#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1by1 n LYS 2 N 0.00 0.46 -1.25 0.03 3.00 -1.26 -2.37 118.16 116.77 1by1 n LYS 2 Ca 0.00 -0.66 0.00 0.00 -0.00 0.00 0.00 58.31 57.65 1by1 n LYS 2 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 35.03 31.88 1by1 n LYS 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1by1 n GLY 3 N 6.53 0.51 0.00 3.14 0.00 -1.26 -5.05 105.19 109.06 1by1 n GLY 3 Ca 0.51 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1by1 n GLY 3 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1by1 n PHE 4 N -1.08 -1.35 0.00 1.61 7.35 -1.00 -4.13 117.46 118.85 1by1 n PHE 4 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1by1 n PHE 4 Cb 0.42 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.25 1by1 n PHE 4 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1by1 n ASP 5 N -1.05 0.00 -0.05 -2.13 -0.08 -1.26 -4.24 116.55 107.74 1by1 n ASP 5 Ca 0.00 0.00 0.15 0.00 -1.51 0.00 0.00 54.79 53.43 1by1 n ASP 5 Cb 0.00 0.00 0.72 0.00 2.34 0.00 0.00 41.12 44.18 1by1 n ASP 5 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1by1 n THR 6 N 0.00 0.00 -2.56 5.18 -1.04 -1.26 -4.82 114.28 109.78 1by1 n THR 6 Ca 0.00 -0.03 -0.43 0.00 -2.04 0.00 0.00 64.05 61.56 1by1 n THR 6 Cb 0.00 -0.33 -0.02 0.00 -1.82 0.00 0.00 70.33 68.15 1by1 n THR 6 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1by1 s THR 7 N -2.46 4.50 -0.03 12.58 -4.23 -1.26 -4.89 115.64 119.85 1by1 s THR 7 Ca 0.31 1.80 0.25 0.00 -1.18 0.00 0.00 61.69 62.88 1by1 s THR 7 Cb 0.20 -4.16 0.44 0.00 1.34 0.00 0.00 72.50 70.32 1by1 s THR 7 CO 0.45 -0.06 1.16 0.00 -0.54 0.00 0.00 174.62 175.63 1by1 n ALA 8 N 5.66 2.40 -2.28 3.99 0.00 -1.26 -5.01 120.51 124.00 1by1 n ALA 8 Ca 0.11 -2.38 -0.42 0.00 0.00 0.00 0.00 53.44 50.75 1by1 n ALA 8 Cb 0.47 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.14 1by1 n ALA 8 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1by1 s ILE 9 N -0.43 3.92 -0.80 0.00 2.07 -1.26 -2.55 121.20 122.17 1by1 s ILE 9 Ca 0.33 1.23 0.00 0.00 -1.41 0.00 0.00 60.65 60.80 1by1 s ILE 9 Cb 0.38 -3.79 0.00 0.00 0.13 0.00 0.00 42.46 39.18 1by1 s ILE 9 CO -0.15 -0.05 0.00 -3.20 -1.91 0.00 0.00 174.94 169.63 1by1 n ASN 10 N 5.93 -3.72 0.00 4.50 5.15 -1.26 -4.40 115.26 121.46 1by1 n ASN 10 Ca 0.14 0.15 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 1by1 n ASN 10 Cb 0.44 -2.13 0.00 0.00 -0.53 0.00 0.00 39.78 37.56 1by1 n ASN 10 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1by1 n LYS 11 N -2.57 0.00 -2.02 1.20 4.81 -1.06 -4.77 118.16 113.75 1by1 n LYS 11 Ca -0.08 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.33 1by1 n LYS 11 Cb 0.32 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.35 1by1 n LYS 11 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1by1 n SER 12 N 1.55 -1.54 -0.20 3.14 2.88 -1.26 -4.58 113.62 113.60 1by1 n SER 12 Ca 0.00 0.71 0.20 0.00 -1.33 0.00 0.00 58.87 58.45 1by1 n SER 12 Cb 0.00 -3.18 0.56 0.00 -0.75 0.00 0.00 64.21 60.84 1by1 n SER 12 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1by1 h TYR 13 N 2.10 0.40 -0.30 0.66 3.20 -1.98 -1.79 116.97 119.26 1by1 h TYR 13 Ca -0.27 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.68 1by1 h TYR 13 Cb 0.61 -0.12 -0.08 0.00 1.54 0.00 0.00 36.73 38.68 1by1 h TYR 13 CO 0.00 0.12 -0.27 -0.92 -1.64 0.00 0.00 178.16 175.45 1by1 h TYR 14 N 0.31 -0.73 0.00 -3.82 3.20 -2.00 0.38 116.97 114.32 1by1 h TYR 14 Ca 0.43 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 62.24 1by1 h TYR 14 Cb 1.18 0.37 -0.02 0.00 1.54 0.00 0.00 36.73 39.80 1by1 h TYR 14 CO -0.00 -0.34 -0.50 -0.91 -1.64 0.00 0.00 178.16 174.76 1by1 h ASN 15 N -0.25 0.00 0.37 -2.11 4.21 -1.61 -2.95 115.58 113.23 1by1 h ASN 15 Ca 0.15 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.58 1by1 h ASN 15 Cb 0.49 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 1by1 h ASN 15 CO -0.44 0.50 -0.39 0.58 -1.29 0.00 0.00 177.43 176.39 1by1 h VAL 16 N 0.00 1.28 -0.03 2.81 2.07 -0.46 -1.31 116.25 120.62 1by1 h VAL 16 Ca -0.01 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 1by1 h VAL 16 Cb 1.04 1.71 -0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1by1 h VAL 16 CO 0.07 0.39 -0.01 0.58 0.02 0.00 0.00 177.57 178.61 1by1 h VAL 17 N 0.03 1.33 -0.59 2.57 2.07 -0.15 -1.23 116.25 120.28 1by1 h VAL 17 Ca -0.00 -1.01 -0.05 0.00 0.82 0.00 0.00 66.70 66.47 1by1 h VAL 17 Cb 0.70 1.96 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 1by1 h VAL 17 CO 0.05 0.27 0.18 -0.07 0.02 0.00 0.00 177.57 178.02 1by1 h LEU 18 N -0.35 0.86 -0.26 2.57 -0.00 -1.55 -1.09 115.31 115.49 1by1 h LEU 18 Ca 0.01 -0.21 0.06 0.00 -0.00 0.00 0.00 57.88 57.74 1by1 h LEU 18 Cb 0.44 -0.23 -0.07 0.00 -0.00 0.00 0.00 40.66 40.80 1by1 h LEU 18 CO 0.00 0.84 -0.23 1.56 -0.00 0.00 0.00 178.44 180.61 1by1 h GLN 19 N 0.84 -0.22 0.38 1.13 4.20 -1.19 1.06 115.11 121.30 1by1 h GLN 19 Ca 0.19 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.90 1by1 h GLN 19 Cb 0.29 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1by1 h GLN 19 CO -0.01 -0.15 -0.18 -0.97 -0.67 0.00 0.00 178.83 176.85 1by1 h ASN 20 N -0.23 -0.44 -0.70 1.46 -1.24 -1.01 -2.63 115.58 110.79 1by1 h ASN 20 Ca 0.14 0.02 0.05 0.00 0.71 0.00 0.00 56.30 57.22 1by1 h ASN 20 Cb 0.45 0.12 -0.04 0.00 0.73 0.00 0.00 38.32 39.58 1by1 h ASN 20 CO -0.39 -0.31 0.46 0.40 -1.29 0.00 0.00 177.43 176.29 1by1 h ILE 21 N -0.51 1.06 -0.04 2.57 1.08 -0.70 -2.66 117.51 118.31 1by1 h ILE 21 Ca -0.05 -0.27 0.03 0.00 -0.39 0.00 0.00 64.86 64.18 1by1 h ILE 21 Cb 0.40 0.21 -0.06 0.00 -3.07 0.00 0.00 36.82 34.30 1by1 h ILE 21 CO 0.08 0.14 -0.40 -0.07 -0.69 0.00 0.00 178.15 177.22 1by1 h LEU 22 N 0.79 -1.22 -0.98 1.44 3.38 0.15 0.44 115.31 119.31 1by1 h LEU 22 Ca 0.29 0.15 0.27 0.00 0.09 0.00 0.00 57.88 58.68 1by1 h LEU 22 Cb 0.15 0.49 -0.13 0.00 0.09 0.00 0.00 40.66 41.25 1by1 h LEU 22 CO -0.09 -0.43 0.54 -0.33 0.09 0.00 0.00 178.44 178.22 1by1 h GLU 23 N -0.53 0.43 0.14 1.13 5.08 -1.32 1.82 114.58 121.33 1by1 h GLU 23 Ca 0.06 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1by1 h GLU 23 Cb 0.63 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1by1 h GLU 23 CO -0.33 0.29 -0.07 1.15 -1.00 0.00 0.00 179.01 179.05 1by1 h THR 24 N 0.44 0.00 -0.63 1.13 2.02 -0.90 -2.69 112.91 112.29 1by1 h THR 24 Ca 0.67 -0.15 0.03 0.00 0.77 0.00 0.00 66.41 67.72 1by1 h THR 24 Cb 1.37 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.75 1by1 h THR 24 CO -0.54 0.00 0.42 1.05 0.37 0.00 0.00 175.52 176.82 1by1 h GLU 25 N -0.35 0.74 -0.14 6.66 4.11 0.21 -1.94 114.58 123.87 1by1 h GLU 25 Ca -0.02 -0.04 0.04 0.00 0.07 0.00 0.00 59.36 59.41 1by1 h GLU 25 Cb 0.15 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.18 1by1 h GLU 25 CO 0.03 0.49 -0.15 -0.91 0.07 0.00 0.00 179.01 178.54 1by1 h ASN 26 N 0.76 -0.47 -0.30 3.06 4.21 0.27 0.82 115.58 123.93 1by1 h ASN 26 Ca 0.25 0.09 0.09 0.00 1.21 0.00 0.00 56.30 57.94 1by1 h ASN 26 Cb 0.06 0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.47 1by1 h ASN 26 CO -0.07 -0.20 0.52 -0.33 -1.29 0.00 0.00 177.43 176.06 1by1 h GLU 27 N -0.18 0.00 0.12 0.81 5.08 -0.99 1.61 114.58 121.02 1by1 h GLU 27 Ca 0.10 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.09 1by1 h GLU 27 Cb 0.33 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1by1 h GLU 27 CO -0.25 0.00 -2.00 0.98 -1.00 0.00 0.00 179.01 176.74 1by1 n TYR 28 N -3.30 1.21 0.13 4.33 9.36 0.98 -2.66 117.16 127.21 1by1 n TYR 28 Ca 0.05 0.26 -0.00 0.00 3.32 0.00 0.00 57.90 61.53 1by1 n TYR 28 Cb 0.65 -1.16 0.26 0.00 -0.63 0.00 0.00 39.34 38.46 1by1 n TYR 28 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1by1 h SER 29 N 0.07 0.12 0.52 2.98 4.64 0.70 -3.01 113.55 119.57 1by1 h SER 29 Ca -0.42 -0.05 -0.29 0.00 -0.47 0.00 0.00 61.79 60.55 1by1 h SER 29 Cb 2.03 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 64.09 1by1 h SER 29 CO 0.08 0.55 -1.38 0.11 -0.87 0.00 0.00 176.83 175.32 1by1 h LYS 30 N 0.10 0.29 -0.61 4.77 1.79 0.18 -3.06 116.57 120.02 1by1 h LYS 30 Ca 0.01 -0.50 0.05 0.00 -2.18 0.00 0.00 60.65 58.03 1by1 h LYS 30 Cb 0.82 0.19 -0.04 0.00 -1.58 0.00 0.00 32.23 31.62 1by1 h LYS 30 CO 0.06 1.20 0.40 0.93 -1.08 0.00 0.00 179.45 180.97 1by1 h GLU 31 N 0.08 0.63 0.03 3.15 5.08 -1.39 -0.29 114.58 121.88 1by1 h GLU 31 Ca -0.19 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.07 1by1 h GLU 31 Cb 2.01 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 31.13 1by1 h GLU 31 CO 0.19 0.42 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.28 1by1 h LEU 32 N 0.65 0.19 -1.81 1.33 3.38 -1.62 -2.93 115.31 114.51 1by1 h LEU 32 Ca 0.26 -0.90 0.11 0.00 0.09 0.00 0.00 57.88 57.43 1by1 h LEU 32 Cb 0.19 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1by1 h LEU 32 CO -0.07 1.07 0.35 -0.61 0.09 0.00 0.00 178.44 179.26 1by1 h GLN 33 N -0.67 0.21 0.31 1.13 -0.00 -1.37 0.11 115.11 114.83 1by1 h GLN 33 Ca -0.04 -0.01 -0.02 0.00 -0.00 0.00 0.00 58.65 58.58 1by1 h GLN 33 Cb 1.14 -0.05 0.00 0.00 0.00 0.00 0.00 27.48 28.58 1by1 h GLN 33 CO 0.05 0.14 -0.15 1.15 0.00 0.00 0.00 178.83 180.02 1by1 h THR 34 N 0.22 0.00 -0.81 2.39 2.02 -1.12 -3.22 112.91 112.38 1by1 h THR 34 Ca 0.24 -0.45 0.17 0.00 0.77 0.00 0.00 66.41 67.14 1by1 h THR 34 Cb 0.65 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.01 1by1 h THR 34 CO -0.04 0.00 0.54 0.58 0.37 0.00 0.00 175.52 176.97 1by1 h VAL 35 N -0.86 0.75 0.10 3.16 2.07 -1.31 0.72 116.25 120.88 1by1 h VAL 35 Ca -0.04 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.36 1by1 h VAL 35 Cb 0.32 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 1by1 h VAL 35 CO 0.07 0.07 -0.45 -0.07 0.02 0.00 0.00 177.57 177.21 1by1 h LEU 36 N 0.40 -1.34 0.00 2.57 3.38 -0.84 0.30 115.31 119.78 1by1 h LEU 36 Ca 0.41 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.53 1by1 h LEU 36 Cb 0.99 0.50 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1by1 h LEU 36 CO -0.14 -0.51 -0.05 -1.28 0.09 0.00 0.00 178.44 176.56 1by1 h SER 37 N -0.67 0.00 0.17 -0.43 0.87 -1.43 1.22 113.55 113.27 1by1 h SER 37 Ca 0.02 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 1by1 h SER 37 Cb 0.70 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.66 1by1 h SER 37 CO -0.27 0.00 -0.08 0.74 -0.53 0.00 0.00 176.83 176.70 1by1 h THR 38 N 0.00 0.00 0.00 2.23 2.02 -0.24 -3.42 112.91 113.49 1by1 h THR 38 Ca 0.00 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1by1 h THR 38 Cb 0.85 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 1by1 h THR 38 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 1by1 n TYR 39 N -3.90 0.00 0.03 3.16 0.18 -0.45 -3.34 117.16 112.83 1by1 n TYR 39 Ca -0.03 0.00 -0.03 0.00 1.88 0.00 0.00 57.90 59.73 1by1 n TYR 39 Cb 0.09 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 38.96 1by1 n TYR 39 CO 0.00 0.00 0.00 1.25 -2.08 0.00 0.00 176.86 176.03 1by1 h LEU 40 N 0.00 0.00 -0.36 -3.48 5.85 -0.59 -3.34 115.31 113.38 1by1 h LEU 40 Ca 0.00 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.80 1by1 h LEU 40 Cb 0.27 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.22 1by1 h LEU 40 CO 0.00 0.71 -0.23 0.03 -0.34 0.00 0.00 178.44 178.62 1by1 h ARG 41 N 0.00 -0.17 0.00 1.25 2.47 0.13 -0.79 114.38 117.27 1by1 h ARG 41 Ca -0.17 0.01 -0.06 0.00 -1.26 0.00 0.00 59.98 58.50 1by1 h ARG 41 Cb 1.69 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 30.04 1by1 h ARG 41 CO 0.06 -0.11 -0.31 -1.35 0.56 0.00 0.00 179.97 178.82 1by1 h PRO 42 N -0.18 0.00 0.00 0.04 0.11 -1.82 -2.67 132.00 127.49 1by1 h PRO 42 Ca 0.18 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.29 1by1 h PRO 42 Cb 0.45 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.56 1by1 h PRO 42 CO -0.47 0.31 -0.00 1.25 -0.21 0.00 0.00 178.00 178.88 1by1 h LEU 43 N 0.00 0.00 -1.24 2.35 7.12 -1.26 -1.29 115.31 120.99 1by1 h LEU 43 Ca -0.00 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.98 1by1 h LEU 43 Cb 0.67 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.77 1by1 h LEU 43 CO 0.04 0.00 0.19 1.56 -0.13 0.00 0.00 178.44 180.10 1by1 h GLN 44 N 0.00 0.71 0.00 1.25 4.20 -1.31 -0.40 115.11 119.56 1by1 h GLN 44 Ca -0.00 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 1by1 h GLN 44 Cb 0.03 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.68 1by1 h GLN 44 CO 0.00 0.60 -0.08 1.15 -0.67 0.00 0.00 178.83 179.83 1by1 h THR 45 N 0.71 0.69 0.00 -0.54 2.02 -1.43 0.25 112.91 114.60 1by1 h THR 45 Ca 0.17 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1by1 h THR 45 Cb 0.16 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1by1 h THR 45 CO -0.01 0.08 0.00 -1.20 0.37 0.00 0.00 175.52 174.75 1by1 n SER 46 N -3.91 0.15 -2.44 4.18 7.64 -0.18 -4.92 113.62 114.14 1by1 n SER 46 Ca -0.02 0.51 -0.15 0.00 1.01 0.00 0.00 58.87 60.22 1by1 n SER 46 Cb 0.17 -0.55 0.05 0.00 -1.01 0.00 0.00 64.21 62.86 1by1 n SER 46 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1by1 n GLU 47 N -1.64 -4.92 -2.89 1.43 -0.58 0.88 -2.49 120.64 110.43 1by1 n GLU 47 Ca 0.07 0.54 -0.22 0.00 -0.42 0.00 0.00 57.16 57.13 1by1 n GLU 47 Cb 0.35 -4.71 0.02 0.00 -0.57 0.00 0.00 31.44 26.54 1by1 n GLU 47 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1by1 n LYS 48 N -3.35 -3.95 -1.95 3.49 5.02 -1.20 -0.59 118.16 115.63 1by1 n LYS 48 Ca -0.00 0.88 -0.13 0.00 -2.02 0.00 0.00 58.31 57.04 1by1 n LYS 48 Cb 0.54 -5.67 -0.02 0.00 -0.02 0.00 0.00 35.03 29.86 1by1 n LYS 48 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1by1 n LEU 49 N -3.73 -1.36 -4.43 -0.35 4.77 -1.04 -4.51 117.00 106.36 1by1 n LEU 49 Ca -0.13 0.09 -0.47 0.00 -0.03 0.00 0.00 56.01 55.47 1by1 n LEU 49 Cb 0.63 -1.95 -0.13 0.00 -2.33 0.00 0.00 43.42 39.63 1by1 n LEU 49 CO 0.42 -0.30 2.06 -1.54 -1.33 0.00 0.00 177.39 176.70 1by1 n SER 50 N -0.28 0.55 0.00 -1.43 3.41 0.24 -3.51 113.62 112.60 1by1 n SER 50 Ca -0.14 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1by1 n SER 50 Cb 0.55 -0.95 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 1by1 n SER 50 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1by1 n SER 51 N 9.77 0.00 0.00 4.04 7.64 -1.26 -4.98 113.62 128.83 1by1 n SER 51 Ca 0.61 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.49 1by1 n SER 51 Cb 0.03 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1by1 n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1by1 n ALA 52 N 0.00 0.00 -0.14 -0.43 0.00 -1.23 -4.98 120.51 113.74 1by1 n ALA 52 Ca 0.00 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.72 1by1 n ALA 52 Cb 0.00 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.08 1by1 n ALA 52 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1by1 h ASN 53 N 0.00 0.00 -0.10 0.00 -0.73 -1.89 -2.65 115.58 110.22 1by1 h ASN 53 Ca 0.00 0.00 0.01 0.00 1.87 0.00 0.00 56.30 58.18 1by1 h ASN 53 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.57 1by1 h ASN 53 CO 0.00 0.00 -0.13 0.40 -0.37 0.00 0.00 177.43 177.33 1by1 h ILE 54 N 0.00 0.00 -0.33 2.57 1.08 -1.80 0.28 117.51 119.30 1by1 h ILE 54 Ca 0.41 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.98 1by1 h ILE 54 Cb 2.15 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.89 1by1 h ILE 54 CO -0.00 0.00 0.72 0.28 -0.69 0.00 0.00 178.15 178.46 1by1 h SER 55 N -0.10 0.00 0.00 1.72 0.02 -1.84 1.07 113.55 114.42 1by1 h SER 55 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1by1 h SER 55 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1by1 h SER 55 CO -0.14 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 174.33 1by1 n TYR 56 N -3.07 0.00 0.00 3.45 4.01 0.90 -4.84 117.16 117.61 1by1 n TYR 56 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1by1 n TYR 56 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.88 1by1 n TYR 56 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1by1 n LEU 57 N 0.00 1.26 -0.27 7.72 4.77 -0.68 -4.61 117.00 125.19 1by1 n LEU 57 Ca 0.00 0.02 0.05 0.00 -0.03 0.00 0.00 56.01 56.05 1by1 n LEU 57 Cb 0.00 -0.05 0.11 0.00 -2.33 0.00 0.00 43.42 41.15 1by1 n LEU 57 CO 0.00 -0.05 0.49 0.23 -1.33 0.00 0.00 177.39 176.74 1by1 n MET 58 N -1.16 -0.07 -0.49 3.23 2.81 -1.25 0.01 117.12 120.21 1by1 n MET 58 Ca 0.00 1.17 0.39 0.00 -1.81 0.00 0.00 57.70 57.45 1by1 n MET 58 Cb 0.00 -1.74 0.64 0.00 -0.71 0.00 0.00 33.22 31.40 1by1 n MET 58 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1by1 n GLY 59 N -1.47 -0.78 0.00 3.03 0.00 0.37 0.15 105.19 106.49 1by1 n GLY 59 Ca 0.12 0.65 0.00 0.00 0.00 0.00 0.00 46.02 46.79 1by1 n GLY 59 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1by1 n ASN 60 N -4.20 0.00 -0.06 1.61 2.85 0.10 -4.24 115.26 111.32 1by1 n ASN 60 Ca 0.37 0.10 -0.08 0.00 -0.11 0.00 0.00 54.58 54.86 1by1 n ASN 60 Cb 1.51 -0.24 -0.02 0.00 1.24 0.00 0.00 39.78 42.27 1by1 n ASN 60 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1by1 h LEU 61 N 0.00 -0.91 -1.96 1.20 5.85 -1.39 0.15 115.31 118.25 1by1 h LEU 61 Ca 0.00 0.16 0.36 0.00 0.84 0.00 0.00 57.88 59.23 1by1 h LEU 61 Cb 0.00 0.42 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1by1 h LEU 61 CO 0.00 -0.31 0.91 1.05 -0.34 0.00 0.00 178.44 179.76 1by1 h GLU 62 N -0.27 0.00 0.00 1.25 -0.00 0.11 0.89 114.58 116.56 1by1 h GLU 62 Ca 0.14 0.00 -0.27 0.00 -0.00 0.00 0.00 59.36 59.24 1by1 h GLU 62 Cb 0.50 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 29.20 1by1 h GLU 62 CO -0.43 0.00 -1.66 0.39 -0.00 0.00 0.00 179.01 177.31 1by1 n GLU 63 N -4.09 0.63 0.16 1.06 1.02 0.27 -4.00 120.64 115.70 1by1 n GLU 63 Ca 0.27 0.28 0.19 0.00 -0.02 0.00 0.00 57.16 57.87 1by1 n GLU 63 Cb 1.31 -1.79 0.79 0.00 -0.02 0.00 0.00 31.44 31.73 1by1 n GLU 63 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1by1 h ILE 64 N 0.00 0.35 -0.49 -3.67 2.04 0.33 -2.37 117.51 113.71 1by1 h ILE 64 Ca -0.26 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.69 1by1 h ILE 64 Cb 1.93 0.72 -0.10 0.00 -0.74 0.00 0.00 36.82 38.63 1by1 h ILE 64 CO 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 178.15 177.94 1by1 h SER 66 N -0.17 0.04 0.32 0.00 0.02 -1.72 -3.08 113.55 108.97 1by1 h SER 66 Ca 0.21 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.13 1by1 h SER 66 Cb 0.51 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1by1 h SER 66 CO -0.58 0.61 -0.16 0.15 -1.14 0.00 0.00 176.83 175.71 1by1 h PHE 67 N 0.03 -0.40 -1.21 3.45 3.04 -0.72 -2.56 116.94 118.57 1by1 h PHE 67 Ca -0.01 -0.01 0.35 0.00 3.98 0.00 0.00 57.97 62.29 1by1 h PHE 67 Cb 1.02 0.13 -0.05 0.00 2.56 0.00 0.00 35.95 39.62 1by1 h PHE 67 CO 0.00 -0.25 0.95 -0.56 -2.02 0.00 0.00 178.31 176.43 1by1 h GLN 68 N -0.81 0.00 0.15 1.11 -0.00 0.21 2.01 115.11 117.78 1by1 h GLN 68 Ca -0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.60 1by1 h GLN 68 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.81 1by1 h GLN 68 CO 0.07 0.00 -0.07 1.96 -0.00 0.00 0.00 178.83 180.79 1by1 h GLN 69 N 0.00 -0.19 0.00 0.06 1.08 -1.55 -3.32 115.11 111.19 1by1 h GLN 69 Ca 0.57 0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.69 1by1 h GLN 69 Cb 2.46 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 29.92 1by1 h GLN 69 CO -0.01 0.22 -0.45 0.00 -0.95 0.00 0.00 178.83 177.64 1by1 h MET 70 N -0.92 0.00 -0.60 1.46 -0.00 -0.53 -3.14 114.93 111.20 1by1 h MET 70 Ca -0.02 0.00 0.06 0.00 -0.00 0.00 0.00 59.70 59.74 1by1 h MET 70 Cb 0.49 0.00 -0.08 0.00 -0.00 0.00 0.00 31.60 32.01 1by1 h MET 70 CO 0.03 0.45 -0.43 1.25 -0.00 0.00 0.00 176.91 178.21 1by1 h LEU 71 N 0.00 -1.54 0.00 -0.10 7.12 0.30 0.16 115.31 121.25 1by1 h LEU 71 Ca -0.00 0.22 -0.04 0.00 0.13 0.00 0.00 57.88 58.19 1by1 h LEU 71 Cb 0.99 0.67 -0.01 0.00 -0.53 0.00 0.00 40.66 41.78 1by1 h LEU 71 CO 0.06 -0.21 -0.28 0.58 -0.13 0.00 0.00 178.44 178.46 1by1 h VAL 72 N -0.10 1.07 -0.03 1.05 2.07 -1.71 -3.35 116.25 115.26 1by1 h VAL 72 Ca 0.10 -1.90 -0.00 0.00 0.82 0.00 0.00 66.70 65.72 1by1 h VAL 72 Cb 0.35 2.12 -0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1by1 h VAL 72 CO -0.61 0.36 0.01 0.06 0.02 0.00 0.00 177.57 177.41 1by1 h GLN 73 N -1.00 0.04 -0.32 1.57 3.07 -1.55 0.45 115.11 117.36 1by1 h GLN 73 Ca -0.07 -0.00 0.07 0.00 0.09 0.00 0.00 58.65 58.74 1by1 h GLN 73 Cb 0.79 -0.01 -0.08 0.00 0.08 0.00 0.00 27.48 28.26 1by1 h GLN 73 CO -0.04 0.13 -0.25 1.03 0.09 0.00 0.00 178.83 179.79 1by1 h SER 74 N -0.06 -0.83 0.32 0.06 0.87 -0.87 0.97 113.55 114.00 1by1 h SER 74 Ca 0.01 0.16 -0.33 0.00 -1.23 0.00 0.00 61.79 60.40 1by1 h SER 74 Cb 0.10 0.40 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 1by1 h SER 74 CO -0.00 -0.28 -1.73 0.17 -0.53 0.00 0.00 176.83 174.46 1by1 h LEU 75 N -0.22 0.37 0.15 2.23 8.10 -1.63 -3.32 115.31 120.99 1by1 h LEU 75 Ca 0.16 -0.64 -0.01 0.00 0.11 0.00 0.00 57.88 57.50 1by1 h LEU 75 Cb 0.48 -0.12 0.00 0.00 -0.44 0.00 0.00 40.66 40.58 1by1 h LEU 75 CO -0.45 1.56 -0.07 -0.33 -4.11 0.00 0.00 178.44 175.03 1by1 h GLU 76 N 0.07 -0.19 -0.59 0.17 4.39 -0.04 -0.35 114.58 118.04 1by1 h GLU 76 Ca -0.32 0.01 0.17 0.00 0.34 0.00 0.00 59.36 59.56 1by1 h GLU 76 Cb 2.04 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 30.71 1by1 h GLU 76 CO 0.13 0.18 0.57 0.93 -1.16 0.00 0.00 179.01 179.66 1by1 h GLU 77 N -0.95 0.00 0.02 2.33 4.39 -0.89 0.64 114.58 120.12 1by1 h GLU 77 Ca -0.02 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.42 1by1 h GLU 77 Cb 0.46 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.08 1by1 h GLU 77 CO 0.03 0.00 -1.43 0.00 -1.16 0.00 0.00 179.01 176.45 1by1 h THR 79 N -0.80 0.41 -0.91 0.00 1.35 -0.38 -2.92 112.91 109.66 1by1 h THR 79 Ca -0.37 0.00 0.10 0.00 -0.55 0.00 0.00 66.41 65.58 1by1 h THR 79 Cb 1.45 0.41 -0.12 0.00 -1.73 0.00 0.00 68.15 68.15 1by1 h THR 79 CO -0.16 0.00 -0.54 0.11 -0.25 0.00 0.00 175.52 174.68 1by1 h LYS 80 N -0.50 -0.06 -6.30 4.72 6.56 -1.09 -3.22 116.57 116.68 1by1 h LYS 80 Ca 0.03 0.00 -0.55 0.00 -1.06 0.00 0.00 60.65 59.07 1by1 h LYS 80 Cb 0.51 0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.17 1by1 h LYS 80 CO -0.14 -0.04 0.79 -0.48 -2.06 0.00 0.00 179.45 177.52 1by1 s LEU 81 N -10.57 4.28 -0.01 2.94 0.05 -1.10 -4.60 118.68 109.66 1by1 s LEU 81 Ca -0.13 1.91 -0.00 0.00 0.05 0.00 0.00 54.13 55.96 1by1 s LEU 81 Cb 0.13 -3.55 -0.00 0.00 -2.05 0.00 0.00 46.19 40.71 1by1 s LEU 81 CO 0.64 -0.67 0.13 -2.65 -0.55 0.00 0.00 176.35 173.25 1by1 n PRO 82 N 5.56 0.00 -2.43 1.48 -0.02 -1.25 -4.80 135.00 133.54 1by1 n PRO 82 Ca 0.12 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.19 1by1 n PRO 82 Cb 0.45 -0.12 -0.03 0.00 -0.02 0.00 0.00 33.50 33.78 1by1 n PRO 82 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1by1 s GLU 83 N 0.61 4.46 0.58 -0.52 2.12 -1.21 -4.91 118.70 119.83 1by1 s GLU 83 Ca 0.02 1.78 0.28 0.00 0.36 0.00 0.00 54.97 57.41 1by1 s GLU 83 Cb -0.01 -3.32 1.57 0.00 0.26 0.00 0.00 34.13 32.63 1by1 s GLU 83 CO 0.01 -0.19 2.02 0.00 -0.54 0.00 0.00 175.26 176.56 1by1 h ALA 84 N 6.36 1.98 0.00 6.30 0.00 -1.91 -3.24 119.26 128.75 1by1 h ALA 84 Ca -0.42 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 1by1 h ALA 84 Cb 1.21 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1by1 h ALA 84 CO 0.79 -0.46 -1.35 1.04 0.00 0.00 0.00 179.25 179.28 1by1 n GLN 85 N -3.81 0.19 -1.26 0.00 1.13 -1.26 -5.01 117.38 107.36 1by1 n GLN 85 Ca 0.04 0.08 -0.09 0.00 -1.94 0.00 0.00 57.00 55.10 1by1 n GLN 85 Cb 0.46 -0.83 -0.04 0.00 0.11 0.00 0.00 30.24 29.94 1by1 n GLN 85 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1by1 n GLN 86 N -3.48 -1.02 -3.60 -1.09 6.02 -1.23 -4.97 117.38 108.02 1by1 n GLN 86 Ca -0.16 0.76 -0.38 0.00 -0.01 0.00 0.00 57.00 57.20 1by1 n GLN 86 Cb 0.56 -4.77 -0.11 0.00 1.02 0.00 0.00 30.24 26.94 1by1 n GLN 86 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1by1 s ARG 87 N -2.52 3.83 0.22 -1.09 0.52 -1.26 -4.59 118.95 114.07 1by1 s ARG 87 Ca 0.00 -0.40 -0.07 0.00 -0.52 0.00 0.00 55.73 54.74 1by1 s ARG 87 Cb 0.00 -3.64 0.33 0.00 0.52 0.00 0.00 34.95 32.16 1by1 s ARG 87 CO 0.00 -0.22 1.77 0.28 0.02 0.00 0.00 175.30 177.14 1by1 h VAL 88 N 5.42 0.82 -0.45 3.52 2.07 -1.88 -2.39 116.25 123.36 1by1 h VAL 88 Ca -0.35 -0.19 0.09 0.00 0.82 0.00 0.00 66.70 67.08 1by1 h VAL 88 Cb 1.18 0.23 -0.09 0.00 -1.52 0.00 0.00 31.29 31.08 1by1 h VAL 88 CO 0.57 0.10 -0.22 1.23 0.02 0.00 0.00 177.57 179.26 1by1 h GLY 89 N 0.55 0.07 -0.82 2.17 0.00 -1.93 -0.69 103.07 102.43 1by1 h GLY 89 Ca 0.34 0.28 0.33 0.00 0.00 0.00 0.00 47.33 48.28 1by1 h GLY 89 CO -0.28 -0.21 0.33 -1.33 0.00 0.00 0.00 176.54 175.05 1by1 h GLY 90 N -0.13 1.76 0.00 4.60 0.00 -1.85 1.19 103.07 108.64 1by1 h GLY 90 Ca 0.21 -0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.42 1by1 h GLY 90 CO -0.53 -0.59 -0.42 0.00 0.00 0.00 0.00 176.54 175.00 1by1 h PHE 92 N -1.00 0.00 0.00 0.00 0.04 -0.32 -0.08 116.94 115.58 1by1 h PHE 92 Ca -0.11 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.58 1by1 h PHE 92 Cb 0.97 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.10 1by1 h PHE 92 CO 0.17 0.00 -0.38 -0.07 -0.60 0.00 0.00 178.31 177.42 1by1 h LEU 93 N 0.00 0.00 -0.59 1.54 4.07 0.13 -2.43 115.31 118.03 1by1 h LEU 93 Ca 0.03 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.97 1by1 h LEU 93 Cb 0.18 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.92 1by1 h LEU 93 CO -0.00 0.38 -0.11 -1.13 -1.08 0.00 0.00 178.44 176.50 1by1 h ASN 94 N 0.00 0.00 0.52 -0.43 -0.73 -1.10 -3.03 115.58 110.82 1by1 h ASN 94 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1by1 h ASN 94 Cb 0.70 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.29 1by1 h ASN 94 CO 0.05 0.11 -0.58 -0.11 -0.37 0.00 0.00 177.43 176.53 1by1 n LEU 95 N -3.17 0.56 -0.29 0.34 -0.00 -0.94 -4.41 117.00 109.09 1by1 n LEU 95 Ca 0.02 0.01 -0.08 0.00 -0.00 0.00 0.00 56.01 55.96 1by1 n LEU 95 Cb 0.48 -0.22 -0.04 0.00 -0.00 0.00 0.00 43.42 43.64 1by1 n LEU 95 CO 0.33 0.10 0.55 0.24 -0.00 0.00 0.00 177.39 178.60 1by1 h MET 96 N 0.00 -0.13 -0.80 1.96 2.86 -1.36 1.23 114.93 118.69 1by1 h MET 96 Ca 0.00 0.01 0.18 0.00 -2.06 0.00 0.00 59.70 57.83 1by1 h MET 96 Cb 0.55 0.03 -0.15 0.00 0.06 0.00 0.00 31.60 32.10 1by1 h MET 96 CO 0.00 -0.09 -0.06 -1.35 1.06 0.00 0.00 176.91 176.47 1by1 h PRO 97 N -0.14 0.05 0.04 -0.22 0.11 -1.81 1.29 132.00 131.32 1by1 h PRO 97 Ca 0.20 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.16 1by1 h PRO 97 Cb 0.54 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 1by1 h PRO 97 CO -0.81 0.04 -0.77 1.96 -0.21 0.00 0.00 178.00 178.21 1by1 h GLN 98 N 0.05 0.09 -0.75 1.05 4.20 -1.51 -3.27 115.11 114.97 1by1 h GLN 98 Ca 0.43 -0.15 0.04 0.00 0.06 0.00 0.00 58.65 59.02 1by1 h GLN 98 Cb 0.74 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.54 1by1 h GLN 98 CO -0.75 1.07 0.49 1.98 -0.67 0.00 0.00 178.83 180.95 1by1 h MET 99 N -0.77 0.88 -0.11 1.46 4.05 0.19 -1.87 114.93 118.76 1by1 h MET 99 Ca -0.18 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.17 1by1 h MET 99 Cb 1.33 -0.20 -0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1by1 h MET 99 CO -0.03 0.58 0.02 -0.22 0.23 0.00 0.00 176.91 177.50 1by1 h LYS 100 N 0.91 0.18 0.06 0.39 3.64 0.15 -0.29 116.57 121.61 1by1 h LYS 100 Ca 0.30 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1by1 h LYS 100 Cb 0.06 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1by1 h LYS 100 CO -0.09 0.37 -0.03 1.15 -2.27 0.00 0.00 179.45 178.58 1by1 h THR 101 N -0.04 1.04 -0.30 1.00 2.02 -1.54 -2.22 112.91 112.87 1by1 h THR 101 Ca 0.03 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 1by1 h THR 101 Cb 0.27 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1by1 h THR 101 CO 0.00 0.09 0.05 -0.07 0.37 0.00 0.00 175.52 175.96 1by1 h LEU 102 N -0.24 0.48 -0.39 2.58 3.38 -1.39 -2.54 115.31 117.19 1by1 h LEU 102 Ca -0.01 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.74 1by1 h LEU 102 Cb 0.21 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1by1 h LEU 102 CO 0.01 0.62 0.15 1.88 0.09 0.00 0.00 178.44 181.19 1by1 h TYR 103 N 0.32 0.26 -0.06 1.13 -1.99 -1.05 -2.11 116.97 113.47 1by1 h TYR 103 Ca 0.09 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.86 1by1 h TYR 103 Cb 0.35 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 39.00 1by1 h TYR 103 CO 0.02 0.11 -0.05 -0.07 -0.00 0.00 0.00 178.16 178.17 1by1 h LEU 104 N 0.31 -0.17 -0.15 3.88 3.38 -1.35 -2.98 115.31 118.24 1by1 h LEU 104 Ca 0.18 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.23 1by1 h LEU 104 Cb 0.15 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 1by1 h LEU 104 CO -0.17 -0.08 -0.25 0.74 0.09 0.00 0.00 178.44 178.77 1by1 h THR 105 N -0.07 0.39 -0.62 0.22 2.02 -1.14 -1.21 112.91 112.51 1by1 h THR 105 Ca 0.04 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.33 1by1 h THR 105 Cb 0.13 0.39 -0.12 0.00 -1.74 0.00 0.00 68.15 66.82 1by1 h THR 105 CO -0.10 0.00 -0.31 0.22 0.37 0.00 0.00 175.52 175.70 1by1 h TYR 106 N -0.31 -0.84 -0.29 3.16 3.20 -1.24 1.36 116.97 122.01 1by1 h TYR 106 Ca 0.11 0.07 -0.14 0.00 3.14 0.00 0.00 58.73 61.91 1by1 h TYR 106 Cb 0.47 0.46 -0.01 0.00 1.54 0.00 0.00 36.73 39.19 1by1 h TYR 106 CO -0.36 -0.37 -0.39 0.00 -1.64 0.00 0.00 178.16 175.40 1by1 h ALA 108 N 0.99 0.09 -0.01 0.00 0.00 -0.04 -3.26 119.26 117.04 1by1 h ALA 108 Ca 0.05 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1by1 h ALA 108 Cb 0.92 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1by1 h ALA 108 CO 0.08 0.09 -0.14 0.09 0.00 0.00 0.00 179.25 179.37 1by1 n ASN 109 N -4.52 0.92 -0.25 0.00 3.02 0.45 -4.33 115.26 110.56 1by1 n ASN 109 Ca -0.09 -0.95 -0.03 0.00 -0.03 0.00 0.00 54.58 53.48 1by1 n ASN 109 Cb 0.46 0.03 0.04 0.00 -0.61 0.00 0.00 39.78 39.70 1by1 n ASN 109 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 1by1 h HIS 110 N 1.24 -0.80 -0.82 3.10 2.76 0.04 1.43 115.15 122.09 1by1 h HIS 110 Ca 0.00 0.08 0.05 0.00 -2.20 0.00 0.00 60.37 58.29 1by1 h HIS 110 Cb 0.43 0.46 -0.05 0.00 1.55 0.00 0.00 27.41 29.80 1by1 h HIS 110 CO 0.00 -0.37 0.54 -1.35 -1.30 0.00 0.00 177.93 175.45 1by1 h PRO 111 N -0.09 0.94 0.00 5.26 0.11 -1.81 -1.51 132.00 134.90 1by1 h PRO 111 Ca 0.29 -0.06 -0.16 0.00 0.11 0.00 0.00 66.00 66.18 1by1 h PRO 111 Cb 0.56 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.44 1by1 h PRO 111 CO -0.76 0.62 -0.77 0.77 -0.21 0.00 0.00 178.00 177.66 1by1 h SER 112 N 0.97 0.00 0.09 -2.05 0.02 -0.91 -3.25 113.55 108.43 1by1 h SER 112 Ca 0.34 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.31 1by1 h SER 112 Cb 0.11 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 1by1 h SER 112 CO -0.11 0.77 -0.41 0.00 -1.14 0.00 0.00 176.83 175.94 1by1 h ALA 113 N 1.23 -0.71 -0.06 3.77 0.00 0.29 0.25 119.26 124.02 1by1 h ALA 113 Ca -0.01 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1by1 h ALA 113 Cb 1.54 0.70 -0.00 0.00 0.00 0.00 0.00 17.79 20.03 1by1 h ALA 113 CO 0.10 -0.97 0.01 0.28 0.00 0.00 0.00 179.25 178.67 1by1 h VAL 114 N -0.63 1.04 -0.08 0.00 2.07 -1.64 -2.35 116.25 114.67 1by1 h VAL 114 Ca 0.03 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1by1 h VAL 114 Cb 0.67 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1by1 h VAL 114 CO -0.25 0.05 -0.00 -1.13 0.02 0.00 0.00 177.57 176.25 1by1 h ASN 115 N 0.09 0.14 -0.95 0.57 -0.73 -1.18 -1.29 115.58 112.22 1by1 h ASN 115 Ca 0.02 -0.32 0.18 0.00 1.87 0.00 0.00 56.30 58.05 1by1 h ASN 115 Cb 0.05 -0.04 -0.08 0.00 0.27 0.00 0.00 38.32 38.52 1by1 h ASN 115 CO -0.00 0.43 0.61 0.58 -0.37 0.00 0.00 177.43 178.67 1by1 h VAL 116 N -0.16 0.74 0.19 2.57 2.07 -0.04 0.64 116.25 122.27 1by1 h VAL 116 Ca 0.02 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1by1 h VAL 116 Cb 0.36 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1by1 h VAL 116 CO 0.00 0.12 -0.09 -0.07 0.02 0.00 0.00 177.57 177.55 1by1 h LEU 117 N 0.66 -0.22 -1.78 2.57 3.38 -1.35 1.30 115.31 119.87 1by1 h LEU 117 Ca 0.51 0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.63 1by1 h LEU 117 Cb 0.92 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 1by1 h LEU 117 CO -0.27 0.05 0.58 0.74 0.09 0.00 0.00 178.44 179.63 1by1 h THR 118 N -0.67 0.26 0.00 0.22 2.02 -1.04 1.56 112.91 115.27 1by1 h THR 118 Ca -0.03 0.00 -0.29 0.00 0.77 0.00 0.00 66.41 66.87 1by1 h THR 118 Cb 0.20 0.52 -0.05 0.00 -1.74 0.00 0.00 68.15 67.08 1by1 h THR 118 CO 0.04 0.00 -1.70 -0.62 0.37 0.00 0.00 175.52 173.61 1by1 n GLU 119 N -3.53 0.63 -0.87 6.66 -0.58 0.22 -4.06 120.64 119.12 1by1 n GLU 119 Ca 0.09 0.29 -0.07 0.00 -0.42 0.00 0.00 57.16 57.06 1by1 n GLU 119 Cb 0.77 -1.79 0.21 0.00 -0.57 0.00 0.00 31.44 30.06 1by1 n GLU 119 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1by1 n HIS 120 N -3.04 1.63 -0.23 -0.32 8.25 0.45 -4.65 115.22 117.30 1by1 n HIS 120 Ca -0.17 -1.51 0.12 0.00 -0.26 0.00 0.00 57.72 55.90 1by1 n HIS 120 Cb 1.05 -0.59 0.41 0.00 1.12 0.00 0.00 29.99 31.98 1by1 n HIS 120 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1by1 h SER 121 N 1.28 0.58 0.13 0.41 0.87 0.16 0.37 113.55 117.35 1by1 h SER 121 Ca 0.28 0.03 -0.36 0.00 -1.23 0.00 0.00 61.79 60.51 1by1 h SER 121 Cb 1.96 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 63.82 1by1 h SER 121 CO 0.55 0.30 -1.97 -0.33 -0.53 0.00 0.00 176.83 174.85 1by1 h GLU 122 N 0.62 0.27 0.77 2.24 4.39 -1.84 -2.82 114.58 118.21 1by1 h GLU 122 Ca 0.42 -0.47 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 1by1 h GLU 122 Cb 0.72 0.17 0.01 0.00 -0.10 0.00 0.00 28.75 29.55 1by1 h GLU 122 CO -0.17 1.22 -0.37 0.93 -1.16 0.00 0.00 179.01 179.46 1by1 h GLU 123 N 0.06 -1.00 -0.65 2.33 5.08 -1.76 1.00 114.58 119.64 1by1 h GLU 123 Ca -0.42 0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 57.94 1by1 h GLU 123 Cb 2.03 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 31.48 1by1 h GLU 123 CO 0.09 -0.66 0.14 -0.07 -1.00 0.00 0.00 179.01 177.51 1by1 h LEU 124 N -1.27 0.99 -1.03 1.33 3.38 -0.49 -2.18 115.31 116.04 1by1 h LEU 124 Ca -0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1by1 h LEU 124 Cb 0.80 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1by1 h LEU 124 CO 0.17 0.97 -0.04 1.23 0.09 0.00 0.00 178.44 180.86 1by1 h GLY 125 N 1.05 0.00 0.92 0.83 0.00 -1.50 -2.67 103.07 101.70 1by1 h GLY 125 Ca 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.49 1by1 h GLY 125 CO 0.01 0.00 0.06 0.83 0.00 0.00 0.00 176.54 177.44 1by1 h GLU 126 N 0.00 0.59 -0.10 4.80 4.39 0.17 1.30 114.58 125.74 1by1 h GLU 126 Ca -0.00 -0.16 -0.21 0.00 0.34 0.00 0.00 59.36 59.33 1by1 h GLU 126 Cb 0.68 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.26 1by1 h GLU 126 CO 0.00 0.66 -0.81 0.27 -1.16 0.00 0.00 179.01 177.98 1by1 h PHE 127 N 0.43 0.84 -0.36 4.33 -5.15 -1.50 -2.98 116.94 112.54 1by1 h PHE 127 Ca 0.11 -0.39 0.00 0.00 -0.20 0.00 0.00 57.97 57.49 1by1 h PHE 127 Cb 0.35 -0.12 0.00 0.00 0.22 0.00 0.00 35.95 36.40 1by1 h PHE 127 CO 0.02 1.19 0.00 -0.12 -2.00 0.00 0.00 178.31 177.41 1by1 n MET 128 N -3.87 1.89 -0.23 6.09 1.56 -1.01 -4.60 117.12 116.95 1by1 n MET 128 Ca -0.07 -1.32 0.05 0.00 -0.27 0.00 0.00 57.70 56.09 1by1 n MET 128 Cb 0.76 -1.31 0.10 0.00 2.15 0.00 0.00 33.22 34.92 1by1 n MET 128 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 1by1 n GLU 129 N 0.56 -0.06 -2.70 2.12 2.13 0.45 -3.72 120.64 119.42 1by1 n GLU 129 Ca 0.12 1.00 -0.06 0.00 0.66 0.00 0.00 57.16 58.88 1by1 n GLU 129 Cb 0.32 -1.50 0.09 0.00 0.27 0.00 0.00 31.44 30.62 1by1 n GLU 129 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1by1 n THR 130 N -5.02 0.00 -2.56 6.31 5.66 -1.26 -4.98 114.28 112.43 1by1 n THR 130 Ca 0.11 -1.05 -0.10 0.00 -3.05 0.00 0.00 64.05 59.95 1by1 n THR 130 Cb 0.34 1.28 0.03 0.00 -1.55 0.00 0.00 70.33 70.43 1by1 n THR 130 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1by1 n LYS 131 N 0.86 2.29 0.00 1.09 5.02 -1.24 -4.90 118.16 121.27 1by1 n LYS 131 Ca 0.02 -3.74 0.00 0.00 -2.02 0.00 0.00 58.31 52.57 1by1 n LYS 131 Cb 0.71 -1.79 0.00 0.00 -0.02 0.00 0.00 35.03 33.93 1by1 n LYS 131 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1by1 n GLY 132 N -0.53 1.63 3.66 0.72 0.00 -1.26 -4.61 105.19 104.80 1by1 n GLY 132 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 1by1 n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1by1 n ALA 133 N 0.00 0.57 -1.33 4.61 0.00 -1.21 -4.19 120.51 118.96 1by1 n ALA 133 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1by1 n ALA 133 Cb 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.26 1by1 n ALA 133 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1by1 n SER 134 N -1.16 0.00 0.06 0.00 7.64 -1.26 -5.02 113.62 113.88 1by1 n SER 134 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.02 1by1 n SER 134 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 1by1 n SER 134 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1by1 n SER 135 N -0.50 0.48 -2.15 6.43 7.64 -1.26 -4.82 113.62 119.44 1by1 n SER 135 Ca 0.00 0.17 -0.06 0.00 1.01 0.00 0.00 58.87 60.00 1by1 n SER 135 Cb 0.00 -0.07 -0.08 0.00 -1.01 0.00 0.00 64.21 63.05 1by1 n SER 135 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1by1 n PRO 136 N -3.29 1.06 0.00 1.43 -0.02 -1.26 -4.89 135.00 128.03 1by1 n PRO 136 Ca 0.00 -0.49 0.00 0.00 -2.02 0.00 0.00 63.50 60.99 1by1 n PRO 136 Cb 0.11 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1by1 n PRO 136 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1by1 n GLY 137 N 2.58 1.87 0.00 -1.23 0.00 -1.26 -1.88 105.19 105.27 1by1 n GLY 137 Ca 0.21 0.54 0.02 0.00 0.00 0.00 0.00 46.02 46.79 1by1 n GLY 137 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1by1 n ILE 138 N 0.00 0.00 0.56 -0.61 0.00 -1.26 -4.48 119.36 113.57 1by1 n ILE 138 Ca 0.00 -0.30 0.06 0.00 0.00 0.00 0.00 62.75 62.51 1by1 n ILE 138 Cb 0.00 0.79 0.29 0.00 0.00 0.00 0.00 39.64 40.72 1by1 n ILE 138 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1by1 n LEU 139 N -1.29 0.00 -0.47 9.51 7.99 -0.79 -3.60 117.00 128.36 1by1 n LEU 139 Ca 0.00 0.27 0.41 0.00 -0.01 0.00 0.00 56.01 56.68 1by1 n LEU 139 Cb 0.07 -0.27 0.66 0.00 -0.11 0.00 0.00 43.42 43.78 1by1 n LEU 139 CO 0.08 -0.16 1.38 0.58 -1.51 0.00 0.00 177.39 177.76 1by1 h VAL 140 N 0.00 0.03 -0.28 4.08 2.07 -1.78 -2.24 116.25 118.13 1by1 h VAL 140 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1by1 h VAL 140 Cb 0.10 0.04 -0.05 0.00 -1.52 0.00 0.00 31.29 29.86 1by1 h VAL 140 CO 0.00 0.00 -0.30 0.25 0.02 0.00 0.00 177.57 177.54 1by1 h LEU 141 N 0.00 -1.01 0.00 2.57 7.12 -1.92 1.28 115.31 123.35 1by1 h LEU 141 Ca 0.72 0.14 0.00 0.00 0.13 0.00 0.00 57.88 58.87 1by1 h LEU 141 Cb 3.30 0.42 0.00 0.00 -0.53 0.00 0.00 40.66 43.85 1by1 h LEU 141 CO -0.01 -0.19 0.00 0.41 -0.13 0.00 0.00 178.44 178.52 1by1 n THR 142 N -4.12 0.00 0.28 1.05 -1.04 -0.84 0.13 114.28 109.74 1by1 n THR 142 Ca -0.01 1.16 0.15 0.00 -2.04 0.00 0.00 64.05 63.31 1by1 n THR 142 Cb 0.17 -1.85 0.83 0.00 -1.82 0.00 0.00 70.33 67.66 1by1 n THR 142 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1by1 h THR 143 N 0.00 0.44 0.00 12.58 2.02 -1.75 -1.77 112.91 124.43 1by1 h THR 143 Ca 0.00 -0.35 -0.21 0.00 0.77 0.00 0.00 66.41 66.62 1by1 h THR 143 Cb 0.00 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 1by1 h THR 143 CO 0.00 0.07 -1.07 1.23 0.37 0.00 0.00 175.52 176.12 1by1 h GLY 144 N 0.65 0.00 -1.42 2.16 0.00 0.20 -3.34 103.07 101.32 1by1 h GLY 144 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1by1 h GLY 144 CO 0.01 0.00 -0.01 1.04 0.00 0.00 0.00 176.54 177.57 1by1 n LEU 145 N -3.27 3.69 0.03 3.11 4.77 0.34 -4.50 117.00 121.17 1by1 n LEU 145 Ca -0.03 -3.17 0.11 0.00 -0.03 0.00 0.00 56.01 52.89 1by1 n LEU 145 Cb 0.93 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 1by1 n LEU 145 CO 0.46 0.79 -0.17 -1.20 -1.33 0.00 0.00 177.39 175.94 1by1 n SER 146 N -0.77 0.54 -0.00 -1.43 7.64 -0.70 -4.28 113.62 114.61 1by1 n SER 146 Ca 0.23 -0.12 -0.17 0.00 1.01 0.00 0.00 58.87 59.82 1by1 n SER 146 Cb 0.88 1.01 -0.11 0.00 -1.01 0.00 0.00 64.21 64.98 1by1 n SER 146 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1by1 h LYS 147 N 0.00 0.37 -0.53 1.43 1.57 -1.80 -3.30 116.57 114.31 1by1 h LYS 147 Ca 0.00 -0.40 0.15 0.00 -1.87 0.00 0.00 60.65 58.54 1by1 h LYS 147 Cb 0.82 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 1by1 h LYS 147 CO 0.00 1.07 0.90 -1.35 -0.57 0.00 0.00 179.45 179.51 1by1 h PRO 148 N -0.17 0.00 0.00 3.15 0.11 -1.87 1.01 132.00 134.23 1by1 h PRO 148 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1by1 h PRO 148 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1by1 h PRO 148 CO 0.11 0.00 0.00 0.34 -0.21 0.00 0.00 178.00 178.24 1by1 n PHE 149 N -3.11 0.00 0.02 0.65 7.35 -1.24 -3.29 117.46 117.84 1by1 n PHE 149 Ca 0.11 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.72 1by1 n PHE 149 Cb 1.08 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 40.78 1by1 n PHE 149 CO 0.00 0.00 0.00 1.98 -0.76 0.00 0.00 176.76 177.98 1by1 h MET 150 N 0.00 0.02 0.00 -4.13 4.05 0.85 -3.29 114.93 112.42 1by1 h MET 150 Ca 0.00 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1by1 h MET 150 Cb 0.00 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 30.81 1by1 h MET 150 CO 0.00 0.78 -0.00 -0.09 0.23 0.00 0.00 176.91 177.83 1by1 h ARG 151 N 0.00 0.00 -0.06 0.39 1.12 -1.73 -2.18 114.38 111.93 1by1 h ARG 151 Ca -0.15 0.00 0.02 0.00 -1.11 0.00 0.00 59.98 58.74 1by1 h ARG 151 Cb 1.90 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 31.85 1by1 h ARG 151 CO 0.11 0.00 0.21 1.25 -3.11 0.00 0.00 179.97 178.43 1by1 h LEU 152 N 0.00 0.00 0.00 3.80 5.85 -1.79 0.27 115.31 123.44 1by1 h LEU 152 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1by1 h LEU 152 Cb 0.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1by1 h LEU 152 CO 0.00 0.00 -0.18 -0.78 -0.34 0.00 0.00 178.44 177.14 1by1 h ASP 153 N 0.00 0.00 0.00 1.25 1.82 -1.66 -3.32 116.42 114.51 1by1 h ASP 153 Ca 0.03 -0.05 -0.14 0.00 -0.39 0.00 0.00 57.03 56.48 1by1 h ASP 153 Cb 0.45 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.43 1by1 h ASP 153 CO -0.00 0.02 -1.76 0.29 -1.61 0.00 0.00 179.24 176.18 1by1 n LYS 154 N -2.39 1.39 -0.30 0.28 4.76 0.73 -4.71 118.16 117.92 1by1 n LYS 154 Ca 0.05 -0.05 -0.08 0.00 -2.87 0.00 0.00 58.31 55.36 1by1 n LYS 154 Cb 0.46 -1.32 -0.07 0.00 -1.84 0.00 0.00 35.03 32.26 1by1 n LYS 154 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1by1 n TYR 155 N -2.28 -0.31 0.14 2.13 4.01 0.12 0.71 117.16 121.67 1by1 n TYR 155 Ca -0.14 0.88 0.08 0.00 -0.16 0.00 0.00 57.90 58.57 1by1 n TYR 155 Cb 0.70 -0.55 0.43 0.00 -0.31 0.00 0.00 39.34 39.61 1by1 n TYR 155 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1by1 n PRO 156 N -4.60 0.10 0.14 -0.72 -0.04 -1.26 -2.29 135.00 126.34 1by1 n PRO 156 Ca 0.01 0.59 -0.12 0.00 -0.04 0.00 0.00 63.50 63.93 1by1 n PRO 156 Cb 0.18 -1.94 -0.08 0.00 -0.04 0.00 0.00 33.50 31.63 1by1 n PRO 156 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1by1 h THR 157 N 0.00 0.66 -0.23 0.52 2.02 -0.01 -2.32 112.91 113.55 1by1 h THR 157 Ca 0.00 -0.70 0.04 0.00 0.77 0.00 0.00 66.41 66.51 1by1 h THR 157 Cb 0.19 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1by1 h THR 157 CO 0.00 0.13 0.16 -0.07 0.37 0.00 0.00 175.52 176.10 1by1 h LEU 158 N -0.82 0.12 -1.51 2.58 3.38 -1.45 0.17 115.31 117.78 1by1 h LEU 158 Ca -0.04 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1by1 h LEU 158 Cb 0.52 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1by1 h LEU 158 CO 0.07 0.08 -0.25 -0.07 0.09 0.00 0.00 178.44 178.36 1by1 h LEU 159 N 0.14 0.00 0.00 1.67 3.38 -1.45 -0.03 115.31 119.01 1by1 h LEU 159 Ca 0.10 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.86 1by1 h LEU 159 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1by1 h LEU 159 CO -0.01 0.25 -1.34 1.17 0.09 0.00 0.00 178.44 178.60 1by1 n LYS 160 N -3.94 0.54 -0.04 1.13 0.00 0.14 -3.86 118.16 112.14 1by1 n LYS 160 Ca -0.02 0.48 -0.14 0.00 0.00 0.00 0.00 58.31 58.64 1by1 n LYS 160 Cb 0.33 -1.66 -0.09 0.00 0.00 0.00 0.00 35.03 33.60 1by1 n LYS 160 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1by1 h GLU 161 N -1.00 0.20 0.00 1.64 5.08 -0.84 -3.02 114.58 116.64 1by1 h GLU 161 Ca -0.32 -0.13 -0.10 0.00 -1.00 0.00 0.00 59.36 57.81 1by1 h GLU 161 Cb 1.18 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1by1 h GLU 161 CO -0.20 0.71 -0.48 1.25 -1.00 0.00 0.00 179.01 179.30 1by1 h LEU 162 N -0.29 0.00 -0.72 1.33 7.12 -1.18 -3.03 115.31 118.54 1by1 h LEU 162 Ca 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 57.88 57.91 1by1 h LEU 162 Cb 0.71 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.82 1by1 h LEU 162 CO 0.03 0.48 -0.49 -0.08 -0.13 0.00 0.00 178.44 178.24 1by1 h GLU 163 N 0.00 0.00 -0.92 1.25 4.81 -1.60 -3.24 114.58 114.88 1by1 h GLU 163 Ca -0.00 0.00 0.27 0.00 -0.13 0.00 0.00 59.36 59.49 1by1 h GLU 163 Cb 0.87 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.21 1by1 h GLU 163 CO 0.06 0.49 0.89 0.00 -0.73 0.00 0.00 179.01 179.72 1by1 h ARG 164 N 0.00 0.00 -4.02 1.92 3.08 -1.40 -3.46 114.38 110.51 1by1 h ARG 164 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1by1 h ARG 164 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.11 1by1 h ARG 164 CO 0.06 0.00 -0.03 1.58 -1.07 0.00 0.00 179.97 180.52 1by1 n HIS 165 N -3.65 -1.32 -2.29 3.04 -0.00 -1.22 -3.79 115.22 105.98 1by1 n HIS 165 Ca 0.20 0.51 -0.10 0.00 0.46 0.00 0.00 57.72 58.78 1by1 n HIS 165 Cb 1.19 -2.63 -0.01 0.00 -0.12 0.00 0.00 29.99 28.42 1by1 n HIS 165 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1by1 n MET 166 N -1.22 -2.20 0.00 1.57 0.00 -1.26 -4.64 117.12 109.37 1by1 n MET 166 Ca 0.01 0.52 0.00 0.00 0.00 0.00 0.00 57.70 58.22 1by1 n MET 166 Cb 0.46 -5.05 0.00 0.00 0.00 0.00 0.00 33.22 28.64 1by1 n MET 166 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1by1 n GLU 167 N -2.61 0.00 -2.40 3.17 1.02 -1.25 -4.84 120.64 113.74 1by1 n GLU 167 Ca -0.12 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.85 1by1 n GLU 167 Cb 0.56 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.97 1by1 n GLU 167 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1by1 n ASP 168 N -3.26 -5.04 0.00 1.62 -0.08 -1.26 -4.75 116.55 103.78 1by1 n ASP 168 Ca 0.00 0.08 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1by1 n ASP 168 Cb 0.00 -4.23 0.00 0.00 2.34 0.00 0.00 41.12 39.23 1by1 n ASP 168 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1by1 n TYR 169 N -3.71 0.00 0.00 -0.67 9.36 -1.26 -5.03 117.16 115.85 1by1 n TYR 169 Ca -0.20 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.02 1by1 n TYR 169 Cb 0.65 0.31 0.00 0.00 -0.63 0.00 0.00 39.34 39.67 1by1 n TYR 169 CO 0.00 0.00 0.00 1.58 0.22 0.00 0.00 176.86 178.66 1by1 n HIS 170 N -2.67 0.00 -0.20 2.98 -0.00 -1.26 -4.83 115.22 109.24 1by1 n HIS 170 Ca 0.00 0.00 -0.24 0.00 0.46 0.00 0.00 57.72 57.94 1by1 n HIS 170 Cb 0.18 0.00 0.23 0.00 -0.12 0.00 0.00 29.99 30.28 1by1 n HIS 170 CO 0.00 0.00 0.00 0.25 0.46 0.00 0.00 176.34 177.05 1by1 n THR 171 N 0.00 0.00 -0.97 3.57 -2.24 -1.26 -3.94 114.28 109.44 1by1 n THR 171 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1by1 n THR 171 Cb 0.00 -0.76 0.00 0.00 -2.10 0.00 0.00 70.33 67.47 1by1 n THR 171 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1by1 n ASP 172 N -4.94 -3.22 -0.00 3.42 2.03 -1.26 -4.88 116.55 107.70 1by1 n ASP 172 Ca 0.11 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.42 1by1 n ASP 172 Cb 0.46 -1.38 0.30 0.00 -0.72 0.00 0.00 41.12 39.78 1by1 n ASP 172 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1by1 h ARG 173 N 0.92 0.53 0.00 -0.67 -0.00 -1.98 -2.17 114.38 111.02 1by1 h ARG 173 Ca 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 59.98 59.87 1by1 h ARG 173 Cb 0.27 -0.08 0.00 0.00 -0.00 0.00 0.00 29.97 30.16 1by1 h ARG 173 CO 0.00 0.55 0.00 0.00 -0.00 0.00 0.00 179.97 180.52 1by1 n GLN 174 N -4.29 0.09 0.15 0.08 10.64 -1.26 -0.88 117.38 121.90 1by1 n GLN 174 Ca 0.02 0.41 0.04 0.00 -1.83 0.00 0.00 57.00 55.63 1by1 n GLN 174 Cb 0.24 -1.69 0.07 0.00 -0.86 0.00 0.00 30.24 27.99 1by1 n GLN 174 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 1by1 h ASP 175 N 0.00 0.00 0.59 2.61 5.19 -1.79 -3.19 116.42 119.83 1by1 h ASP 175 Ca 0.00 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.23 1by1 h ASP 175 Cb 0.21 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 1by1 h ASP 175 CO 0.00 0.46 -0.79 0.40 -3.12 0.00 0.00 179.24 176.18 1by1 h ILE 176 N 0.00 1.49 0.00 0.35 2.04 -1.11 -3.04 117.51 117.24 1by1 h ILE 176 Ca -0.00 -2.49 -0.03 0.00 1.00 0.00 0.00 64.86 63.34 1by1 h ILE 176 Cb 1.31 2.36 -0.00 0.00 -0.74 0.00 0.00 36.82 39.75 1by1 h ILE 176 CO 0.06 0.72 -0.12 1.56 0.00 0.00 0.00 178.15 180.37 1by1 h GLN 177 N 0.09 0.00 0.20 2.37 4.20 -1.51 0.26 115.11 120.72 1by1 h GLN 177 Ca -0.03 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.37 1by1 h GLN 177 Cb 1.38 0.00 0.03 0.00 0.30 0.00 0.00 27.48 29.19 1by1 h GLN 177 CO 0.12 0.12 -1.38 -0.22 -0.67 0.00 0.00 178.83 176.81 1by1 h LYS 178 N 0.00 0.51 0.03 1.46 3.11 -1.62 -1.81 116.57 118.26 1by1 h LYS 178 Ca -0.00 -0.82 -0.00 0.00 -2.81 0.00 0.00 60.65 57.02 1by1 h LYS 178 Cb 0.23 0.29 0.00 0.00 -1.00 0.00 0.00 32.23 31.75 1by1 h LYS 178 CO 0.02 1.38 -0.02 0.77 -2.81 0.00 0.00 179.45 178.79 1by1 h SER 179 N 0.17 -0.04 -0.50 4.20 0.02 -1.32 -2.08 113.55 114.00 1by1 h SER 179 Ca -0.22 -0.47 -0.03 0.00 -0.84 0.00 0.00 61.79 60.24 1by1 h SER 179 Cb 2.07 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 64.59 1by1 h SER 179 CO 0.25 0.46 0.22 0.00 -1.14 0.00 0.00 176.83 176.62 1by1 h MET 180 N -0.55 0.74 0.00 3.45 -0.00 -0.63 -0.77 114.93 117.18 1by1 h MET 180 Ca -0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 59.70 59.57 1by1 h MET 180 Cb 0.50 -0.13 0.00 0.00 -0.00 0.00 0.00 31.60 31.98 1by1 h MET 180 CO 0.01 0.65 0.00 0.00 -0.00 0.00 0.00 176.91 177.57 1by1 h ALA 181 N 1.06 1.00 0.10 -3.00 0.00 -1.37 0.83 119.26 117.89 1by1 h ALA 181 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.74 1by1 h ALA 181 Cb 0.17 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1by1 h ALA 181 CO -0.02 0.00 -1.84 0.00 0.00 0.00 0.00 179.25 177.39 1by1 h ALA 182 N 2.08 0.39 -0.38 0.00 0.00 -0.75 -2.55 119.26 118.04 1by1 h ALA 182 Ca 0.00 -1.35 -0.14 0.00 0.00 0.00 0.00 54.91 53.42 1by1 h ALA 182 Cb 0.32 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1by1 h ALA 182 CO 0.00 1.18 -0.32 0.35 0.00 0.00 0.00 179.25 180.46 1by1 h PHE 183 N -0.14 1.01 -0.07 0.00 3.04 -0.96 -3.18 116.94 116.65 1by1 h PHE 183 Ca -0.41 -0.28 -0.19 0.00 3.98 0.00 0.00 57.97 61.08 1by1 h PHE 183 Cb 1.89 -0.22 0.01 0.00 2.56 0.00 0.00 35.95 40.19 1by1 h PHE 183 CO 0.08 1.07 -0.70 -0.22 -2.02 0.00 0.00 178.31 176.52 1by1 h LYS 184 N 0.72 0.59 -0.26 1.11 3.11 -1.00 -3.09 116.57 117.75 1by1 h LYS 184 Ca 0.07 -0.55 0.08 0.00 -2.81 0.00 0.00 60.65 57.45 1by1 h LYS 184 Cb 0.89 0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 32.24 1by1 h LYS 184 CO 0.08 1.17 0.54 -0.97 -2.81 0.00 0.00 179.45 177.46 1by1 h ASN 185 N 0.21 0.00 0.41 4.20 -1.24 -1.44 0.14 115.58 117.85 1by1 h ASN 185 Ca -0.07 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.92 1by1 h ASN 185 Cb 1.36 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.41 1by1 h ASN 185 CO 0.14 0.00 -0.20 -0.07 -1.29 0.00 0.00 177.43 176.01 1by1 h LEU 186 N 0.00 -0.47 0.06 0.34 3.38 -1.52 -0.23 115.31 116.87 1by1 h LEU 186 Ca 0.12 -0.09 -0.28 0.00 0.09 0.00 0.00 57.88 57.73 1by1 h LEU 186 Cb 1.20 0.12 0.02 0.00 0.09 0.00 0.00 40.66 42.09 1by1 h LEU 186 CO -0.00 -0.18 -1.19 0.77 0.09 0.00 0.00 178.44 177.93 1by1 h SER 187 N -0.76 0.66 -0.68 -0.43 4.64 -1.32 -3.08 113.55 112.58 1by1 h SER 187 Ca -0.06 -0.62 0.03 0.00 -0.47 0.00 0.00 61.79 60.67 1by1 h SER 187 Cb 0.52 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.37 1by1 h SER 187 CO 0.09 1.45 0.45 0.00 -0.87 0.00 0.00 176.83 177.96 1by1 h ALA 188 N 0.47 1.62 -0.29 5.18 0.00 -0.85 -1.82 119.26 123.57 1by1 h ALA 188 Ca -0.15 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.56 1by1 h ALA 188 Cb 1.87 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1by1 h ALA 188 CO 0.21 0.31 -0.46 1.96 0.00 0.00 0.00 179.25 181.27 1by1 h GLN 189 N 0.82 0.75 -0.88 0.00 1.08 -1.06 -2.95 115.11 112.86 1by1 h GLN 189 Ca 0.27 -0.43 0.24 0.00 -1.45 0.00 0.00 58.65 57.29 1by1 h GLN 189 Cb 0.07 0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.48 1by1 h GLN 189 CO -0.08 1.05 0.62 0.00 -0.95 0.00 0.00 178.83 179.48 1by1 h GLN 191 N 0.09 0.19 0.00 0.00 1.08 -1.46 -3.16 115.11 111.85 1by1 h GLN 191 Ca 0.43 -0.19 -0.23 0.00 -1.45 0.00 0.00 58.65 57.22 1by1 h GLN 191 Cb 1.57 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 29.01 1by1 h GLN 191 CO -0.05 0.90 -1.53 0.93 -0.95 0.00 0.00 178.83 178.13 1by1 h GLU 192 N 0.12 0.00 -0.45 1.46 4.39 -0.32 -3.37 114.58 116.41 1by1 h GLU 192 Ca -0.03 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.70 1by1 h GLU 192 Cb 1.40 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.02 1by1 h GLU 192 CO 0.12 0.40 0.24 0.28 -1.16 0.00 0.00 179.01 178.90 1by1 h VAL 193 N 0.00 1.00 -0.38 3.13 2.07 0.16 0.67 116.25 122.90 1by1 h VAL 193 Ca -0.21 -0.17 0.08 0.00 0.82 0.00 0.00 66.70 67.22 1by1 h VAL 193 Cb 1.79 0.47 -0.09 0.00 -1.52 0.00 0.00 31.29 31.94 1by1 h VAL 193 CO 0.06 0.09 -0.27 0.03 0.02 0.00 0.00 177.57 177.51 1by1 h ARG 194 N 0.49 -0.20 0.00 1.57 2.47 -1.70 -1.57 114.38 115.44 1by1 h ARG 194 Ca 0.19 0.01 -0.11 0.00 -1.26 0.00 0.00 59.98 58.81 1by1 h ARG 194 Cb 0.06 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.41 1by1 h ARG 194 CO -0.11 -0.13 -0.60 0.87 0.56 0.00 0.00 179.97 180.56 1by1 h LYS 195 N -0.21 0.00 -0.99 0.04 1.57 -1.71 -3.35 116.57 111.92 1by1 h LYS 195 Ca 0.18 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 59.09 1by1 h LYS 195 Cb 0.49 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.66 1by1 h LYS 195 CO -0.50 0.46 -0.48 -0.09 -0.57 0.00 0.00 179.45 178.28 1by1 h ARG 196 N 0.00 -0.00 0.00 3.15 9.65 0.14 1.49 114.38 128.80 1by1 h ARG 196 Ca -0.02 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1by1 h ARG 196 Cb 1.39 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.97 1by1 h ARG 196 CO 0.06 -0.00 -0.07 1.63 2.80 0.00 0.00 179.97 184.38 1by1 n LYS 197 N -5.38 0.19 0.02 0.20 4.76 -1.22 -2.86 118.16 113.87 1by1 n LYS 197 Ca 0.07 0.14 -0.12 0.00 -2.87 0.00 0.00 58.31 55.53 1by1 n LYS 197 Cb 0.34 -1.71 -0.14 0.00 -1.84 0.00 0.00 35.03 31.69 1by1 n LYS 197 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1by1 h GLU 198 N 0.00 0.09 0.03 1.97 5.08 0.09 -3.00 114.58 118.84 1by1 h GLU 198 Ca 0.00 -0.15 -0.23 0.00 -1.00 0.00 0.00 59.36 57.98 1by1 h GLU 198 Cb 0.67 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 1by1 h GLU 198 CO 0.00 0.81 -1.12 1.25 -1.00 0.00 0.00 179.01 178.95 1by1 h LEU 199 N 0.02 0.10 0.00 1.33 7.12 0.17 -3.36 115.31 120.68 1by1 h LEU 199 Ca -0.24 -0.11 -0.01 0.00 0.13 0.00 0.00 57.88 57.65 1by1 h LEU 199 Cb 1.97 -0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 42.07 1by1 h LEU 199 CO 0.11 1.09 -0.10 1.05 -0.13 0.00 0.00 178.44 180.45 1by1 h GLU 200 N 0.02 0.00 -5.61 1.25 4.11 -1.67 -3.50 114.58 109.17 1by1 h GLU 200 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1by1 h GLU 200 Cb 1.84 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.08 1by1 h GLU 200 CO 0.14 0.58 -1.00 -0.11 0.07 0.00 0.00 179.01 178.70 1by1 n LEU 201 N -4.66 -6.18 0.11 3.06 0.00 -1.13 -4.96 117.00 103.24 1by1 n LEU 201 Ca -0.08 1.12 0.00 0.00 0.00 0.00 0.00 56.01 57.05 1by1 n LEU 201 Cb 0.30 -2.64 0.00 0.00 0.00 0.00 0.00 43.42 41.08 1by1 n LEU 201 CO 0.19 -2.64 0.00 1.67 0.00 0.00 0.00 177.39 176.61 1by1 n GLN 202 N 1.08 0.00 0.07 1.96 -0.06 -1.26 -4.92 117.38 114.24 1by1 n GLN 202 Ca -0.03 0.00 0.11 0.00 -2.00 0.00 0.00 57.00 55.08 1by1 n GLN 202 Cb 0.23 0.00 -0.01 0.00 -4.06 0.00 0.00 30.24 26.40 1by1 n GLN 202 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 1by1 n ILE 203 N -2.93 0.41 -1.73 1.69 -0.00 -1.26 -4.93 119.36 110.61 1by1 n ILE 203 Ca 0.00 -0.46 -0.38 0.00 -0.00 0.00 0.00 62.75 61.91 1by1 n ILE 203 Cb 0.00 -0.16 0.05 0.00 -0.00 0.00 0.00 39.64 39.53 1by1 n ILE 203 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1by1 n LEU 204 N -2.42 5.57 -2.93 1.39 -0.00 -1.26 -5.00 117.00 112.35 1by1 n LEU 204 Ca 0.00 0.92 -0.04 0.00 -0.00 0.00 0.00 56.01 56.89 1by1 n LEU 204 Cb 0.52 -1.56 -0.00 0.00 -0.00 0.00 0.00 43.42 42.38 1by1 n LEU 204 CO 0.41 -0.81 0.08 0.28 -0.00 0.00 0.00 177.39 177.35 1by1 s THR 205 N -1.33 -0.92 0.20 1.47 -1.32 -1.26 -5.08 115.64 107.39 1by1 s THR 205 Ca 0.76 -0.80 -0.03 0.00 -1.21 0.00 0.00 61.69 60.40 1by1 s THR 205 Cb -0.41 -0.07 0.05 0.00 -1.51 0.00 0.00 72.50 70.56 1by1 s THR 205 CO 0.46 -0.07 0.16 -0.62 -2.21 0.00 0.00 174.62 172.34 1by1 n GLU 206 N 3.38 -1.54 -0.06 7.08 1.02 -1.26 -5.02 120.64 124.24 1by1 n GLU 206 Ca 0.16 -0.26 -0.07 0.00 -0.02 0.00 0.00 57.16 56.97 1by1 n GLU 206 Cb 0.56 -0.26 -0.08 0.00 -0.02 0.00 0.00 31.44 31.64 1by1 n GLU 206 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1by1 n ALA 207 N -3.31 1.71 -3.27 0.62 0.00 -1.26 -5.07 120.51 109.93 1by1 n ALA 207 Ca -0.03 -0.69 -0.19 0.00 0.00 0.00 0.00 53.44 52.52 1by1 n ALA 207 Cb 0.09 0.07 0.02 0.00 0.00 0.00 0.00 19.45 19.62 1by1 n ALA 207 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1by1 n ILE 208 N -2.58 -7.24 1.96 0.00 5.41 -1.26 -5.38 119.36 110.27 1by1 n ILE 208 Ca -0.20 0.26 0.16 0.00 1.00 0.00 0.00 62.75 63.96 1by1 n ILE 208 Cb 0.83 -5.25 0.93 0.00 -0.71 0.00 0.00 39.64 35.45 1by1 n ILE 208 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41