#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rpw n LEU 3 N 0.00 0.00 -0.09 1.20 4.32 -1.26 -4.39 117.00 116.78 1rpw n LEU 3 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.92 1rpw n LEU 3 Cb 0.00 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 41.81 1rpw n LEU 3 CO 0.00 0.00 0.90 0.50 -1.22 0.00 0.00 177.39 177.57 1rpw h LYS 4 N 0.00 0.17 -2.02 3.23 3.64 -2.02 -2.90 116.57 116.67 1rpw h LYS 4 Ca 0.00 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1rpw h LYS 4 Cb 0.00 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1rpw h LYS 4 CO 0.00 0.11 -0.14 -0.25 -2.27 0.00 0.00 179.45 176.91 1rpw n ASP 5 N -5.09 5.04 0.00 4.20 9.92 -1.26 -2.59 116.55 126.77 1rpw n ASP 5 Ca 0.00 -2.37 0.00 0.00 -0.53 0.00 0.00 54.79 51.89 1rpw n ASP 5 Cb 0.14 -1.18 0.00 0.00 -0.64 0.00 0.00 41.12 39.44 1rpw n ASP 5 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1rpw n LYS 6 N 1.92 0.20 0.27 -1.24 3.00 -1.10 -4.63 118.16 116.57 1rpw n LYS 6 Ca 0.16 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.36 1rpw n LYS 6 Cb 0.63 -0.65 -0.05 0.00 0.00 0.00 0.00 35.03 34.96 1rpw n LYS 6 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 1rpw h ILE 7 N 0.00 0.00 -0.87 3.15 1.08 -1.58 -2.01 117.51 117.28 1rpw h ILE 7 Ca 0.00 -0.26 0.32 0.00 -0.39 0.00 0.00 64.86 64.54 1rpw h ILE 7 Cb 0.31 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 33.90 1rpw h ILE 7 CO 0.00 0.00 0.31 0.18 -0.69 0.00 0.00 178.15 177.95 1rpw n LEU 8 N -4.61 0.16 0.34 1.44 4.77 -1.17 0.53 117.00 118.47 1rpw n LEU 8 Ca -0.09 1.46 -0.14 0.00 -0.03 0.00 0.00 56.01 57.22 1rpw n LEU 8 Cb 0.28 -0.65 -0.06 0.00 -2.33 0.00 0.00 43.42 40.66 1rpw n LEU 8 CO 0.21 -1.58 0.42 1.23 -1.33 0.00 0.00 177.39 176.34 1rpw h GLY 9 N 0.00 -0.93 0.48 -0.72 0.00 -1.78 -1.35 103.07 98.77 1rpw h GLY 9 Ca 0.67 0.34 0.14 0.00 0.00 0.00 0.00 47.33 48.48 1rpw h GLY 9 CO -0.73 -0.34 0.60 -2.08 0.00 0.00 0.00 176.54 173.99 1rpw h VAL 10 N -1.06 0.86 0.12 4.60 2.07 0.27 -1.99 116.25 121.11 1rpw h VAL 10 Ca -0.09 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1rpw h VAL 10 Cb 0.68 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1rpw h VAL 10 CO 0.15 0.15 -0.08 0.00 0.02 0.00 0.00 177.57 177.80 1rpw h ALA 11 N 1.58 -0.93 -0.99 1.67 0.00 0.17 -1.67 119.26 119.09 1rpw h ALA 11 Ca 0.48 -0.04 0.38 0.00 0.00 0.00 0.00 54.91 55.73 1rpw h ALA 11 Cb 0.65 0.22 -0.18 0.00 0.00 0.00 0.00 17.79 18.49 1rpw h ALA 11 CO -0.24 -0.92 0.42 1.17 0.00 0.00 0.00 179.25 179.67 1rpw n LYS 12 N -2.72 -0.06 0.01 0.00 4.81 -0.52 0.08 118.16 119.76 1rpw n LYS 12 Ca -0.02 1.39 -0.10 0.00 -0.87 0.00 0.00 58.31 58.70 1rpw n LYS 12 Cb 0.08 -2.43 -0.05 0.00 0.02 0.00 0.00 35.03 32.66 1rpw n LYS 12 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1rpw h GLU 13 N 0.00 -0.04 0.00 1.64 4.22 -0.88 -2.41 114.58 117.11 1rpw h GLU 13 Ca 0.78 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 60.08 1rpw h GLU 13 Cb 2.00 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 31.23 1rpw h GLU 13 CO -0.80 -0.03 -0.69 -0.07 -2.18 0.00 0.00 179.01 175.24 1rpw h LEU 14 N -0.04 0.00 -1.37 1.64 3.38 0.57 -1.08 115.31 118.40 1rpw h LEU 14 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1rpw h LEU 14 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1rpw h LEU 14 CO -0.11 0.69 -0.23 -0.26 0.09 0.00 0.00 178.44 178.63 1rpw h PHE 15 N 0.00 0.14 0.00 1.13 0.05 -0.76 0.59 116.94 118.09 1rpw h PHE 15 Ca -0.01 -0.02 -0.17 0.00 3.82 0.00 0.00 57.97 61.59 1rpw h PHE 15 Cb 1.45 -0.04 -0.03 0.00 2.00 0.00 0.00 35.95 39.34 1rpw h PHE 15 CO 0.00 0.35 -0.93 0.82 -0.18 0.00 0.00 178.31 178.37 1rpw h ILE 16 N 0.12 1.07 -0.79 -0.55 2.04 -1.41 -3.37 117.51 114.62 1rpw h ILE 16 Ca 0.02 -2.16 0.13 0.00 1.00 0.00 0.00 64.86 63.85 1rpw h ILE 16 Cb 0.47 2.39 -0.06 0.00 -0.74 0.00 0.00 36.82 38.89 1rpw h ILE 16 CO 0.03 0.36 0.52 0.50 0.00 0.00 0.00 178.15 179.57 1rpw h LYS 17 N -1.00 0.56 0.00 2.37 3.64 -1.16 -3.43 116.57 117.54 1rpw h LYS 17 Ca -0.25 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 1rpw h LYS 17 Cb 1.19 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1rpw h LYS 17 CO -0.15 0.37 0.00 0.09 -2.27 0.00 0.00 179.45 177.49 1rpw n ASN 18 N -4.51 1.39 -2.18 4.20 3.02 0.19 -5.06 115.26 112.31 1rpw n ASN 18 Ca 0.14 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.96 1rpw n ASN 18 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 1rpw n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rpw n GLY 19 N 3.48 -0.30 0.09 7.41 0.00 -1.26 -4.58 105.19 110.02 1rpw n GLY 19 Ca 0.00 -1.74 -0.12 0.00 0.00 0.00 0.00 46.02 44.15 1rpw n GLY 19 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1rpw h TYR 20 N -0.36 0.30 0.05 1.61 3.20 -1.81 -3.26 116.97 116.69 1rpw h TYR 20 Ca 0.00 -0.22 -0.26 0.00 3.14 0.00 0.00 58.73 61.39 1rpw h TYR 20 Cb 0.00 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 1rpw h TYR 20 CO 0.00 1.17 -1.40 -0.91 -1.64 0.00 0.00 178.16 175.38 1rpw h ASN 21 N 0.04 0.17 -1.35 -2.11 2.35 -1.94 -3.34 115.58 109.40 1rpw h ASN 21 Ca -0.08 -0.70 0.39 0.00 -0.55 0.00 0.00 56.30 55.36 1rpw h ASN 21 Cb 1.89 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 40.15 1rpw h ASN 21 CO 0.17 1.58 1.09 0.00 -1.65 0.00 0.00 177.43 178.62 1rpw h ALA 22 N -0.26 3.25 -3.40 -0.83 0.00 -1.93 -3.35 119.26 112.74 1rpw h ALA 22 Ca -0.34 -0.05 -0.66 0.00 0.00 0.00 0.00 54.91 53.86 1rpw h ALA 22 Cb 1.54 0.10 -0.19 0.00 0.00 0.00 0.00 17.79 19.24 1rpw h ALA 22 CO -0.08 -1.78 -0.66 -0.08 0.00 0.00 0.00 179.25 176.64 1rpw s THR 23 N -4.77 3.94 0.13 0.00 -1.32 -1.23 -4.82 115.64 107.56 1rpw s THR 23 Ca -0.04 -0.36 0.00 0.00 -1.21 0.00 0.00 61.69 60.08 1rpw s THR 23 Cb 0.22 -2.68 -0.04 0.00 -1.51 0.00 0.00 72.50 68.48 1rpw s THR 23 CO 0.74 0.54 -0.00 0.28 -2.21 0.00 0.00 174.62 173.97 1rpw s THR 24 N -0.21 0.43 0.41 5.08 -1.32 -1.26 -4.85 115.64 113.93 1rpw s THR 24 Ca 0.04 -1.92 0.22 0.00 -1.21 0.00 0.00 61.69 58.81 1rpw s THR 24 Cb -0.13 -1.91 0.41 0.00 -1.51 0.00 0.00 72.50 69.36 1rpw s THR 24 CO 0.02 -0.64 1.72 0.71 -2.21 0.00 0.00 174.62 174.23 1rpw h THR 25 N 2.87 0.39 0.15 5.08 1.35 -1.97 0.97 112.91 121.75 1rpw h THR 25 Ca -0.35 -0.10 0.02 0.00 -0.55 0.00 0.00 66.41 65.42 1rpw h THR 25 Cb 1.18 0.07 -0.04 0.00 -1.73 0.00 0.00 68.15 67.63 1rpw h THR 25 CO 0.63 0.05 -0.41 1.23 -0.25 0.00 0.00 175.52 176.77 1rpw h GLY 26 N 0.30 -0.85 0.80 5.82 0.00 -2.00 0.79 103.07 107.93 1rpw h GLY 26 Ca 0.67 0.49 0.01 0.00 0.00 0.00 0.00 47.33 48.51 1rpw h GLY 26 CO -0.35 -0.27 -0.08 0.83 0.00 0.00 0.00 176.54 176.66 1rpw h GLU 27 N -0.67 -0.14 -0.32 4.80 5.08 -1.25 -2.59 114.58 119.49 1rpw h GLU 27 Ca 0.01 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1rpw h GLU 27 Cb 0.68 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.88 1rpw h GLU 27 CO -0.22 -0.09 -0.29 0.82 -1.00 0.00 0.00 179.01 178.23 1rpw h ILE 28 N -0.15 0.29 0.24 3.13 2.04 -1.04 -1.60 117.51 120.42 1rpw h ILE 28 Ca 0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.89 1rpw h ILE 28 Cb 0.18 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 1rpw h ILE 28 CO -0.08 0.00 -0.40 0.58 0.00 0.00 0.00 178.15 178.25 1rpw h VAL 29 N -0.26 0.00 -0.43 1.67 2.07 -0.70 0.77 116.25 119.37 1rpw h VAL 29 Ca 0.15 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.76 1rpw h VAL 29 Cb 0.51 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.20 1rpw h VAL 29 CO -0.47 0.00 -0.08 0.50 0.02 0.00 0.00 177.57 177.55 1rpw h LYS 30 N -0.68 0.03 0.00 1.57 3.64 -1.26 0.21 116.57 120.08 1rpw h LYS 30 Ca -0.03 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1rpw h LYS 30 Cb 0.63 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1rpw h LYS 30 CO -0.14 0.02 0.00 -0.11 -2.27 0.00 0.00 179.45 176.95 1rpw n LEU 31 N -5.29 0.37 -0.73 5.20 7.94 -0.62 -2.22 117.00 121.65 1rpw n LEU 31 Ca 0.03 0.56 0.06 0.00 -1.11 0.00 0.00 56.01 55.55 1rpw n LEU 31 Cb 0.23 -0.48 0.21 0.00 0.53 0.00 0.00 43.42 43.92 1rpw n LEU 31 CO 0.15 -0.26 0.65 -0.24 -1.11 0.00 0.00 177.39 176.58 1rpw n SER 32 N -1.87 3.06 -1.35 1.96 2.88 0.26 -5.03 113.62 113.52 1rpw n SER 32 Ca 0.04 -3.26 -0.02 0.00 -1.33 0.00 0.00 58.87 54.31 1rpw n SER 32 Cb 0.29 -0.54 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 1rpw n SER 32 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1rpw n GLU 33 N -0.92 -0.15 -0.25 -1.46 4.71 0.58 -4.91 120.64 118.24 1rpw n GLU 33 Ca 0.23 0.25 0.00 0.00 -0.01 0.00 0.00 57.16 57.63 1rpw n GLU 33 Cb 0.85 -0.33 0.00 0.00 -1.01 0.00 0.00 31.44 30.95 1rpw n GLU 33 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 1rpw n SER 34 N 1.31 0.00 -4.07 1.62 7.64 -1.11 -5.03 113.62 113.99 1rpw n SER 34 Ca -0.00 -0.19 -0.26 0.00 1.01 0.00 0.00 58.87 59.43 1rpw n SER 34 Cb 0.15 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.30 1rpw n SER 34 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1rpw n SER 35 N -0.13 2.85 -0.04 6.43 3.41 -1.26 -4.73 113.62 120.14 1rpw n SER 35 Ca 0.00 -2.81 -0.12 0.00 -0.26 0.00 0.00 58.87 55.68 1rpw n SER 35 Cb 0.00 0.37 -0.10 0.00 -0.26 0.00 0.00 64.21 64.22 1rpw n SER 35 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1rpw h LYS 36 N 0.00 -0.03 -0.95 4.33 -0.00 -1.97 -3.35 116.57 114.60 1rpw h LYS 36 Ca -0.33 0.00 0.13 0.00 -0.00 0.00 0.00 60.65 60.45 1rpw h LYS 36 Cb 1.03 0.01 -0.14 0.00 -0.00 0.00 0.00 32.23 33.13 1rpw h LYS 36 CO 0.55 0.71 -0.43 0.41 -0.00 0.00 0.00 179.45 180.69 1rpw n GLY 37 N 1.32 -2.11 0.10 0.07 0.00 -1.26 -1.12 105.19 102.19 1rpw n GLY 37 Ca -0.08 1.08 -0.03 0.00 0.00 0.00 0.00 46.02 46.99 1rpw n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1rpw n ASN 38 N -5.34 -0.26 -3.09 1.61 5.03 -1.25 -1.04 115.26 110.91 1rpw n ASN 38 Ca 0.07 0.57 -0.13 0.00 0.87 0.00 0.00 54.58 55.97 1rpw n ASN 38 Cb 0.34 -0.12 -0.01 0.00 -1.02 0.00 0.00 39.78 38.97 1rpw n ASN 38 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1rpw n LEU 39 N -3.75 2.92 0.00 3.41 7.99 -0.28 -3.78 117.00 123.52 1rpw n LEU 39 Ca 0.00 -2.12 0.00 0.00 -0.01 0.00 0.00 56.01 53.89 1rpw n LEU 39 Cb 0.06 -0.85 0.00 0.00 -0.11 0.00 0.00 43.42 42.53 1rpw n LEU 39 CO -0.04 -0.13 0.00 0.00 -1.51 0.00 0.00 177.39 175.71 1rpw n TYR 40 N 4.50 0.00 0.18 -1.77 9.36 -0.21 -4.47 117.16 124.75 1rpw n TYR 40 Ca 0.26 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.37 1rpw n TYR 40 Cb 0.08 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 38.73 1rpw n TYR 40 CO 0.00 0.00 0.00 -0.92 0.22 0.00 0.00 176.86 176.16 1rpw h TYR 41 N 0.00 -0.48 0.09 2.98 3.20 -1.78 -3.27 116.97 117.71 1rpw h TYR 41 Ca 0.00 -0.01 -0.31 0.00 3.14 0.00 0.00 58.73 61.54 1rpw h TYR 41 Cb 0.00 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1rpw h TYR 41 CO 0.00 -0.18 -1.66 0.45 -1.64 0.00 0.00 178.16 175.13 1rpw h HIS 42 N -1.02 0.35 -3.67 -3.82 3.86 -1.93 -3.41 115.15 105.49 1rpw h HIS 42 Ca -0.05 -0.26 -0.75 0.00 -1.16 0.00 0.00 60.37 58.15 1rpw h HIS 42 Cb 0.51 -0.01 -0.30 0.00 1.06 0.00 0.00 27.41 28.67 1rpw h HIS 42 CO 0.02 1.38 -0.11 -0.06 0.86 0.00 0.00 177.93 180.02 1rpw s PHE 43 N -2.60 3.60 0.00 2.45 2.99 -1.26 -4.93 117.98 118.22 1rpw s PHE 43 Ca -0.11 -2.27 0.00 0.00 0.00 0.00 0.00 56.93 54.55 1rpw s PHE 43 Cb 0.07 -3.56 0.00 0.00 0.00 0.00 0.00 43.02 39.53 1rpw s PHE 43 CO 0.83 -0.93 0.00 1.63 -0.00 0.00 0.00 175.22 176.75 1rpw n LYS 44 N 3.83 0.00 -1.67 0.44 4.01 -1.23 -1.25 118.16 122.29 1rpw n LYS 44 Ca 0.10 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.60 1rpw n LYS 44 Cb 0.43 -0.15 0.19 0.00 -0.51 0.00 0.00 35.03 34.99 1rpw n LYS 44 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1rpw s THR 45 N 0.00 1.89 0.11 -0.18 -1.32 -1.26 -4.67 115.64 110.21 1rpw s THR 45 Ca 0.00 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.39 1rpw s THR 45 Cb 0.00 -2.84 -0.18 0.00 -1.51 0.00 0.00 72.50 67.97 1rpw s THR 45 CO 0.00 0.00 1.29 0.50 -2.21 0.00 0.00 174.62 174.20 1rpw h LYS 46 N -1.87 0.60 0.00 7.08 3.64 -1.95 -2.71 116.57 121.35 1rpw h LYS 46 Ca -0.45 -0.57 0.00 0.00 -1.27 0.00 0.00 60.65 58.35 1rpw h LYS 46 Cb 1.26 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 1rpw h LYS 46 CO 0.40 1.19 0.00 -0.85 -2.27 0.00 0.00 179.45 177.92 1rpw n GLU 47 N -3.84 0.42 -0.06 1.90 0.28 -1.26 -1.71 120.64 116.36 1rpw n GLU 47 Ca -0.08 0.06 -0.07 0.00 -0.16 0.00 0.00 57.16 56.91 1rpw n GLU 47 Cb 0.81 -1.50 -0.05 0.00 1.43 0.00 0.00 31.44 32.13 1rpw n GLU 47 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 1rpw h ASN 48 N 0.00 0.00 -0.63 -1.84 -1.24 -1.84 -1.04 115.58 108.99 1rpw h ASN 48 Ca 0.00 -0.36 0.09 0.00 0.71 0.00 0.00 56.30 56.74 1rpw h ASN 48 Cb 0.07 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.08 1rpw h ASN 48 CO 0.00 0.77 0.42 0.25 -1.29 0.00 0.00 177.43 177.58 1rpw h LEU 49 N -1.00 0.44 0.13 0.34 5.85 -1.41 0.16 115.31 119.82 1rpw h LEU 49 Ca -0.03 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1rpw h LEU 49 Cb 0.48 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1rpw h LEU 49 CO -0.02 0.27 -0.06 0.15 -0.34 0.00 0.00 178.44 178.44 1rpw h PHE 50 N 0.50 -0.16 -0.77 1.25 3.04 -1.42 -2.03 116.94 117.35 1rpw h PHE 50 Ca 0.29 -0.00 0.22 0.00 3.98 0.00 0.00 57.97 62.45 1rpw h PHE 50 Cb 0.47 0.05 -0.03 0.00 2.56 0.00 0.00 35.95 39.00 1rpw h PHE 50 CO -0.00 0.24 0.55 1.25 -2.02 0.00 0.00 178.31 178.33 1rpw h LEU 51 N -0.95 0.01 0.00 0.59 5.85 -0.86 -0.67 115.31 119.29 1rpw h LEU 51 Ca -0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1rpw h LEU 51 Cb 0.47 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1rpw h LEU 51 CO 0.03 0.01 0.00 1.21 -0.34 0.00 0.00 178.44 179.34 1rpw n GLU 52 N -4.31 0.00 -0.33 1.25 4.07 0.52 -2.56 120.64 119.28 1rpw n GLU 52 Ca 0.16 0.48 0.18 0.00 -0.06 0.00 0.00 57.16 57.91 1rpw n GLU 52 Cb 0.83 -1.38 0.34 0.00 -0.06 0.00 0.00 31.44 31.17 1rpw n GLU 52 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 1rpw n ILE 53 N -1.94 -0.41 -0.06 6.31 5.41 -0.50 0.98 119.36 129.16 1rpw n ILE 53 Ca 0.00 2.09 -0.08 0.00 1.00 0.00 0.00 62.75 65.76 1rpw n ILE 53 Cb 0.00 -3.12 -0.02 0.00 -0.71 0.00 0.00 39.64 35.80 1rpw n ILE 53 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1rpw h LEU 54 N 0.00 -0.15 -0.38 1.39 3.38 -1.18 -1.18 115.31 117.20 1rpw h LEU 54 Ca 0.63 0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.73 1rpw h LEU 54 Cb 1.39 0.12 -0.07 0.00 0.09 0.00 0.00 40.66 42.19 1rpw h LEU 54 CO -0.88 -0.04 -0.03 -1.13 0.09 0.00 0.00 178.44 176.45 1rpw h ASN 55 N 0.05 -0.23 0.23 -0.43 -1.24 0.90 0.16 115.58 115.02 1rpw h ASN 55 Ca 0.12 0.10 0.01 0.00 0.71 0.00 0.00 56.30 57.23 1rpw h ASN 55 Cb 0.16 0.19 -0.04 0.00 0.73 0.00 0.00 38.32 39.36 1rpw h ASN 55 CO -0.22 -0.07 -0.43 0.40 -1.29 0.00 0.00 177.43 175.82 1rpw h ILE 56 N 0.06 0.14 -0.65 2.57 1.08 -0.75 -1.44 117.51 118.53 1rpw h ILE 56 Ca 0.19 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.72 1rpw h ILE 56 Cb 0.27 0.14 -0.05 0.00 -3.07 0.00 0.00 36.82 34.11 1rpw h ILE 56 CO -0.34 0.00 0.35 -0.33 -0.69 0.00 0.00 178.15 177.14 1rpw h GLU 57 N -0.74 0.63 -0.71 2.37 4.39 -0.84 0.19 114.58 119.87 1rpw h GLU 57 Ca -0.00 -0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.68 1rpw h GLU 57 Cb 0.72 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 29.19 1rpw h GLU 57 CO -0.18 0.42 0.45 1.49 -1.16 0.00 0.00 179.01 180.03 1rpw h GLU 58 N 0.65 0.87 0.04 2.33 4.22 -0.44 0.13 114.58 122.39 1rpw h GLU 58 Ca 0.29 -0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.68 1rpw h GLU 58 Cb 0.19 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1rpw h GLU 58 CO -0.19 0.58 -0.02 0.77 -2.18 0.00 0.00 179.01 177.97 1rpw h SER 59 N 0.90 -0.05 -0.29 1.04 0.02 -0.44 -0.38 113.55 114.36 1rpw h SER 59 Ca 0.28 -0.28 0.07 0.00 -0.84 0.00 0.00 61.79 61.01 1rpw h SER 59 Cb -0.02 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 62.46 1rpw h SER 59 CO -0.09 0.25 -0.15 0.11 -1.14 0.00 0.00 176.83 175.81 1rpw h LYS 60 N -0.35 -0.11 0.45 3.45 1.57 -0.36 -0.98 116.57 120.24 1rpw h LYS 60 Ca -0.01 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1rpw h LYS 60 Cb 0.32 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1rpw h LYS 60 CO 0.01 -0.07 -0.25 2.35 -0.57 0.00 0.00 179.45 180.92 1rpw h TRP 61 N -0.11 -0.66 0.00 -1.35 2.91 -0.67 -0.98 115.95 115.09 1rpw h TRP 61 Ca 0.15 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.16 1rpw h TRP 61 Cb 0.34 0.23 0.00 0.00 -0.51 0.00 0.00 29.16 29.22 1rpw h TRP 61 CO -0.34 -0.39 0.09 0.37 -1.03 0.00 0.00 178.44 177.13 1rpw h GLN 62 N -0.66 0.00 0.06 2.65 5.75 -0.78 -0.20 115.11 121.93 1rpw h GLN 62 Ca -0.06 0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 58.22 1rpw h GLN 62 Cb 0.53 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.06 1rpw h GLN 62 CO 0.07 0.00 -1.20 1.49 -2.65 0.00 0.00 178.83 176.54 1rpw h GLU 63 N 0.00 0.13 -0.40 1.69 4.81 -0.64 -3.18 114.58 116.98 1rpw h GLU 63 Ca 0.00 -0.22 0.05 0.00 -0.13 0.00 0.00 59.36 59.06 1rpw h GLU 63 Cb 0.18 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1rpw h GLU 63 CO 0.00 1.11 0.27 0.37 -0.73 0.00 0.00 179.01 180.03 1rpw h GLN 64 N -0.61 0.33 -0.07 1.92 4.15 -0.16 0.08 115.11 120.75 1rpw h GLN 64 Ca -0.28 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.11 1rpw h GLN 64 Cb 1.52 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 29.13 1rpw h GLN 64 CO -0.04 0.22 0.04 2.35 -1.93 0.00 0.00 178.83 179.47 1rpw h TRP 65 N 0.34 0.10 -0.38 3.99 -0.00 -1.17 -2.65 115.95 116.19 1rpw h TRP 65 Ca 0.17 -0.00 -0.10 0.00 -0.00 0.00 0.00 58.89 58.96 1rpw h TRP 65 Cb 0.25 -0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 29.37 1rpw h TRP 65 CO -0.00 0.16 -0.14 0.87 -0.00 0.00 0.00 178.44 179.34 1rpw h LYS 66 N 0.01 0.77 -0.35 2.65 1.57 -1.36 0.64 116.57 120.51 1rpw h LYS 66 Ca 0.03 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1rpw h LYS 66 Cb 0.10 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1rpw h LYS 66 CO -0.00 0.93 0.00 1.63 -0.57 0.00 0.00 179.45 181.44 1rpw n LYS 67 N -4.31 0.45 0.00 3.15 5.02 -0.05 -2.71 118.16 119.71 1rpw n LYS 67 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1rpw n LYS 67 Cb 0.39 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 1rpw n LYS 67 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1rpw n GLU 68 N 0.10 0.79 0.12 1.97 1.02 -0.48 -4.88 120.64 119.29 1rpw n GLU 68 Ca 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.27 1rpw n GLU 68 Cb 0.09 -0.07 0.44 0.00 -0.02 0.00 0.00 31.44 31.89 1rpw n GLU 68 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rpw n GLN 69 N 0.00 0.25 -0.03 3.49 10.64 0.21 -3.10 117.38 128.84 1rpw n GLN 69 Ca 0.00 0.32 0.11 0.00 -1.83 0.00 0.00 57.00 55.60 1rpw n GLN 69 Cb 0.00 -1.86 0.52 0.00 -0.86 0.00 0.00 30.24 28.04 1rpw n GLN 69 CO 0.00 0.00 0.00 0.82 -1.83 0.00 0.00 177.06 176.05 1rpw h ILE 70 N 0.00 0.93 0.00 -0.39 1.08 -1.84 -0.71 117.51 116.58 1rpw h ILE 70 Ca 0.00 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.35 1rpw h ILE 70 Cb 0.58 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.87 1rpw h ILE 70 CO 0.00 0.07 0.00 0.29 -0.69 0.00 0.00 178.15 177.82 1rpw n LYS 71 N -4.47 0.48 -3.68 2.37 5.02 -1.18 -4.40 118.16 112.30 1rpw n LYS 71 Ca 0.07 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.10 1rpw n LYS 71 Cb 0.31 -1.20 -0.17 0.00 -0.02 0.00 0.00 35.03 33.95 1rpw n LYS 71 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rpw s ALA 72 N -1.16 0.70 0.02 7.82 0.00 -0.27 -5.04 121.76 123.82 1rpw s ALA 72 Ca 0.00 -0.45 -0.24 0.00 0.00 0.00 0.00 51.96 51.27 1rpw s ALA 72 Cb 0.00 -1.06 -0.17 0.00 0.00 0.00 0.00 23.12 21.89 1rpw s ALA 72 CO 0.00 -1.10 1.39 0.87 0.00 0.00 0.00 175.76 176.92 1rpw h LYS 73 N 8.33 0.11 -6.69 0.00 1.57 -1.84 -3.44 116.57 114.61 1rpw h LYS 73 Ca -0.16 -0.04 -0.43 0.00 -1.87 0.00 0.00 60.65 58.15 1rpw h LYS 73 Cb 1.13 -0.01 0.04 0.00 0.08 0.00 0.00 32.23 33.48 1rpw h LYS 73 CO 0.30 0.46 -0.12 0.95 -0.57 0.00 0.00 179.45 180.47 1rpw s THR 74 N -4.67 2.78 0.09 -0.16 -4.23 -1.26 -5.01 115.64 103.17 1rpw s THR 74 Ca -0.15 -0.80 0.04 0.00 -1.18 0.00 0.00 61.69 59.61 1rpw s THR 74 Cb 0.04 -2.98 -0.23 0.00 1.34 0.00 0.00 72.50 70.66 1rpw s THR 74 CO 0.69 0.00 1.17 0.78 -0.54 0.00 0.00 174.62 176.72 1rpw h ASN 75 N 0.28 0.12 -0.49 3.99 4.21 -1.91 -2.26 115.58 119.52 1rpw h ASN 75 Ca -0.41 -0.14 0.08 0.00 1.21 0.00 0.00 56.30 57.05 1rpw h ASN 75 Cb 1.29 -0.04 -0.07 0.00 -1.12 0.00 0.00 38.32 38.38 1rpw h ASN 75 CO 0.49 1.11 0.08 -0.09 -1.29 0.00 0.00 177.43 177.73 1rpw h ARG 76 N 0.02 0.20 -0.47 0.81 2.43 -1.95 0.37 114.38 115.80 1rpw h ARG 76 Ca -0.07 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.04 1rpw h ARG 76 Cb 1.85 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 31.34 1rpw h ARG 76 CO 0.14 0.13 0.12 0.93 -1.51 0.00 0.00 179.97 179.79 1rpw h GLU 77 N 0.21 0.74 -0.51 0.20 5.08 -1.94 -2.55 114.58 115.81 1rpw h GLU 77 Ca 0.24 -0.17 0.09 0.00 -1.00 0.00 0.00 59.36 58.52 1rpw h GLU 77 Cb 0.33 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.41 1rpw h GLU 77 CO -0.33 0.72 0.12 0.87 -1.00 0.00 0.00 179.01 179.39 1rpw h LYS 78 N 0.62 0.26 0.26 2.33 1.57 -0.34 0.21 116.57 121.48 1rpw h LYS 78 Ca 0.15 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1rpw h LYS 78 Cb 0.31 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1rpw h LYS 78 CO -0.00 0.17 -0.38 0.35 -0.57 0.00 0.00 179.45 179.02 1rpw h PHE 79 N 0.26 -1.07 -0.66 -1.35 3.57 -0.17 0.89 116.94 118.41 1rpw h PHE 79 Ca 0.26 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.90 1rpw h PHE 79 Cb 0.34 0.43 -0.13 0.00 2.79 0.00 0.00 35.95 39.39 1rpw h PHE 79 CO -0.22 -0.47 -0.22 1.88 -2.23 0.00 0.00 178.31 177.05 1rpw h TYR 80 N -0.67 -0.54 -0.46 0.41 0.05 -1.00 -2.17 116.97 112.58 1rpw h TYR 80 Ca -0.03 0.07 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 1rpw h TYR 80 Cb 0.61 0.34 -0.02 0.00 1.01 0.00 0.00 36.73 38.67 1rpw h TYR 80 CO -0.29 -0.33 0.21 1.25 -1.05 0.00 0.00 178.16 177.96 1rpw h LEU 81 N -0.05 0.62 -0.61 3.88 5.85 -0.29 -0.92 115.31 123.79 1rpw h LEU 81 Ca 0.30 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1rpw h LEU 81 Cb 0.52 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1rpw h LEU 81 CO -0.70 0.58 0.35 0.22 -0.34 0.00 0.00 178.44 178.56 1rpw h TYR 82 N 0.61 0.66 -0.52 1.25 3.20 -0.23 0.12 116.97 122.06 1rpw h TYR 82 Ca 0.16 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.95 1rpw h TYR 82 Cb 0.14 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 1rpw h TYR 82 CO -0.01 0.35 -0.06 -0.91 -1.64 0.00 0.00 178.16 175.90 1rpw h ASN 83 N 0.68 0.95 -0.12 -2.11 -0.26 -1.24 -0.55 115.58 112.93 1rpw h ASN 83 Ca 0.25 -0.33 -0.01 0.00 -0.56 0.00 0.00 56.30 55.65 1rpw h ASN 83 Cb 0.08 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 37.08 1rpw h ASN 83 CO -0.13 1.06 0.03 -0.33 -1.06 0.00 0.00 177.43 177.00 1rpw h GLU 84 N 0.82 0.20 -0.58 0.81 5.08 -0.70 -2.86 114.58 117.36 1rpw h GLU 84 Ca 0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1rpw h GLU 84 Cb 0.61 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1rpw h GLU 84 CO 0.04 0.38 0.36 -0.07 -1.00 0.00 0.00 179.01 178.72 1rpw h LEU 85 N -0.01 0.68 -1.13 1.33 4.07 -0.70 -1.90 115.31 117.66 1rpw h LEU 85 Ca 0.04 -0.03 0.25 0.00 0.08 0.00 0.00 57.88 58.23 1rpw h LEU 85 Cb 0.27 -0.17 -0.11 0.00 1.08 0.00 0.00 40.66 41.72 1rpw h LEU 85 CO 0.00 0.51 0.62 0.28 -1.08 0.00 0.00 178.44 178.78 1rpw h SER 86 N 0.79 0.60 0.94 -0.43 0.02 -0.85 0.37 113.55 114.99 1rpw h SER 86 Ca 0.21 0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 61.24 1rpw h SER 86 Cb -0.06 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1rpw h SER 86 CO -0.04 0.10 -0.19 -0.07 -1.14 0.00 0.00 176.83 175.49 1rpw h LEU 87 N 0.52 0.00 0.00 5.07 3.38 -1.36 -3.34 115.31 119.58 1rpw h LEU 87 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1rpw h LEU 87 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1rpw h LEU 87 CO -0.42 0.19 -1.56 0.35 0.09 0.00 0.00 178.44 177.09 1rpw n THR 88 N -3.35 0.00 -0.43 0.22 -2.24 0.12 -5.03 114.28 103.57 1rpw n THR 88 Ca 0.00 -0.30 -0.14 0.00 -2.27 0.00 0.00 64.05 61.34 1rpw n THR 88 Cb 0.41 0.23 0.13 0.00 -2.10 0.00 0.00 70.33 69.01 1rpw n THR 88 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1rpw n THR 89 N -1.93 0.00 -0.52 4.28 -1.04 -0.56 -4.94 114.28 109.57 1rpw n THR 89 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1rpw n THR 89 Cb 0.34 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.40 1rpw n THR 89 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1rpw n GLU 90 N -1.40 0.98 -4.29 -2.82 0.00 -1.26 -4.96 120.64 106.89 1rpw n GLU 90 Ca 0.06 -0.80 -0.32 0.00 0.00 0.00 0.00 57.16 56.10 1rpw n GLU 90 Cb 0.27 -0.74 -0.09 0.00 0.00 0.00 0.00 31.44 30.88 1rpw n GLU 90 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1rpw s TYR 91 N -0.36 2.97 0.00 -1.84 4.12 -1.26 -4.76 117.35 116.21 1rpw s TYR 91 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.07 57.09 1rpw s TYR 91 Cb 0.00 -1.60 0.00 0.00 -1.52 0.00 0.00 41.96 38.84 1rpw s TYR 91 CO 0.00 0.44 0.00 0.98 0.02 0.00 0.00 175.55 176.99 1rpw n TYR 92 N 1.18 0.00 0.04 2.71 4.19 -1.26 -4.09 117.16 119.93 1rpw n TYR 92 Ca -0.14 0.00 0.21 0.00 3.31 0.00 0.00 57.90 61.29 1rpw n TYR 92 Cb 0.52 0.00 0.73 0.00 0.49 0.00 0.00 39.34 41.09 1rpw n TYR 92 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 1rpw h TYR 93 N 0.00 0.00 0.00 2.98 0.05 -1.91 0.15 116.97 118.25 1rpw h TYR 93 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1rpw h TYR 93 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1rpw h TYR 93 CO 0.00 0.00 0.00 -2.30 -1.05 0.00 0.00 178.16 174.81 1rpw n PRO 94 N -3.84 0.84 -0.01 4.88 -0.02 -1.26 -2.72 135.00 132.86 1rpw n PRO 94 Ca 0.09 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.60 1rpw n PRO 94 Cb 0.67 -1.23 0.03 0.00 -0.02 0.00 0.00 33.50 32.96 1rpw n PRO 94 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1rpw n LEU 95 N -0.73 1.63 -0.15 2.45 4.77 0.53 -4.70 117.00 120.81 1rpw n LEU 95 Ca 0.09 -1.13 -0.03 0.00 -0.03 0.00 0.00 56.01 54.90 1rpw n LEU 95 Cb 0.04 -0.02 0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1rpw n LEU 95 CO 0.07 0.35 0.94 1.56 -1.33 0.00 0.00 177.39 178.98 1rpw h GLN 96 N 1.15 0.29 -0.26 3.23 1.08 -1.60 0.65 115.11 119.64 1rpw h GLN 96 Ca 0.00 -0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.22 1rpw h GLN 96 Cb 0.30 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.63 1rpw h GLN 96 CO 0.00 0.19 0.06 -0.91 -0.95 0.00 0.00 178.83 177.22 1rpw h ASN 97 N 0.30 0.03 -0.39 1.46 2.35 -1.84 0.08 115.58 117.58 1rpw h ASN 97 Ca 0.23 0.04 0.02 0.00 -0.55 0.00 0.00 56.30 56.04 1rpw h ASN 97 Cb 0.26 0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.65 1rpw h ASN 97 CO -0.26 0.05 0.21 0.00 -1.65 0.00 0.00 177.43 175.79 1rpw h ALA 98 N 1.19 0.49 -0.89 -0.83 0.00 -1.49 -2.16 119.26 115.57 1rpw h ALA 98 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1rpw h ALA 98 Cb 0.12 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1rpw h ALA 98 CO -0.15 -0.13 0.57 0.82 0.00 0.00 0.00 179.25 180.35 1rpw h ILE 99 N 0.44 1.09 -0.49 0.00 2.04 0.84 -2.23 117.51 119.20 1rpw h ILE 99 Ca 0.16 -0.36 0.08 0.00 1.00 0.00 0.00 64.86 65.73 1rpw h ILE 99 Cb 0.03 -0.06 -0.06 0.00 -0.74 0.00 0.00 36.82 35.99 1rpw h ILE 99 CO -0.09 0.19 0.14 0.40 0.00 0.00 0.00 178.15 178.79 1rpw h ILE 100 N 1.06 0.78 0.89 -0.67 2.04 -0.33 0.96 117.51 122.24 1rpw h ILE 100 Ca 0.38 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 66.09 1rpw h ILE 100 Cb 0.11 0.46 0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1rpw h ILE 100 CO -0.15 0.05 -0.43 -0.33 0.00 0.00 0.00 178.15 177.29 1rpw h GLU 101 N 0.29 -1.15 -0.94 2.37 5.08 -1.27 -1.76 114.58 117.19 1rpw h GLU 101 Ca 0.24 0.08 0.08 0.00 -1.00 0.00 0.00 59.36 58.76 1rpw h GLU 101 Cb 0.29 0.26 -0.11 0.00 0.50 0.00 0.00 28.75 29.69 1rpw h GLU 101 CO -0.28 -0.77 -0.56 0.34 -1.00 0.00 0.00 179.01 176.74 1rpw n PHE 102 N -5.27 -0.41 -0.14 4.33 -0.00 -0.87 0.45 117.46 115.55 1rpw n PHE 102 Ca -0.15 1.18 0.07 0.00 -0.00 0.00 0.00 57.45 58.55 1rpw n PHE 102 Cb 0.47 -0.58 0.40 0.00 -0.00 0.00 0.00 39.48 39.77 1rpw n PHE 102 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.76 175.84 1rpw h TYR 103 N 0.00 0.65 -0.40 -5.13 5.03 -0.80 -1.67 116.97 114.64 1rpw h TYR 103 Ca 0.15 0.02 -0.26 0.00 2.58 0.00 0.00 58.73 61.22 1rpw h TYR 103 Cb 0.39 -0.22 -0.12 0.00 1.55 0.00 0.00 36.73 38.33 1rpw h TYR 103 CO -1.02 0.35 0.33 0.25 -1.32 0.00 0.00 178.16 176.75 1rpw n THR 104 N -4.48 2.46 -1.87 1.81 -2.24 0.17 -2.34 114.28 107.80 1rpw n THR 104 Ca 0.09 -1.30 0.00 0.00 -2.27 0.00 0.00 64.05 60.58 1rpw n THR 104 Cb 0.24 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.26 1rpw n THR 104 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1rpw n GLU 105 N 0.34 0.00 -0.71 -0.78 1.02 -0.65 -4.89 120.64 114.98 1rpw n GLU 105 Ca 0.25 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.36 1rpw n GLU 105 Cb 0.67 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.06 1rpw n GLU 105 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1rpw n TYR 106 N 0.00 0.00 1.09 -0.32 4.01 -1.09 -4.91 117.16 115.94 1rpw n TYR 106 Ca 0.00 -0.24 0.12 0.00 -0.16 0.00 0.00 57.90 57.62 1rpw n TYR 106 Cb 0.45 0.36 0.29 0.00 -0.31 0.00 0.00 39.34 40.13 1rpw n TYR 106 CO 0.00 0.00 0.00 2.48 -0.46 0.00 0.00 176.86 178.88 1rpw n TYR 107 N 0.00 0.00 1.33 -0.72 4.11 -0.99 -3.66 117.16 117.23 1rpw n TYR 107 Ca -0.13 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 57.90 1rpw n TYR 107 Cb 0.54 -0.19 0.52 0.00 -0.00 0.00 0.00 39.34 40.20 1rpw n TYR 107 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1rpw n LYS 108 N -1.17 0.73 -4.09 -3.48 5.02 -1.26 -4.88 118.16 109.03 1rpw n LYS 108 Ca 0.08 -0.33 -0.23 0.00 -2.02 0.00 0.00 58.31 55.81 1rpw n LYS 108 Cb 0.34 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.79 1rpw n LYS 108 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1rpw s THR 109 N -2.50 2.84 -0.17 -0.18 -1.32 -1.24 -5.08 115.64 108.00 1rpw s THR 109 Ca 0.27 -1.69 0.10 0.00 -1.21 0.00 0.00 61.69 59.15 1rpw s THR 109 Cb 0.20 -2.97 -0.23 0.00 -1.51 0.00 0.00 72.50 67.99 1rpw s THR 109 CO 0.50 -0.14 0.17 0.59 -2.21 0.00 0.00 174.62 173.52 1rpw n ASN 110 N -1.18 0.96 0.00 8.08 3.02 -1.26 -4.16 115.26 120.71 1rpw n ASN 110 Ca -0.02 0.09 0.01 0.00 -0.03 0.00 0.00 54.58 54.62 1rpw n ASN 110 Cb 0.62 0.18 0.04 0.00 -0.61 0.00 0.00 39.78 40.01 1rpw n ASN 110 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1rpw n SER 111 N -3.04 0.00 -0.10 6.41 2.88 -1.26 -2.59 113.62 115.92 1rpw n SER 111 Ca -0.32 0.20 -0.13 0.00 -1.33 0.00 0.00 58.87 57.29 1rpw n SER 111 Cb 1.08 -0.23 -0.05 0.00 -0.75 0.00 0.00 64.21 64.26 1rpw n SER 111 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1rpw n ILE 112 N -1.23 1.49 0.13 2.46 2.08 -1.26 -3.92 119.36 119.10 1rpw n ILE 112 Ca 0.01 0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.37 1rpw n ILE 112 Cb 0.01 -2.24 0.01 0.00 -0.75 0.00 0.00 39.64 36.67 1rpw n ILE 112 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1rpw n ASN 113 N -4.46 0.00 -0.03 4.38 3.02 -1.07 0.01 115.26 117.10 1rpw n ASN 113 Ca -0.22 -0.12 -0.05 0.00 -0.03 0.00 0.00 54.58 54.16 1rpw n ASN 113 Cb 0.54 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.69 1rpw n ASN 113 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1rpw n GLU 114 N -0.55 0.31 0.05 3.52 0.00 -1.21 -4.13 120.64 118.63 1rpw n GLU 114 Ca 0.00 0.12 -0.13 0.00 0.00 0.00 0.00 57.16 57.16 1rpw n GLU 114 Cb 0.00 -1.04 -0.09 0.00 0.00 0.00 0.00 31.44 30.32 1rpw n GLU 114 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 1rpw h LYS 115 N -0.59 -0.14 0.00 5.31 1.79 -1.57 1.58 116.57 122.95 1rpw h LYS 115 Ca 0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1rpw h LYS 115 Cb 0.59 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.27 1rpw h LYS 115 CO 0.00 0.23 0.05 -0.12 -1.08 0.00 0.00 179.45 178.53 1rpw n MET 116 N -4.97 0.00 -0.01 3.15 1.56 0.10 -0.52 117.12 116.43 1rpw n MET 116 Ca -0.09 0.42 0.00 0.00 -0.27 0.00 0.00 57.70 57.77 1rpw n MET 116 Cb 0.23 -1.55 -0.03 0.00 2.15 0.00 0.00 33.22 34.02 1rpw n MET 116 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 1rpw n ASN 117 N -1.42 4.09 0.18 6.12 5.15 -0.92 -4.27 115.26 124.20 1rpw n ASN 117 Ca 0.00 0.00 0.13 0.00 -0.60 0.00 0.00 54.58 54.11 1rpw n ASN 117 Cb 0.05 0.94 0.34 0.00 -0.53 0.00 0.00 39.78 40.58 1rpw n ASN 117 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 1rpw h LYS 118 N 0.00 0.00 0.00 1.20 3.11 0.48 -2.40 116.57 118.96 1rpw h LYS 118 Ca -0.04 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.79 1rpw h LYS 118 Cb 0.61 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.84 1rpw h LYS 118 CO 0.00 0.00 -0.77 1.25 -2.81 0.00 0.00 179.45 177.13 1rpw h LEU 119 N 0.00 0.00 -1.84 5.20 6.46 -1.03 -3.30 115.31 120.81 1rpw h LEU 119 Ca 0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 1rpw h LEU 119 Cb 0.79 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.72 1rpw h LEU 119 CO 0.00 0.04 -0.09 -0.08 -0.62 0.00 0.00 178.44 177.69 1rpw h GLU 120 N 0.00 0.00 -0.24 1.25 4.81 -1.61 -1.79 114.58 117.00 1rpw h GLU 120 Ca -0.01 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 1rpw h GLU 120 Cb 1.04 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 1rpw h GLU 120 CO 0.00 0.09 -0.29 -0.91 -0.73 0.00 0.00 179.01 177.17 1rpw h ASN 121 N 0.00 0.67 -0.28 1.04 2.35 -1.65 -1.01 115.58 116.70 1rpw h ASN 121 Ca -0.00 -0.50 -0.03 0.00 -0.55 0.00 0.00 56.30 55.22 1rpw h ASN 121 Cb 0.17 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1rpw h ASN 121 CO 0.01 1.03 0.09 0.50 -1.65 0.00 0.00 177.43 177.42 1rpw h LYS 122 N 0.32 0.51 -0.24 0.81 3.64 -1.57 0.22 116.57 120.26 1rpw h LYS 122 Ca 0.03 -0.08 -0.19 0.00 -1.27 0.00 0.00 60.65 59.14 1rpw h LYS 122 Cb 0.87 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1rpw h LYS 122 CO 0.07 0.46 -0.61 -0.92 -2.27 0.00 0.00 179.45 176.18 1rpw h TYR 123 N 0.50 1.04 0.00 1.91 3.20 -1.16 -3.29 116.97 119.17 1rpw h TYR 123 Ca 0.12 -0.40 0.00 0.00 3.14 0.00 0.00 58.73 61.59 1rpw h TYR 123 Cb 0.18 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.27 1rpw h TYR 123 CO 0.01 1.22 -0.98 0.44 -1.64 0.00 0.00 178.16 177.21 1rpw n ILE 124 N -3.98 0.01 -0.04 1.81 -5.35 -0.40 -4.42 119.36 107.00 1rpw n ILE 124 Ca -0.05 -0.05 -0.09 0.00 -0.27 0.00 0.00 62.75 62.29 1rpw n ILE 124 Cb 0.66 0.75 -0.03 0.00 -1.74 0.00 0.00 39.64 39.28 1rpw n ILE 124 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 1rpw h ASP 125 N 0.00 -0.99 -0.97 7.28 3.58 -0.64 -0.80 116.42 123.88 1rpw h ASP 125 Ca 0.00 0.16 0.27 0.00 0.42 0.00 0.00 57.03 57.88 1rpw h ASP 125 Cb 0.55 0.44 -0.18 0.00 1.72 0.00 0.00 39.33 41.86 1rpw h ASP 125 CO 0.00 -0.34 0.08 0.00 -2.88 0.00 0.00 179.24 176.10 1rpw h ALA 126 N 0.56 1.22 -0.04 -0.78 0.00 -1.77 0.85 119.26 119.30 1rpw h ALA 126 Ca 0.12 0.32 -0.17 0.00 0.00 0.00 0.00 54.91 55.19 1rpw h ALA 126 Cb 0.53 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1rpw h ALA 126 CO -0.41 -0.58 -0.71 1.88 0.00 0.00 0.00 179.25 179.44 1rpw h TYR 127 N 0.03 0.30 -0.12 0.00 0.05 -1.48 -2.61 116.97 113.14 1rpw h TYR 127 Ca 0.60 -0.13 -0.00 0.00 0.05 0.00 0.00 58.73 59.24 1rpw h TYR 127 Cb 1.26 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 38.95 1rpw h TYR 127 CO -0.44 0.85 0.05 1.25 -1.05 0.00 0.00 178.16 178.82 1rpw h HIS 128 N 0.15 0.17 0.73 4.88 2.76 0.19 0.66 115.15 124.69 1rpw h HIS 128 Ca -0.02 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.11 1rpw h HIS 128 Cb 1.26 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 30.16 1rpw h HIS 128 CO 0.02 0.23 -0.48 0.28 -1.30 0.00 0.00 177.93 176.68 1rpw h VAL 129 N 0.06 0.00 -1.05 5.26 2.07 -1.11 0.26 116.25 121.73 1rpw h VAL 129 Ca 0.04 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.84 1rpw h VAL 129 Cb 0.13 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.81 1rpw h VAL 129 CO -0.00 0.00 0.69 0.40 0.02 0.00 0.00 177.57 178.68 1rpw h ILE 130 N -1.15 0.51 0.06 4.57 2.04 -1.36 0.22 117.51 122.39 1rpw h ILE 130 Ca -0.10 -0.11 -0.29 0.00 1.00 0.00 0.00 64.86 65.37 1rpw h ILE 130 Cb 0.93 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1rpw h ILE 130 CO 0.07 0.06 -1.53 -0.26 0.00 0.00 0.00 178.15 176.49 1rpw h PHE 131 N 0.32 0.21 0.14 1.37 0.04 -0.48 -2.90 116.94 115.65 1rpw h PHE 131 Ca 0.58 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 61.19 1rpw h PHE 131 Cb 1.63 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.77 1rpw h PHE 131 CO -0.00 1.21 -0.07 -0.22 -0.60 0.00 0.00 178.31 178.63 1rpw h LYS 132 N 0.03 -0.18 -0.65 1.51 3.64 0.79 -2.84 116.57 118.86 1rpw h LYS 132 Ca -0.23 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.25 1rpw h LYS 132 Cb 1.97 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 33.79 1rpw h LYS 132 CO 0.12 0.25 0.43 1.49 -2.27 0.00 0.00 179.45 179.47 1rpw h GLU 133 N -0.69 0.52 0.00 1.90 4.57 -0.79 0.38 114.58 120.47 1rpw h GLU 133 Ca -0.02 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 1rpw h GLU 133 Cb 0.51 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1rpw h GLU 133 CO 0.03 0.34 -0.12 0.78 -1.18 0.00 0.00 179.01 178.86 1rpw h GLY 134 N 0.54 0.00 0.98 1.92 0.00 -1.43 0.16 103.07 105.24 1rpw h GLY 134 Ca 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.39 1rpw h GLY 134 CO -0.09 0.00 -1.01 3.43 0.00 0.00 0.00 176.54 178.87 1rpw h ASN 135 N 0.00 0.69 -0.48 0.19 2.35 -0.02 0.46 115.58 118.77 1rpw h ASN 135 Ca -0.00 -0.85 -0.06 0.00 -0.55 0.00 0.00 56.30 54.83 1rpw h ASN 135 Cb 0.45 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1rpw h ASN 135 CO 0.02 1.48 0.06 -0.07 -1.65 0.00 0.00 177.43 177.26 1rpw h LEU 136 N 0.00 0.78 0.00 1.61 4.07 -1.08 -2.07 115.31 118.62 1rpw h LEU 136 Ca -0.16 -0.27 0.00 0.00 0.08 0.00 0.00 57.88 57.53 1rpw h LEU 136 Cb 1.73 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 43.26 1rpw h LEU 136 CO 0.19 0.86 0.00 -3.20 -1.08 0.00 0.00 178.44 175.21 1rpw n ASN 137 N -4.41 0.00 -1.77 -0.43 5.15 0.53 -4.89 115.26 109.43 1rpw n ASN 137 Ca 0.01 -0.97 -0.17 0.00 -0.60 0.00 0.00 54.58 52.85 1rpw n ASN 137 Cb 0.27 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.46 1rpw n ASN 137 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1rpw n GLY 138 N 0.60 1.02 0.21 8.20 0.00 -0.74 -4.83 105.19 109.65 1rpw n GLY 138 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 1rpw n GLY 138 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1rpw h GLU 139 N 0.00 0.00 0.00 1.61 5.08 -1.21 -3.47 114.58 116.59 1rpw h GLU 139 Ca -0.37 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.06 1rpw h GLU 139 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1rpw h GLU 139 CO 0.51 0.25 0.40 -2.67 -1.00 0.00 0.00 179.01 176.49 1rpw n TRP 140 N -3.38 -1.57 -3.54 4.33 2.14 -1.20 -5.07 117.44 109.16 1rpw n TRP 140 Ca 0.00 -1.24 -0.29 0.00 2.07 0.00 0.00 57.50 58.05 1rpw n TRP 140 Cb 0.46 0.61 -0.15 0.00 -0.81 0.00 0.00 31.31 31.42 1rpw n TRP 140 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 1rpw s SER 141 N -2.92 3.45 -0.22 -0.67 0.15 -1.26 -4.26 113.70 107.97 1rpw s SER 141 Ca 0.17 -1.25 -0.04 0.00 0.70 0.00 0.00 55.95 55.52 1rpw s SER 141 Cb -0.03 -0.32 -0.01 0.00 -1.71 0.00 0.00 66.02 63.94 1rpw s SER 141 CO 0.07 -0.44 -0.03 -0.63 1.20 0.00 0.00 173.24 173.41 1rpw s ILE 142 N 2.11 3.55 -2.67 6.45 -1.09 -1.26 -4.91 121.20 123.37 1rpw s ILE 142 Ca 0.09 -0.44 0.23 0.00 -2.23 0.00 0.00 60.65 58.30 1rpw s ILE 142 Cb -0.16 -2.61 0.30 0.00 -1.58 0.00 0.00 42.46 38.41 1rpw s ILE 142 CO -0.36 0.42 1.31 -0.46 -1.23 0.00 0.00 174.94 174.62 1rpw n ASN 143 N 4.70 3.20 -2.70 3.58 0.23 -1.26 -4.34 115.26 118.67 1rpw n ASN 143 Ca -0.18 -1.98 -0.19 0.00 -0.53 0.00 0.00 54.58 51.70 1rpw n ASN 143 Cb 0.51 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 1rpw n ASN 143 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1rpw n ASP 144 N 1.39 2.96 -0.35 0.53 3.85 -1.26 -4.98 116.55 118.70 1rpw n ASP 144 Ca 0.16 -3.25 -0.11 0.00 -0.71 0.00 0.00 54.79 50.88 1rpw n ASP 144 Cb 0.59 -0.52 -0.10 0.00 -1.35 0.00 0.00 41.12 39.75 1rpw n ASP 144 CO 0.00 0.00 0.00 0.58 -1.01 0.00 0.00 177.20 176.77 1rpw h VAL 145 N 2.59 0.00 -0.87 2.12 2.07 -1.98 -1.32 116.25 118.85 1rpw h VAL 145 Ca 0.10 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.81 1rpw h VAL 145 Cb 0.97 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.63 1rpw h VAL 145 CO 0.67 0.00 0.41 0.78 0.02 0.00 0.00 177.57 179.45 1rpw h ASN 146 N -0.09 0.42 0.91 0.57 2.35 -1.97 1.49 115.58 119.26 1rpw h ASN 146 Ca 0.14 0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 55.97 1rpw h ASN 146 Cb 0.45 0.08 0.01 0.00 0.05 0.00 0.00 38.32 38.90 1rpw h ASN 146 CO -0.85 0.10 -0.44 0.00 -1.65 0.00 0.00 177.43 174.60 1rpw h ALA 147 N 1.64 -1.22 -0.70 -0.83 0.00 -1.70 0.17 119.26 116.61 1rpw h ALA 147 Ca 0.51 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 55.26 1rpw h ALA 147 Cb 0.87 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 19.05 1rpw h ALA 147 CO -0.45 -1.17 0.31 0.28 0.00 0.00 0.00 179.25 178.22 1rpw h VAL 148 N -1.26 0.78 -0.28 0.00 2.07 -0.43 0.37 116.25 117.51 1rpw h VAL 148 Ca -0.13 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.23 1rpw h VAL 148 Cb 0.94 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1rpw h VAL 148 CO 0.21 0.09 0.15 0.28 0.02 0.00 0.00 177.57 178.32 1rpw h SER 149 N 0.51 0.24 -0.06 0.57 0.02 0.23 -0.16 113.55 114.90 1rpw h SER 149 Ca 0.36 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.31 1rpw h SER 149 Cb 0.44 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 1rpw h SER 149 CO -0.31 0.17 0.02 0.11 -1.14 0.00 0.00 176.83 175.69 1rpw h LYS 150 N 0.31 0.09 -0.65 3.45 1.57 0.54 0.17 116.57 122.06 1rpw h LYS 150 Ca 0.11 -0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.96 1rpw h LYS 150 Cb 0.01 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.24 1rpw h LYS 150 CO -0.06 0.24 0.29 0.82 -0.57 0.00 0.00 179.45 180.18 1rpw h ILE 151 N -0.07 0.83 0.13 1.86 2.04 -0.10 -0.17 117.51 122.02 1rpw h ILE 151 Ca 0.02 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1rpw h ILE 151 Cb 0.19 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 1rpw h ILE 151 CO -0.00 0.09 -0.06 0.00 0.00 0.00 0.00 178.15 178.18 1rpw h ALA 152 N 1.41 -0.17 -0.81 1.87 0.00 -0.86 0.17 119.26 120.87 1rpw h ALA 152 Ca 0.32 -0.16 0.16 0.00 0.00 0.00 0.00 54.91 55.23 1rpw h ALA 152 Cb 0.35 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.11 1rpw h ALA 152 CO -0.27 -0.44 0.36 0.00 0.00 0.00 0.00 179.25 178.89 1rpw h ALA 153 N 0.35 1.19 0.18 0.00 0.00 -0.62 -0.25 119.26 120.10 1rpw h ALA 153 Ca -0.02 0.12 -0.31 0.00 0.00 0.00 0.00 54.91 54.70 1rpw h ALA 153 Cb 0.38 0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.27 1rpw h ALA 153 CO 0.03 -0.20 -1.35 -0.91 0.00 0.00 0.00 179.25 176.82 1rpw h ASN 154 N 0.49 0.81 0.11 0.00 -0.26 -0.88 -1.86 115.58 113.98 1rpw h ASN 154 Ca 0.46 -0.81 0.02 0.00 -0.56 0.00 0.00 56.30 55.41 1rpw h ASN 154 Cb 0.71 -0.26 -0.03 0.00 -1.06 0.00 0.00 38.32 37.68 1rpw h ASN 154 CO -0.42 1.62 -0.25 0.00 -1.06 0.00 0.00 177.43 177.32 1rpw h ALA 155 N 0.28 -0.41 0.14 -0.83 0.00 -0.13 -0.79 119.26 117.51 1rpw h ALA 155 Ca -0.21 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1rpw h ALA 155 Cb 2.03 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 20.19 1rpw h ALA 155 CO 0.25 -0.78 -0.25 0.28 0.00 0.00 0.00 179.25 178.75 1rpw h VAL 156 N -0.45 0.45 -1.04 0.00 2.07 -1.13 0.74 116.25 116.90 1rpw h VAL 156 Ca 0.03 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.82 1rpw h VAL 156 Cb 0.48 0.45 -0.09 0.00 -1.52 0.00 0.00 31.29 30.61 1rpw h VAL 156 CO -0.15 0.00 0.68 -1.13 0.02 0.00 0.00 177.57 176.99 1rpw h ASN 157 N -0.47 0.41 0.49 0.57 -0.00 -1.09 0.82 115.58 116.31 1rpw h ASN 157 Ca 0.02 0.07 -0.02 0.00 -0.00 0.00 0.00 56.30 56.37 1rpw h ASN 157 Cb 0.48 0.01 0.00 0.00 -0.00 0.00 0.00 38.32 38.81 1rpw h ASN 157 CO -0.12 0.08 -0.24 1.23 -0.00 0.00 0.00 177.43 178.38 1rpw h GLY 158 N 0.36 -0.69 1.08 1.57 0.00 0.62 0.13 103.07 106.14 1rpw h GLY 158 Ca 0.58 0.25 0.05 0.00 0.00 0.00 0.00 47.33 48.22 1rpw h GLY 158 CO -0.27 -0.25 0.49 -2.22 0.00 0.00 0.00 176.54 174.29 1rpw h ILE 159 N -0.72 1.07 -0.20 2.60 2.04 0.09 -0.63 117.51 121.77 1rpw h ILE 159 Ca -0.07 -0.29 -0.10 0.00 1.00 0.00 0.00 64.86 65.41 1rpw h ILE 159 Cb 0.53 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1rpw h ILE 159 CO 0.11 0.15 -0.25 0.58 0.00 0.00 0.00 178.15 178.75 1rpw h VAL 160 N 0.84 1.33 -0.11 1.67 2.07 -0.82 -3.31 116.25 117.93 1rpw h VAL 160 Ca 0.31 -1.44 -0.22 0.00 0.82 0.00 0.00 66.70 66.17 1rpw h VAL 160 Cb 0.16 1.81 0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1rpw h VAL 160 CO -0.10 0.44 -0.77 0.74 0.02 0.00 0.00 177.57 177.90 1rpw h THR 161 N 0.18 1.30 -0.71 2.57 2.02 -0.20 -3.27 112.91 114.80 1rpw h THR 161 Ca 0.02 -2.00 -0.23 0.00 0.77 0.00 0.00 66.41 64.98 1rpw h THR 161 Cb 0.81 2.12 -0.13 0.00 -1.74 0.00 0.00 68.15 69.21 1rpw h THR 161 CO 0.06 0.62 0.29 0.49 0.37 0.00 0.00 175.52 177.35 1rpw n PHE 162 N -3.99 2.36 -0.16 3.16 3.72 -0.29 -3.71 117.46 118.54 1rpw n PHE 162 Ca -0.08 -1.18 0.00 0.00 -0.05 0.00 0.00 57.45 56.14 1rpw n PHE 162 Cb 0.74 -0.68 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 1rpw n PHE 162 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1rpw n THR 163 N -0.18 0.00 -1.17 4.37 -2.24 -1.25 -5.01 114.28 108.81 1rpw n THR 163 Ca 0.40 -0.15 -0.26 0.00 -2.27 0.00 0.00 64.05 61.77 1rpw n THR 163 Cb 1.34 1.16 -0.12 0.00 -2.10 0.00 0.00 70.33 70.62 1rpw n THR 163 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1rpw n HIS 164 N -0.23 0.58 0.00 4.78 -0.00 -1.23 -2.55 115.22 116.56 1rpw n HIS 164 Ca 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 57.72 57.42 1rpw n HIS 164 Cb 0.04 -1.91 0.00 0.00 -0.00 0.00 0.00 29.99 28.12 1rpw n HIS 164 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 1rpw n GLU 165 N 8.08 0.00 -4.28 1.57 -0.00 -1.26 -5.11 120.64 119.65 1rpw n GLU 165 Ca 0.43 0.00 -0.15 0.00 -0.00 0.00 0.00 57.16 57.44 1rpw n GLU 165 Cb 0.45 0.00 -0.10 0.00 -0.00 0.00 0.00 31.44 31.79 1rpw n GLU 165 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 1rpw s GLN 166 N 0.00 1.30 -0.34 3.44 -2.07 -1.06 -5.07 119.66 115.85 1rpw s GLN 166 Ca 0.00 -1.68 -0.31 0.00 -1.82 0.00 0.00 55.36 51.55 1rpw s GLN 166 Cb 0.00 -0.15 -0.13 0.00 -1.09 0.00 0.00 33.01 31.63 1rpw s GLN 166 CO 0.00 -0.28 1.40 -1.71 -1.32 0.00 0.00 175.29 173.38 1rpw n ASN 167 N -0.37 0.58 0.11 12.60 4.05 -1.26 -4.77 115.26 126.19 1rpw n ASN 167 Ca -0.01 0.54 0.19 0.00 0.45 0.00 0.00 54.58 55.75 1rpw n ASN 167 Cb 0.66 -0.62 0.76 0.00 1.23 0.00 0.00 39.78 41.81 1rpw n ASN 167 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 177.26 173.92 1rpw h ILE 168 N 4.55 0.51 0.00 -1.44 6.09 -1.97 0.26 117.51 125.51 1rpw h ILE 168 Ca -0.12 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.37 1rpw h ILE 168 Cb 0.97 0.74 0.00 0.00 0.47 0.00 0.00 36.82 39.00 1rpw h ILE 168 CO 0.74 0.00 -0.48 0.59 -3.07 0.00 0.00 178.15 175.93 1rpw n ASN 169 N -3.93 0.66 0.10 2.19 3.02 -1.26 -2.42 115.26 113.62 1rpw n ASN 169 Ca 0.06 0.17 -0.19 0.00 -0.03 0.00 0.00 54.58 54.59 1rpw n ASN 169 Cb 0.51 -0.02 -0.15 0.00 -0.61 0.00 0.00 39.78 39.51 1rpw n ASN 169 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1rpw h GLU 170 N 0.00 0.34 0.68 3.52 4.81 -0.86 -2.92 114.58 120.15 1rpw h GLU 170 Ca 0.00 -0.58 -0.03 0.00 -0.13 0.00 0.00 59.36 58.62 1rpw h GLU 170 Cb 0.70 0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.30 1rpw h GLU 170 CO 0.00 1.24 -0.37 0.00 -0.73 0.00 0.00 179.01 179.15 1rpw h ARG 171 N 0.09 -0.94 -0.75 1.92 2.47 -1.36 -1.47 114.38 114.34 1rpw h ARG 171 Ca -0.22 0.06 0.22 0.00 -1.26 0.00 0.00 59.98 58.78 1rpw h ARG 171 Cb 2.04 0.21 -0.03 0.00 -1.65 0.00 0.00 29.97 30.55 1rpw h ARG 171 CO 0.20 -0.63 0.54 0.82 0.56 0.00 0.00 179.97 181.47 1rpw h ILE 172 N -0.97 0.63 0.39 2.04 2.04 -1.58 0.58 117.51 120.63 1rpw h ILE 172 Ca -0.09 -0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 1rpw h ILE 172 Cb 0.77 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1rpw h ILE 172 CO 0.12 0.00 -0.19 0.50 0.00 0.00 0.00 178.15 178.58 1rpw h LYS 173 N 0.01 -0.50 -0.51 2.37 3.64 -1.11 -2.69 116.57 117.77 1rpw h LYS 173 Ca 0.36 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.87 1rpw h LYS 173 Cb 1.42 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 33.26 1rpw h LYS 173 CO -0.01 -0.25 -0.07 -0.07 -2.27 0.00 0.00 179.45 176.78 1rpw h LEU 174 N -1.07 -0.36 -1.59 5.20 3.38 -0.58 0.13 115.31 120.41 1rpw h LEU 174 Ca -0.05 0.14 0.16 0.00 0.09 0.00 0.00 57.88 58.22 1rpw h LEU 174 Cb 0.48 0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.46 1rpw h LEU 174 CO 0.09 -0.13 0.52 -0.03 0.09 0.00 0.00 178.44 178.98 1rpw h MET 175 N 0.05 0.38 0.07 1.13 4.05 -0.96 0.47 114.93 120.11 1rpw h MET 175 Ca 0.25 -0.02 -0.25 0.00 -0.28 0.00 0.00 59.70 59.40 1rpw h MET 175 Cb 0.39 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 1rpw h MET 175 CO -0.49 0.25 -1.15 -0.91 0.23 0.00 0.00 176.91 174.84 1rpw h ASN 176 N 0.39 0.22 0.33 1.39 2.35 -0.45 -1.94 115.58 117.87 1rpw h ASN 176 Ca 0.38 -0.24 -0.10 0.00 -0.55 0.00 0.00 56.30 55.79 1rpw h ASN 176 Cb 0.93 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.22 1rpw h ASN 176 CO -0.12 1.19 -0.44 0.50 -1.65 0.00 0.00 177.43 176.91 1rpw h LYS 177 N 0.04 0.14 0.68 0.81 1.63 0.21 -0.33 116.57 119.75 1rpw h LYS 177 Ca -0.09 -0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 59.61 1rpw h LYS 177 Cb 1.88 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 33.52 1rpw h LYS 177 CO 0.17 0.56 -0.33 0.35 -3.45 0.00 0.00 179.45 176.75 1rpw h PHE 178 N 0.12 -0.85 -0.97 1.91 3.57 -0.03 0.50 116.94 121.19 1rpw h PHE 178 Ca 0.01 -0.02 0.24 0.00 3.53 0.00 0.00 57.97 61.73 1rpw h PHE 178 Cb 0.83 0.28 -0.13 0.00 2.79 0.00 0.00 35.95 39.72 1rpw h PHE 178 CO 0.01 -0.53 0.53 0.77 -2.23 0.00 0.00 178.31 176.86 1rpw h SER 179 N -1.08 0.56 0.15 0.41 0.02 -1.27 0.42 113.55 112.76 1rpw h SER 179 Ca -0.09 0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1rpw h SER 179 Cb 0.70 0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.31 1rpw h SER 179 CO 0.15 0.06 -0.10 -0.61 -1.14 0.00 0.00 176.83 175.19 1rpw h GLN 180 N 0.52 -0.23 -0.99 3.45 -0.00 -0.89 -2.07 115.11 114.89 1rpw h GLN 180 Ca 0.62 0.02 0.14 0.00 -0.00 0.00 0.00 58.65 59.43 1rpw h GLN 180 Cb 1.19 0.05 -0.09 0.00 0.00 0.00 0.00 27.48 28.64 1rpw h GLN 180 CO -0.50 -0.15 0.62 0.82 0.00 0.00 0.00 178.83 179.62 1rpw h ILE 181 N -0.24 0.86 0.01 2.39 2.04 0.62 -1.75 117.51 121.43 1rpw h ILE 181 Ca -0.02 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 1rpw h ILE 181 Cb 0.20 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 1rpw h ILE 181 CO 0.01 0.16 -0.00 0.15 0.00 0.00 0.00 178.15 178.47 1rpw h PHE 182 N 0.90 -0.01 -0.62 1.37 3.57 -0.20 -2.51 116.94 119.44 1rpw h PHE 182 Ca 0.51 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 62.00 1rpw h PHE 182 Cb 0.62 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 1rpw h PHE 182 CO -0.00 0.25 0.34 -0.07 -2.23 0.00 0.00 178.31 176.60 1rpw h LEU 183 N -0.26 0.76 -1.13 0.59 3.38 -1.10 -1.18 115.31 116.37 1rpw h LEU 183 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1rpw h LEU 183 Cb 0.26 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1rpw h LEU 183 CO 0.00 0.62 0.00 -1.13 0.09 0.00 0.00 178.44 178.02 1rpw h ASN 184 N 0.86 0.00 0.67 -0.43 -1.24 -1.18 -2.26 115.58 112.01 1rpw h ASN 184 Ca 0.22 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.23 1rpw h ASN 184 Cb 0.02 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.07 1rpw h ASN 184 CO -0.04 0.00 -0.61 0.61 -1.29 0.00 0.00 177.43 176.10 1rpw n GLY 185 N 0.01 -1.32 0.03 1.57 0.00 -0.46 -3.97 105.19 101.03 1rpw n GLY 185 Ca 0.01 -0.31 0.10 0.00 0.00 0.00 0.00 46.02 45.83 1rpw n GLY 185 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rpw n LEU 186 N -1.83 0.18 0.00 0.99 4.77 -0.85 -5.11 117.00 115.15 1rpw n LEU 186 Ca 0.04 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1rpw n LEU 186 Cb 0.39 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1rpw n LEU 186 CO 0.36 -0.23 0.00 -1.20 -1.33 0.00 0.00 177.39 174.99