h ALA 89 N 1.63 0.32 -0.28 -0.75 0.00 -1.77 -2.61 119.26 115.81 2i9l h ALA 89 Ca 0.60 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 55.26 2i9l h ALA 89 Cb 1.51 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.18 2i9l h ALA 89 CO -0.32 0.16 0.07 0.52 0.00 0.00 0.00 179.25 179.68 2i9l h MET 90 N 0.19 0.18 -0.11 0.00 2.86 -0.80 -0.70 114.93 116.54 2i9l h MET 90 Ca 0.05 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 2i9l h MET 90 Cb 0.59 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.16 2i9l h MET 90 CO 0.03 0.12 -0.35 0.74 1.06 0.00 0.00 176.91 178.51 2i9l h PHE 91 N 0.18 -1.03 -0.69 -0.22 -1.00 -1.05 0.11 116.94 113.23 2i9l h PHE 91 Ca 0.13 0.04 0.10 0.00 2.81 0.00 0.00 57.97 61.05 2i9l h PHE 91 Cb 0.12 0.46 -0.04 0.00 3.61 0.00 0.00 35.95 40.10 2i9l h PHE 91 CO -0.15 -0.34 0.46 1.15 -1.61 0.00 0.00 178.31 177.82 2i9l h THR 92 N -0.35 0.91 -0.44 -1.55 2.02 -1.30 0.43 112.91 112.62 2i9l h THR 92 Ca 0.02 -0.19 -0.14 0.00 0.77 0.00 0.00 66.41 66.87 2i9l h THR 92 Cb 0.42 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2i9l h THR 92 CO -0.29 0.10 -0.28 0.00 0.37 0.00 0.00 175.52 175.42 2i9l h ALA 93 N 1.65 0.62 -0.01 6.16 0.00 -0.15 -1.53 119.26 126.00 2i9l h ALA 93 Ca 0.32 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2i9l h ALA 93 Cb 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2i9l h ALA 93 CO -0.11 0.66 -0.76 0.00 0.00 0.00 0.00 179.25 179.04 2i9l n ALA 94 N -2.53 4.21 0.00 0.00 0.00 0.28 -4.73 120.51 117.75 2i9l n ALA 94 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.81 2i9l n ALA 94 Cb 0.49 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.16 2i9l n ALA 94 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2i9l n LEU 95 N -0.84 0.00 -1.78 0.00 4.77 0.14 -4.96 117.00 114.33 2i9l n LEU 95 Ca 0.06 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.03 2i9l n LEU 95 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2i9l n LEU 95 CO 0.36 0.00 0.01 0.59 -1.33 0.00 0.00 177.39 177.03 2i9l n ASN 96 N -0.33 -3.24 -3.43 -1.43 4.13 -0.58 -4.99 115.26 105.39 2i9l n ASN 96 Ca 0.00 0.11 0.01 0.00 1.68 0.00 0.00 54.58 56.38 2i9l n ASN 96 Cb 0.02 -1.91 -0.03 0.00 -1.54 0.00 0.00 39.78 36.31 2i9l n ASN 96 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2i9l s ILE 97 N -1.43 -0.76 0.98 2.41 -1.09 -1.26 -4.96 121.20 115.09 2i9l s ILE 97 Ca 0.05 0.00 -0.12 0.00 -2.23 0.00 0.00 60.65 58.35 2i9l s ILE 97 Cb -0.01 -1.00 0.18 0.00 -1.58 0.00 0.00 42.46 40.04 2i9l s ILE 97 CO 0.16 0.00 1.08 -1.10 -1.23 0.00 0.00 174.94 173.85 2i9l s GLN 98 N 2.74 0.59 0.00 2.79 1.11 -1.26 -3.73 119.66 121.90 2i9l s GLN 98 Ca 0.00 0.82 0.00 0.00 0.01 0.00 0.00 55.36 56.19 2i9l s GLN 98 Cb -0.10 -1.73 0.00 0.00 -1.01 0.00 0.00 33.01 30.17 2i9l s GLN 98 CO -0.18 -2.70 0.00 -2.37 0.01 0.00 0.00 175.29 170.05 2i9l n THR 99 N -4.20 0.00 -2.03 -0.19 5.66 -1.26 -5.00 114.28 107.27 2i9l n THR 99 Ca 0.06 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.79 2i9l n THR 99 Cb 0.55 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 69.41 2i9l n THR 99 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2i9l s SER 100 N 0.00 4.65 0.00 1.09 1.04 -1.26 -4.73 113.70 114.49 2i9l s SER 100 Ca 0.00 0.64 0.09 0.00 0.48 0.00 0.00 55.95 57.16 2i9l s SER 100 Cb 0.00 -1.21 0.44 0.00 0.10 0.00 0.00 66.02 65.35 2i9l s SER 100 CO 0.00 -1.77 1.13 1.33 0.98 0.00 0.00 173.24 174.91 2i9l n VAL 101 N -3.14 0.74 -0.06 5.02 0.24 -1.26 -2.51 118.33 117.36 2i9l n VAL 101 Ca 0.08 0.19 -0.12 0.00 -2.04 0.00 0.00 64.34 62.45 2i9l n VAL 101 Cb 0.61 -1.05 -0.04 0.00 -1.47 0.00 0.00 33.84 31.89 2i9l n VAL 101 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2i9l n ASN 102 N -1.26 1.43 0.00 -1.34 3.02 -1.26 -4.58 115.26 111.27 2i9l n ASN 102 Ca 0.04 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 2i9l n ASN 102 Cb 0.06 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 38.69 2i9l n ASN 102 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2i9l n THR 103 N -3.94 1.60 0.10 3.41 -2.24 -1.18 -3.27 114.28 108.76 2i9l n THR 103 Ca -0.21 0.42 -0.08 0.00 -2.27 0.00 0.00 64.05 61.92 2i9l n THR 103 Cb 0.52 -1.42 -0.04 0.00 -2.10 0.00 0.00 70.33 67.29 2i9l n THR 103 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2i9l h VAL 104 N 0.00 0.00 -0.89 2.28 2.07 -1.74 0.38 116.25 118.35 2i9l h VAL 104 Ca 0.00 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.74 2i9l h VAL 104 Cb 0.04 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.65 2i9l h VAL 104 CO 0.00 0.00 -0.02 0.58 0.02 0.00 0.00 177.57 178.15 2i9l h VAL 105 N -0.41 0.16 0.50 2.57 2.07 -1.89 0.10 116.25 119.36 2i9l h VAL 105 Ca -0.02 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2i9l h VAL 105 Cb 0.37 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2i9l h VAL 105 CO -0.06 0.01 -0.24 -0.09 0.02 0.00 0.00 177.57 177.21 2i9l h ARG 106 N 0.05 -0.65 -0.92 1.57 2.43 -1.71 -2.46 114.38 112.70 2i9l h ARG 106 Ca 0.50 0.04 0.23 0.00 -0.81 0.00 0.00 59.98 59.95 2i9l h ARG 106 Cb 0.94 0.15 -0.13 0.00 -0.42 0.00 0.00 29.97 30.51 2i9l h ARG 106 CO -0.83 -0.35 0.42 -0.44 -1.51 0.00 0.00 179.97 177.26 2i9l h ASP 107 N -1.04 0.37 0.89 -3.80 3.45 0.78 -0.30 116.42 116.77 2i9l h ASP 107 Ca -0.07 0.16 -0.04 0.00 0.43 0.00 0.00 57.03 57.51 2i9l h ASP 107 Cb 0.60 0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.50 2i9l h ASP 107 CO 0.11 -0.01 -0.46 0.15 -1.57 0.00 0.00 179.24 177.46 2i9l h PHE 108 N 0.41 -1.21 -0.88 4.55 3.57 -0.82 -1.09 116.94 121.46 2i9l h PHE 108 Ca 0.58 -0.02 0.24 0.00 3.53 0.00 0.00 57.97 62.30 2i9l h PHE 108 Cb 1.13 0.41 -0.14 0.00 2.79 0.00 0.00 35.95 40.14 2i9l h PHE 108 CO -0.12 -0.73 0.24 0.93 -2.23 0.00 0.00 178.31 176.40 2i9l h GLU 109 N -1.24 0.20 0.09 1.11 5.08 -0.62 0.21 114.58 119.41 2i9l h GLU 109 Ca -0.12 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2i9l h GLU 109 Cb 0.97 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2i9l h GLU 109 CO 0.18 0.13 -0.04 -0.91 -1.00 0.00 0.00 179.01 177.36 2i9l h ASN 110 N 0.21 -0.11 -0.41 1.42 2.35 -0.90 -0.10 115.58 118.05 2i9l h ASN 110 Ca 0.56 -0.13 0.08 0.00 -0.55 0.00 0.00 56.30 56.25 2i9l h ASN 110 Cb 1.13 0.03 -0.07 0.00 0.05 0.00 0.00 38.32 39.46 2i9l h ASN 110 CO -0.66 0.07 -0.01 0.22 -1.65 0.00 0.00 177.43 175.40 2i9l h TYR 111 N -0.28 -0.03 0.33 1.19 3.20 0.49 -0.97 116.97 120.90 2i9l h TYR 111 Ca -0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2i9l h TYR 111 Cb 0.23 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 2i9l h TYR 111 CO -0.02 -0.09 -0.26 0.28 -1.64 0.00 0.00 178.16 176.43 2i9l h VAL 112 N 0.10 0.00 -0.81 1.81 2.07 -0.49 -1.19 116.25 117.74 2i9l h VAL 112 Ca 0.20 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.86 2i9l h VAL 112 Cb 0.29 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.92 2i9l h VAL 112 CO -0.34 0.00 -0.35 0.11 0.02 0.00 0.00 177.57 177.01 2i9l h LYS 113 N -0.58 -0.07 0.00 1.57 1.79 -0.84 0.56 116.57 119.01 2i9l h LYS 113 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2i9l h LYS 113 Cb 0.48 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 2i9l h LYS 113 CO 0.01 -0.05 0.00 1.04 -1.08 0.00 0.00 179.45 179.37 2i9l n GLN 114 N -5.46 0.00 -0.21 3.15 6.02 -0.39 -2.55 117.38 117.94 2i9l n GLN 114 Ca 0.08 0.53 -0.05 0.00 -0.01 0.00 0.00 57.00 57.55 2i9l n GLN 114 Cb 0.38 -1.44 0.01 0.00 1.02 0.00 0.00 30.24 30.22 2i9l n GLN 114 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2i9l h THR 115 N 0.00 0.18 0.00 5.09 2.02 -0.77 -1.62 112.91 117.81 2i9l h THR 115 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2i9l h THR 115 Cb 0.00 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.59 2i9l h THR 115 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 2i9l n ASN 117 N -1.54 1.99 -4.54 0.00 3.02 -0.65 -4.38 115.26 109.16 2i9l n ASN 117 Ca 0.03 -1.49 -0.37 0.00 -0.03 0.00 0.00 54.58 52.72 2i9l n ASN 117 Cb 0.14 0.15 0.07 0.00 -0.61 0.00 0.00 39.78 39.53 2i9l n ASN 117 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2i9l n SER 118 N 0.50 -0.29 -0.24 6.41 7.64 -0.71 -4.62 113.62 122.32 2i9l n SER 118 Ca 0.08 0.68 -0.04 0.00 1.01 0.00 0.00 58.87 60.59 2i9l n SER 118 Cb 0.35 -1.30 0.13 0.00 -1.01 0.00 0.00 64.21 62.37 2i9l n SER 118 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2i9l h SER 119 N -0.09 0.98 -0.76 6.43 0.02 -1.93 -0.57 113.55 117.64 2i9l h SER 119 Ca -0.47 -0.13 0.16 0.00 -0.84 0.00 0.00 61.79 60.51 2i9l h SER 119 Cb 1.36 -0.25 -0.10 0.00 0.14 0.00 0.00 62.40 63.54 2i9l h SER 119 CO 0.46 0.86 0.27 0.00 -1.14 0.00 0.00 176.83 177.28 2i9l h ALA 120 N 1.28 1.07 0.06 3.77 0.00 -1.93 -0.29 119.26 123.22 2i9l h ALA 120 Ca 0.25 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 2i9l h ALA 120 Cb 0.17 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2i9l h ALA 120 CO -0.02 -0.26 -0.03 0.28 0.00 0.00 0.00 179.25 179.21 2i9l h VAL 121 N 0.38 0.00 -0.09 0.00 2.07 -1.63 -3.33 116.25 113.66 2i9l h VAL 121 Ca 0.43 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.62 2i9l h VAL 121 Cb 0.70 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2i9l h VAL 121 CO -0.45 0.00 0.08 -0.37 0.02 0.00 0.00 177.57 176.85 2i9l h VAL 122 N -0.43 0.75 -0.04 2.57 -1.51 -1.15 -1.95 116.25 114.49 2i9l h VAL 122 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.46 2i9l h VAL 122 Cb 0.06 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 30.17 2i9l h VAL 122 CO 0.01 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.82 2i9l n ASP 123 N -4.20 0.92 -4.62 4.19 8.00 -0.12 -4.83 116.55 115.88 2i9l n ASP 123 Ca -0.01 -1.38 -0.43 0.00 0.71 0.00 0.00 54.79 53.68 2i9l n ASP 123 Cb 0.18 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.24 2i9l n ASP 123 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2i9l s ASN 124 N -1.87 6.48 0.00 -2.24 3.84 -0.73 -4.83 114.94 115.58 2i9l s ASN 124 Ca 0.39 1.23 0.16 0.00 0.21 0.00 0.00 52.86 54.84 2i9l s ASN 124 Cb 0.20 -2.54 0.39 0.00 -0.55 0.00 0.00 41.25 38.75 2i9l s ASN 124 CO 0.32 -1.24 1.31 1.17 -2.79 0.00 0.00 177.10 175.86 2i9l n LYS 125 N 7.64 2.49 -2.25 0.43 3.00 -1.26 -4.84 118.16 123.37 2i9l n LYS 125 Ca 0.17 -2.15 -0.43 0.00 -0.00 0.00 0.00 58.31 55.90 2i9l n LYS 125 Cb 0.47 -1.38 -0.02 0.00 0.00 0.00 0.00 35.03 34.09 2i9l n LYS 125 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2i9l s LEU 126 N -1.08 3.85 0.07 3.14 2.96 -1.26 -4.95 118.68 121.42 2i9l s LEU 126 Ca 0.31 1.39 -0.32 0.00 -0.22 0.00 0.00 54.13 55.30 2i9l s LEU 126 Cb 0.17 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 43.15 2i9l s LEU 126 CO 0.23 -1.21 1.64 0.50 -1.32 0.00 0.00 176.35 176.18 2i9l h LYS 127 N 10.22 -0.76 -5.47 1.98 3.64 -1.92 -3.40 116.57 120.85 2i9l h LYS 127 Ca -0.30 0.05 -0.62 0.00 -1.27 0.00 0.00 60.65 58.51 2i9l h LYS 127 Cb 1.13 0.17 -0.13 0.00 -0.41 0.00 0.00 32.23 32.99 2i9l h LYS 127 CO 1.02 -0.51 0.12 0.42 -2.27 0.00 0.00 179.45 178.23 2i9l s ILE 128 N -6.07 4.94 -0.05 2.00 1.09 -1.26 -1.30 121.20 120.55 2i9l s ILE 128 Ca -0.17 0.77 0.05 0.00 -1.10 0.00 0.00 60.65 60.20 2i9l s ILE 128 Cb 0.04 -4.00 -0.02 0.00 -1.06 0.00 0.00 42.46 37.42 2i9l s ILE 128 CO 0.63 -0.16 -0.20 -1.10 -0.10 0.00 0.00 174.94 174.01 2i9l s GLN 129 N 2.59 2.50 -0.09 2.79 -0.21 -0.01 -4.79 119.66 122.44 2i9l s GLN 129 Ca 0.24 -0.80 -0.16 0.00 0.02 0.00 0.00 55.36 54.65 2i9l s GLN 129 Cb -0.15 -2.27 -0.05 0.00 1.00 0.00 0.00 33.01 31.55 2i9l s GLN 129 CO 0.12 0.51 0.42 -0.80 -2.12 0.00 0.00 175.29 173.42 2i9l s ASN 130 N -0.46 6.67 -0.26 5.90 0.01 -1.26 -0.04 114.94 125.51 2i9l s ASN 130 Ca 0.05 0.80 -0.10 0.00 -0.71 0.00 0.00 52.86 52.91 2i9l s ASN 130 Cb -0.12 -2.26 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 2i9l s ASN 130 CO 0.01 0.11 0.14 -0.69 -1.51 0.00 0.00 177.10 175.17 2i9l s VAL 131 N 0.11 5.02 -0.29 1.60 1.01 -0.08 -4.95 120.40 122.82 2i9l s VAL 131 Ca 0.24 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.27 2i9l s VAL 131 Cb -0.15 -3.36 0.09 0.00 0.00 0.00 0.00 36.38 32.96 2i9l s VAL 131 CO 0.10 0.31 0.09 -0.63 0.00 0.00 0.00 175.10 174.97 2i9l s ILE 132 N 1.47 0.64 0.50 2.22 -1.09 -1.26 -1.75 121.20 121.94 2i9l s ILE 132 Ca 0.07 -1.16 -0.07 0.00 -2.23 0.00 0.00 60.65 57.26 2i9l s ILE 132 Cb -0.15 -1.44 0.11 0.00 -1.58 0.00 0.00 42.46 39.40 2i9l s ILE 132 CO 0.07 -0.62 0.69 -0.38 -1.23 0.00 0.00 174.94 173.47 2i9l n ILE 133 N 4.95 0.00 -0.67 2.92 2.08 -1.06 -4.97 119.36 122.61 2i9l n ILE 133 Ca -0.04 -0.61 0.00 0.00 0.56 0.00 0.00 62.75 62.66 2i9l n ILE 133 Cb 0.43 -1.59 0.00 0.00 -0.75 0.00 0.00 39.64 37.73 2i9l n ILE 133 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 2i9l n ASP 134 N -3.35 0.19 -3.64 4.38 3.85 -1.26 -2.87 116.55 113.85 2i9l n ASP 134 Ca 0.09 -0.88 -0.10 0.00 -0.71 0.00 0.00 54.79 53.19 2i9l n ASP 134 Cb 0.32 0.03 -0.07 0.00 -1.35 0.00 0.00 41.12 40.05 2i9l n ASP 134 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 2i9l s GLU 135 N -0.03 0.67 -0.28 0.11 2.12 -1.26 -1.54 118.70 118.49 2i9l s GLU 135 Ca 0.00 0.90 -0.24 0.00 0.36 0.00 0.00 54.97 55.99 2i9l s GLU 135 Cb 0.00 0.27 0.11 0.00 0.26 0.00 0.00 34.13 34.77 2i9l s GLU 135 CO 0.00 -0.10 0.91 0.00 -0.54 0.00 0.00 175.26 175.54 2i9l s TYR 137 N 0.42 1.69 0.01 0.00 2.02 -1.26 -0.86 117.35 119.38 2i9l s TYR 137 Ca 0.01 -0.45 -0.01 0.00 -0.37 0.00 0.00 57.07 56.25 2i9l s TYR 137 Cb -0.05 -0.90 -0.01 0.00 -0.40 0.00 0.00 41.96 40.59 2i9l s TYR 137 CO -0.05 0.21 0.00 0.20 -1.57 0.00 0.00 175.55 174.34 2i9l s GLY 138 N -2.12 0.17 0.71 0.71 0.00 -0.71 -4.64 107.32 101.44 2i9l s GLY 138 Ca 0.08 -0.41 -0.15 0.00 0.00 0.00 0.00 44.72 44.25 2i9l s GLY 138 CO 0.04 -0.47 1.16 0.00 0.00 0.00 0.00 173.10 173.83 2i9l s ALA 139 N -1.17 2.23 0.13 3.20 0.00 -1.06 -4.76 121.76 120.33 2i9l s ALA 139 Ca -0.13 0.72 -0.19 0.00 0.00 0.00 0.00 51.96 52.36 2i9l s ALA 139 Cb -0.08 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 2i9l s ALA 139 CO -0.00 -1.68 1.75 -1.35 0.00 0.00 0.00 175.76 174.48 2i9l h PRO 140 N -0.26 0.21 0.00 0.00 0.11 -1.98 -3.23 132.00 126.85 2i9l h PRO 140 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2i9l h PRO 140 Cb 1.27 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2i9l h PRO 140 CO 0.51 0.14 0.00 0.41 -0.21 0.00 0.00 178.00 178.85 2i9l n GLY 141 N -1.18 -2.51 3.54 -0.55 0.00 -1.26 -4.72 105.19 98.50 2i9l n GLY 141 Ca -0.02 0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 2i9l n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i9l s SER 142 N -2.08 4.82 0.68 1.61 1.04 -1.22 -5.12 113.70 113.43 2i9l s SER 142 Ca 0.00 -0.07 -0.10 0.00 0.48 0.00 0.00 55.95 56.26 2i9l s SER 142 Cb 0.00 -1.61 0.02 0.00 0.10 0.00 0.00 66.02 64.52 2i9l s SER 142 CO 0.00 0.24 1.04 -2.16 0.98 0.00 0.00 173.24 173.34 2i9l s PRO 143 N -0.05 2.81 -0.07 4.02 0.04 -1.25 -2.56 135.00 137.94 2i9l s PRO 143 Ca 0.01 0.29 -0.18 0.00 0.04 0.00 0.00 61.00 61.16 2i9l s PRO 143 Cb -0.13 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 2i9l s PRO 143 CO 0.03 -0.98 0.50 0.99 0.04 0.00 0.00 177.00 177.57 2i9l s THR 144 N -3.27 5.09 -0.33 1.26 2.01 -0.32 -4.86 115.64 115.22 2i9l s THR 144 Ca 0.57 1.01 -0.11 0.00 0.31 0.00 0.00 61.69 63.48 2i9l s THR 144 Cb -0.11 -3.83 -0.00 0.00 0.01 0.00 0.00 72.50 68.57 2i9l s THR 144 CO 0.50 0.39 0.19 0.20 -0.69 0.00 0.00 174.62 175.20 2i9l s ASN 145 N 0.15 5.72 -0.05 3.53 -0.87 -1.26 0.98 114.94 123.13 2i9l s ASN 145 Ca 0.27 -0.62 0.01 0.00 -1.57 0.00 0.00 52.86 50.95 2i9l s ASN 145 Cb -0.16 -2.04 -0.03 0.00 -0.02 0.00 0.00 41.25 39.00 2i9l s ASN 145 CO 0.13 -0.26 -0.06 -0.76 -2.57 0.00 0.00 177.10 173.58 2i9l s LEU 146 N 1.63 3.24 -0.09 0.60 1.43 0.49 -4.94 118.68 121.03 2i9l s LEU 146 Ca 0.04 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 2i9l s LEU 146 Cb -0.18 -1.75 0.02 0.00 0.03 0.00 0.00 46.19 44.31 2i9l s LEU 146 CO 0.07 0.35 -0.11 -0.70 0.23 0.00 0.00 176.35 176.19 2i9l s GLU 147 N -0.97 1.69 -0.33 1.70 2.12 -1.26 -1.39 118.70 120.26 2i9l s GLU 147 Ca 0.14 -0.37 -0.16 0.00 0.36 0.00 0.00 54.97 54.94 2i9l s GLU 147 Cb -0.11 -1.52 -0.01 0.00 0.26 0.00 0.00 34.13 32.75 2i9l s GLU 147 CO 0.03 -0.09 0.39 0.12 -0.54 0.00 0.00 175.26 175.17 2i9l s PHE 148 N 1.08 3.21 -0.41 5.30 5.36 0.80 -4.95 117.98 128.37 2i9l s PHE 148 Ca -0.07 0.08 -0.23 0.00 -0.96 0.00 0.00 56.93 55.75 2i9l s PHE 148 Cb -0.14 -2.70 0.02 0.00 -0.34 0.00 0.00 43.02 39.85 2i9l s PHE 148 CO -0.01 -0.42 0.79 0.42 -1.46 0.00 0.00 175.22 174.53 2i9l s ILE 149 N 2.09 4.69 -0.46 3.12 1.09 -1.26 -0.07 121.20 130.40 2i9l s ILE 149 Ca 0.13 0.66 -0.29 0.00 -1.10 0.00 0.00 60.65 60.06 2i9l s ILE 149 Cb -0.16 -4.27 0.03 0.00 -1.06 0.00 0.00 42.46 37.00 2i9l s ILE 149 CO 0.12 -0.58 1.18 0.21 -0.10 0.00 0.00 174.94 175.77 2i9l s ASN 150 N 1.99 6.60 0.27 3.58 2.47 0.26 -4.89 114.94 125.23 2i9l s ASN 150 Ca 0.31 0.57 0.07 0.00 0.42 0.00 0.00 52.86 54.23 2i9l s ASN 150 Cb -0.13 -2.55 0.36 0.00 -1.45 0.00 0.00 41.25 37.49 2i9l s ASN 150 CO 0.20 -1.26 1.63 0.71 -3.72 0.00 0.00 177.10 174.66 2i9l h THR 151 N 6.24 1.37 0.00 -5.21 1.35 -1.86 -0.92 112.91 113.89 2i9l h THR 151 Ca -0.24 -1.85 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2i9l h THR 151 Cb 1.07 1.94 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 2i9l h THR 151 CO 1.11 0.54 0.00 0.61 -0.25 0.00 0.00 175.52 177.54 2i9l n GLY 152 N 0.10 0.93 3.12 5.82 0.00 -1.26 -2.51 105.19 111.38 2i9l n GLY 152 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 2i9l n GLY 152 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i9l s SER 153 N -1.76 1.24 0.21 1.61 1.04 -1.26 -0.80 113.70 113.97 2i9l s SER 153 Ca 0.00 -0.60 -0.09 0.00 0.48 0.00 0.00 55.95 55.73 2i9l s SER 153 Cb 0.00 0.00 0.24 0.00 0.10 0.00 0.00 66.02 66.36 2i9l s SER 153 CO 0.00 -0.16 1.80 0.28 0.98 0.00 0.00 173.24 176.14 2i9l h SER 154 N 4.31 0.50 -0.49 7.02 0.02 -1.88 0.09 113.55 123.13 2i9l h SER 154 Ca -0.38 0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 60.50 2i9l h SER 154 Cb 1.20 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.66 2i9l h SER 154 CO 0.42 0.32 -0.08 0.50 -1.14 0.00 0.00 176.83 176.85 2i9l h LYS 155 N 0.64 0.96 -0.00 3.45 3.64 -1.83 -2.27 116.57 121.16 2i9l h LYS 155 Ca 0.30 -0.33 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2i9l h LYS 155 Cb 0.21 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2i9l h LYS 155 CO -0.20 0.99 0.00 0.78 -2.27 0.00 0.00 179.45 178.76 2i9l h GLY 156 N 0.97 0.00 2.00 5.01 0.00 -1.62 -3.01 103.07 106.41 2i9l h GLY 156 Ca 0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.45 2i9l h GLY 156 CO 0.04 0.00 -0.12 3.43 0.00 0.00 0.00 176.54 179.89 2i9l h ASN 157 N -0.28 0.00 -0.76 0.19 2.35 -1.02 -2.06 115.58 114.00 2i9l h ASN 157 Ca 0.00 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.81 2i9l h ASN 157 Cb 0.28 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.59 2i9l h ASN 157 CO 0.00 0.12 0.45 0.00 -1.65 0.00 0.00 177.43 176.35 2i9l h ALA 159 N 1.37 0.24 -0.69 0.00 0.00 -1.39 -1.53 119.26 117.26 2i9l h ALA 159 Ca 0.34 -0.33 0.06 0.00 0.00 0.00 0.00 54.91 54.97 2i9l h ALA 159 Cb 0.18 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2i9l h ALA 159 CO -0.18 0.14 0.39 0.82 0.00 0.00 0.00 179.25 180.42 2i9l h ILE 160 N 0.04 0.98 -0.59 0.00 1.08 -1.07 -0.50 117.51 117.45 2i9l h ILE 160 Ca 0.03 -0.25 -0.05 0.00 -0.39 0.00 0.00 64.86 64.20 2i9l h ILE 160 Cb 0.70 0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.61 2i9l h ILE 160 CO 0.04 0.13 0.17 0.50 -0.69 0.00 0.00 178.15 178.30 2i9l h LYS 161 N 0.73 0.92 -0.84 2.37 3.64 0.03 -0.30 116.57 123.13 2i9l h LYS 161 Ca 0.31 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 2i9l h LYS 161 Cb 0.18 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 2i9l h LYS 161 CO -0.18 0.84 0.49 0.00 -2.27 0.00 0.00 179.45 178.33 2i9l h ALA 162 N 1.04 1.07 -0.33 5.00 0.00 -0.70 0.03 119.26 125.38 2i9l h ALA 162 Ca 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2i9l h ALA 162 Cb 0.31 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2i9l h ALA 162 CO -0.00 0.55 0.16 1.25 0.00 0.00 0.00 179.25 181.20 2i9l h LEU 163 N 1.15 0.43 -0.61 0.00 5.85 -0.63 -2.79 115.31 118.72 2i9l h LEU 163 Ca 0.30 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.90 2i9l h LEU 163 Cb -0.02 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 2i9l h LEU 163 CO -0.05 0.44 0.40 -0.03 -0.34 0.00 0.00 178.44 178.85 2i9l h MET 164 N 0.39 0.80 -0.79 1.25 4.05 -0.34 -1.45 114.93 118.84 2i9l h MET 164 Ca 0.11 -0.05 0.13 0.00 -0.28 0.00 0.00 59.70 59.61 2i9l h MET 164 Cb 0.12 -0.18 -0.06 0.00 -0.80 0.00 0.00 31.60 30.69 2i9l h MET 164 CO -0.01 0.53 0.52 1.96 0.23 0.00 0.00 176.91 180.13 2i9l h GLN 165 N 0.82 0.56 -0.04 0.39 4.20 -0.80 -0.46 115.11 119.78 2i9l h GLN 165 Ca 0.22 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.85 2i9l h GLN 165 Cb -0.09 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.56 2i9l h GLN 165 CO -0.05 0.37 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.23 2i9l h LEU 166 N 0.58 0.22 -0.28 1.46 3.38 -1.07 -3.15 115.31 116.44 2i9l h LEU 166 Ca 0.39 -0.66 0.07 0.00 0.09 0.00 0.00 57.88 57.76 2i9l h LEU 166 Cb 0.69 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.30 2i9l h LEU 166 CO -0.15 0.84 -0.24 0.74 0.09 0.00 0.00 178.44 179.73 2i9l h THR 167 N -0.39 0.39 -0.19 0.22 2.02 -0.29 -0.61 112.91 114.06 2i9l h THR 167 Ca -0.01 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.22 2i9l h THR 167 Cb 0.84 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 2i9l h THR 167 CO 0.04 0.00 0.14 0.71 0.37 0.00 0.00 175.52 176.77 2i9l h THR 168 N -0.23 0.90 0.00 3.16 1.35 -1.22 0.83 112.91 117.71 2i9l h THR 168 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.01 2i9l h THR 168 Cb 0.46 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 2i9l h THR 168 CO -0.41 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.15 2i9l n LYS 169 N -4.47 0.44 -0.00 4.72 4.76 -0.25 -2.25 118.16 121.11 2i9l n LYS 169 Ca 0.02 0.05 0.10 0.00 -2.87 0.00 0.00 58.31 55.61 2i9l n LYS 169 Cb 0.28 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 31.87 2i9l n LYS 169 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2i9l n ALA 170 N -1.21 4.60 0.87 7.82 0.00 0.28 -3.95 120.51 128.93 2i9l n ALA 170 Ca 0.13 -0.58 0.13 0.00 0.00 0.00 0.00 53.44 53.11 2i9l n ALA 170 Cb 0.16 -0.79 0.36 0.00 0.00 0.00 0.00 19.45 19.17 2i9l n ALA 170 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2i9l n THR 171 N -1.54 0.13 0.80 0.00 -2.24 -0.95 -3.08 114.28 107.40 2i9l n THR 171 Ca 0.04 -0.09 0.11 0.00 -2.27 0.00 0.00 64.05 61.84 2i9l n THR 171 Cb 0.34 -0.13 0.48 0.00 -2.10 0.00 0.00 70.33 68.92 2i9l n THR 171 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2i9l n THR 172 N -1.70 0.47 -0.02 4.28 -2.24 -1.25 -3.21 114.28 110.61 2i9l n THR 172 Ca 0.05 0.12 -0.03 0.00 -2.27 0.00 0.00 64.05 61.92 2i9l n THR 172 Cb 0.37 -0.74 -0.12 0.00 -2.10 0.00 0.00 70.33 67.73 2i9l n THR 172 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i9l n GLN 173 N -1.47 0.65 -0.03 -0.78 1.13 -1.18 -4.39 117.38 111.32 2i9l n GLN 173 Ca 0.06 0.13 -0.15 0.00 -1.94 0.00 0.00 57.00 55.11 2i9l n GLN 173 Cb 0.24 -1.70 -0.10 0.00 0.11 0.00 0.00 30.24 28.79 2i9l n GLN 173 CO 0.00 0.00 0.00 -0.84 -1.44 0.00 0.00 177.06 174.78 2i9l h ILE 174 N 0.00 1.48 -3.54 5.09 -0.00 -1.70 -3.42 117.51 115.40 2i9l h ILE 174 Ca -0.28 -1.76 -0.56 0.00 -0.00 0.00 0.00 64.86 62.26 2i9l h ILE 174 Cb 1.79 2.50 -0.06 0.00 -0.00 0.00 0.00 36.82 41.05 2i9l h ILE 174 CO 0.04 0.49 0.94 0.00 -0.00 0.00 0.00 178.15 179.63 2i9l s ALA 175 N -3.48 3.21 -2.00 0.16 0.00 -1.24 -4.88 121.76 113.53 2i9l s ALA 175 Ca -0.15 -0.32 0.05 0.00 0.00 0.00 0.00 51.96 51.54 2i9l s ALA 175 Cb 0.02 -3.86 0.31 0.00 0.00 0.00 0.00 23.12 19.59 2i9l s ALA 175 CO 0.75 -2.12 0.78 -2.30 0.00 0.00 0.00 175.76 172.86