#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dtw s THR 18 N 0.00 0.03 0.08 5.09 2.01 -1.26 -1.61 115.64 119.98 1dtw s THR 18 Ca 0.00 -0.23 0.09 0.00 0.31 0.00 0.00 61.69 61.85 1dtw s THR 18 Cb 0.00 -0.17 -0.03 0.00 0.01 0.00 0.00 72.50 72.31 1dtw s THR 18 CO 0.00 -0.13 -0.23 -1.58 -0.69 0.00 0.00 174.62 171.99 1dtw s GLN 19 N -0.38 1.38 0.11 4.92 0.74 -0.99 -4.86 119.66 120.58 1dtw s GLN 19 Ca -0.04 -1.13 -0.30 0.00 0.05 0.00 0.00 55.36 53.93 1dtw s GLN 19 Cb -0.03 -1.63 -0.07 0.00 1.10 0.00 0.00 33.01 32.38 1dtw s GLN 19 CO 0.00 0.40 1.20 0.15 -0.55 0.00 0.00 175.29 176.49 1dtw s LYS 20 N -1.61 4.46 0.06 1.67 1.02 -1.26 -0.21 119.74 123.88 1dtw s LYS 20 Ca 0.09 1.81 0.02 0.00 0.02 0.00 0.00 55.97 57.91 1dtw s LYS 20 Cb -0.10 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.88 1dtw s LYS 20 CO 0.04 -0.18 -0.07 -1.64 -0.92 0.00 0.00 175.35 172.57 1dtw s MET 21 N 0.56 0.64 0.56 1.68 -1.94 0.14 -4.79 119.30 116.15 1dtw s MET 21 Ca 0.56 -0.98 -0.07 0.00 -1.71 0.00 0.00 55.69 53.50 1dtw s MET 21 Cb -0.31 -0.26 -0.02 0.00 2.01 0.00 0.00 34.83 36.25 1dtw s MET 21 CO 0.32 0.03 0.89 -0.80 -0.01 0.00 0.00 175.02 175.44 1dtw s ASN 22 N -2.13 6.01 0.14 3.03 0.02 -1.26 -2.03 114.94 118.72 1dtw s ASN 22 Ca -0.02 0.98 -0.17 0.00 -1.02 0.00 0.00 52.86 52.63 1dtw s ASN 22 Cb -0.04 -2.12 -0.00 0.00 0.02 0.00 0.00 41.25 39.11 1dtw s ASN 22 CO -0.02 -0.83 1.79 0.25 0.02 0.00 0.00 177.10 178.31 1dtw h LEU 23 N -0.06 0.31 -1.95 0.60 5.85 -1.61 -0.56 115.31 117.89 1dtw h LEU 23 Ca -0.46 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 1dtw h LEU 23 Cb 1.22 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 1dtw h LEU 23 CO 0.62 0.22 -0.11 2.19 -0.34 0.00 0.00 178.44 181.02 1dtw h PHE 24 N 0.39 0.00 0.16 1.25 -5.15 -1.77 -2.30 116.94 109.52 1dtw h PHE 24 Ca 0.13 0.00 -0.30 0.00 -0.20 0.00 0.00 57.97 57.60 1dtw h PHE 24 Cb -0.00 0.00 0.02 0.00 0.22 0.00 0.00 35.95 36.19 1dtw h PHE 24 CO -0.07 0.11 -1.30 1.96 -2.00 0.00 0.00 178.31 177.01 1dtw h GLN 25 N 0.00 0.45 -0.06 6.09 4.20 -1.56 -2.77 115.11 121.46 1dtw h GLN 25 Ca -0.00 -0.70 -0.06 0.00 0.06 0.00 0.00 58.65 57.95 1dtw h GLN 25 Cb 0.28 0.25 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 1dtw h GLN 25 CO 0.01 1.32 -0.23 0.66 -0.67 0.00 0.00 178.83 179.92 1dtw h SER 26 N 0.16 0.09 -0.32 1.46 4.64 -0.74 0.11 113.55 118.95 1dtw h SER 26 Ca -0.18 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.02 1dtw h SER 26 Cb 1.99 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 64.05 1dtw h SER 26 CO 0.23 0.33 -0.15 0.58 -0.87 0.00 0.00 176.83 176.95 1dtw h VAL 27 N 0.09 1.29 -0.81 0.95 2.07 -1.40 0.85 116.25 119.30 1dtw h VAL 27 Ca 0.02 -1.26 -0.04 0.00 0.82 0.00 0.00 66.70 66.23 1dtw h VAL 27 Cb 0.46 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 1dtw h VAL 27 CO 0.03 0.41 0.35 0.74 0.02 0.00 0.00 177.57 179.12 1dtw h THR 28 N 0.44 1.26 0.57 2.57 2.02 -1.13 0.35 112.91 118.99 1dtw h THR 28 Ca 0.07 -0.79 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 1dtw h THR 28 Cb 0.68 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1dtw h THR 28 CO 0.05 0.33 -0.40 -1.28 0.37 0.00 0.00 175.52 174.59 1dtw h SER 29 N 1.17 -1.03 -0.90 4.18 0.87 -0.67 0.57 113.55 117.74 1dtw h SER 29 Ca 0.27 0.07 0.06 0.00 -1.23 0.00 0.00 61.79 60.96 1dtw h SER 29 Cb 0.18 0.32 -0.06 0.00 -0.44 0.00 0.00 62.40 62.39 1dtw h SER 29 CO -0.03 -0.60 0.57 0.00 -0.53 0.00 0.00 176.83 176.24 1dtw h ALA 30 N -0.64 1.24 -0.01 6.23 0.00 -0.63 0.13 119.26 125.58 1dtw h ALA 30 Ca -0.07 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1dtw h ALA 30 Cb 0.78 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1dtw h ALA 30 CO 0.04 0.34 -0.40 -0.07 0.00 0.00 0.00 179.25 179.15 1dtw h LEU 31 N 1.04 0.02 -0.02 0.00 3.38 -0.53 -1.70 115.31 117.49 1dtw h LEU 31 Ca 0.39 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.32 1dtw h LEU 31 Cb 0.16 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1dtw h LEU 31 CO -0.17 0.42 -0.11 -0.78 0.09 0.00 0.00 178.44 177.88 1dtw h ASP 32 N 0.01 0.14 -1.00 -0.43 1.82 0.16 -2.66 116.42 114.47 1dtw h ASP 32 Ca -0.00 -0.67 0.17 0.00 -0.39 0.00 0.00 57.03 56.14 1dtw h ASP 32 Cb 0.71 -0.04 -0.10 0.00 0.68 0.00 0.00 39.33 40.58 1dtw h ASP 32 CO 0.05 0.79 0.62 0.78 -1.61 0.00 0.00 179.24 179.87 1dtw h ASN 33 N -0.50 0.81 -0.18 2.28 4.21 -0.61 -0.59 115.58 121.01 1dtw h ASN 33 Ca -0.01 0.08 -0.04 0.00 1.21 0.00 0.00 56.30 57.55 1dtw h ASN 33 Cb 0.78 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.91 1dtw h ASN 33 CO 0.02 0.33 -0.03 0.28 -1.29 0.00 0.00 177.43 176.75 1dtw h SER 34 N 0.81 0.33 0.25 5.81 0.02 -1.26 0.66 113.55 120.17 1dtw h SER 34 Ca 0.55 -0.35 -0.10 0.00 -0.84 0.00 0.00 61.79 61.05 1dtw h SER 34 Cb 0.80 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 1dtw h SER 34 CO -0.34 0.60 -0.40 -0.07 -1.14 0.00 0.00 176.83 175.48 1dtw h LEU 35 N 0.06 0.22 -0.40 5.07 3.38 -1.10 0.23 115.31 122.76 1dtw h LEU 35 Ca 0.05 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1dtw h LEU 35 Cb 0.44 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1dtw h LEU 35 CO 0.01 0.60 0.00 0.00 0.09 0.00 0.00 178.44 179.15 1dtw h ALA 36 N 1.41 0.55 0.07 1.53 0.00 -0.91 -3.31 119.26 118.61 1dtw h ALA 36 Ca 0.02 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1dtw h ALA 36 Cb 0.79 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.44 1dtw h ALA 36 CO 0.06 0.32 -0.50 0.87 0.00 0.00 0.00 179.25 180.00 1dtw h LYS 37 N 0.54 0.16 -4.44 0.00 1.57 -0.68 -3.44 116.57 110.28 1dtw h LYS 37 Ca 0.12 -0.27 -0.73 0.00 -1.87 0.00 0.00 60.65 57.90 1dtw h LYS 37 Cb 0.47 0.10 -0.22 0.00 0.08 0.00 0.00 32.23 32.67 1dtw h LYS 37 CO 0.02 1.13 -0.20 0.34 -0.57 0.00 0.00 179.45 180.17 1dtw s ASP 38 N -6.64 6.17 0.65 0.86 2.15 0.78 -4.91 116.67 115.72 1dtw s ASP 38 Ca -0.17 -1.32 0.35 0.00 0.43 0.00 0.00 52.55 51.85 1dtw s ASP 38 Cb -0.01 -2.22 1.94 0.00 -0.30 0.00 0.00 42.92 42.34 1dtw s ASP 38 CO 0.76 -0.77 2.14 -0.65 -0.17 0.00 0.00 175.17 176.48 1dtw h PRO 39 N 8.86 0.00 0.12 4.34 0.11 -1.84 -1.81 132.00 141.78 1dtw h PRO 39 Ca -0.29 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.53 1dtw h PRO 39 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1dtw h PRO 39 CO 0.94 0.00 -1.46 1.15 -0.21 0.00 0.00 178.00 178.42 1dtw h THR 40 N 0.00 1.24 -1.69 -1.15 2.02 -1.91 -3.48 112.91 107.94 1dtw h THR 40 Ca 0.02 -2.86 -0.66 0.00 0.77 0.00 0.00 66.41 63.68 1dtw h THR 40 Cb 0.37 2.81 0.09 0.00 -1.74 0.00 0.00 68.15 69.68 1dtw h THR 40 CO -0.00 0.83 0.00 0.00 0.37 0.00 0.00 175.52 176.73 1dtw n ALA 41 N -2.63 -1.57 -3.26 6.16 0.00 -0.68 -4.24 120.51 114.29 1dtw n ALA 41 Ca -0.14 0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.63 1dtw n ALA 41 Cb 1.04 -1.88 -0.13 0.00 0.00 0.00 0.00 19.45 18.47 1dtw n ALA 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1dtw s VAL 42 N -0.56 -0.02 -0.12 0.00 0.11 -0.52 -4.91 120.40 114.37 1dtw s VAL 42 Ca 0.70 0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.82 1dtw s VAL 42 Cb -0.89 -0.20 -0.01 0.00 -1.53 0.00 0.00 36.38 33.74 1dtw s VAL 42 CO 0.55 0.03 -0.15 -0.63 -3.33 0.00 0.00 175.10 171.57 1dtw s ILE 43 N 0.45 2.92 0.10 7.04 1.01 0.18 -0.62 121.20 132.27 1dtw s ILE 43 Ca -0.03 -0.71 -0.18 0.00 0.00 0.00 0.00 60.65 59.73 1dtw s ILE 43 Cb -0.05 -2.21 0.04 0.00 0.01 0.00 0.00 42.46 40.25 1dtw s ILE 43 CO -0.02 0.53 0.44 0.72 0.00 0.00 0.00 174.94 176.61 1dtw s PHE 44 N 0.33 -0.28 -4.39 3.97 -0.12 -1.02 -1.51 117.98 114.96 1dtw s PHE 44 Ca -0.12 0.10 0.00 0.00 -0.05 0.00 0.00 56.93 56.86 1dtw s PHE 44 Cb -0.16 0.29 0.00 0.00 -0.63 0.00 0.00 43.02 42.52 1dtw s PHE 44 CO 0.06 -0.67 0.00 0.41 -0.05 0.00 0.00 175.22 174.97 1dtw n GLY 45 N 0.04 -0.82 3.70 1.99 0.00 -1.13 -1.34 105.19 107.63 1dtw n GLY 45 Ca -0.17 -1.10 -0.41 0.00 0.00 0.00 0.00 46.02 44.34 1dtw n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dtw s GLU 46 N -1.76 4.40 -1.50 1.61 2.02 -1.26 -1.53 118.70 120.69 1dtw s GLU 46 Ca 0.00 1.00 -0.05 0.00 0.02 0.00 0.00 54.97 55.94 1dtw s GLU 46 Cb 0.00 -3.49 0.02 0.00 0.10 0.00 0.00 34.13 30.76 1dtw s GLU 46 CO 0.00 -0.09 0.54 -0.25 0.02 0.00 0.00 175.26 175.48 1dtw n ASP 47 N 4.30 -5.55 0.01 -0.19 9.92 -1.26 -4.83 116.55 118.95 1dtw n ASP 47 Ca 0.02 -0.28 -0.04 0.00 -0.53 0.00 0.00 54.79 53.96 1dtw n ASP 47 Cb 0.50 -4.51 -0.10 0.00 -0.64 0.00 0.00 41.12 36.37 1dtw n ASP 47 CO 0.00 0.00 0.00 1.62 0.13 0.00 0.00 177.20 178.95 1dtw h VAL 48 N -1.20 0.67 -0.00 2.53 3.04 -1.83 -2.52 116.25 116.95 1dtw h VAL 48 Ca -0.50 -2.32 0.03 0.00 -1.01 0.00 0.00 66.70 62.90 1dtw h VAL 48 Cb 1.35 2.21 -0.04 0.00 -2.01 0.00 0.00 31.29 32.80 1dtw h VAL 48 CO 0.56 0.38 -0.22 0.00 -1.01 0.00 0.00 177.57 177.28 1dtw h ALA 49 N 1.24 -0.28 0.00 3.17 0.00 -1.84 -2.40 119.26 119.15 1dtw h ALA 49 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1dtw h ALA 49 Cb 1.76 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.93 1dtw h ALA 49 CO 0.06 -0.71 0.00 1.97 0.00 0.00 0.00 179.25 180.57 1dtw n PHE 50 N -5.34 0.00 0.00 0.00 -0.00 -1.26 -4.47 117.46 106.38 1dtw n PHE 50 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.40 1dtw n PHE 50 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.74 1dtw n PHE 50 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1dtw n GLY 51 N 0.43 2.05 0.00 4.97 0.00 -0.90 -4.74 105.19 107.00 1dtw n GLY 51 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1dtw n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dtw n GLY 52 N 0.00 1.05 0.26 -0.02 0.00 -0.95 -0.52 105.19 105.00 1dtw n GLY 52 Ca 0.00 -1.84 0.15 0.00 0.00 0.00 0.00 46.02 44.32 1dtw n GLY 52 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dtw h VAL 53 N 0.00 0.14 -0.16 1.61 2.07 -1.88 -2.95 116.25 115.09 1dtw h VAL 53 Ca 0.00 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.78 1dtw h VAL 53 Cb 0.00 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1dtw h VAL 53 CO 0.00 0.06 0.00 0.49 0.02 0.00 0.00 177.57 178.14 1dtw n PHE 54 N -3.17 0.27 -1.52 1.57 3.01 -1.26 -4.99 117.46 111.38 1dtw n PHE 54 Ca 0.01 -0.59 -0.10 0.00 1.01 0.00 0.00 57.45 57.78 1dtw n PHE 54 Cb 0.37 -0.08 -0.03 0.00 -0.01 0.00 0.00 39.48 39.73 1dtw n PHE 54 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1dtw n ARG 55 N -0.22 -0.70 0.18 -1.08 5.12 -1.11 -4.93 116.66 113.92 1dtw n ARG 55 Ca 0.08 0.74 0.06 0.00 -1.93 0.00 0.00 57.85 56.81 1dtw n ARG 55 Cb 0.43 -4.69 0.22 0.00 -1.16 0.00 0.00 32.46 27.26 1dtw n ARG 55 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1dtw n THR 57 N -3.31 2.21 -1.85 0.00 -2.24 0.32 -3.67 114.28 105.75 1dtw n THR 57 Ca 0.01 -2.97 -0.41 0.00 -2.27 0.00 0.00 64.05 58.42 1dtw n THR 57 Cb 0.59 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1dtw n THR 57 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1dtw s VAL 58 N -3.17 2.14 0.00 2.28 1.01 -1.11 -2.91 120.40 118.65 1dtw s VAL 58 Ca 0.38 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1dtw s VAL 58 Cb 0.36 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.65 1dtw s VAL 58 CO -0.04 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1dtw n GLY 59 N 0.50 1.16 0.33 4.51 0.00 -1.26 -4.80 105.19 105.64 1dtw n GLY 59 Ca 0.01 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.24 1dtw n GLY 59 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dtw h LEU 60 N 0.00 0.40 -1.21 0.99 3.38 -1.87 0.67 115.31 117.67 1dtw h LEU 60 Ca 0.00 0.19 -0.08 0.00 0.09 0.00 0.00 57.88 58.08 1dtw h LEU 60 Cb 0.00 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1dtw h LEU 60 CO 0.00 -0.13 -0.35 -0.09 0.09 0.00 0.00 178.44 177.96 1dtw h ARG 61 N 0.31 0.07 0.12 1.13 2.43 -1.78 -0.58 114.38 116.08 1dtw h ARG 61 Ca 0.68 -0.03 -0.27 0.00 -0.81 0.00 0.00 59.98 59.55 1dtw h ARG 61 Cb 1.51 -0.00 0.03 0.00 -0.42 0.00 0.00 29.97 31.08 1dtw h ARG 61 CO -0.61 0.42 -1.14 -0.44 -1.51 0.00 0.00 179.97 176.69 1dtw h ASP 62 N 0.06 0.80 0.62 -3.80 3.32 -1.22 0.26 116.42 116.46 1dtw h ASP 62 Ca 0.01 -0.84 -0.11 0.00 0.02 0.00 0.00 57.03 56.11 1dtw h ASP 62 Cb 0.66 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1dtw h ASP 62 CO 0.05 1.55 -0.52 0.50 -1.72 0.00 0.00 179.24 179.10 1dtw h LYS 63 N 0.15 0.00 0.00 3.56 3.64 -1.13 -3.37 116.57 119.42 1dtw h LYS 63 Ca -0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 1dtw h LYS 63 Cb 1.83 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.65 1dtw h LYS 63 CO 0.22 0.52 -0.67 0.66 -2.27 0.00 0.00 179.45 177.91 1dtw n TYR 64 N -3.80 0.00 0.00 1.91 4.02 -0.24 -5.09 117.16 113.97 1dtw n TYR 64 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 1dtw n TYR 64 Cb 0.55 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 1dtw n TYR 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1dtw n GLY 65 N 1.89 3.22 0.17 2.72 0.00 0.08 -4.72 105.19 108.54 1dtw n GLY 65 Ca -0.00 -1.91 0.13 0.00 0.00 0.00 0.00 46.02 44.24 1dtw n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dtw h LYS 66 N 0.00 0.00 -0.52 1.61 1.57 -1.82 -2.94 116.57 114.47 1dtw h LYS 66 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1dtw h LYS 66 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1dtw h LYS 66 CO 0.00 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 178.48 1dtw n ASP 67 N -2.50 4.43 0.00 0.86 3.85 -1.26 -4.22 116.55 117.71 1dtw n ASP 67 Ca 0.02 -2.54 0.00 0.00 -0.71 0.00 0.00 54.79 51.56 1dtw n ASP 67 Cb 0.29 -0.53 0.00 0.00 -1.35 0.00 0.00 41.12 39.53 1dtw n ASP 67 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1dtw n ARG 68 N 0.66 2.42 -3.52 0.11 5.12 -1.12 -4.96 116.66 115.37 1dtw n ARG 68 Ca 0.23 0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.94 1dtw n ARG 68 Cb 0.86 -0.77 -0.14 0.00 -1.16 0.00 0.00 32.46 31.25 1dtw n ARG 68 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1dtw s VAL 69 N -1.20 -0.25 0.20 1.55 1.01 -1.14 0.50 120.40 121.07 1dtw s VAL 69 Ca 0.00 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.59 1dtw s VAL 69 Cb 0.00 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.67 1dtw s VAL 69 CO 0.00 -0.31 0.46 0.72 0.00 0.00 0.00 175.10 175.97 1dtw s PHE 70 N 2.26 0.08 0.22 5.22 -0.12 -0.57 -4.62 117.98 120.45 1dtw s PHE 70 Ca 0.06 -0.44 -0.18 0.00 -0.05 0.00 0.00 56.93 56.32 1dtw s PHE 70 Cb -0.16 0.26 -0.08 0.00 -0.63 0.00 0.00 43.02 42.41 1dtw s PHE 70 CO -0.16 -0.88 0.71 -0.80 -0.05 0.00 0.00 175.22 174.03 1dtw s ASN 71 N -2.92 7.00 0.45 1.98 0.01 -1.26 -2.85 114.94 117.35 1dtw s ASN 71 Ca 0.13 1.36 0.06 0.00 -0.71 0.00 0.00 52.86 53.71 1dtw s ASN 71 Cb 0.00 -2.40 -0.02 0.00 0.41 0.00 0.00 41.25 39.24 1dtw s ASN 71 CO -0.00 0.01 0.24 0.42 -1.51 0.00 0.00 177.10 176.26 1dtw s THR 72 N -1.57 2.07 1.04 1.60 -4.23 -0.58 -4.87 115.64 109.10 1dtw s THR 72 Ca 0.44 -1.64 -0.13 0.00 -1.18 0.00 0.00 61.69 59.17 1dtw s THR 72 Cb -0.16 -2.71 0.21 0.00 1.34 0.00 0.00 72.50 71.18 1dtw s THR 72 CO 0.20 0.00 1.10 -2.84 -0.54 0.00 0.00 174.62 172.54 1dtw s PRO 73 N -4.01 0.12 -1.27 3.99 0.02 -1.26 -4.71 135.00 127.87 1dtw s PRO 73 Ca 0.37 0.39 -0.17 0.00 0.02 0.00 0.00 61.00 61.60 1dtw s PRO 73 Cb 0.01 -1.71 0.09 0.00 0.02 0.00 0.00 34.50 32.92 1dtw s PRO 73 CO 0.21 -2.91 1.66 -1.17 -0.33 0.00 0.00 177.00 174.46 1dtw s LEU 74 N -6.54 4.11 -0.30 -5.54 0.20 -1.26 -4.79 118.68 104.56 1dtw s LEU 74 Ca 0.66 -2.55 0.05 0.00 0.69 0.00 0.00 54.13 52.98 1dtw s LEU 74 Cb -0.17 -2.54 0.19 0.00 -0.43 0.00 0.00 46.19 43.23 1dtw s LEU 74 CO 0.57 -1.08 0.53 0.00 -0.29 0.00 0.00 176.35 176.08 1dtw h GLU 76 N 7.99 0.06 -0.09 0.00 9.09 -1.89 -0.67 114.58 129.07 1dtw h GLU 76 Ca -0.03 -0.01 -0.11 0.00 0.05 0.00 0.00 59.36 59.26 1dtw h GLU 76 Cb 1.16 -0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 28.24 1dtw h GLU 76 CO 0.19 0.23 -0.42 -0.56 0.05 0.00 0.00 179.01 178.50 1dtw h GLN 77 N 0.05 0.20 0.03 1.06 3.07 -1.93 -2.42 115.11 115.17 1dtw h GLN 77 Ca 0.01 -0.10 -0.21 0.00 0.09 0.00 0.00 58.65 58.44 1dtw h GLN 77 Cb 0.34 -0.00 0.02 0.00 0.08 0.00 0.00 27.48 27.92 1dtw h GLN 77 CO 0.02 0.59 -0.85 0.78 0.09 0.00 0.00 178.83 179.47 1dtw h GLY 78 N 1.24 0.58 0.06 0.06 0.00 -1.78 -2.34 103.07 100.89 1dtw h GLY 78 Ca 0.01 -1.08 0.11 0.00 0.00 0.00 0.00 47.33 46.38 1dtw h GLY 78 CO 0.06 0.95 -0.01 -2.22 0.00 0.00 0.00 176.54 175.33 1dtw h ILE 79 N 0.07 0.55 -0.07 2.60 2.04 -0.90 0.45 117.51 122.25 1dtw h ILE 79 Ca -0.11 -0.04 -0.20 0.00 1.00 0.00 0.00 64.86 65.50 1dtw h ILE 79 Cb 1.54 0.43 0.01 0.00 -0.74 0.00 0.00 36.82 38.07 1dtw h ILE 79 CO 0.16 0.02 -0.75 0.58 0.00 0.00 0.00 178.15 178.17 1dtw h VAL 80 N 0.11 1.33 -0.89 1.67 2.07 -1.51 -0.94 116.25 118.09 1dtw h VAL 80 Ca 0.28 -2.03 0.01 0.00 0.82 0.00 0.00 66.70 65.79 1dtw h VAL 80 Cb 0.44 2.25 -0.04 0.00 -1.52 0.00 0.00 31.29 32.42 1dtw h VAL 80 CO -0.47 0.62 0.59 1.23 0.02 0.00 0.00 177.57 179.56 1dtw h GLY 81 N 0.28 1.26 1.00 2.17 0.00 -1.02 0.18 103.07 106.94 1dtw h GLY 81 Ca -0.07 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1dtw h GLY 81 CO 0.15 0.46 0.26 -2.75 0.00 0.00 0.00 176.54 174.66 1dtw h PHE 82 N 1.21 0.50 -0.60 5.60 3.57 -0.06 0.19 116.94 127.34 1dtw h PHE 82 Ca 0.33 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.83 1dtw h PHE 82 Cb -0.14 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.41 1dtw h PHE 82 CO -0.01 0.32 0.33 0.78 -2.23 0.00 0.00 178.31 177.49 1dtw h GLY 83 N 0.53 0.91 1.31 2.40 0.00 -0.24 -1.60 103.07 106.38 1dtw h GLY 83 Ca 0.14 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1dtw h GLY 83 CO -0.03 0.40 0.41 -2.22 0.00 0.00 0.00 176.54 175.10 1dtw h ILE 84 N 0.82 1.19 -0.27 2.60 2.04 -0.28 -1.03 117.51 122.59 1dtw h ILE 84 Ca 0.21 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1dtw h ILE 84 Cb 0.05 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1dtw h ILE 84 CO -0.03 0.20 0.18 1.23 0.00 0.00 0.00 178.15 179.72 1dtw h GLY 85 N 0.97 0.38 0.84 5.37 0.00 -0.01 -1.36 103.07 109.27 1dtw h GLY 85 Ca 0.25 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 1dtw h GLY 85 CO -0.05 0.14 0.03 -2.22 0.00 0.00 0.00 176.54 174.44 1dtw h ILE 86 N 0.36 1.16 -0.62 2.60 2.04 -1.05 -3.05 117.51 118.95 1dtw h ILE 86 Ca 0.10 -0.47 0.12 0.00 1.00 0.00 0.00 64.86 65.61 1dtw h ILE 86 Cb -0.03 1.34 -0.09 0.00 -0.74 0.00 0.00 36.82 37.30 1dtw h ILE 86 CO -0.02 0.13 0.13 0.00 0.00 0.00 0.00 178.15 178.40 1dtw h ALA 87 N 0.85 0.74 -0.86 1.87 0.00 -1.00 0.22 119.26 121.08 1dtw h ALA 87 Ca 0.02 0.13 0.23 0.00 0.00 0.00 0.00 54.91 55.30 1dtw h ALA 87 Cb 0.19 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1dtw h ALA 87 CO -0.00 -0.31 0.60 0.28 0.00 0.00 0.00 179.25 179.82 1dtw h VAL 88 N 0.26 0.61 0.00 0.00 2.07 -1.14 0.69 116.25 118.74 1dtw h VAL 88 Ca 0.33 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.80 1dtw h VAL 88 Cb 0.49 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1dtw h VAL 88 CO -0.42 0.02 0.00 0.41 0.02 0.00 0.00 177.57 177.61 1dtw n THR 89 N -4.36 0.82 -0.14 2.57 -1.04 0.76 -4.71 114.28 108.17 1dtw n THR 89 Ca 0.18 0.19 0.00 0.00 -2.04 0.00 0.00 64.05 62.38 1dtw n THR 89 Cb 0.84 -0.95 0.00 0.00 -1.82 0.00 0.00 70.33 68.40 1dtw n THR 89 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1dtw n GLY 90 N 0.25 0.75 3.82 3.41 0.00 0.24 -5.05 105.19 108.61 1dtw n GLY 90 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1dtw n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dtw s ALA 91 N -2.43 3.38 -0.20 4.61 0.00 -1.18 -4.95 121.76 121.00 1dtw s ALA 91 Ca 0.00 0.18 -0.29 0.00 0.00 0.00 0.00 51.96 51.85 1dtw s ALA 91 Cb 0.00 -2.85 -0.01 0.00 0.00 0.00 0.00 23.12 20.26 1dtw s ALA 91 CO 0.00 0.31 1.29 0.99 0.00 0.00 0.00 175.76 178.36 1dtw s THR 92 N -1.58 4.22 -0.23 0.00 2.01 -1.26 -3.42 115.64 115.37 1dtw s THR 92 Ca 0.45 1.45 -0.03 0.00 0.31 0.00 0.00 61.69 63.86 1dtw s THR 92 Cb -0.16 -4.01 0.01 0.00 0.01 0.00 0.00 72.50 68.34 1dtw s THR 92 CO 0.21 -0.22 -0.05 0.00 -0.69 0.00 0.00 174.62 173.87 1dtw s ALA 93 N 3.77 2.77 -0.63 7.40 0.00 0.11 -1.45 121.76 133.74 1dtw s ALA 93 Ca 0.56 -1.30 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 1dtw s ALA 93 Cb -0.21 -1.71 0.16 0.00 0.00 0.00 0.00 23.12 21.37 1dtw s ALA 93 CO 0.17 -0.60 0.44 0.42 0.00 0.00 0.00 175.76 176.19 1dtw s ILE 94 N 1.42 3.60 0.30 0.00 1.01 0.21 -0.37 121.20 127.36 1dtw s ILE 94 Ca 0.04 -3.09 -0.22 0.00 0.00 0.00 0.00 60.65 57.37 1dtw s ILE 94 Cb -0.15 -3.36 -0.09 0.00 0.01 0.00 0.00 42.46 38.87 1dtw s ILE 94 CO -0.04 -0.88 0.84 0.00 0.00 0.00 0.00 174.94 174.86 1dtw s ALA 95 N -0.21 3.28 -0.07 9.38 0.00 0.16 -2.43 121.76 131.87 1dtw s ALA 95 Ca 0.18 0.33 0.05 0.00 0.00 0.00 0.00 51.96 52.52 1dtw s ALA 95 Cb -0.20 -3.00 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 1dtw s ALA 95 CO -0.03 0.24 -0.24 -2.00 0.00 0.00 0.00 175.76 173.73 1dtw s GLU 96 N -2.24 2.63 -0.29 0.00 2.12 -0.45 -0.91 118.70 119.56 1dtw s GLU 96 Ca 0.49 -0.87 -0.03 0.00 0.36 0.00 0.00 54.97 54.93 1dtw s GLU 96 Cb -0.16 -2.14 0.04 0.00 0.26 0.00 0.00 34.13 32.13 1dtw s GLU 96 CO 0.21 0.30 0.00 0.42 -0.54 0.00 0.00 175.26 175.65 1dtw s ILE 97 N 0.02 3.11 0.35 -3.70 -1.09 -0.63 -4.24 121.20 115.01 1dtw s ILE 97 Ca -0.09 -1.25 0.15 0.00 -2.23 0.00 0.00 60.65 57.23 1dtw s ILE 97 Cb -0.15 -2.74 0.35 0.00 -1.58 0.00 0.00 42.46 38.35 1dtw s ILE 97 CO 0.05 -0.05 1.60 -0.61 -1.23 0.00 0.00 174.94 174.71 1dtw h GLN 98 N 8.04 0.09 -3.76 2.79 4.15 -1.89 -3.34 115.11 121.19 1dtw h GLN 98 Ca -0.24 -0.01 -0.24 0.00 0.77 0.00 0.00 58.65 58.93 1dtw h GLN 98 Cb 1.08 -0.02 -0.28 0.00 0.21 0.00 0.00 27.48 28.46 1dtw h GLN 98 CO 0.55 0.06 -0.72 -0.06 -1.93 0.00 0.00 178.83 176.73 1dtw s PHE 99 N -5.67 0.04 0.56 3.99 0.40 -1.26 -4.07 117.98 111.96 1dtw s PHE 99 Ca -0.10 -0.00 0.28 0.00 -0.60 0.00 0.00 56.93 56.51 1dtw s PHE 99 Cb 0.32 -0.03 1.73 0.00 0.51 0.00 0.00 43.02 45.54 1dtw s PHE 99 CO 0.78 -0.01 2.23 0.00 0.70 0.00 0.00 175.22 178.92 1dtw h ALA 100 N 6.20 1.54 0.00 5.36 0.00 -1.11 0.87 119.26 132.12 1dtw h ALA 100 Ca -0.25 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1dtw h ALA 100 Cb 1.20 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1dtw h ALA 100 CO 0.51 0.02 -0.02 -0.44 0.00 0.00 0.00 179.25 179.31 1dtw h ASP 101 N 0.00 0.00 -0.69 0.00 5.19 -1.85 -2.83 116.42 116.23 1dtw h ASP 101 Ca -0.00 0.00 -0.32 0.00 -0.62 0.00 0.00 57.03 56.09 1dtw h ASP 101 Cb 0.04 0.00 -0.19 0.00 0.18 0.00 0.00 39.33 39.36 1dtw h ASP 101 CO 0.00 0.02 0.30 -1.22 -3.12 0.00 0.00 179.24 175.23 1dtw n TYR 102 N -3.17 2.17 0.74 4.55 0.53 0.30 -4.42 117.16 117.86 1dtw n TYR 102 Ca -0.01 -1.59 0.11 0.00 -1.02 0.00 0.00 57.90 55.39 1dtw n TYR 102 Cb 0.22 -0.71 0.02 0.00 -1.03 0.00 0.00 39.34 37.84 1dtw n TYR 102 CO 0.00 0.00 0.00 1.51 -1.02 0.00 0.00 176.86 177.35 1dtw n ILE 103 N -0.92 0.08 0.12 -0.72 3.06 -1.07 -4.26 119.36 115.64 1dtw n ILE 103 Ca 0.45 -0.14 0.01 0.00 -2.50 0.00 0.00 62.75 60.57 1dtw n ILE 103 Cb 1.36 0.43 0.33 0.00 0.54 0.00 0.00 39.64 42.30 1dtw n ILE 103 CO 0.00 0.00 0.00 -0.26 -2.50 0.00 0.00 176.55 173.79 1dtw h PHE 104 N 0.00 0.23 0.00 9.51 -1.00 -1.81 -1.49 116.94 122.38 1dtw h PHE 104 Ca 0.00 -0.04 -0.00 0.00 2.81 0.00 0.00 57.97 60.74 1dtw h PHE 104 Cb 0.63 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 40.13 1dtw h PHE 104 CO 0.00 0.45 -0.01 -1.35 -1.61 0.00 0.00 178.31 175.80 1dtw h PRO 105 N 0.19 0.00 -0.19 1.51 0.11 -1.92 -1.12 132.00 130.58 1dtw h PRO 105 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1dtw h PRO 105 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 1dtw h PRO 105 CO 0.04 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 177.84 1dtw n ALA 106 N -2.23 2.44 -0.32 -0.75 0.00 -0.60 -4.28 120.51 114.77 1dtw n ALA 106 Ca -0.03 -0.83 0.10 0.00 0.00 0.00 0.00 53.44 52.68 1dtw n ALA 106 Cb 0.09 -0.82 0.27 0.00 0.00 0.00 0.00 19.45 19.00 1dtw n ALA 106 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1dtw h PHE 107 N 4.50 0.86 -0.02 0.00 3.57 -0.80 -0.86 116.94 124.18 1dtw h PHE 107 Ca 0.00 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1dtw h PHE 107 Cb 0.97 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.47 1dtw h PHE 107 CO 0.11 0.16 0.01 0.22 -2.23 0.00 0.00 178.31 176.59 1dtw h ASP 108 N 0.64 0.02 -0.46 0.41 -0.00 -1.81 -0.03 116.42 115.19 1dtw h ASP 108 Ca 0.52 -0.16 0.09 0.00 -0.00 0.00 0.00 57.03 57.48 1dtw h ASP 108 Cb 0.80 -0.01 -0.02 0.00 -0.00 0.00 0.00 39.33 40.10 1dtw h ASP 108 CO -0.40 0.18 0.31 1.56 -0.00 0.00 0.00 179.24 180.90 1dtw h GLN 109 N -0.13 0.24 0.05 0.28 1.08 -1.54 -0.43 115.11 114.66 1dtw h GLN 109 Ca 0.01 -0.01 -0.10 0.00 -1.45 0.00 0.00 58.65 57.09 1dtw h GLN 109 Cb 0.16 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1dtw h GLN 109 CO -0.00 0.16 -0.50 0.82 -0.95 0.00 0.00 178.83 178.35 1dtw h ILE 110 N 0.24 1.55 0.01 2.54 2.04 -0.85 -2.31 117.51 120.73 1dtw h ILE 110 Ca 0.21 -2.40 -0.02 0.00 1.00 0.00 0.00 64.86 63.66 1dtw h ILE 110 Cb 0.51 3.16 0.00 0.00 -0.74 0.00 0.00 36.82 39.76 1dtw h ILE 110 CO -0.04 0.62 -0.07 0.58 0.00 0.00 0.00 178.15 179.24 1dtw h VAL 111 N -0.75 1.67 0.00 1.67 2.07 -0.85 -0.79 116.25 119.27 1dtw h VAL 111 Ca -0.11 -2.07 -0.09 0.00 0.82 0.00 0.00 66.70 65.25 1dtw h VAL 111 Cb 1.30 3.06 -0.01 0.00 -1.52 0.00 0.00 31.29 34.12 1dtw h VAL 111 CO 0.03 0.54 -0.46 0.78 0.02 0.00 0.00 177.57 178.49 1dtw h ASN 112 N -0.80 0.00 0.00 0.57 2.35 -1.28 -3.37 115.58 113.05 1dtw h ASN 112 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1dtw h ASN 112 Cb 0.93 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.30 1dtw h ASN 112 CO 0.01 0.44 0.00 -0.62 -1.65 0.00 0.00 177.43 175.62 1dtw n GLU 113 N -3.20 0.00 -0.25 0.81 -0.58 -1.20 -4.53 120.64 111.68 1dtw n GLU 113 Ca 0.02 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.72 1dtw n GLU 113 Cb 0.71 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.60 1dtw n GLU 113 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1dtw h ALA 114 N -1.61 0.00 0.00 0.62 0.00 -1.43 0.37 119.26 117.21 1dtw h ALA 114 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1dtw h ALA 114 Cb 0.00 0.84 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1dtw h ALA 114 CO 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 179.25 178.58 1dtw n ALA 115 N -3.23 1.35 -0.30 0.00 0.00 -0.31 -2.42 120.51 115.61 1dtw n ALA 115 Ca 0.06 0.12 0.02 0.00 0.00 0.00 0.00 53.44 53.63 1dtw n ALA 115 Cb 0.37 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.53 1dtw n ALA 115 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1dtw n LYS 116 N -2.14 2.46 0.40 0.00 5.02 0.98 -4.02 118.16 120.87 1dtw n LYS 116 Ca 0.01 -1.67 -0.17 0.00 -2.02 0.00 0.00 58.31 54.45 1dtw n LYS 116 Cb 0.12 -1.08 -0.08 0.00 -0.02 0.00 0.00 35.03 33.98 1dtw n LYS 116 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1dtw h TYR 117 N 0.00 -0.97 0.54 2.13 3.20 -0.35 -2.46 116.97 119.05 1dtw h TYR 117 Ca 0.00 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 1dtw h TYR 117 Cb 0.64 0.32 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 1dtw h TYR 117 CO 0.00 -0.59 -0.33 -0.09 -1.64 0.00 0.00 178.16 175.51 1dtw h ARG 118 N -1.22 -0.80 -0.51 1.82 2.43 -1.81 -3.07 114.38 111.22 1dtw h ARG 118 Ca -0.11 0.05 0.10 0.00 -0.81 0.00 0.00 59.98 59.22 1dtw h ARG 118 Cb 0.81 0.18 -0.10 0.00 -0.42 0.00 0.00 29.97 30.44 1dtw h ARG 118 CO 0.17 -0.53 -0.18 -0.92 -1.51 0.00 0.00 179.97 177.01 1dtw h TYR 119 N -0.83 -0.42 0.00 2.20 3.20 -1.88 -1.35 116.97 117.90 1dtw h TYR 119 Ca -0.06 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1dtw h TYR 119 Cb 0.67 0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.21 1dtw h TYR 119 CO -0.10 -0.27 0.00 2.89 -1.64 0.00 0.00 178.16 179.04 1dtw n ARG 120 N -5.39 0.10 -0.14 1.82 1.85 -0.93 -2.48 116.66 111.49 1dtw n ARG 120 Ca 0.05 0.33 0.07 0.00 -1.00 0.00 0.00 57.85 57.29 1dtw n ARG 120 Cb 0.30 -1.69 0.14 0.00 -1.05 0.00 0.00 32.46 30.16 1dtw n ARG 120 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1dtw n SER 121 N -1.87 2.77 -3.58 2.89 3.41 -0.56 -4.96 113.62 111.72 1dtw n SER 121 Ca 0.03 -1.85 -0.26 0.00 -0.26 0.00 0.00 58.87 56.53 1dtw n SER 121 Cb 0.21 -0.18 0.04 0.00 -0.26 0.00 0.00 64.21 64.01 1dtw n SER 121 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dtw n GLY 122 N 0.71 -0.52 2.47 5.00 0.00 -0.94 -1.34 105.19 110.58 1dtw n GLY 122 Ca 0.12 0.18 -0.14 0.00 0.00 0.00 0.00 46.02 46.18 1dtw n GLY 122 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1dtw n ASP 123 N -2.74 -4.40 -0.03 1.61 4.64 -0.91 -4.92 116.55 109.79 1dtw n ASP 123 Ca -0.00 -0.14 -0.09 0.00 -1.38 0.00 0.00 54.79 53.17 1dtw n ASP 123 Cb 0.56 -3.36 -0.14 0.00 -1.04 0.00 0.00 41.12 37.13 1dtw n ASP 123 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1dtw n LEU 124 N -2.47 0.87 -3.89 -2.67 4.77 -0.45 -4.96 117.00 108.20 1dtw n LEU 124 Ca -0.10 0.35 -0.09 0.00 -0.03 0.00 0.00 56.01 56.14 1dtw n LEU 124 Cb 0.59 0.14 -0.09 0.00 -2.33 0.00 0.00 43.42 41.73 1dtw n LEU 124 CO 0.27 0.43 -0.16 -0.36 -1.33 0.00 0.00 177.39 176.24 1dtw s PHE 125 N -2.58 0.16 0.22 -1.77 0.40 -1.26 -5.13 117.98 108.02 1dtw s PHE 125 Ca -0.06 -0.47 -0.21 0.00 -0.60 0.00 0.00 56.93 55.58 1dtw s PHE 125 Cb 0.08 -0.10 0.04 0.00 0.51 0.00 0.00 43.02 43.55 1dtw s PHE 125 CO 0.82 -0.43 0.64 0.54 0.70 0.00 0.00 175.22 177.50 1dtw s ASN 126 N -2.32 -0.39 -0.27 1.36 2.20 -1.26 -3.65 114.94 110.60 1dtw s ASN 126 Ca -0.02 -0.33 0.10 0.00 -0.94 0.00 0.00 52.86 51.67 1dtw s ASN 126 Cb 0.01 0.66 0.46 0.00 -2.00 0.00 0.00 41.25 40.38 1dtw s ASN 126 CO -0.06 -1.15 1.18 0.00 -2.94 0.00 0.00 177.10 174.13 1dtw n GLY 128 N -0.71 -1.15 2.14 0.00 0.00 -1.26 -1.95 105.19 102.25 1dtw n GLY 128 Ca 0.36 0.06 -0.17 0.00 0.00 0.00 0.00 46.02 46.27 1dtw n GLY 128 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dtw n SER 129 N -2.04 4.19 -4.56 1.61 3.41 -1.26 -2.62 113.62 112.35 1dtw n SER 129 Ca 0.02 -3.44 -0.34 0.00 -0.26 0.00 0.00 58.87 54.85 1dtw n SER 129 Cb 0.19 -0.80 -0.11 0.00 -0.26 0.00 0.00 64.21 63.23 1dtw n SER 129 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1dtw s LEU 130 N -3.14 3.48 -0.02 1.04 2.96 -0.82 -0.71 118.68 121.47 1dtw s LEU 130 Ca 0.56 -0.03 0.02 0.00 -0.22 0.00 0.00 54.13 54.45 1dtw s LEU 130 Cb 0.46 -1.85 0.01 0.00 0.50 0.00 0.00 46.19 45.30 1dtw s LEU 130 CO 0.12 0.18 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.38 1dtw s THR 131 N 0.30 0.60 -0.20 3.68 2.01 0.50 -2.59 115.64 119.94 1dtw s THR 131 Ca -0.01 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 61.74 1dtw s THR 131 Cb -0.13 -0.55 0.02 0.00 0.01 0.00 0.00 72.50 71.85 1dtw s THR 131 CO 0.02 0.20 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.36 1dtw s ILE 132 N 0.26 2.34 0.08 1.82 1.01 -0.47 -0.67 121.20 125.57 1dtw s ILE 132 Ca -0.03 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.68 1dtw s ILE 132 Cb -0.08 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.30 1dtw s ILE 132 CO 0.00 0.44 0.20 -0.13 0.00 0.00 0.00 174.94 175.45 1dtw s ARG 133 N 1.30 3.36 -0.29 2.79 0.52 -0.08 0.40 118.95 126.95 1dtw s ARG 133 Ca 0.03 -0.51 -0.18 0.00 -0.52 0.00 0.00 55.73 54.56 1dtw s ARG 133 Cb -0.14 -2.98 0.12 0.00 0.52 0.00 0.00 34.95 32.47 1dtw s ARG 133 CO -0.10 0.59 0.91 0.45 0.02 0.00 0.00 175.30 177.17 1dtw s SER 134 N -2.62 -0.61 0.23 0.23 0.15 -0.43 -1.61 113.70 109.04 1dtw s SER 134 Ca 0.34 1.01 -0.32 0.00 0.70 0.00 0.00 55.95 57.68 1dtw s SER 134 Cb -0.13 1.21 -0.12 0.00 -1.71 0.00 0.00 66.02 65.27 1dtw s SER 134 CO 0.27 -0.16 1.63 -2.65 1.20 0.00 0.00 173.24 173.53 1dtw n PRO 135 N 3.58 2.58 -4.46 5.44 -0.02 -1.25 -0.89 135.00 139.98 1dtw n PRO 135 Ca -0.18 0.93 -0.22 0.00 -2.02 0.00 0.00 63.50 62.01 1dtw n PRO 135 Cb 0.58 -2.72 -0.11 0.00 -0.02 0.00 0.00 33.50 31.23 1dtw n PRO 135 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1dtw s TRP 136 N 0.65 2.05 0.35 6.00 -0.00 0.16 -0.68 118.94 127.48 1dtw s TRP 136 Ca 0.72 -0.77 0.00 0.00 -0.00 0.00 0.00 56.10 56.05 1dtw s TRP 136 Cb -0.54 -1.27 0.00 0.00 -0.00 0.00 0.00 33.47 31.66 1dtw s TRP 136 CO 0.40 0.23 0.00 0.41 -0.00 0.00 0.00 176.95 177.99 1dtw n GLY 137 N -0.67 -2.21 3.86 5.86 0.00 -1.04 -1.40 105.19 109.58 1dtw n GLY 137 Ca -0.04 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 1dtw n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dtw n VAL 139 N -3.38 0.00 0.00 0.00 0.24 -1.26 -4.06 118.33 109.87 1dtw n VAL 139 Ca 0.07 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1dtw n VAL 139 Cb 0.59 0.11 0.00 0.00 -1.47 0.00 0.00 33.84 33.07 1dtw n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dtw n GLY 140 N -0.06 -2.45 2.29 7.63 0.00 -1.26 -4.00 105.19 107.34 1dtw n GLY 140 Ca 0.00 0.47 -0.20 0.00 0.00 0.00 0.00 46.02 46.30 1dtw n GLY 140 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1dtw n HIS 141 N -2.50 -0.77 0.25 1.61 8.25 -1.26 -4.91 115.22 115.90 1dtw n HIS 141 Ca 0.00 -3.31 0.15 0.00 -0.26 0.00 0.00 57.72 54.30 1dtw n HIS 141 Cb 0.00 -0.02 0.49 0.00 1.12 0.00 0.00 29.99 31.59 1dtw n HIS 141 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1dtw h GLY 142 N 3.75 0.00 0.00 -1.41 0.00 -1.80 -3.48 103.07 100.12 1dtw h GLY 142 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1dtw h GLY 142 CO 0.44 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.98 1dtw n ALA 143 N -2.10 0.00 0.10 3.60 0.00 -1.26 -3.28 120.51 117.57 1dtw n ALA 143 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.48 1dtw n ALA 143 Cb 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.83 1dtw n ALA 143 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1dtw h LEU 144 N 0.00 0.00 -3.66 0.00 4.07 -1.68 -3.38 115.31 110.67 1dtw h LEU 144 Ca 0.00 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 57.61 1dtw h LEU 144 Cb 0.00 0.00 -0.30 0.00 1.08 0.00 0.00 40.66 41.44 1dtw h LEU 144 CO 0.00 0.51 -0.77 -1.22 -1.08 0.00 0.00 178.44 175.89 1dtw n TYR 145 N -3.09 1.69 -1.98 1.13 4.02 -1.22 -4.48 117.16 113.23 1dtw n TYR 145 Ca -0.02 -1.92 0.00 0.00 -0.01 0.00 0.00 57.90 55.94 1dtw n TYR 145 Cb 0.77 -0.29 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 1dtw n TYR 145 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1dtw n HIS 146 N -0.76 0.00 0.00 -0.72 8.25 -1.20 -4.75 115.22 116.03 1dtw n HIS 146 Ca 0.32 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.78 1dtw n HIS 146 Cb 0.88 0.24 0.00 0.00 1.12 0.00 0.00 29.99 32.24 1dtw n HIS 146 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1dtw n SER 147 N 0.00 1.10 -4.49 0.41 7.64 -1.26 -4.47 113.62 112.55 1dtw n SER 147 Ca 0.00 -0.04 -0.35 0.00 1.01 0.00 0.00 58.87 59.50 1dtw n SER 147 Cb 0.49 0.29 0.10 0.00 -1.01 0.00 0.00 64.21 64.08 1dtw n SER 147 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dtw n GLN 148 N -0.40 0.08 -3.68 1.43 6.02 -1.26 -2.55 117.38 117.01 1dtw n GLN 148 Ca 0.00 0.08 -0.27 0.00 -0.01 0.00 0.00 57.00 56.80 1dtw n GLN 148 Cb 0.00 -1.96 -0.11 0.00 1.02 0.00 0.00 30.24 29.19 1dtw n GLN 148 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1dtw n SER 149 N -1.24 1.90 0.09 1.08 7.64 -1.26 -2.48 113.62 119.35 1dtw n SER 149 Ca 0.10 -2.95 0.07 0.00 1.01 0.00 0.00 58.87 57.09 1dtw n SER 149 Cb 0.51 -0.68 0.35 0.00 -1.01 0.00 0.00 64.21 63.38 1dtw n SER 149 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1dtw n PRO 150 N 2.12 0.09 -0.22 1.43 -0.02 -1.26 -4.24 135.00 132.90 1dtw n PRO 150 Ca 0.24 0.53 -0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1dtw n PRO 150 Cb 0.40 -1.75 0.03 0.00 -0.02 0.00 0.00 33.50 32.16 1dtw n PRO 150 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1dtw n GLU 151 N -1.93 -0.13 -0.13 -0.52 0.28 -1.26 -0.41 120.64 116.53 1dtw n GLU 151 Ca -0.00 0.89 0.04 0.00 -0.16 0.00 0.00 57.16 57.93 1dtw n GLU 151 Cb 0.06 -1.32 0.35 0.00 1.43 0.00 0.00 31.44 31.96 1dtw n GLU 151 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1dtw h ALA 152 N 0.82 1.64 -0.58 -1.84 0.00 -1.91 -2.56 119.26 114.84 1dtw h ALA 152 Ca 0.21 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.12 1dtw h ALA 152 Cb 0.35 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1dtw h ALA 152 CO -0.57 0.29 0.33 0.74 0.00 0.00 0.00 179.25 180.04 1dtw h PHE 153 N 0.76 0.61 0.00 0.00 -1.00 -1.06 -2.26 116.94 113.99 1dtw h PHE 153 Ca 0.25 0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.05 1dtw h PHE 153 Cb 0.06 -0.19 0.00 0.00 3.61 0.00 0.00 35.95 39.43 1dtw h PHE 153 CO -0.00 0.32 0.00 1.19 -1.61 0.00 0.00 178.31 178.21 1dtw n PHE 154 N -4.80 0.95 0.24 -0.55 3.01 -1.00 -3.52 117.46 111.78 1dtw n PHE 154 Ca 0.06 0.30 0.09 0.00 1.01 0.00 0.00 57.45 58.91 1dtw n PHE 154 Cb 0.12 -0.99 0.58 0.00 -0.01 0.00 0.00 39.48 39.19 1dtw n PHE 154 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1dtw h ALA 155 N 2.44 1.32 -0.28 4.37 0.00 -1.02 -2.14 119.26 123.95 1dtw h ALA 155 Ca 0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 1dtw h ALA 155 Cb 0.65 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1dtw h ALA 155 CO 0.00 0.25 0.08 1.58 0.00 0.00 0.00 179.25 181.16 1dtw n HIS 156 N -3.80 0.95 -3.76 0.00 -0.00 -1.23 -4.75 115.22 102.63 1dtw n HIS 156 Ca -0.02 -0.53 -0.30 0.00 -0.00 0.00 0.00 57.72 56.88 1dtw n HIS 156 Cb 0.30 -0.35 -0.14 0.00 -0.00 0.00 0.00 29.99 29.80 1dtw n HIS 156 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1dtw n PRO 158 N 4.36 2.22 0.00 0.00 -0.02 -1.26 -3.46 135.00 136.85 1dtw n PRO 158 Ca 0.02 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1dtw n PRO 158 Cb 0.40 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1dtw n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dtw n GLY 159 N 2.45 1.15 3.61 -1.23 0.00 -1.26 -4.59 105.19 105.33 1dtw n GLY 159 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1dtw n GLY 159 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1dtw s ILE 160 N -1.43 3.35 0.08 -0.61 -4.36 -1.22 -4.33 121.20 112.68 1dtw s ILE 160 Ca 0.00 -1.78 0.07 0.00 -0.26 0.00 0.00 60.65 58.68 1dtw s ILE 160 Cb 0.00 -2.73 -0.04 0.00 1.25 0.00 0.00 42.46 40.94 1dtw s ILE 160 CO 0.00 -0.25 -0.13 -0.54 0.24 0.00 0.00 174.94 174.26 1dtw s LYS 161 N -3.28 2.11 -0.16 0.37 1.02 -0.55 -4.71 119.74 114.55 1dtw s LYS 161 Ca 0.29 -1.00 -0.00 0.00 0.02 0.00 0.00 55.97 55.27 1dtw s LYS 161 Cb -0.08 -2.27 0.04 0.00 -0.52 0.00 0.00 37.83 35.00 1dtw s LYS 161 CO 0.18 0.52 -0.08 0.08 -0.92 0.00 0.00 175.35 175.14 1dtw s VAL 162 N -1.11 1.23 -0.06 3.17 1.01 -1.26 -0.96 120.40 122.41 1dtw s VAL 162 Ca 0.19 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.59 1dtw s VAL 162 Cb -0.11 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1dtw s VAL 162 CO 0.10 0.22 -0.24 -0.69 0.00 0.00 0.00 175.10 174.50 1dtw s VAL 163 N 1.59 2.18 -0.10 2.92 1.01 -0.31 0.78 120.40 128.47 1dtw s VAL 163 Ca 0.02 -1.02 -0.00 0.00 0.00 0.00 0.00 61.98 60.97 1dtw s VAL 163 Cb -0.15 -1.80 0.02 0.00 0.00 0.00 0.00 36.38 34.46 1dtw s VAL 163 CO -0.08 0.57 -0.06 -0.63 0.00 0.00 0.00 175.10 174.89 1dtw s ILE 164 N -0.13 0.90 0.51 2.22 1.01 0.29 -1.59 121.20 124.41 1dtw s ILE 164 Ca -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 60.65 60.37 1dtw s ILE 164 Cb -0.14 -0.93 0.00 0.00 0.01 0.00 0.00 42.46 41.40 1dtw s ILE 164 CO 0.04 0.34 0.77 -2.16 0.00 0.00 0.00 174.94 173.93 1dtw s PRO 165 N 1.67 3.02 0.00 2.79 0.04 -1.26 -4.28 135.00 136.99 1dtw s PRO 165 Ca 0.03 -0.27 0.00 0.00 0.04 0.00 0.00 61.00 60.80 1dtw s PRO 165 Cb -0.13 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 31.98 1dtw s PRO 165 CO -0.07 -0.45 0.65 2.89 0.04 0.00 0.00 177.00 180.06 1dtw n ARG 166 N -2.29 0.36 -3.58 4.56 1.85 -1.26 -4.07 116.66 112.22 1dtw n ARG 166 Ca 0.03 -0.81 -0.05 0.00 -1.00 0.00 0.00 57.85 56.02 1dtw n ARG 166 Cb 0.58 -0.97 -0.02 0.00 -1.05 0.00 0.00 32.46 30.99 1dtw n ARG 166 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 1dtw s SER 167 N -0.33 -0.19 0.31 2.89 1.04 -1.26 -4.91 113.70 111.25 1dtw s SER 167 Ca 0.00 -0.05 0.07 0.00 0.48 0.00 0.00 55.95 56.45 1dtw s SER 167 Cb 0.00 0.24 0.83 0.00 0.10 0.00 0.00 66.02 67.18 1dtw s SER 167 CO 0.00 -0.40 1.72 -0.65 0.98 0.00 0.00 173.24 174.89 1dtw h PRO 168 N 2.00 0.49 -0.03 4.02 0.11 -1.85 0.23 132.00 136.96 1dtw h PRO 168 Ca -0.17 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 1dtw h PRO 168 Cb 1.20 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1dtw h PRO 168 CO 0.26 0.32 -0.02 0.35 -0.21 0.00 0.00 178.00 178.71 1dtw h PHE 169 N 0.51 0.08 -0.71 0.65 3.57 -1.90 -2.72 116.94 116.42 1dtw h PHE 169 Ca 0.61 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 62.06 1dtw h PHE 169 Cb 1.17 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.85 1dtw h PHE 169 CO -0.06 0.48 0.32 1.96 -2.23 0.00 0.00 178.31 178.78 1dtw h GLN 170 N -0.33 1.02 0.41 1.11 1.08 -1.76 -2.85 115.11 113.78 1dtw h GLN 170 Ca 0.01 -0.15 -0.01 0.00 -1.45 0.00 0.00 58.65 57.05 1dtw h GLN 170 Cb 0.46 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1dtw h GLN 170 CO 0.01 0.80 -0.40 0.00 -0.95 0.00 0.00 178.83 178.29 1dtw h ALA 171 N 1.34 -0.88 -0.90 3.87 0.00 -0.50 -0.69 119.26 121.50 1dtw h ALA 171 Ca 0.24 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1dtw h ALA 171 Cb 0.13 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1dtw h ALA 171 CO -0.03 -1.03 0.53 -0.22 0.00 0.00 0.00 179.25 178.50 1dtw h LYS 172 N -0.82 1.23 -0.01 0.00 3.64 -1.45 0.16 116.57 119.32 1dtw h LYS 172 Ca -0.04 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1dtw h LYS 172 Cb 0.73 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1dtw h LYS 172 CO -0.06 0.87 -0.00 0.78 -2.27 0.00 0.00 179.45 178.77 1dtw h GLY 173 N 1.24 0.01 0.92 5.01 0.00 -1.40 -1.90 103.07 106.96 1dtw h GLY 173 Ca 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.63 1dtw h GLY 173 CO -0.06 0.01 0.11 1.41 0.00 0.00 0.00 176.54 178.01 1dtw h LEU 174 N -0.36 0.31 0.37 3.11 3.38 -1.04 -0.78 115.31 120.31 1dtw h LEU 174 Ca 0.00 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1dtw h LEU 174 Cb 0.37 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1dtw h LEU 174 CO 0.00 0.35 -0.33 0.25 0.09 0.00 0.00 178.44 178.81 1dtw h LEU 175 N 0.24 -0.87 -1.38 1.67 5.85 -0.73 0.38 115.31 120.47 1dtw h LEU 175 Ca 0.08 0.07 0.13 0.00 0.84 0.00 0.00 57.88 59.00 1dtw h LEU 175 Cb 0.13 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 1dtw h LEU 175 CO -0.01 -0.47 0.53 -0.07 -0.34 0.00 0.00 178.44 178.08 1dtw h LEU 176 N -0.71 0.60 -0.49 2.25 3.38 -1.27 0.32 115.31 119.38 1dtw h LEU 176 Ca -0.03 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1dtw h LEU 176 Cb 0.63 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1dtw h LEU 176 CO -0.03 0.33 0.05 0.28 0.09 0.00 0.00 178.44 179.15 1dtw h SER 177 N 0.65 0.81 0.09 -0.43 0.02 -0.19 -2.36 113.55 112.13 1dtw h SER 177 Ca 0.40 -0.28 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1dtw h SER 177 Cb 0.64 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1dtw h SER 177 CO -0.16 0.89 -0.04 0.00 -1.14 0.00 0.00 176.83 176.38 1dtw h ILE 179 N -0.14 0.79 0.00 0.00 2.04 -0.49 -2.16 117.51 117.55 1dtw h ILE 179 Ca -0.01 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1dtw h ILE 179 Cb 0.11 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1dtw h ILE 179 CO 0.02 0.08 -0.95 -0.62 0.00 0.00 0.00 178.15 176.68 1dtw n GLU 180 N -4.48 0.06 -1.87 2.37 1.02 -0.90 -4.86 120.64 111.97 1dtw n GLU 180 Ca 0.15 -0.01 -0.36 0.00 -0.02 0.00 0.00 57.16 56.91 1dtw n GLU 180 Cb 0.54 -1.51 0.05 0.00 -0.02 0.00 0.00 31.44 30.50 1dtw n GLU 180 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1dtw s ASP 181 N -3.15 4.89 -0.34 1.62 -1.08 0.23 -4.88 116.67 113.95 1dtw s ASP 181 Ca 0.07 2.50 0.01 0.00 -0.52 0.00 0.00 52.55 54.62 1dtw s ASP 181 Cb 0.16 -2.61 0.37 0.00 -1.46 0.00 0.00 42.92 39.38 1dtw s ASP 181 CO 0.83 -1.81 1.75 0.29 0.52 0.00 0.00 175.17 176.76 1dtw n LYS 182 N -1.77 1.89 -3.82 4.34 4.76 -1.26 -4.60 118.16 117.70 1dtw n LYS 182 Ca 0.15 -1.95 -0.12 0.00 -2.87 0.00 0.00 58.31 53.51 1dtw n LYS 182 Cb 0.49 -1.76 -0.13 0.00 -1.84 0.00 0.00 35.03 31.79 1dtw n LYS 182 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1dtw s ASN 183 N -0.42 -0.14 -0.04 4.39 0.01 -1.08 -4.46 114.94 113.21 1dtw s ASN 183 Ca 0.38 0.28 -0.36 0.00 -0.71 0.00 0.00 52.86 52.45 1dtw s ASN 183 Cb 0.31 0.28 -0.14 0.00 0.41 0.00 0.00 41.25 42.11 1dtw s ASN 183 CO 0.04 -0.05 1.69 -2.65 -1.51 0.00 0.00 177.10 174.62 1dtw n PRO 184 N 3.06 1.81 -5.05 -0.60 -0.02 -1.25 -4.80 135.00 128.15 1dtw n PRO 184 Ca -0.13 0.66 -0.28 0.00 -2.02 0.00 0.00 63.50 61.73 1dtw n PRO 184 Cb 0.59 -2.42 -0.16 0.00 -0.02 0.00 0.00 33.50 31.48 1dtw n PRO 184 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dtw s ILE 186 N -0.27 4.50 -0.33 0.00 1.01 -0.14 -1.37 121.20 124.61 1dtw s ILE 186 Ca 0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 60.65 60.52 1dtw s ILE 186 Cb -0.11 -3.07 0.05 0.00 0.01 0.00 0.00 42.46 39.35 1dtw s ILE 186 CO 0.01 0.38 0.06 0.12 0.00 0.00 0.00 174.94 175.51 1dtw s PHE 187 N 1.11 3.30 -0.29 3.97 5.36 0.16 -1.17 117.98 130.43 1dtw s PHE 187 Ca 0.04 -1.81 -0.17 0.00 -0.96 0.00 0.00 56.93 54.03 1dtw s PHE 187 Cb -0.14 -2.31 -0.02 0.00 -0.34 0.00 0.00 43.02 40.20 1dtw s PHE 187 CO 0.03 -0.81 0.48 -0.06 -1.46 0.00 0.00 175.22 173.40 1dtw s PHE 188 N 1.28 3.23 -0.40 10.12 2.99 -0.62 -1.31 117.98 133.27 1dtw s PHE 188 Ca -0.02 0.43 -0.13 0.00 0.00 0.00 0.00 56.93 57.20 1dtw s PHE 188 Cb -0.20 -2.75 0.03 0.00 0.00 0.00 0.00 43.02 40.10 1dtw s PHE 188 CO -0.00 -0.35 0.27 -1.21 -0.00 0.00 0.00 175.22 173.93 1dtw s GLU 189 N 2.27 2.90 -0.40 0.44 2.02 -0.07 -4.00 118.70 121.85 1dtw s GLU 189 Ca 0.19 -1.10 -0.29 0.00 0.02 0.00 0.00 54.97 53.79 1dtw s GLU 189 Cb -0.16 -3.90 -0.08 0.00 0.10 0.00 0.00 34.13 30.09 1dtw s GLU 189 CO 0.11 -0.77 2.32 -2.30 0.02 0.00 0.00 175.26 174.64 1dtw n PRO 190 N 5.09 1.29 0.30 0.39 -0.02 -1.26 0.40 135.00 141.19 1dtw n PRO 190 Ca -0.11 0.25 0.16 0.00 -2.02 0.00 0.00 63.50 61.78 1dtw n PRO 190 Cb 0.46 -3.00 0.92 0.00 -0.02 0.00 0.00 33.50 31.86 1dtw n PRO 190 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1dtw h LYS 191 N 15.82 0.00 0.00 -0.52 2.10 -1.51 -1.72 116.57 130.74 1dtw h LYS 191 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 1dtw h LYS 191 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1dtw h LYS 191 CO 1.07 0.03 0.00 0.97 -2.00 0.00 0.00 179.45 179.53 1dtw h ILE 192 N 0.00 0.00 -0.01 0.07 6.09 -1.79 -2.73 117.51 119.15 1dtw h ILE 192 Ca -0.00 -0.41 0.00 0.00 -1.37 0.00 0.00 64.86 63.08 1dtw h ILE 192 Cb 0.11 1.38 0.00 0.00 0.47 0.00 0.00 36.82 38.79 1dtw h ILE 192 CO 0.00 0.00 -0.60 0.18 -3.07 0.00 0.00 178.15 174.66 1dtw n LEU 193 N -3.03 1.20 -0.33 2.19 4.77 -0.65 -4.39 117.00 116.76 1dtw n LEU 193 Ca 0.00 -0.42 0.21 0.00 -0.03 0.00 0.00 56.01 55.77 1dtw n LEU 193 Cb 0.26 -0.08 0.46 0.00 -2.33 0.00 0.00 43.42 41.74 1dtw n LEU 193 CO 0.25 0.25 1.20 1.88 -1.33 0.00 0.00 177.39 179.64 1dtw h TYR 194 N 0.93 0.79 0.00 -1.77 0.99 -1.53 -2.44 116.97 113.95 1dtw h TYR 194 Ca 0.00 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1dtw h TYR 194 Cb 0.57 -0.23 0.00 0.00 1.00 0.00 0.00 36.73 38.08 1dtw h TYR 194 CO 0.00 0.06 -0.03 0.54 -0.00 0.00 0.00 178.16 178.74 1dtw n ARG 195 N -4.72 1.77 0.00 4.88 1.74 -1.26 -2.61 116.66 116.46 1dtw n ARG 195 Ca 0.26 -2.06 0.00 0.00 -0.77 0.00 0.00 57.85 55.28 1dtw n ARG 195 Cb 0.84 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 31.03 1dtw n ARG 195 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1dtw n ALA 196 N -1.00 0.00 -1.70 7.54 0.00 -0.92 -4.91 120.51 119.53 1dtw n ALA 196 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.09 1dtw n ALA 196 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 1dtw n ALA 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dtw n ALA 197 N -3.00 1.61 -1.05 0.00 0.00 -1.26 -4.84 120.51 111.97 1dtw n ALA 197 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1dtw n ALA 197 Cb 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.11 1dtw n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dtw n ALA 198 N 2.05 0.00 0.00 0.00 0.00 -1.26 -4.75 120.51 116.55 1dtw n ALA 198 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1dtw n ALA 198 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 1dtw n ALA 198 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1dtw n GLU 199 N -0.75 0.00 -1.81 0.00 0.28 -0.86 -4.85 120.64 112.65 1dtw n GLU 199 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.58 1dtw n GLU 199 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 1dtw n GLU 199 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1dtw s GLU 200 N -2.00 4.16 -0.05 3.44 0.41 -1.26 0.28 118.70 123.68 1dtw s GLU 200 Ca 0.00 2.50 -0.00 0.00 -0.41 0.00 0.00 54.97 57.06 1dtw s GLU 200 Cb 0.00 -3.29 0.03 0.00 -1.78 0.00 0.00 34.13 29.08 1dtw s GLU 200 CO 0.00 -0.73 -0.01 0.08 -0.49 0.00 0.00 175.26 174.11 1dtw s VAL 201 N 1.75 0.35 0.13 2.63 1.01 0.71 -4.80 120.40 122.17 1dtw s VAL 201 Ca 0.75 0.06 -0.35 0.00 0.00 0.00 0.00 61.98 62.44 1dtw s VAL 201 Cb -0.46 -0.46 -0.17 0.00 0.00 0.00 0.00 36.38 35.30 1dtw s VAL 201 CO 0.33 0.22 1.16 -2.65 0.00 0.00 0.00 175.10 174.16 1dtw n PRO 202 N 4.61 0.93 0.13 2.72 -0.02 -1.26 -2.34 135.00 139.77 1dtw n PRO 202 Ca -0.16 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1dtw n PRO 202 Cb 0.50 -1.85 0.30 0.00 -0.02 0.00 0.00 33.50 32.44 1dtw n PRO 202 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1dtw h ILE 203 N 2.81 1.27 -1.70 4.25 1.08 -1.66 -3.45 117.51 120.11 1dtw h ILE 203 Ca -0.45 -1.29 -0.43 0.00 -0.39 0.00 0.00 64.86 62.30 1dtw h ILE 203 Cb 1.36 1.59 0.01 0.00 -3.07 0.00 0.00 36.82 36.71 1dtw h ILE 203 CO 0.71 0.38 -0.28 -1.61 -0.69 0.00 0.00 178.15 176.66 1dtw s GLU 204 N -4.28 2.96 0.73 2.37 2.02 -1.26 -4.94 118.70 116.31 1dtw s GLU 204 Ca -0.04 -1.09 -0.16 0.00 0.02 0.00 0.00 54.97 53.70 1dtw s GLU 204 Cb 0.14 -2.77 -0.05 0.00 0.10 0.00 0.00 34.13 31.55 1dtw s GLU 204 CO 0.75 -0.13 0.40 -2.30 0.02 0.00 0.00 175.26 173.99 1dtw n PRO 205 N -1.78 0.23 -3.64 0.39 -0.02 -1.26 -5.02 135.00 123.89 1dtw n PRO 205 Ca 0.04 0.11 -0.03 0.00 -2.02 0.00 0.00 63.50 61.60 1dtw n PRO 205 Cb 0.59 -1.72 -0.06 0.00 -0.02 0.00 0.00 33.50 32.29 1dtw n PRO 205 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1dtw s TYR 206 N -1.95 -0.10 0.33 6.00 -0.85 -1.26 -5.10 117.35 114.42 1dtw s TYR 206 Ca 0.63 0.21 0.10 0.00 -0.52 0.00 0.00 57.07 57.48 1dtw s TYR 206 Cb -0.34 0.48 -0.06 0.00 0.38 0.00 0.00 41.96 42.42 1dtw s TYR 206 CO 0.61 -0.07 -0.07 -0.80 -1.52 0.00 0.00 175.55 173.70 1dtw s ASN 207 N -0.48 3.92 -0.05 -0.18 -0.87 -1.26 -4.23 114.94 111.79 1dtw s ASN 207 Ca 0.07 -1.06 -0.00 0.00 -1.57 0.00 0.00 52.86 50.30 1dtw s ASN 207 Cb -0.03 -0.44 0.03 0.00 -0.02 0.00 0.00 41.25 40.79 1dtw s ASN 207 CO -0.11 -0.16 -0.01 -0.63 -2.57 0.00 0.00 177.10 173.62 1dtw s ILE 208 N -2.54 0.35 0.19 0.60 1.01 -1.16 -4.92 121.20 114.74 1dtw s ILE 208 Ca 0.33 0.05 -0.32 0.00 0.00 0.00 0.00 60.65 60.71 1dtw s ILE 208 Cb -0.00 -0.46 -0.16 0.00 0.01 0.00 0.00 42.46 41.85 1dtw s ILE 208 CO 0.17 0.22 1.04 -2.65 0.00 0.00 0.00 174.94 173.72 1dtw n PRO 209 N 4.54 0.98 -3.24 2.79 -0.02 -1.26 -4.54 135.00 134.26 1dtw n PRO 209 Ca -0.18 0.35 -0.32 0.00 -2.02 0.00 0.00 63.50 61.34 1dtw n PRO 209 Cb 0.50 -1.75 -0.05 0.00 -0.02 0.00 0.00 33.50 32.18 1dtw n PRO 209 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1dtw s LEU 210 N 0.88 4.08 -0.86 2.45 1.43 -1.26 -4.09 118.68 121.30 1dtw s LEU 210 Ca 0.70 1.06 -0.02 0.00 -1.03 0.00 0.00 54.13 54.85 1dtw s LEU 210 Cb -0.86 -3.86 0.00 0.00 0.03 0.00 0.00 46.19 41.50 1dtw s LEU 210 CO 0.55 -0.17 0.22 -1.20 0.23 0.00 0.00 176.35 175.98 1dtw n SER 211 N -0.43 -3.86 -3.74 2.29 7.64 -1.26 -5.02 113.62 109.24 1dtw n SER 211 Ca 0.02 -0.11 -0.27 0.00 1.01 0.00 0.00 58.87 59.52 1dtw n SER 211 Cb 0.53 -2.86 -0.17 0.00 -1.01 0.00 0.00 64.21 60.70 1dtw n SER 211 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1dtw s GLN 212 N -4.96 0.63 0.64 1.43 -1.52 -1.26 -4.13 119.66 110.49 1dtw s GLN 212 Ca 0.11 -0.34 -0.15 0.00 -1.95 0.00 0.00 55.36 53.03 1dtw s GLN 212 Cb -0.05 -1.95 -0.01 0.00 -0.22 0.00 0.00 33.01 30.78 1dtw s GLN 212 CO 0.14 -0.60 1.09 0.00 -0.25 0.00 0.00 175.29 175.67 1dtw s ALA 213 N 1.88 2.56 -0.13 6.09 0.00 -1.26 -4.72 121.76 126.19 1dtw s ALA 213 Ca -0.00 0.47 0.01 0.00 0.00 0.00 0.00 51.96 52.45 1dtw s ALA 213 Cb -0.16 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.69 1dtw s ALA 213 CO -0.08 -1.13 -0.16 -2.00 0.00 0.00 0.00 175.76 172.40 1dtw s GLU 214 N -4.14 2.42 -0.31 0.00 2.12 0.04 -4.96 118.70 113.87 1dtw s GLU 214 Ca 0.65 -0.62 -0.22 0.00 0.36 0.00 0.00 54.97 55.14 1dtw s GLU 214 Cb -0.19 -2.10 -0.00 0.00 0.26 0.00 0.00 34.13 32.10 1dtw s GLU 214 CO 0.41 -0.13 0.73 0.08 -0.54 0.00 0.00 175.26 175.80 1dtw s VAL 215 N 1.18 4.85 -1.46 3.70 1.01 -1.26 -0.62 120.40 127.80 1dtw s VAL 215 Ca -0.01 1.05 0.15 0.00 0.00 0.00 0.00 61.98 63.16 1dtw s VAL 215 Cb -0.14 -4.09 0.35 0.00 0.00 0.00 0.00 36.38 32.50 1dtw s VAL 215 CO -0.06 -0.21 1.27 -0.38 0.00 0.00 0.00 175.10 175.71 1dtw n ILE 216 N 5.49 0.76 -3.15 2.22 5.41 -0.88 -4.86 119.36 124.35 1dtw n ILE 216 Ca 0.02 -0.88 0.05 0.00 1.00 0.00 0.00 62.75 62.94 1dtw n ILE 216 Cb 0.48 0.70 -0.01 0.00 -0.71 0.00 0.00 39.64 40.11 1dtw n ILE 216 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 1dtw s GLN 217 N -1.07 0.18 0.38 0.38 0.74 -1.24 -4.97 119.66 114.05 1dtw s GLN 217 Ca 0.29 0.26 -0.22 0.00 0.05 0.00 0.00 55.36 55.74 1dtw s GLN 217 Cb 0.16 0.14 -0.10 0.00 1.10 0.00 0.00 33.01 34.30 1dtw s GLN 217 CO 0.21 -0.24 0.92 -1.83 -0.55 0.00 0.00 175.29 173.80 1dtw s GLU 218 N 2.95 4.32 0.33 1.67 -1.05 -1.26 -0.69 118.70 124.98 1dtw s GLU 218 Ca 0.09 1.14 0.05 0.00 -0.15 0.00 0.00 54.97 56.10 1dtw s GLU 218 Cb -0.07 -2.41 -0.02 0.00 -0.44 0.00 0.00 34.13 31.18 1dtw s GLU 218 CO -0.15 0.09 0.34 0.41 0.95 0.00 0.00 175.26 176.90 1dtw n GLY 219 N -0.20 2.70 0.00 -3.83 0.00 -1.23 -4.64 105.19 97.99 1dtw n GLY 219 Ca 0.05 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1dtw n GLY 219 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dtw n SER 220 N -1.68 0.05 -0.10 1.61 3.41 -0.59 -4.55 113.62 111.78 1dtw n SER 220 Ca 0.06 -0.31 -0.13 0.00 -0.26 0.00 0.00 58.87 58.23 1dtw n SER 220 Cb 0.59 0.37 -0.11 0.00 -0.26 0.00 0.00 64.21 64.80 1dtw n SER 220 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1dtw n ASP 221 N -0.37 1.87 -3.86 4.04 10.43 0.14 -4.51 116.55 124.29 1dtw n ASP 221 Ca 0.00 -0.08 -0.11 0.00 2.57 0.00 0.00 54.79 57.17 1dtw n ASP 221 Cb 0.02 0.05 -0.10 0.00 1.84 0.00 0.00 41.12 42.93 1dtw n ASP 221 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1dtw s VAL 222 N -2.42 0.08 -0.19 2.53 1.01 -1.10 -4.41 120.40 115.91 1dtw s VAL 222 Ca -0.23 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.02 1dtw s VAL 222 Cb 0.07 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.95 1dtw s VAL 222 CO 0.56 -0.38 -0.01 -0.89 0.00 0.00 0.00 175.10 174.38 1dtw s THR 223 N -1.45 3.98 -0.17 3.92 2.01 -0.88 0.86 115.64 123.91 1dtw s THR 223 Ca -0.14 -0.31 -0.03 0.00 0.31 0.00 0.00 61.69 61.52 1dtw s THR 223 Cb -0.07 -2.78 -0.02 0.00 0.01 0.00 0.00 72.50 69.64 1dtw s THR 223 CO 0.02 0.45 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.57 1dtw s LEU 224 N 0.78 2.98 -0.06 4.42 1.02 0.55 -1.89 118.68 126.48 1dtw s LEU 224 Ca -0.00 -0.27 0.04 0.00 0.02 0.00 0.00 54.13 53.92 1dtw s LEU 224 Cb -0.14 -1.72 -0.00 0.00 0.02 0.00 0.00 46.19 44.35 1dtw s LEU 224 CO 0.02 0.11 -0.20 -0.69 0.02 0.00 0.00 176.35 175.61 1dtw s VAL 225 N 0.71 1.66 0.29 -1.59 1.01 -0.72 -0.18 120.40 121.59 1dtw s VAL 225 Ca -0.03 -0.82 -0.14 0.00 0.00 0.00 0.00 61.98 60.98 1dtw s VAL 225 Cb -0.15 -1.44 0.05 0.00 0.00 0.00 0.00 36.38 34.85 1dtw s VAL 225 CO 0.02 0.47 0.72 0.00 0.00 0.00 0.00 175.10 176.32 1dtw n ALA 226 N 3.31 -1.71 -3.46 5.51 0.00 -1.06 -1.44 120.51 121.66 1dtw n ALA 226 Ca -0.19 -1.02 -0.10 0.00 0.00 0.00 0.00 53.44 52.13 1dtw n ALA 226 Cb 0.53 0.76 -0.03 0.00 0.00 0.00 0.00 19.45 20.71 1dtw n ALA 226 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1dtw s TRP 227 N -3.07 -0.29 0.00 0.00 -2.14 -1.26 -1.75 118.94 110.42 1dtw s TRP 227 Ca 0.15 -0.03 0.00 0.00 2.66 0.00 0.00 56.10 58.88 1dtw s TRP 227 Cb -0.04 0.52 0.00 0.00 -3.10 0.00 0.00 33.47 30.85 1dtw s TRP 227 CO 0.09 -0.96 0.00 0.41 -2.66 0.00 0.00 176.95 173.83 1dtw n GLY 228 N -0.38 1.57 0.18 3.67 0.00 -1.26 -2.71 105.19 106.28 1dtw n GLY 228 Ca -0.11 -0.67 0.03 0.00 0.00 0.00 0.00 46.02 45.27 1dtw n GLY 228 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1dtw h THR 229 N 0.00 1.18 -0.59 2.61 2.02 -1.91 -3.01 112.91 113.20 1dtw h THR 229 Ca 0.00 -1.41 0.14 0.00 0.77 0.00 0.00 66.41 65.92 1dtw h THR 229 Cb 0.00 1.78 -0.03 0.00 -1.74 0.00 0.00 68.15 68.16 1dtw h THR 229 CO 0.00 0.39 0.41 -0.61 0.37 0.00 0.00 175.52 176.08 1dtw h GLN 230 N 0.00 0.16 -0.39 6.66 5.75 -1.89 -1.75 115.11 123.64 1dtw h GLN 230 Ca -0.00 -0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.54 1dtw h GLN 230 Cb 0.75 -0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.21 1dtw h GLN 230 CO 0.05 0.11 0.10 0.28 -2.65 0.00 0.00 178.83 176.72 1dtw h VAL 231 N 0.17 0.83 -0.15 2.39 2.07 -1.62 0.28 116.25 120.22 1dtw h VAL 231 Ca 0.28 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.72 1dtw h VAL 231 Cb 0.89 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1dtw h VAL 231 CO -0.04 0.04 0.07 0.45 0.02 0.00 0.00 177.57 178.10 1dtw h HIS 232 N 0.24 0.19 -0.04 1.57 3.86 -1.52 0.52 115.15 119.97 1dtw h HIS 232 Ca 0.18 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.35 1dtw h HIS 232 Cb 0.20 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.61 1dtw h HIS 232 CO -0.18 0.15 -0.14 0.28 0.86 0.00 0.00 177.93 178.90 1dtw h VAL 233 N 0.20 1.47 0.00 2.45 2.07 -0.68 -2.29 116.25 119.47 1dtw h VAL 233 Ca 0.05 -1.59 -0.02 0.00 0.82 0.00 0.00 66.70 65.96 1dtw h VAL 233 Cb 0.03 2.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1dtw h VAL 233 CO -0.01 0.44 -0.11 0.16 0.02 0.00 0.00 177.57 178.07 1dtw h ILE 234 N -0.41 0.45 -0.55 4.57 3.07 -0.15 -0.47 117.51 124.03 1dtw h ILE 234 Ca -0.01 -0.54 -0.12 0.00 1.55 0.00 0.00 64.86 65.74 1dtw h ILE 234 Cb 0.78 1.37 -0.02 0.00 -0.27 0.00 0.00 36.82 38.69 1dtw h ILE 234 CO 0.03 0.10 -0.12 -0.09 -1.05 0.00 0.00 178.15 177.03 1dtw h ARG 235 N 0.00 1.04 -0.14 0.16 2.43 -0.80 -2.14 114.38 114.93 1dtw h ARG 235 Ca -0.00 -0.39 -0.08 0.00 -0.81 0.00 0.00 59.98 58.70 1dtw h ARG 235 Cb 0.37 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1dtw h ARG 235 CO 0.01 1.08 -0.22 0.93 -1.51 0.00 0.00 179.97 180.27 1dtw h GLU 236 N 0.92 0.40 -0.16 0.20 4.39 -0.60 -2.68 114.58 117.06 1dtw h GLU 236 Ca 0.14 -0.24 0.05 0.00 0.34 0.00 0.00 59.36 59.64 1dtw h GLU 236 Cb 0.69 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 1dtw h GLU 236 CO 0.05 0.83 0.30 0.28 -1.16 0.00 0.00 179.01 179.31 1dtw h VAL 237 N 0.01 0.22 0.35 3.13 2.07 -1.05 -0.83 116.25 120.15 1dtw h VAL 237 Ca 0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 1dtw h VAL 237 Cb 0.79 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1dtw h VAL 237 CO 0.05 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 177.47 1dtw h ALA 238 N 1.55 -0.51 -0.90 1.67 0.00 -1.05 -0.25 119.26 119.78 1dtw h ALA 238 Ca 0.07 -0.10 0.14 0.00 0.00 0.00 0.00 54.91 55.03 1dtw h ALA 238 Cb 0.67 0.18 -0.15 0.00 0.00 0.00 0.00 17.79 18.49 1dtw h ALA 238 CO -0.00 -0.47 -0.37 1.03 0.00 0.00 0.00 179.25 179.44 1dtw h SER 239 N -1.04 -1.34 0.45 0.00 0.87 -1.01 -0.28 113.55 111.20 1dtw h SER 239 Ca -0.05 0.29 -0.02 0.00 -1.23 0.00 0.00 61.79 60.79 1dtw h SER 239 Cb 0.36 0.71 -0.01 0.00 -0.44 0.00 0.00 62.40 63.01 1dtw h SER 239 CO 0.08 -0.29 -0.39 0.24 -0.53 0.00 0.00 176.83 175.94 1dtw h MET 240 N -0.04 -0.79 -0.33 2.24 2.86 -1.34 -2.43 114.93 115.09 1dtw h MET 240 Ca 0.33 0.05 0.03 0.00 -2.06 0.00 0.00 59.70 58.05 1dtw h MET 240 Cb 0.59 0.18 -0.04 0.00 0.06 0.00 0.00 31.60 32.39 1dtw h MET 240 CO -0.91 -0.53 -0.20 0.00 1.06 0.00 0.00 176.91 176.33 1dtw n ALA 241 N -2.66 -0.21 0.14 6.32 0.00 -0.11 0.63 120.51 124.62 1dtw n ALA 241 Ca -0.10 0.28 -0.14 0.00 0.00 0.00 0.00 53.44 53.49 1dtw n ALA 241 Cb 0.37 0.14 -0.08 0.00 0.00 0.00 0.00 19.45 19.88 1dtw n ALA 241 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1dtw h LYS 242 N 0.00 -0.31 0.00 0.00 2.10 -0.98 0.37 116.57 117.76 1dtw h LYS 242 Ca 0.05 0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.72 1dtw h LYS 242 Cb 0.14 0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 1dtw h LYS 242 CO -0.31 -0.07 0.05 1.49 -2.00 0.00 0.00 179.45 178.60 1dtw h GLU 243 N -0.51 0.00 0.00 0.07 4.22 -0.77 1.44 114.58 119.03 1dtw h GLU 243 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.41 1dtw h GLU 243 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1dtw h GLU 243 CO 0.05 0.00 0.00 1.63 -2.18 0.00 0.00 179.01 178.51 1dtw n LYS 244 N -2.72 3.21 0.00 1.92 5.02 0.21 -4.76 118.16 121.04 1dtw n LYS 244 Ca -0.02 -0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 1dtw n LYS 244 Cb 0.10 -0.68 0.00 0.00 -0.02 0.00 0.00 35.03 34.43 1dtw n LYS 244 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1dtw n LEU 245 N -0.52 0.00 -3.52 -0.35 4.77 0.13 -5.02 117.00 112.49 1dtw n LEU 245 Ca 0.00 -0.15 -0.19 0.00 -0.03 0.00 0.00 56.01 55.64 1dtw n LEU 245 Cb 0.01 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1dtw n LEU 245 CO 0.00 0.17 0.01 0.61 -1.33 0.00 0.00 177.39 176.85 1dtw n GLY 246 N 0.00 -1.18 2.69 -0.72 0.00 0.49 -4.89 105.19 101.57 1dtw n GLY 246 Ca 0.00 0.51 -0.19 0.00 0.00 0.00 0.00 46.02 46.34 1dtw n GLY 246 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dtw s VAL 247 N -3.17 -0.10 -0.41 1.61 1.01 -1.24 -4.91 120.40 113.19 1dtw s VAL 247 Ca 0.18 0.40 -0.24 0.00 0.00 0.00 0.00 61.98 62.31 1dtw s VAL 247 Cb -0.06 -0.14 0.02 0.00 0.00 0.00 0.00 36.38 36.19 1dtw s VAL 247 CO 0.84 0.17 0.84 -0.55 0.00 0.00 0.00 175.10 176.39 1dtw s SER 248 N 2.01 6.52 -0.12 3.32 0.15 -1.26 -2.21 113.70 122.12 1dtw s SER 248 Ca 0.03 0.22 -0.06 0.00 0.70 0.00 0.00 55.95 56.83 1dtw s SER 248 Cb -0.12 -2.42 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 1dtw s SER 248 CO -0.03 -0.87 0.12 0.00 1.20 0.00 0.00 173.24 173.66 1dtw s GLU 250 N -1.00 2.97 -0.10 0.00 2.12 0.25 -3.51 118.70 119.43 1dtw s GLU 250 Ca 0.15 -1.14 -0.26 0.00 0.36 0.00 0.00 54.97 54.08 1dtw s GLU 250 Cb -0.12 -4.03 -0.03 0.00 0.26 0.00 0.00 34.13 30.22 1dtw s GLU 250 CO 0.04 -0.85 0.82 0.08 -0.54 0.00 0.00 175.26 174.81 1dtw s VAL 251 N 1.66 4.94 -0.04 3.70 1.01 0.14 -0.33 120.40 131.47 1dtw s VAL 251 Ca 0.05 1.66 0.04 0.00 0.00 0.00 0.00 61.98 63.73 1dtw s VAL 251 Cb -0.21 -4.14 -0.00 0.00 0.00 0.00 0.00 36.38 32.03 1dtw s VAL 251 CO 0.09 0.13 -0.17 -0.63 0.00 0.00 0.00 175.10 174.52 1dtw s ILE 252 N 1.44 1.40 -0.33 2.22 1.01 0.75 -2.06 121.20 125.62 1dtw s ILE 252 Ca 0.41 -0.69 -0.10 0.00 0.00 0.00 0.00 60.65 60.27 1dtw s ILE 252 Cb -0.18 -1.21 0.01 0.00 0.01 0.00 0.00 42.46 41.09 1dtw s ILE 252 CO 0.18 0.41 0.16 -0.62 0.00 0.00 0.00 174.94 175.06 1dtw s ASP 253 N 0.08 5.57 0.25 3.58 2.15 0.21 -2.58 116.67 125.94 1dtw s ASP 253 Ca -0.05 -0.69 -0.04 0.00 0.43 0.00 0.00 52.55 52.21 1dtw s ASP 253 Cb -0.12 -2.00 0.30 0.00 -0.30 0.00 0.00 42.92 40.81 1dtw s ASP 253 CO 0.02 -0.25 1.80 0.25 -0.17 0.00 0.00 175.17 176.82 1dtw h LEU 254 N 8.37 0.89 0.00 -1.34 5.85 -1.64 0.15 115.31 127.58 1dtw h LEU 254 Ca -0.30 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1dtw h LEU 254 Cb 1.13 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1dtw h LEU 254 CO 0.63 0.85 0.00 0.54 -0.34 0.00 0.00 178.44 180.12 1dtw n ARG 255 N -4.26 0.00 -3.54 1.25 1.74 -1.26 -4.08 116.66 106.51 1dtw n ARG 255 Ca 0.05 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.75 1dtw n ARG 255 Cb 0.23 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.58 1dtw n ARG 255 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1dtw s THR 256 N 0.00 5.28 -0.10 0.55 2.01 -1.26 -0.54 115.64 121.58 1dtw s THR 256 Ca 0.00 0.42 -0.02 0.00 0.31 0.00 0.00 61.69 62.40 1dtw s THR 256 Cb 0.00 -3.60 -0.01 0.00 0.01 0.00 0.00 72.50 68.90 1dtw s THR 256 CO 0.00 0.30 -0.03 0.40 -0.69 0.00 0.00 174.62 174.60 1dtw h ILE 257 N 5.04 0.00 0.00 1.82 1.08 0.09 -3.38 117.51 122.15 1dtw h ILE 257 Ca -0.37 -0.89 0.00 0.00 -0.39 0.00 0.00 64.86 63.21 1dtw h ILE 257 Cb 1.17 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.92 1dtw h ILE 257 CO 0.68 0.00 0.00 -0.38 -0.69 0.00 0.00 178.15 177.76 1dtw n ILE 258 N -4.46 0.00 -2.29 -0.67 5.41 -1.25 -3.43 119.36 112.66 1dtw n ILE 258 Ca -0.01 0.71 -0.34 0.00 1.00 0.00 0.00 62.75 64.12 1dtw n ILE 258 Cb 0.04 -1.42 -0.04 0.00 -0.71 0.00 0.00 39.64 37.52 1dtw n ILE 258 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1dtw s PRO 259 N -0.79 3.06 0.23 0.38 0.02 -1.26 -4.89 135.00 131.74 1dtw s PRO 259 Ca 0.00 -0.73 -0.18 0.00 0.02 0.00 0.00 61.00 60.11 1dtw s PRO 259 Cb 0.00 -5.21 -0.08 0.00 0.02 0.00 0.00 34.50 29.22 1dtw s PRO 259 CO 0.00 -2.83 0.71 1.67 -0.33 0.00 0.00 177.00 176.22 1dtw s TRP 260 N 7.65 3.59 -0.48 6.54 1.48 -1.22 -4.15 118.94 132.35 1dtw s TRP 260 Ca 0.59 1.33 -0.24 0.00 -1.06 0.00 0.00 56.10 56.72 1dtw s TRP 260 Cb -0.03 -2.58 -0.23 0.00 -1.16 0.00 0.00 33.47 29.47 1dtw s TRP 260 CO -0.04 0.30 1.79 -3.47 -4.06 0.00 0.00 176.95 171.46 1dtw n ASP 261 N 0.52 2.01 -0.28 -2.66 -0.08 -1.26 -4.73 116.55 110.07 1dtw n ASP 261 Ca -0.01 -2.58 0.08 0.00 -1.51 0.00 0.00 54.79 50.77 1dtw n ASP 261 Cb 0.51 -0.87 0.24 0.00 2.34 0.00 0.00 41.12 43.34 1dtw n ASP 261 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1dtw h VAL 262 N 4.59 0.58 0.29 5.18 2.07 -1.93 -3.06 116.25 123.98 1dtw h VAL 262 Ca 0.35 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.71 1dtw h VAL 262 Cb 0.63 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1dtw h VAL 262 CO 1.94 0.08 -0.14 0.44 0.02 0.00 0.00 177.57 179.91 1dtw h ASP 263 N 0.44 -0.33 -0.92 0.57 3.32 -1.99 -1.60 116.42 115.91 1dtw h ASP 263 Ca 0.48 -0.09 0.21 0.00 0.02 0.00 0.00 57.03 57.65 1dtw h ASP 263 Cb 0.80 0.09 -0.07 0.00 0.22 0.00 0.00 39.33 40.37 1dtw h ASP 263 CO -0.46 -0.11 0.61 0.74 -1.72 0.00 0.00 179.24 178.30 1dtw h THR 264 N -0.55 0.65 0.27 0.35 2.02 -1.94 0.11 112.91 113.82 1dtw h THR 264 Ca -0.04 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 1dtw h THR 264 Cb 0.41 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1dtw h THR 264 CO 0.07 0.07 -0.13 0.40 0.37 0.00 0.00 175.52 176.30 1dtw h ILE 265 N 0.39 0.00 -0.95 3.11 1.08 -1.44 -2.83 117.51 116.86 1dtw h ILE 265 Ca 0.48 -0.32 0.20 0.00 -0.39 0.00 0.00 64.86 64.83 1dtw h ILE 265 Cb 1.24 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.90 1dtw h ILE 265 CO -0.18 0.00 0.61 0.00 -0.69 0.00 0.00 178.15 177.89 1dtw h LYS 267 N 0.55 -1.26 -0.44 0.00 3.64 -0.85 -0.44 116.57 117.76 1dtw h LYS 267 Ca 0.52 0.09 0.09 0.00 -1.27 0.00 0.00 60.65 60.07 1dtw h LYS 267 Cb 1.08 0.29 -0.10 0.00 -0.41 0.00 0.00 32.23 33.09 1dtw h LYS 267 CO -0.26 -0.84 -0.25 1.03 -2.27 0.00 0.00 179.45 176.86 1dtw h SER 268 N -1.31 -0.86 -0.99 4.20 0.87 -0.98 0.05 113.55 114.54 1dtw h SER 268 Ca -0.13 0.18 0.09 0.00 -1.23 0.00 0.00 61.79 60.70 1dtw h SER 268 Cb 1.02 0.44 -0.07 0.00 -0.44 0.00 0.00 62.40 63.34 1dtw h SER 268 CO 0.19 -0.27 0.63 0.58 -0.53 0.00 0.00 176.83 177.44 1dtw h VAL 269 N -0.16 1.01 -0.99 2.23 2.07 -1.03 0.12 116.25 119.49 1dtw h VAL 269 Ca 0.20 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.39 1dtw h VAL 269 Cb 0.49 -0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 30.05 1dtw h VAL 269 CO -0.54 0.20 0.65 0.40 0.02 0.00 0.00 177.57 178.30 1dtw h ILE 270 N 1.07 1.19 -0.03 4.57 2.04 0.74 1.81 117.51 128.91 1dtw h ILE 270 Ca 0.45 -0.44 -0.15 0.00 1.00 0.00 0.00 64.86 65.73 1dtw h ILE 270 Cb 0.32 -0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.18 1dtw h ILE 270 CO -0.21 0.23 -0.65 0.50 0.00 0.00 0.00 178.15 178.02 1dtw h LYS 271 N 1.28 0.12 0.00 2.37 3.64 -0.37 -3.37 116.57 120.24 1dtw h LYS 271 Ca 0.39 -0.09 -0.23 0.00 -1.27 0.00 0.00 60.65 59.45 1dtw h LYS 271 Cb -0.04 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1dtw h LYS 271 CO -0.11 0.73 -1.28 2.41 -2.27 0.00 0.00 179.45 178.92 1dtw n THR 272 N -3.80 1.53 -0.35 1.00 -1.04 0.24 -4.87 114.28 106.99 1dtw n THR 272 Ca -0.02 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 1dtw n THR 272 Cb 0.65 -2.04 0.00 0.00 -1.82 0.00 0.00 70.33 67.11 1dtw n THR 272 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1dtw n GLY 273 N 1.43 0.95 3.01 3.41 0.00 0.60 -4.67 105.19 109.93 1dtw n GLY 273 Ca -0.32 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 1dtw n GLY 273 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dtw s ARG 274 N -0.51 0.26 -0.03 1.61 0.52 -1.26 0.70 118.95 120.23 1dtw s ARG 274 Ca 0.00 -0.15 0.01 0.00 -0.52 0.00 0.00 55.73 55.07 1dtw s ARG 274 Cb 0.00 0.11 0.02 0.00 0.52 0.00 0.00 34.95 35.60 1dtw s ARG 274 CO 0.00 -0.05 -0.02 -1.17 0.02 0.00 0.00 175.30 174.08 1dtw s LEU 275 N -0.63 1.29 -0.18 2.53 0.20 -1.26 -2.08 118.68 118.56 1dtw s LEU 275 Ca -0.07 -0.06 -0.01 0.00 0.69 0.00 0.00 54.13 54.68 1dtw s LEU 275 Cb -0.04 -0.29 0.05 0.00 -0.43 0.00 0.00 46.19 45.47 1dtw s LEU 275 CO 0.00 -0.07 -0.02 -0.22 -0.29 0.00 0.00 176.35 175.75 1dtw s LEU 276 N 0.88 1.55 -0.06 -0.68 0.20 -0.79 -0.09 118.68 119.69 1dtw s LEU 276 Ca -0.10 -0.75 -0.01 0.00 0.69 0.00 0.00 54.13 53.97 1dtw s LEU 276 Cb -0.13 -0.82 -0.03 0.00 -0.43 0.00 0.00 46.19 44.78 1dtw s LEU 276 CO -0.01 -0.23 0.00 -0.63 -0.29 0.00 0.00 176.35 175.19 1dtw s ILE 277 N 1.69 4.26 -0.01 6.68 1.01 0.53 -1.75 121.20 133.62 1dtw s ILE 277 Ca -0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.23 1dtw s ILE 277 Cb -0.16 -2.82 0.00 0.00 0.01 0.00 0.00 42.46 39.49 1dtw s ILE 277 CO -0.07 0.54 0.13 -0.94 0.00 0.00 0.00 174.94 174.59 1dtw s SER 278 N -1.08 0.01 -0.22 3.58 1.04 -0.52 -0.32 113.70 116.18 1dtw s SER 278 Ca 0.15 -0.13 -0.26 0.00 0.48 0.00 0.00 55.95 56.19 1dtw s SER 278 Cb -0.11 0.22 0.08 0.00 0.10 0.00 0.00 66.02 66.31 1dtw s SER 278 CO 0.05 -0.30 0.79 -1.38 0.98 0.00 0.00 173.24 173.38 1dtw s HIS 279 N -1.09 -0.68 0.25 5.02 -3.43 -1.02 -4.44 115.29 109.91 1dtw s HIS 279 Ca -0.12 1.55 -0.04 0.00 -0.80 0.00 0.00 55.06 55.65 1dtw s HIS 279 Cb -0.06 0.33 0.49 0.00 -1.43 0.00 0.00 32.58 31.90 1dtw s HIS 279 CO 0.01 -0.39 1.68 0.93 -2.00 0.00 0.00 174.74 174.96 1dtw h GLU 280 N 4.31 0.24 -6.32 -0.38 5.08 -1.93 -2.84 114.58 112.75 1dtw h GLU 280 Ca -0.28 -0.01 -0.59 0.00 -1.00 0.00 0.00 59.36 57.48 1dtw h GLU 280 Cb 1.16 -0.05 0.18 0.00 0.50 0.00 0.00 28.75 30.53 1dtw h GLU 280 CO 0.14 0.16 -0.70 0.00 -1.00 0.00 0.00 179.01 177.61 1dtw n ALA 281 N -2.69 -1.97 -1.42 3.43 0.00 -1.26 -2.17 120.51 114.43 1dtw n ALA 281 Ca 0.15 -0.06 -0.37 0.00 0.00 0.00 0.00 53.44 53.16 1dtw n ALA 281 Cb 0.48 -1.66 0.07 0.00 0.00 0.00 0.00 19.45 18.34 1dtw n ALA 281 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1dtw n PRO 282 N 0.52 0.55 0.00 0.00 -0.02 -1.26 -1.47 135.00 133.31 1dtw n PRO 282 Ca 0.10 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1dtw n PRO 282 Cb 0.48 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1dtw n PRO 282 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1dtw n LEU 283 N -0.77 0.03 -4.68 2.45 7.94 -0.68 -3.50 117.00 117.79 1dtw n LEU 283 Ca 0.12 0.86 -0.55 0.00 -1.11 0.00 0.00 56.01 55.34 1dtw n LEU 283 Cb 0.49 -0.39 -0.07 0.00 0.53 0.00 0.00 43.42 43.99 1dtw n LEU 283 CO 0.49 -0.39 1.24 0.41 -1.11 0.00 0.00 177.39 178.04 1dtw n THR 284 N -1.66 0.26 0.00 1.96 -1.04 -1.26 -0.54 114.28 112.00 1dtw n THR 284 Ca 0.00 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 1dtw n THR 284 Cb 0.00 -1.21 0.00 0.00 -1.82 0.00 0.00 70.33 67.30 1dtw n THR 284 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1dtw n GLY 285 N 3.81 2.65 3.47 3.41 0.00 -1.26 -4.99 105.19 112.28 1dtw n GLY 285 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1dtw n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dtw n GLY 286 N -1.97 -1.69 0.22 -0.02 0.00 0.30 -4.88 105.19 97.14 1dtw n GLY 286 Ca 0.00 -0.91 0.07 0.00 0.00 0.00 0.00 46.02 45.18 1dtw n GLY 286 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1dtw h PHE 287 N -2.18 0.00 -0.27 1.61 3.57 -1.86 -2.55 116.94 115.26 1dtw h PHE 287 Ca -0.52 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.06 1dtw h PHE 287 Cb 1.31 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 1dtw h PHE 287 CO 0.32 0.23 0.36 0.00 -2.23 0.00 0.00 178.31 177.00 1dtw h ALA 288 N 1.77 1.87 0.26 2.41 0.00 -1.90 -1.42 119.26 122.25 1dtw h ALA 288 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1dtw h ALA 288 Cb 0.47 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1dtw h ALA 288 CO 0.03 -0.50 -0.13 0.77 0.00 0.00 0.00 179.25 179.42 1dtw h SER 289 N 0.00 -0.30 -0.82 0.00 0.02 -1.77 -0.79 113.55 109.88 1dtw h SER 289 Ca 0.13 -0.08 0.06 0.00 -0.84 0.00 0.00 61.79 61.06 1dtw h SER 289 Cb 0.85 0.08 -0.05 0.00 0.14 0.00 0.00 62.40 63.41 1dtw h SER 289 CO -0.00 -0.10 0.54 -0.08 -1.14 0.00 0.00 176.83 176.05 1dtw h GLU 290 N -0.48 0.89 0.20 3.45 4.57 -1.45 -0.99 114.58 120.76 1dtw h GLU 290 Ca -0.04 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 1dtw h GLU 290 Cb 0.36 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1dtw h GLU 290 CO 0.06 0.59 -0.10 0.82 -1.18 0.00 0.00 179.01 179.20 1dtw h ILE 291 N 0.91 0.89 0.27 2.32 2.04 -1.37 -1.99 117.51 120.57 1dtw h ILE 291 Ca 0.35 -0.68 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 1dtw h ILE 291 Cb 0.21 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 1dtw h ILE 291 CO -0.12 0.15 -0.40 -1.28 0.00 0.00 0.00 178.15 176.50 1dtw h SER 292 N -0.62 -1.14 -0.95 1.72 0.87 -0.80 0.17 113.55 112.80 1dtw h SER 292 Ca -0.03 0.10 0.23 0.00 -1.23 0.00 0.00 61.79 60.86 1dtw h SER 292 Cb 0.45 0.40 -0.07 0.00 -0.44 0.00 0.00 62.40 62.74 1dtw h SER 292 CO 0.05 -0.48 0.63 0.77 -0.53 0.00 0.00 176.83 177.26 1dtw h SER 293 N -0.70 0.39 0.15 6.23 4.64 -1.29 0.18 113.55 123.15 1dtw h SER 293 Ca -0.03 0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1dtw h SER 293 Cb 0.64 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1dtw h SER 293 CO -0.12 0.13 -0.07 0.74 -0.87 0.00 0.00 176.83 176.64 1dtw h THR 294 N 0.37 0.78 -0.61 2.95 2.02 -0.67 -2.97 112.91 114.79 1dtw h THR 294 Ca 0.50 -1.17 0.11 0.00 0.77 0.00 0.00 66.41 66.62 1dtw h THR 294 Cb 1.32 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 69.04 1dtw h THR 294 CO -0.19 0.21 0.41 0.58 0.37 0.00 0.00 175.52 176.90 1dtw h VAL 295 N -0.90 0.87 -0.55 3.16 2.07 -0.08 -0.24 116.25 120.58 1dtw h VAL 295 Ca -0.02 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 1dtw h VAL 295 Cb 0.51 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1dtw h VAL 295 CO 0.03 0.07 0.33 -0.61 0.02 0.00 0.00 177.57 177.42 1dtw h GLN 296 N 0.38 0.74 -0.23 1.57 -0.00 -0.71 0.26 115.11 117.12 1dtw h GLN 296 Ca 0.28 -0.07 -0.06 0.00 -0.00 0.00 0.00 58.65 58.81 1dtw h GLN 296 Cb 0.61 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.92 1dtw h GLN 296 CO -0.08 0.53 -0.07 0.93 0.00 0.00 0.00 178.83 180.14 1dtw h GLU 297 N 0.74 0.46 0.33 1.69 5.08 -0.93 -2.85 114.58 119.10 1dtw h GLU 297 Ca 0.20 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1dtw h GLU 297 Cb -0.02 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1dtw h GLU 297 CO -0.04 0.71 -0.16 0.93 -1.00 0.00 0.00 179.01 179.45 1dtw h GLU 298 N 0.19 -0.42 -1.25 2.33 4.39 -1.02 -3.35 114.58 115.44 1dtw h GLU 298 Ca 0.06 0.03 -0.41 0.00 0.34 0.00 0.00 59.36 59.38 1dtw h GLU 298 Cb 0.54 0.10 -0.19 0.00 -0.10 0.00 0.00 28.75 29.10 1dtw h GLU 298 CO 0.03 -0.28 0.52 0.00 -1.16 0.00 0.00 179.01 178.12 1dtw h PHE 300 N 1.35 0.00 0.14 0.00 3.57 -1.62 -2.21 116.94 118.16 1dtw h PHE 300 Ca 0.40 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.58 1dtw h PHE 300 Cb 1.27 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.00 1dtw h PHE 300 CO 1.01 0.00 -1.61 -0.07 -2.23 0.00 0.00 178.31 175.41 1dtw h LEU 301 N 0.00 0.45 -1.15 0.59 4.07 -1.88 -3.34 115.31 114.04 1dtw h LEU 301 Ca 0.19 -0.65 0.00 0.00 0.08 0.00 0.00 57.88 57.50 1dtw h LEU 301 Cb 0.81 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.41 1dtw h LEU 301 CO -0.00 1.55 0.00 0.78 -1.08 0.00 0.00 178.44 179.68 1dtw h ASN 302 N 0.08 0.00 -2.74 -0.43 2.35 -1.78 -3.44 115.58 109.62 1dtw h ASN 302 Ca -0.28 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 54.90 1dtw h ASN 302 Cb 2.04 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 40.38 1dtw h ASN 302 CO 0.16 0.00 1.20 -0.76 -1.65 0.00 0.00 177.43 176.38 1dtw s LEU 303 N -6.04 3.70 0.09 1.61 2.01 -0.94 -4.10 118.68 115.01 1dtw s LEU 303 Ca 0.02 1.45 0.22 0.00 0.01 0.00 0.00 54.13 55.84 1dtw s LEU 303 Cb 0.08 -3.53 -0.16 0.00 0.01 0.00 0.00 46.19 42.59 1dtw s LEU 303 CO 0.55 -1.48 0.78 -0.62 1.01 0.00 0.00 176.35 176.59 1dtw n GLU 304 N 8.06 0.62 -4.00 1.70 1.02 0.22 -4.95 120.64 123.30 1dtw n GLU 304 Ca 0.21 -0.03 -0.09 0.00 -0.02 0.00 0.00 57.16 57.23 1dtw n GLU 304 Cb 0.46 -1.67 -0.11 0.00 -0.02 0.00 0.00 31.44 30.10 1dtw n GLU 304 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dtw s ALA 305 N -3.43 0.19 0.37 0.62 0.00 -1.23 -5.05 121.76 113.22 1dtw s ALA 305 Ca -0.04 -0.70 -0.28 0.00 0.00 0.00 0.00 51.96 50.94 1dtw s ALA 305 Cb 0.12 0.17 -0.11 0.00 0.00 0.00 0.00 23.12 23.30 1dtw s ALA 305 CO 0.85 -0.20 1.51 -2.14 0.00 0.00 0.00 175.76 175.79 1dtw s PRO 306 N -1.88 4.09 0.35 0.00 0.02 -1.26 -4.67 135.00 131.65 1dtw s PRO 306 Ca -0.12 2.60 -0.29 0.00 0.02 0.00 0.00 61.00 63.21 1dtw s PRO 306 Cb -0.07 -2.97 -0.11 0.00 0.02 0.00 0.00 34.50 31.37 1dtw s PRO 306 CO -0.03 -0.57 1.53 -0.89 -0.33 0.00 0.00 177.00 176.71 1dtw n ILE 307 N 0.68 1.66 -4.43 2.83 5.41 -1.26 -4.75 119.36 119.49 1dtw n ILE 307 Ca 0.02 -0.41 -0.34 0.00 1.00 0.00 0.00 62.75 63.01 1dtw n ILE 307 Cb 0.39 -1.98 -0.10 0.00 -0.71 0.00 0.00 39.64 37.24 1dtw n ILE 307 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1dtw s SER 308 N 0.09 5.03 -0.24 4.38 0.15 0.87 -5.02 113.70 118.96 1dtw s SER 308 Ca 0.57 0.06 0.01 0.00 0.70 0.00 0.00 55.95 57.28 1dtw s SER 308 Cb -0.48 -1.35 0.07 0.00 -1.71 0.00 0.00 66.02 62.55 1dtw s SER 308 CO 0.59 0.35 -0.03 -0.13 1.20 0.00 0.00 173.24 175.22 1dtw s ARG 309 N -1.02 1.46 -0.71 5.44 0.52 -1.26 -0.35 118.95 123.04 1dtw s ARG 309 Ca 0.14 -1.00 -0.09 0.00 -0.52 0.00 0.00 55.73 54.27 1dtw s ARG 309 Cb -0.11 -2.54 0.19 0.00 0.52 0.00 0.00 34.95 33.00 1dtw s ARG 309 CO 0.04 -0.65 0.59 0.08 0.02 0.00 0.00 175.30 175.38 1dtw s VAL 310 N 1.42 4.65 0.49 3.52 1.01 0.56 -4.99 120.40 127.06 1dtw s VAL 310 Ca -0.03 -2.65 0.02 0.00 0.00 0.00 0.00 61.98 59.32 1dtw s VAL 310 Cb -0.19 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 1dtw s VAL 310 CO -0.08 -0.94 0.01 0.00 0.00 0.00 0.00 175.10 174.09 1dtw s GLY 312 N -3.83 1.59 0.67 0.00 0.00 -0.54 -4.66 107.32 100.54 1dtw s GLY 312 Ca 0.11 -0.14 -0.11 0.00 0.00 0.00 0.00 44.72 44.58 1dtw s GLY 312 CO 0.06 0.44 1.05 -0.19 0.00 0.00 0.00 173.10 174.46 1dtw s TYR 313 N -2.81 3.22 -1.44 1.90 4.12 -1.26 -1.68 117.35 119.40 1dtw s TYR 313 Ca 0.66 1.40 -0.09 0.00 0.02 0.00 0.00 57.07 59.05 1dtw s TYR 313 Cb -0.20 -2.85 -0.08 0.00 -1.52 0.00 0.00 41.96 37.31 1dtw s TYR 313 CO 0.59 -1.09 2.72 -0.25 0.02 0.00 0.00 175.55 177.54 1dtw n ASP 314 N -2.95 7.60 -4.06 2.29 8.00 -1.26 -4.47 116.55 121.70 1dtw n ASP 314 Ca 0.07 -2.52 -0.10 0.00 0.71 0.00 0.00 54.79 52.95 1dtw n ASP 314 Cb 0.54 -1.45 -0.08 0.00 -0.02 0.00 0.00 41.12 40.11 1dtw n ASP 314 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1dtw s THR 315 N 2.54 0.03 0.93 -3.53 -4.23 -1.26 -5.09 115.64 105.03 1dtw s THR 315 Ca 0.62 -1.63 -0.12 0.00 -1.18 0.00 0.00 61.69 59.37 1dtw s THR 315 Cb 0.16 -2.15 0.15 0.00 1.34 0.00 0.00 72.50 72.00 1dtw s THR 315 CO -0.05 -0.15 1.10 -2.84 -0.54 0.00 0.00 174.62 172.13 1dtw s PRO 316 N -4.05 1.02 -0.35 3.99 0.02 -1.26 -4.93 135.00 129.44 1dtw s PRO 316 Ca 0.26 0.62 -0.29 0.00 0.02 0.00 0.00 61.00 61.60 1dtw s PRO 316 Cb 0.04 -1.80 0.01 0.00 0.02 0.00 0.00 34.50 32.77 1dtw s PRO 316 CO 0.06 -2.35 1.23 0.12 -0.33 0.00 0.00 177.00 175.72 1dtw s PHE 317 N -3.01 2.80 0.47 6.54 5.36 -1.26 -5.00 117.98 123.87 1dtw s PHE 317 Ca 0.64 0.91 -0.22 0.00 -0.96 0.00 0.00 56.93 57.29 1dtw s PHE 317 Cb -0.17 -3.98 -0.07 0.00 -0.34 0.00 0.00 43.02 38.46 1dtw s PHE 317 CO 0.56 -1.42 1.17 -2.14 -1.46 0.00 0.00 175.22 171.93 1dtw s PRO 318 N 4.16 3.69 0.00 10.12 0.02 -1.26 -1.90 135.00 149.82 1dtw s PRO 318 Ca 0.53 1.77 0.00 0.00 0.02 0.00 0.00 61.00 63.31 1dtw s PRO 318 Cb -0.14 -2.35 0.00 0.00 0.02 0.00 0.00 34.50 32.03 1dtw s PRO 318 CO 0.23 -0.61 0.14 1.58 -0.33 0.00 0.00 177.00 178.02 1dtw n HIS 319 N -0.60 0.00 0.48 6.54 -0.00 -1.26 -3.71 115.22 116.66 1dtw n HIS 319 Ca 0.08 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 57.91 1dtw n HIS 319 Cb 0.48 -0.15 0.44 0.00 -0.00 0.00 0.00 29.99 30.77 1dtw n HIS 319 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 1dtw n ILE 320 N -0.94 0.80 0.29 3.57 -5.35 -1.26 -3.14 119.36 113.33 1dtw n ILE 320 Ca 0.00 0.17 0.12 0.00 -0.27 0.00 0.00 62.75 62.76 1dtw n ILE 320 Cb 0.00 -1.03 0.25 0.00 -1.74 0.00 0.00 39.64 37.12 1dtw n ILE 320 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1dtw n PHE 321 N -2.03 0.57 -0.28 4.28 3.01 -1.26 -4.62 117.46 117.13 1dtw n PHE 321 Ca 0.03 -0.28 0.03 0.00 1.01 0.00 0.00 57.45 58.24 1dtw n PHE 321 Cb 0.24 0.00 0.11 0.00 -0.01 0.00 0.00 39.48 39.83 1dtw n PHE 321 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1dtw h GLU 322 N 4.20 0.01 -0.66 -1.08 4.81 -1.62 0.14 114.58 120.37 1dtw h GLU 322 Ca 0.00 -0.00 0.19 0.00 -0.13 0.00 0.00 59.36 59.42 1dtw h GLU 322 Cb 0.93 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.28 1dtw h GLU 322 CO 0.00 0.01 0.51 -1.35 -0.73 0.00 0.00 179.01 177.45 1dtw h PRO 323 N 0.01 0.00 0.00 0.92 0.11 -1.89 0.96 132.00 132.11 1dtw h PRO 323 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 1dtw h PRO 323 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1dtw h PRO 323 CO -0.81 0.00 -1.08 1.19 -0.21 0.00 0.00 178.00 177.09 1dtw n PHE 324 N -4.19 0.07 -0.08 0.65 3.01 0.37 -4.51 117.46 112.78 1dtw n PHE 324 Ca 0.13 0.02 -0.15 0.00 1.01 0.00 0.00 57.45 58.46 1dtw n PHE 324 Cb 0.76 -0.22 -0.11 0.00 -0.01 0.00 0.00 39.48 39.91 1dtw n PHE 324 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 1dtw h TYR 325 N 0.00 0.00 -4.08 1.38 3.20 0.32 -3.49 116.97 114.30 1dtw h TYR 325 Ca 0.00 0.00 -0.55 0.00 3.14 0.00 0.00 58.73 61.32 1dtw h TYR 325 Cb 0.63 0.00 0.18 0.00 1.54 0.00 0.00 36.73 39.08 1dtw h TYR 325 CO 0.00 1.02 0.32 0.44 -1.64 0.00 0.00 178.16 178.30 1dtw n ILE 326 N -4.57 2.86 -1.64 1.81 -5.35 -0.98 -4.19 119.36 107.30 1dtw n ILE 326 Ca -0.15 -0.31 -0.38 0.00 -0.27 0.00 0.00 62.75 61.64 1dtw n ILE 326 Cb 0.49 -1.24 -0.02 0.00 -1.74 0.00 0.00 39.64 37.12 1dtw n ILE 326 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 1dtw n PRO 327 N -2.66 4.02 -0.61 6.28 -0.02 -1.26 -4.96 135.00 135.79 1dtw n PRO 327 Ca 0.14 -2.77 -0.31 0.00 -2.02 0.00 0.00 63.50 58.54 1dtw n PRO 327 Cb 0.50 -2.66 0.19 0.00 -0.02 0.00 0.00 33.50 31.51 1dtw n PRO 327 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1dtw n ASP 328 N 2.52 -2.42 -0.27 2.55 3.85 -1.26 -4.55 116.55 116.96 1dtw n ASP 328 Ca 0.68 -0.20 0.15 0.00 -0.71 0.00 0.00 54.79 54.72 1dtw n ASP 328 Cb 0.28 -0.98 0.43 0.00 -1.35 0.00 0.00 41.12 39.50 1dtw n ASP 328 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.20 176.26 1dtw h LYS 329 N -2.29 0.56 -0.43 0.11 2.10 -1.94 -1.82 116.57 112.87 1dtw h LYS 329 Ca -0.53 -0.03 -0.11 0.00 -2.00 0.00 0.00 60.65 57.98 1dtw h LYS 329 Cb 1.32 -0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 32.50 1dtw h LYS 329 CO 0.38 0.37 -0.17 -1.49 -2.00 0.00 0.00 179.45 176.55 1dtw h TRP 330 N 0.58 0.92 -0.48 0.07 4.06 -1.97 0.02 115.95 119.14 1dtw h TRP 330 Ca 0.48 -0.19 -0.11 0.00 2.06 0.00 0.00 58.89 61.13 1dtw h TRP 330 Cb 0.95 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.87 1dtw h TRP 330 CO -0.00 0.92 -0.14 0.87 -3.56 0.00 0.00 178.44 176.53 1dtw h LYS 331 N 0.73 0.92 0.27 0.49 1.57 -1.64 -1.97 116.57 116.94 1dtw h LYS 331 Ca 0.11 -0.34 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1dtw h LYS 331 Cb 0.68 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1dtw h LYS 331 CO 0.05 0.99 -0.13 0.00 -0.57 0.00 0.00 179.45 179.79 1dtw h TYR 333 N -0.74 -1.27 -0.91 0.00 3.20 -0.96 0.35 116.97 116.64 1dtw h TYR 333 Ca -0.04 0.06 0.12 0.00 3.14 0.00 0.00 58.73 62.01 1dtw h TYR 333 Cb 0.49 0.59 -0.07 0.00 1.54 0.00 0.00 36.73 39.28 1dtw h TYR 333 CO 0.03 -0.47 0.58 0.22 -1.64 0.00 0.00 178.16 176.88 1dtw h ASP 334 N -0.44 0.77 -0.25 -2.11 3.58 -1.44 0.39 116.42 116.92 1dtw h ASP 334 Ca 0.09 0.03 -0.08 0.00 0.42 0.00 0.00 57.03 57.50 1dtw h ASP 334 Cb 0.62 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.53 1dtw h ASP 334 CO -0.46 0.43 -0.10 0.00 -2.88 0.00 0.00 179.24 176.22 1dtw h ALA 335 N 1.57 1.14 -0.44 -0.78 0.00 -0.59 -2.06 119.26 118.11 1dtw h ALA 335 Ca 0.44 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 1dtw h ALA 335 Cb 0.52 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1dtw h ALA 335 CO -0.20 0.54 -0.16 1.25 0.00 0.00 0.00 179.25 180.68 1dtw h LEU 336 N 0.58 0.90 0.44 0.00 5.85 0.34 -2.45 115.31 120.98 1dtw h LEU 336 Ca 0.11 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1dtw h LEU 336 Cb 0.51 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1dtw h LEU 336 CO 0.03 1.08 -0.49 0.03 -0.34 0.00 0.00 178.44 178.75 1dtw h ARG 337 N 0.71 -0.92 -0.61 1.25 3.08 0.00 -0.37 114.38 117.53 1dtw h ARG 337 Ca 0.10 0.06 0.08 0.00 0.07 0.00 0.00 59.98 60.30 1dtw h ARG 337 Cb 0.72 0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.91 1dtw h ARG 337 CO 0.05 -0.61 0.26 0.87 -1.07 0.00 0.00 179.97 179.48 1dtw h LYS 338 N -0.95 0.46 0.22 0.04 1.57 -1.41 0.25 116.57 116.75 1dtw h LYS 338 Ca -0.05 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1dtw h LYS 338 Cb 0.84 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 1dtw h LYS 338 CO -0.09 0.31 -0.23 1.98 -0.57 0.00 0.00 179.45 180.84 1dtw h MET 339 N 0.48 -0.44 -0.67 3.15 4.05 -1.11 -2.78 114.93 117.62 1dtw h MET 339 Ca 0.29 0.03 0.14 0.00 -0.28 0.00 0.00 59.70 59.88 1dtw h MET 339 Cb 0.31 0.10 -0.10 0.00 -0.80 0.00 0.00 31.60 31.11 1dtw h MET 339 CO -0.26 -0.29 0.13 0.82 0.23 0.00 0.00 176.91 177.54 1dtw h ILE 340 N -0.46 0.56 0.00 1.77 2.04 -0.78 0.27 117.51 120.92 1dtw h ILE 340 Ca -0.03 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1dtw h ILE 340 Cb 0.40 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1dtw h ILE 340 CO -0.04 0.04 0.00 0.59 0.00 0.00 0.00 178.15 178.75 1dtw n ASN 341 N -5.16 0.10 0.00 1.72 4.13 0.85 -5.10 115.26 111.80 1dtw n ASN 341 Ca 0.11 -0.43 0.01 0.00 1.68 0.00 0.00 54.58 55.95 1dtw n ASN 341 Cb 0.39 -0.05 0.05 0.00 -1.54 0.00 0.00 39.78 38.63 1dtw n ASN 341 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54