#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1im8 n ASP 20 N 0.00 0.00 0.09 4.37 5.75 -1.26 -4.82 116.55 120.68 1im8 n ASP 20 Ca 0.00 -0.74 0.11 0.00 -0.01 0.00 0.00 54.79 54.15 1im8 n ASP 20 Cb 0.00 0.00 0.44 0.00 -1.03 0.00 0.00 41.12 40.53 1im8 n ASP 20 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1im8 n GLU 21 N -0.74 0.14 0.04 0.11 2.13 -1.26 -2.14 120.64 118.93 1im8 n GLU 21 Ca 0.00 0.33 -0.03 0.00 0.66 0.00 0.00 57.16 58.12 1im8 n GLU 21 Cb 0.00 -1.75 -0.02 0.00 0.27 0.00 0.00 31.44 29.95 1im8 n GLU 21 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1im8 h ASN 22 N 0.00 -0.17 -0.99 4.31 -0.26 -1.99 -2.00 115.58 114.48 1im8 h ASN 22 Ca 0.00 0.01 0.23 0.00 -0.56 0.00 0.00 56.30 55.97 1im8 h ASN 22 Cb 0.38 0.05 -0.09 0.00 -1.06 0.00 0.00 38.32 37.60 1im8 h ASN 22 CO 0.00 0.25 0.63 0.58 -1.06 0.00 0.00 177.43 177.83 1im8 h VAL 23 N -0.95 0.62 -0.17 2.81 2.07 -1.91 0.37 116.25 119.07 1im8 h VAL 23 Ca -0.02 -0.17 -0.12 0.00 0.82 0.00 0.00 66.70 67.20 1im8 h VAL 23 Cb 0.16 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 1im8 h VAL 23 CO 0.03 0.09 -0.42 0.00 0.02 0.00 0.00 177.57 177.30 1im8 h ALA 24 N 1.63 0.96 -0.16 1.67 0.00 -1.50 0.11 119.26 121.96 1im8 h ALA 24 Ca 0.56 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1im8 h ALA 24 Cb 1.23 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1im8 h ALA 24 CO -0.29 0.63 -0.29 1.49 0.00 0.00 0.00 179.25 180.78 1im8 h GLU 25 N 0.34 0.48 0.00 0.00 4.22 0.39 -3.32 114.58 116.68 1im8 h GLU 25 Ca 0.03 -0.30 -0.04 0.00 0.08 0.00 0.00 59.36 59.12 1im8 h GLU 25 Cb 0.88 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1im8 h GLU 25 CO 0.07 0.91 -0.20 0.28 -2.18 0.00 0.00 179.01 177.89 1im8 h VAL 26 N 0.11 0.35 -0.24 0.32 2.07 -0.76 -3.43 116.25 114.67 1im8 h VAL 26 Ca 0.01 -1.48 0.02 0.00 0.82 0.00 0.00 66.70 66.07 1im8 h VAL 26 Cb 0.88 2.17 -0.03 0.00 -1.52 0.00 0.00 31.29 32.79 1im8 h VAL 26 CO 0.07 0.20 -0.14 0.33 0.02 0.00 0.00 177.57 178.04 1im8 n PHE 27 N -3.15 -0.10 -0.34 1.57 7.35 0.36 -0.93 117.46 122.22 1im8 n PHE 27 Ca 0.03 0.30 0.06 0.00 -0.76 0.00 0.00 57.45 57.08 1im8 n PHE 27 Cb 0.61 -0.40 0.22 0.00 0.35 0.00 0.00 39.48 40.26 1im8 n PHE 27 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1im8 h PRO 28 N 0.00 0.88 -1.24 -7.13 0.13 -1.86 0.19 132.00 122.97 1im8 h PRO 28 Ca 0.04 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1im8 h PRO 28 Cb 0.10 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.03 1im8 h PRO 28 CO -0.22 0.58 0.00 -3.47 -0.23 0.00 0.00 178.00 174.66 1im8 n ASP 29 N -4.68 1.41 0.00 1.44 4.64 -0.11 -1.82 116.55 117.43 1im8 n ASP 29 Ca 0.18 -1.11 0.00 0.00 -1.38 0.00 0.00 54.79 52.47 1im8 n ASP 29 Cb 0.35 -0.28 0.00 0.00 -1.04 0.00 0.00 41.12 40.15 1im8 n ASP 29 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1im8 n ILE 31 N 0.61 0.00 0.02 5.18 3.06 0.68 -1.50 119.36 127.41 1im8 n ILE 31 Ca 0.00 0.00 -0.01 0.00 -2.50 0.00 0.00 62.75 60.24 1im8 n ILE 31 Cb 0.25 0.00 0.26 0.00 0.54 0.00 0.00 39.64 40.69 1im8 n ILE 31 CO 0.00 0.00 0.00 -0.61 -2.50 0.00 0.00 176.55 173.44 1im8 h GLN 32 N 0.00 0.48 0.00 9.51 4.15 -1.57 0.64 115.11 128.32 1im8 h GLN 32 Ca 0.00 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.29 1im8 h GLN 32 Cb 0.00 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.64 1im8 h GLN 32 CO 0.00 0.60 -0.29 0.54 -1.93 0.00 0.00 178.83 177.75 1im8 n ARG 33 N -4.21 0.13 -0.00 1.69 1.74 -0.56 -4.33 116.66 111.12 1im8 n ARG 33 Ca 0.01 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 1im8 n ARG 33 Cb 0.32 -1.61 -0.00 0.00 -1.02 0.00 0.00 32.46 30.14 1im8 n ARG 33 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1im8 n SER 34 N -1.81 2.37 -4.22 0.55 3.41 -0.98 -4.25 113.62 108.69 1im8 n SER 34 Ca 0.05 -0.26 -0.37 0.00 -0.26 0.00 0.00 58.87 58.03 1im8 n SER 34 Cb 0.38 1.02 -0.13 0.00 -0.26 0.00 0.00 64.21 65.22 1im8 n SER 34 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1im8 s VAL 35 N -1.54 3.47 0.20 -3.33 1.01 0.18 -4.95 120.40 115.43 1im8 s VAL 35 Ca 0.00 -1.36 -0.30 0.00 0.00 0.00 0.00 61.98 60.32 1im8 s VAL 35 Cb 0.00 -3.04 -0.09 0.00 0.00 0.00 0.00 36.38 33.26 1im8 s VAL 35 CO 0.03 -0.24 1.36 -2.16 0.00 0.00 0.00 175.10 174.09 1im8 s PRO 36 N 1.32 4.34 0.00 2.72 0.04 -1.26 -2.39 135.00 139.76 1im8 s PRO 36 Ca -0.01 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.16 1im8 s PRO 36 Cb -0.20 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1im8 s PRO 36 CO 0.00 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.12 1im8 n GLY 37 N 2.56 0.84 0.32 0.56 0.00 -1.26 -4.78 105.19 103.43 1im8 n GLY 37 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.08 1im8 n GLY 37 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1im8 h TYR 38 N 0.00 -0.68 -0.08 1.61 3.20 -1.82 -0.29 116.97 118.90 1im8 h TYR 38 Ca 0.00 0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 1im8 h TYR 38 Cb 0.00 0.41 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1im8 h TYR 38 CO 0.00 -0.36 -0.23 0.66 -1.64 0.00 0.00 178.16 176.59 1im8 h SER 39 N -0.07 0.14 -0.72 -2.11 4.64 -1.94 -1.64 113.55 111.85 1im8 h SER 39 Ca 0.30 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.54 1im8 h SER 39 Cb 0.55 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 1im8 h SER 39 CO -0.75 0.38 0.28 0.78 -0.87 0.00 0.00 176.83 176.65 1im8 h ASN 40 N 0.13 1.01 -0.57 4.97 -0.26 -1.51 0.57 115.58 119.91 1im8 h ASN 40 Ca 0.02 -0.18 -0.07 0.00 -0.56 0.00 0.00 56.30 55.52 1im8 h ASN 40 Cb 0.49 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.47 1im8 h ASN 40 CO 0.03 0.91 0.10 0.40 -1.06 0.00 0.00 177.43 177.82 1im8 h ILE 41 N 1.04 1.25 -0.55 2.81 2.04 -0.55 -0.77 117.51 122.78 1im8 h ILE 41 Ca 0.24 -0.96 -0.07 0.00 1.00 0.00 0.00 64.86 65.07 1im8 h ILE 41 Cb 0.22 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1im8 h ILE 41 CO -0.02 0.35 0.06 0.40 0.00 0.00 0.00 178.15 178.94 1im8 h ILE 42 N 0.84 1.26 -0.28 -0.67 1.08 -0.88 -1.47 117.51 117.39 1im8 h ILE 42 Ca 0.18 -1.03 -0.01 0.00 -0.39 0.00 0.00 64.86 63.61 1im8 h ILE 42 Cb 0.40 0.84 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 1im8 h ILE 42 CO 0.01 0.37 0.15 0.74 -0.69 0.00 0.00 178.15 178.73 1im8 h THR 43 N 0.83 1.13 0.00 -0.27 2.02 -0.63 -2.63 112.91 113.36 1im8 h THR 43 Ca 0.16 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 66.97 1im8 h THR 43 Cb 0.46 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1im8 h THR 43 CO 0.02 0.13 -0.19 0.00 0.37 0.00 0.00 175.52 175.85 1im8 h ALA 44 N 1.03 1.43 -0.77 6.16 0.00 -1.05 -1.70 119.26 124.36 1im8 h ALA 44 Ca 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1im8 h ALA 44 Cb 0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1im8 h ALA 44 CO -0.02 0.23 0.41 0.82 0.00 0.00 0.00 179.25 180.70 1im8 h ILE 45 N 0.00 1.23 0.00 0.00 2.04 -0.89 -0.01 117.51 119.88 1im8 h ILE 45 Ca -0.00 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1im8 h ILE 45 Cb 0.40 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1im8 h ILE 45 CO 0.02 0.26 0.00 0.61 0.00 0.00 0.00 178.15 179.05 1im8 n GLY 46 N -1.06 0.23 0.03 5.37 0.00 -0.64 -0.80 105.19 108.32 1im8 n GLY 46 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1im8 n GLY 46 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1im8 n LEU 48 N 0.91 0.00 0.24 0.99 4.77 -0.02 -2.54 117.00 121.35 1im8 n LEU 48 Ca 0.00 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1im8 n LEU 48 Cb 0.06 0.00 0.62 0.00 -2.33 0.00 0.00 43.42 41.76 1im8 n LEU 48 CO 0.00 0.00 1.07 0.00 -1.33 0.00 0.00 177.39 177.13 1im8 h ALA 49 N 0.00 1.97 0.00 -1.18 0.00 -1.23 0.13 119.26 118.95 1im8 h ALA 49 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1im8 h ALA 49 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1im8 h ALA 49 CO 0.00 0.03 -0.46 1.49 0.00 0.00 0.00 179.25 180.31 1im8 h GLU 50 N 0.05 0.00 0.01 0.00 4.81 -1.61 -1.73 114.58 116.10 1im8 h GLU 50 Ca 0.01 0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 58.90 1im8 h GLU 50 Cb 0.00 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 1im8 h GLU 50 CO -0.00 0.46 -2.14 0.54 -0.73 0.00 0.00 179.01 177.14 1im8 n ARG 51 N -3.50 0.67 -0.05 1.92 1.74 -0.45 -4.70 116.66 112.29 1im8 n ARG 51 Ca 0.00 0.13 -0.01 0.00 -0.77 0.00 0.00 57.85 57.20 1im8 n ARG 51 Cb 0.58 -1.63 -0.14 0.00 -1.02 0.00 0.00 32.46 30.26 1im8 n ARG 51 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1im8 n PHE 52 N -2.94 0.00 -2.35 -1.55 3.01 0.34 -4.95 117.46 109.02 1im8 n PHE 52 Ca -0.28 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.75 1im8 n PHE 52 Cb 1.10 -0.65 -0.03 0.00 -0.01 0.00 0.00 39.48 39.90 1im8 n PHE 52 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1im8 s VAL 53 N -2.79 4.07 0.24 -4.37 1.01 -0.65 -4.86 120.40 113.04 1im8 s VAL 53 Ca -0.08 1.37 0.06 0.00 0.00 0.00 0.00 61.98 63.34 1im8 s VAL 53 Cb 0.08 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1im8 s VAL 53 CO 0.72 -0.06 0.22 0.42 0.00 0.00 0.00 175.10 176.40 1im8 s THR 54 N 2.90 4.60 0.69 3.92 -4.23 -1.26 -4.91 115.64 117.35 1im8 s THR 54 Ca 0.59 -1.28 -0.17 0.00 -1.18 0.00 0.00 61.69 59.65 1im8 s THR 54 Cb -0.26 -3.47 -0.00 0.00 1.34 0.00 0.00 72.50 70.10 1im8 s THR 54 CO 0.21 -0.31 1.01 0.00 -0.54 0.00 0.00 174.62 174.99 1im8 n ALA 55 N -1.11 0.02 -3.61 3.99 0.00 -1.26 -3.39 120.51 115.15 1im8 n ALA 55 Ca -0.08 -0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.02 1im8 n ALA 55 Cb 0.57 -2.14 0.06 0.00 0.00 0.00 0.00 19.45 17.94 1im8 n ALA 55 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1im8 n ASP 56 N -1.57 -2.57 -4.01 0.00 10.43 0.63 -4.97 116.55 114.49 1im8 n ASP 56 Ca 0.14 -0.70 -0.10 0.00 2.57 0.00 0.00 54.79 56.70 1im8 n ASP 56 Cb 0.49 -4.57 -0.06 0.00 1.84 0.00 0.00 41.12 38.82 1im8 n ASP 56 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1im8 s SER 57 N -4.11 -0.04 0.19 -2.24 1.04 -0.92 -5.00 113.70 102.61 1im8 s SER 57 Ca 0.15 -1.00 0.07 0.00 0.48 0.00 0.00 55.95 55.65 1im8 s SER 57 Cb -0.07 0.56 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 1im8 s SER 57 CO 0.77 -1.11 0.07 0.20 0.98 0.00 0.00 173.24 174.15 1im8 s ASN 58 N -3.04 5.09 -0.09 7.02 0.02 -0.20 -2.00 114.94 121.74 1im8 s ASN 58 Ca 0.25 -0.31 0.03 0.00 -1.02 0.00 0.00 52.86 51.81 1im8 s ASN 58 Cb 0.00 -1.19 0.01 0.00 0.02 0.00 0.00 41.25 40.09 1im8 s ASN 58 CO 0.10 0.06 -0.19 -0.69 0.02 0.00 0.00 177.10 176.40 1im8 s VAL 59 N -1.83 1.71 -0.01 1.60 1.01 -0.17 -1.51 120.40 121.21 1im8 s VAL 59 Ca 0.29 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.52 1im8 s VAL 59 Cb -0.09 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 1im8 s VAL 59 CO 0.21 0.48 -0.15 -0.31 0.00 0.00 0.00 175.10 175.33 1im8 s TYR 60 N 0.55 2.65 -0.35 5.22 1.51 -1.26 -0.64 117.35 125.04 1im8 s TYR 60 Ca -0.15 -0.19 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1im8 s TYR 60 Cb -0.17 -1.56 0.11 0.00 -0.11 0.00 0.00 41.96 40.22 1im8 s TYR 60 CO 0.05 0.22 0.11 0.34 -1.11 0.00 0.00 175.55 175.16 1im8 s ASP 61 N -1.04 4.25 -0.34 2.29 -1.08 -0.03 -0.92 116.67 119.80 1im8 s ASP 61 Ca 0.13 -2.00 -0.24 0.00 -0.52 0.00 0.00 52.55 49.92 1im8 s ASP 61 Cb -0.11 -1.18 0.01 0.00 -1.46 0.00 0.00 42.92 40.18 1im8 s ASP 61 CO 0.03 -0.38 0.81 -0.76 0.52 0.00 0.00 175.17 175.40 1im8 s LEU 62 N 1.13 4.09 -0.06 -1.34 1.43 0.44 -1.33 118.68 123.03 1im8 s LEU 62 Ca 0.12 0.53 -0.00 0.00 -1.03 0.00 0.00 54.13 53.74 1im8 s LEU 62 Cb -0.19 -3.09 -0.00 0.00 0.03 0.00 0.00 46.19 42.93 1im8 s LEU 62 CO -0.15 -0.71 0.06 0.61 0.23 0.00 0.00 176.35 176.39 1im8 n GLY 63 N 4.36 0.71 0.15 -3.19 0.00 0.18 -4.18 105.19 103.22 1im8 n GLY 63 Ca 0.04 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 45.97 1im8 n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1im8 n SER 65 N -2.57 0.00 -0.73 0.00 7.64 -1.26 -0.69 113.62 116.01 1im8 n SER 65 Ca 0.04 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.04 1im8 n SER 65 Cb 0.43 0.00 0.33 0.00 -1.01 0.00 0.00 64.21 63.96 1im8 n SER 65 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1im8 n ARG 66 N 6.63 1.98 -2.50 1.43 5.12 -1.26 -4.32 116.66 123.75 1im8 n ARG 66 Ca 0.00 -1.46 -0.04 0.00 -1.93 0.00 0.00 57.85 54.42 1im8 n ARG 66 Cb 0.00 -1.45 0.01 0.00 -1.16 0.00 0.00 32.46 29.85 1im8 n ARG 66 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1im8 n GLY 67 N 1.26 0.59 0.15 -0.13 0.00 0.14 -4.60 105.19 102.60 1im8 n GLY 67 Ca 0.17 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.44 1im8 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1im8 h ALA 68 N 0.16 0.18 -0.47 4.61 0.00 -1.94 -2.40 119.26 119.40 1im8 h ALA 68 Ca -0.08 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.23 1im8 h ALA 68 Cb 1.06 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1im8 h ALA 68 CO 0.09 0.28 -0.21 0.00 0.00 0.00 0.00 179.25 179.41 1im8 h ALA 69 N 0.47 0.74 -0.12 0.00 0.00 -1.93 -1.06 119.26 117.36 1im8 h ALA 69 Ca -0.02 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.53 1im8 h ALA 69 Cb 1.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1im8 h ALA 69 CO 0.08 0.67 -0.06 1.15 0.00 0.00 0.00 179.25 181.09 1im8 h THR 70 N 0.83 0.81 -0.29 0.00 2.02 -1.89 0.22 112.91 114.61 1im8 h THR 70 Ca 0.11 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.19 1im8 h THR 70 Cb 0.77 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1im8 h THR 70 CO 0.06 0.00 -0.25 -0.07 0.37 0.00 0.00 175.52 175.64 1im8 h LEU 71 N -0.05 0.56 -0.55 2.58 3.38 -1.41 0.74 115.31 120.56 1im8 h LEU 71 Ca 0.07 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1im8 h LEU 71 Cb 0.15 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1im8 h LEU 71 CO -0.15 0.80 -0.04 -1.28 0.09 0.00 0.00 178.44 177.86 1im8 h SER 72 N 0.49 0.98 0.28 -0.43 0.87 -0.81 -1.76 113.55 113.18 1im8 h SER 72 Ca 0.07 -0.32 -0.01 0.00 -1.23 0.00 0.00 61.79 60.29 1im8 h SER 72 Cb 0.69 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1im8 h SER 72 CO 0.05 1.07 -0.13 0.00 -0.53 0.00 0.00 176.83 177.29 1im8 h ALA 73 N 0.95 -0.37 -0.79 6.23 0.00 -0.67 -3.26 119.26 121.34 1im8 h ALA 73 Ca 0.15 -0.16 0.16 0.00 0.00 0.00 0.00 54.91 55.07 1im8 h ALA 73 Cb 0.59 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.42 1im8 h ALA 73 CO 0.04 -0.60 0.32 -0.09 0.00 0.00 0.00 179.25 178.92 1im8 h ARG 74 N -0.60 0.42 0.00 0.00 2.43 -0.79 -0.64 114.38 115.20 1im8 h ARG 74 Ca -0.04 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1im8 h ARG 74 Cb 0.43 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1im8 h ARG 74 CO 0.06 0.28 0.00 0.54 -1.51 0.00 0.00 179.97 179.34 1im8 n ARG 75 N -5.02 0.10 -0.04 0.20 1.74 -0.67 -3.11 116.66 109.87 1im8 n ARG 75 Ca 0.16 0.40 0.02 0.00 -0.77 0.00 0.00 57.85 57.66 1im8 n ARG 75 Cb 0.47 -1.72 0.04 0.00 -1.02 0.00 0.00 32.46 30.24 1im8 n ARG 75 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1im8 n ASN 76 N -1.91 1.87 -4.60 0.55 3.02 -0.27 -4.97 115.26 108.96 1im8 n ASN 76 Ca 0.02 -1.58 -0.39 0.00 -0.03 0.00 0.00 54.58 52.60 1im8 n ASN 76 Cb 0.16 -0.05 -0.09 0.00 -0.61 0.00 0.00 39.78 39.19 1im8 n ASN 76 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1im8 s ILE 77 N -0.68 5.20 -0.60 2.41 1.01 -1.08 -3.94 121.20 123.52 1im8 s ILE 77 Ca 0.07 0.45 0.05 0.00 0.00 0.00 0.00 60.65 61.22 1im8 s ILE 77 Cb 0.04 -3.68 0.34 0.00 0.01 0.00 0.00 42.46 39.17 1im8 s ILE 77 CO 0.06 0.15 1.02 -3.20 0.00 0.00 0.00 174.94 172.97 1im8 n ASN 78 N 5.29 4.71 -4.09 3.58 4.05 -1.26 -5.02 115.26 122.51 1im8 n ASN 78 Ca -0.09 -3.69 -0.16 0.00 0.45 0.00 0.00 54.58 51.09 1im8 n ASN 78 Cb 0.51 -0.60 -0.12 0.00 1.23 0.00 0.00 39.78 40.80 1im8 n ASN 78 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 1im8 s GLN 79 N -3.54 0.66 0.46 1.20 -1.52 -1.26 -5.04 119.66 110.61 1im8 s GLN 79 Ca 0.48 -0.75 -0.20 0.00 -1.95 0.00 0.00 55.36 52.94 1im8 s GLN 79 Cb 0.28 -0.55 -0.10 0.00 -0.22 0.00 0.00 33.01 32.42 1im8 s GLN 79 CO -0.14 0.12 0.96 -1.25 -0.25 0.00 0.00 175.29 174.73 1im8 s PRO 80 N -1.41 4.14 -1.15 2.91 0.04 -1.26 -4.30 135.00 133.96 1im8 s PRO 80 Ca -0.05 1.07 -0.10 0.00 0.04 0.00 0.00 61.00 61.96 1im8 s PRO 80 Cb -0.09 -2.17 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 1im8 s PRO 80 CO 0.01 -0.11 0.82 0.09 0.04 0.00 0.00 177.00 177.85 1im8 n ASN 81 N -0.94 -4.67 -4.17 6.66 3.02 -1.26 -1.34 115.26 112.56 1im8 n ASN 81 Ca 0.07 -0.85 -0.30 0.00 -0.03 0.00 0.00 54.58 53.46 1im8 n ASN 81 Cb 0.54 -4.22 -0.17 0.00 -0.61 0.00 0.00 39.78 35.32 1im8 n ASN 81 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1im8 s VAL 82 N -3.48 1.86 -0.03 2.41 1.01 -1.26 -0.27 120.40 120.64 1im8 s VAL 82 Ca 0.34 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.48 1im8 s VAL 82 Cb -0.09 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 1im8 s VAL 82 CO 0.80 0.52 -0.19 -0.75 0.00 0.00 0.00 175.10 175.47 1im8 s LYS 83 N 0.46 2.31 -0.09 2.72 2.20 -0.85 -4.13 119.74 122.35 1im8 s LYS 83 Ca -0.17 -0.81 0.02 0.00 -0.36 0.00 0.00 55.97 54.65 1im8 s LYS 83 Cb -0.17 -2.22 -0.02 0.00 -1.51 0.00 0.00 37.83 33.90 1im8 s LYS 83 CO 0.07 0.59 -0.14 0.42 -0.36 0.00 0.00 175.35 175.93 1im8 s ILE 84 N -0.69 3.02 -0.13 5.43 1.01 -0.75 -0.99 121.20 128.09 1im8 s ILE 84 Ca 0.11 -0.71 0.03 0.00 0.00 0.00 0.00 60.65 60.08 1im8 s ILE 84 Cb -0.10 -2.22 0.01 0.00 0.01 0.00 0.00 42.46 40.16 1im8 s ILE 84 CO 0.00 0.56 -0.21 -0.63 0.00 0.00 0.00 174.94 174.66 1im8 s ILE 85 N -0.18 1.94 0.00 2.92 1.01 0.19 0.50 121.20 127.59 1im8 s ILE 85 Ca -0.00 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.79 1im8 s ILE 85 Cb -0.13 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 1im8 s ILE 85 CO 0.03 0.53 -0.18 -0.83 0.00 0.00 0.00 174.94 174.49 1im8 s GLY 86 N 0.77 1.52 -0.03 6.18 0.00 0.29 -0.85 107.32 115.21 1im8 s GLY 86 Ca -0.09 -1.11 0.02 0.00 0.00 0.00 0.00 44.72 43.55 1im8 s GLY 86 CO -0.00 -0.95 -0.09 -0.42 0.00 0.00 0.00 173.10 171.64 1im8 s ILE 87 N -0.81 0.76 -0.15 0.90 1.01 -0.44 -0.01 121.20 122.45 1im8 s ILE 87 Ca 0.13 -0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.32 1im8 s ILE 87 Cb -0.10 -0.68 0.05 0.00 0.01 0.00 0.00 42.46 41.73 1im8 s ILE 87 CO 0.03 0.24 0.38 -0.62 0.00 0.00 0.00 174.94 174.97 1im8 s ASP 88 N 0.21 -0.43 0.00 3.58 -1.08 -1.10 0.50 116.67 118.34 1im8 s ASP 88 Ca -0.03 0.80 0.08 0.00 -0.52 0.00 0.00 52.55 52.87 1im8 s ASP 88 Cb -0.09 0.75 0.34 0.00 -1.46 0.00 0.00 42.92 42.47 1im8 s ASP 88 CO 0.00 -0.16 1.24 -0.46 0.52 0.00 0.00 175.17 176.32 1im8 n ASN 89 N 3.45 0.66 -4.40 -0.34 2.04 -0.78 -1.60 115.26 114.28 1im8 n ASN 89 Ca -0.18 -1.87 -0.37 0.00 -0.44 0.00 0.00 54.58 51.72 1im8 n ASN 89 Cb 0.56 -0.07 -0.13 0.00 -2.53 0.00 0.00 39.78 37.61 1im8 n ASN 89 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 1im8 s SER 90 N -1.15 5.09 0.16 0.53 0.15 -1.26 -4.77 113.70 112.45 1im8 s SER 90 Ca 0.14 -0.39 -0.15 0.00 0.70 0.00 0.00 55.95 56.25 1im8 s SER 90 Cb 0.07 -1.90 0.04 0.00 -1.71 0.00 0.00 66.02 62.52 1im8 s SER 90 CO 0.10 -0.09 1.79 1.56 1.20 0.00 0.00 173.24 177.80 1im8 h GLN 91 N 8.24 0.66 -0.34 5.44 4.20 -1.91 -0.78 115.11 130.62 1im8 h GLN 91 Ca -0.36 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.28 1im8 h GLN 91 Cb 1.16 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.80 1im8 h GLN 91 CO 0.59 0.50 0.00 -0.35 -0.67 0.00 0.00 178.83 178.90 1im8 n PRO 92 N -4.69 0.00 0.00 1.46 -0.04 -1.26 -0.02 135.00 130.45 1im8 n PRO 92 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1im8 n PRO 92 Cb 0.06 -0.96 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1im8 n PRO 92 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1im8 n VAL 94 N 0.48 0.00 -0.02 0.52 0.31 -0.30 -1.58 118.33 117.74 1im8 n VAL 94 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 1im8 n VAL 94 Cb 0.00 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.85 1im8 n VAL 94 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1im8 h GLU 95 N 0.00 0.11 -0.08 5.55 5.08 -0.70 0.10 114.58 124.63 1im8 h GLU 95 Ca 0.00 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1im8 h GLU 95 Cb 0.00 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 1im8 h GLU 95 CO 0.00 0.38 0.03 0.00 -1.00 0.00 0.00 179.01 178.42 1im8 h ARG 96 N -0.18 0.13 -0.20 2.33 3.08 -1.53 -1.90 114.38 116.11 1im8 h ARG 96 Ca 0.02 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.09 1im8 h ARG 96 Cb 0.34 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.30 1im8 h ARG 96 CO 0.00 0.29 -0.23 0.00 -1.07 0.00 0.00 179.97 178.96 1im8 h ARG 98 N -0.25 0.23 -0.26 0.00 2.43 -0.74 -0.29 114.38 115.50 1im8 h ARG 98 Ca 0.12 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1im8 h ARG 98 Cb 0.44 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1im8 h ARG 98 CO -0.35 0.15 0.15 0.37 -1.51 0.00 0.00 179.97 178.79 1im8 h GLN 99 N 0.24 0.30 -0.58 0.20 4.15 -0.64 -1.55 115.11 117.24 1im8 h GLN 99 Ca 0.19 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.62 1im8 h GLN 99 Cb 0.21 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.79 1im8 h GLN 99 CO -0.23 0.20 0.33 1.25 -1.93 0.00 0.00 178.83 178.46 1im8 h HIS 100 N 0.31 0.62 -0.16 3.99 2.76 0.24 -2.25 115.15 120.66 1im8 h HIS 100 Ca 0.10 0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 58.15 1im8 h HIS 100 Cb -0.01 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 28.75 1im8 h HIS 100 CO -0.08 0.34 -0.50 0.82 -1.30 0.00 0.00 177.93 177.21 1im8 h ILE 101 N 0.65 1.33 -0.04 6.26 2.04 -0.92 -2.88 117.51 123.94 1im8 h ILE 101 Ca 0.24 -1.73 -0.01 0.00 1.00 0.00 0.00 64.86 64.36 1im8 h ILE 101 Cb 0.07 1.75 -0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1im8 h ILE 101 CO -0.12 0.53 -0.01 0.00 0.00 0.00 0.00 178.15 178.54 1im8 h ALA 102 N 1.14 1.90 0.00 1.87 0.00 -0.72 -2.41 119.26 121.04 1im8 h ALA 102 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1im8 h ALA 102 Cb 0.99 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1im8 h ALA 102 CO 0.09 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.41 1im8 n ALA 103 N -2.53 1.40 -2.34 0.00 0.00 -0.96 -4.69 120.51 111.41 1im8 n ALA 103 Ca -0.02 0.04 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 1im8 n ALA 103 Cb 0.12 -1.24 -0.16 0.00 0.00 0.00 0.00 19.45 18.18 1im8 n ALA 103 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1im8 s TYR 104 N -3.18 2.23 -0.02 0.00 1.51 -0.91 -5.12 117.35 111.85 1im8 s TYR 104 Ca 0.03 -0.42 -0.14 0.00 -1.01 0.00 0.00 57.07 55.53 1im8 s TYR 104 Cb 0.07 -1.43 -0.05 0.00 -0.11 0.00 0.00 41.96 40.43 1im8 s TYR 104 CO 0.23 -0.03 0.37 -1.58 -1.11 0.00 0.00 175.55 173.42 1im8 s HIS 105 N -0.59 3.70 0.00 2.71 2.46 -1.26 -4.99 115.29 117.32 1im8 s HIS 105 Ca 0.10 0.92 -0.29 0.00 0.47 0.00 0.00 55.06 56.25 1im8 s HIS 105 Cb -0.10 -2.24 0.10 0.00 -0.13 0.00 0.00 32.58 30.22 1im8 s HIS 105 CO -0.01 0.65 0.90 -1.54 -2.47 0.00 0.00 174.74 172.27 1im8 s SER 106 N -1.03 -0.34 0.02 9.88 1.04 -1.26 -5.03 113.70 116.98 1im8 s SER 106 Ca 0.22 -0.03 0.27 0.00 0.48 0.00 0.00 55.95 56.89 1im8 s SER 106 Cb -0.16 0.38 0.87 0.00 0.10 0.00 0.00 66.02 67.21 1im8 s SER 106 CO 0.12 -0.63 1.68 -0.62 0.98 0.00 0.00 173.24 174.77 1im8 n GLU 107 N -0.26 0.04 -3.08 4.02 1.02 -1.26 -4.78 120.64 116.35 1im8 n GLU 107 Ca -0.08 0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.67 1im8 n GLU 107 Cb 0.62 -1.53 -0.06 0.00 -0.02 0.00 0.00 31.44 30.44 1im8 n GLU 107 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1im8 s ILE 108 N -3.02 4.96 0.50 -3.67 1.01 -1.26 -5.03 121.20 114.69 1im8 s ILE 108 Ca 0.12 1.19 -0.21 0.00 0.00 0.00 0.00 60.65 61.75 1im8 s ILE 108 Cb 0.18 -3.96 -0.07 0.00 0.01 0.00 0.00 42.46 38.62 1im8 s ILE 108 CO 0.61 0.01 1.11 -2.16 0.00 0.00 0.00 174.94 174.51 1im8 s PRO 109 N 2.55 3.60 -0.01 2.79 0.04 -1.26 -4.94 135.00 137.77 1im8 s PRO 109 Ca 0.27 1.58 0.03 0.00 0.04 0.00 0.00 61.00 62.93 1im8 s PRO 109 Cb -0.15 -2.15 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 1im8 s PRO 109 CO 0.08 -0.64 -0.10 0.08 0.04 0.00 0.00 177.00 176.46 1im8 s VAL 110 N -1.76 0.82 -0.10 -0.36 1.01 -1.26 -1.82 120.40 116.93 1im8 s VAL 110 Ca 0.69 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 62.24 1im8 s VAL 110 Cb -0.23 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.48 1im8 s VAL 110 CO 0.27 0.24 -0.09 -0.70 0.00 0.00 0.00 175.10 174.81 1im8 s GLU 111 N -0.16 1.58 -0.20 2.72 2.12 0.18 -4.95 118.70 119.99 1im8 s GLU 111 Ca 0.03 -0.31 -0.04 0.00 0.36 0.00 0.00 54.97 55.00 1im8 s GLU 111 Cb -0.05 -1.51 -0.02 0.00 0.26 0.00 0.00 34.13 32.81 1im8 s GLU 111 CO -0.00 -0.16 -0.02 0.42 -0.54 0.00 0.00 175.26 174.95 1im8 s ILE 112 N 1.33 3.72 -0.04 -3.70 1.01 -1.26 -0.54 121.20 121.71 1im8 s ILE 112 Ca -0.02 -0.39 0.06 0.00 0.00 0.00 0.00 60.65 60.30 1im8 s ILE 112 Cb -0.14 -2.68 -0.02 0.00 0.01 0.00 0.00 42.46 39.64 1im8 s ILE 112 CO -0.04 0.43 -0.22 -0.76 0.00 0.00 0.00 174.94 174.35 1im8 s LEU 113 N 1.09 2.28 -0.40 2.97 1.02 0.98 -4.93 118.68 121.69 1im8 s LEU 113 Ca 0.02 -0.39 -0.23 0.00 0.02 0.00 0.00 54.13 53.55 1im8 s LEU 113 Cb -0.14 -1.42 0.02 0.00 0.02 0.00 0.00 46.19 44.66 1im8 s LEU 113 CO 0.01 0.30 0.76 0.00 0.02 0.00 0.00 176.35 177.44 1im8 s ASN 115 N 1.96 -0.20 -0.05 0.00 3.84 -0.63 -4.94 114.94 114.92 1im8 s ASN 115 Ca 0.29 -0.24 -0.27 0.00 0.21 0.00 0.00 52.86 52.86 1im8 s ASN 115 Cb -0.13 0.39 -0.03 0.00 -0.55 0.00 0.00 41.25 40.93 1im8 s ASN 115 CO 0.19 -0.70 0.86 -0.62 -2.79 0.00 0.00 177.10 174.04 1im8 s ASP 116 N -2.79 7.17 0.54 -4.21 3.68 -1.26 -1.86 116.67 117.94 1im8 s ASP 116 Ca 0.11 1.41 0.24 0.00 2.13 0.00 0.00 52.55 56.45 1im8 s ASP 116 Cb -0.00 -2.49 1.43 0.00 -1.45 0.00 0.00 42.92 40.40 1im8 s ASP 116 CO -0.02 -0.23 2.04 0.40 0.13 0.00 0.00 175.17 177.49 1im8 h ILE 117 N 4.84 0.71 0.00 4.11 2.04 -1.95 0.81 117.51 128.08 1im8 h ILE 117 Ca -0.39 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1im8 h ILE 117 Cb 1.20 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 1im8 h ILE 117 CO 0.77 0.00 0.00 0.54 0.00 0.00 0.00 178.15 179.46 1im8 n ARG 118 N -4.26 0.11 -0.15 2.37 1.74 -1.26 -3.68 116.66 111.53 1im8 n ARG 118 Ca 0.06 0.22 0.05 0.00 -0.77 0.00 0.00 57.85 57.41 1im8 n ARG 118 Cb 0.46 -1.67 0.12 0.00 -1.02 0.00 0.00 32.46 30.36 1im8 n ARG 118 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1im8 n HIS 119 N -1.87 0.36 -3.82 -1.55 8.25 0.27 -5.00 115.22 111.87 1im8 n HIS 119 Ca 0.05 -0.56 -0.23 0.00 -0.26 0.00 0.00 57.72 56.72 1im8 n HIS 119 Cb 0.29 -0.07 -0.02 0.00 1.12 0.00 0.00 29.99 31.31 1im8 n HIS 119 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1im8 s VAL 120 N -1.28 5.23 -0.15 1.59 -7.23 -1.21 -4.97 120.40 112.37 1im8 s VAL 120 Ca 0.19 -0.80 -0.09 0.00 -1.81 0.00 0.00 61.98 59.47 1im8 s VAL 120 Cb 0.12 -3.84 -0.05 0.00 0.56 0.00 0.00 36.38 33.17 1im8 s VAL 120 CO 0.10 -0.35 0.16 -0.70 -0.31 0.00 0.00 175.10 174.00 1im8 s GLU 121 N -3.94 3.83 -0.25 4.82 2.12 -1.26 -5.06 118.70 118.95 1im8 s GLU 121 Ca 0.36 -0.13 -0.05 0.00 0.36 0.00 0.00 54.97 55.51 1im8 s GLU 121 Cb -0.09 -3.30 -0.00 0.00 0.26 0.00 0.00 34.13 30.99 1im8 s GLU 121 CO 0.30 0.54 0.02 0.42 -0.54 0.00 0.00 175.26 176.00 1im8 s ILE 122 N -0.36 3.71 0.02 -3.70 1.01 -1.26 -5.09 121.20 115.53 1im8 s ILE 122 Ca 0.13 -0.53 -0.00 0.00 0.00 0.00 0.00 60.65 60.25 1im8 s ILE 122 Cb -0.12 -2.78 -0.02 0.00 0.01 0.00 0.00 42.46 39.55 1im8 s ILE 122 CO 0.02 0.28 -0.03 -1.59 0.00 0.00 0.00 174.94 173.63 1im8 s LYS 123 N 1.50 0.32 -1.52 2.79 -2.85 -1.26 -4.05 119.74 114.66 1im8 s LYS 123 Ca 0.04 -0.61 -0.07 0.00 -1.00 0.00 0.00 55.97 54.33 1im8 s LYS 123 Cb -0.15 0.11 0.06 0.00 -2.06 0.00 0.00 37.83 35.79 1im8 s LYS 123 CO -0.00 -0.05 0.54 -1.71 0.10 0.00 0.00 175.35 174.22 1im8 n ASN 124 N 1.58 -1.41 -4.83 0.03 4.05 -1.16 -4.60 115.26 108.91 1im8 n ASN 124 Ca -0.24 -1.02 -0.36 0.00 0.45 0.00 0.00 54.58 53.41 1im8 n ASN 124 Cb 0.55 -2.89 -0.07 0.00 1.23 0.00 0.00 39.78 38.61 1im8 n ASN 124 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1im8 s ALA 125 N -3.73 3.80 -1.35 5.20 0.00 -0.95 -1.03 121.76 123.70 1im8 s ALA 125 Ca 0.28 -0.66 0.19 0.00 0.00 0.00 0.00 51.96 51.77 1im8 s ALA 125 Cb -0.15 -2.00 0.70 0.00 0.00 0.00 0.00 23.12 21.67 1im8 s ALA 125 CO 0.91 0.50 1.60 -1.13 0.00 0.00 0.00 175.76 177.64 1im8 n SER 126 N 2.39 4.53 -3.64 0.00 3.41 -0.57 -0.73 113.62 119.01 1im8 n SER 126 Ca -0.19 -2.34 -0.02 0.00 -0.26 0.00 0.00 58.87 56.06 1im8 n SER 126 Cb 0.54 -0.56 -0.07 0.00 -0.26 0.00 0.00 64.21 63.87 1im8 n SER 126 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1im8 s VAL 128 N -1.66 0.00 -0.17 -3.33 1.01 0.14 -1.86 120.40 114.52 1im8 s VAL 128 Ca 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.46 1im8 s VAL 128 Cb 0.31 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1im8 s VAL 128 CO 0.26 0.00 -0.09 -0.63 0.00 0.00 0.00 175.10 174.65 1im8 s ILE 129 N 1.03 3.25 -0.56 2.22 1.01 -0.10 -0.28 121.20 127.76 1im8 s ILE 129 Ca -0.06 -0.57 0.04 0.00 0.00 0.00 0.00 60.65 60.07 1im8 s ILE 129 Cb -0.04 -2.42 0.16 0.00 0.01 0.00 0.00 42.46 40.18 1im8 s ILE 129 CO -0.13 0.48 0.40 -0.76 0.00 0.00 0.00 174.94 174.93 1im8 s LEU 130 N 0.86 3.37 -0.48 2.97 1.43 0.47 -0.42 118.68 126.89 1im8 s LEU 130 Ca -0.02 -3.39 -0.17 0.00 -1.03 0.00 0.00 54.13 49.52 1im8 s LEU 130 Cb -0.15 -1.15 0.06 0.00 0.03 0.00 0.00 46.19 44.98 1im8 s LEU 130 CO 0.01 -0.14 0.49 0.21 0.23 0.00 0.00 176.35 177.14 1im8 s ASN 131 N -0.65 6.18 -1.43 2.29 2.47 -1.26 -1.00 114.94 121.54 1im8 s ASN 131 Ca 0.26 -1.09 -0.10 0.00 0.42 0.00 0.00 52.86 52.35 1im8 s ASN 131 Cb -0.05 -2.23 0.07 0.00 -1.45 0.00 0.00 41.25 37.58 1im8 s ASN 131 CO -0.15 -0.73 0.68 0.49 -3.72 0.00 0.00 177.10 173.67 1im8 n PHE 132 N 5.62 -1.99 -0.02 0.43 3.01 0.11 -4.83 117.46 119.79 1im8 n PHE 132 Ca -0.10 0.63 -0.02 0.00 1.01 0.00 0.00 57.45 58.97 1im8 n PHE 132 Cb 0.45 -3.58 -0.01 0.00 -0.01 0.00 0.00 39.48 36.32 1im8 n PHE 132 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1im8 n THR 133 N -4.30 0.18 -0.24 4.37 -1.04 -1.26 -4.66 114.28 107.32 1im8 n THR 133 Ca -0.01 -0.06 0.27 0.00 -2.04 0.00 0.00 64.05 62.20 1im8 n THR 133 Cb 0.55 -0.79 0.65 0.00 -1.82 0.00 0.00 70.33 68.92 1im8 n THR 133 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1im8 h LEU 134 N -0.02 0.16 -0.49 -4.42 5.85 -1.87 0.87 115.31 115.39 1im8 h LEU 134 Ca -0.07 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1im8 h LEU 134 Cb 1.10 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1im8 h LEU 134 CO -0.02 0.05 0.00 0.00 -0.34 0.00 0.00 178.44 178.13 1im8 n GLN 135 N -4.37 0.10 0.00 1.25 10.64 -1.26 -2.10 117.38 121.65 1im8 n GLN 135 Ca 0.21 0.40 0.12 0.00 -1.83 0.00 0.00 57.00 55.90 1im8 n GLN 135 Cb 0.94 -1.72 0.18 0.00 -0.86 0.00 0.00 30.24 28.78 1im8 n GLN 135 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1im8 n PHE 136 N -1.92 0.00 -3.68 2.61 3.01 0.30 -4.46 117.46 113.32 1im8 n PHE 136 Ca 0.02 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.16 1im8 n PHE 136 Cb 0.16 -0.02 -0.05 0.00 -0.01 0.00 0.00 39.48 39.56 1im8 n PHE 136 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1im8 s LEU 137 N -2.25 4.27 0.32 4.37 1.02 -0.89 -5.04 118.68 120.49 1im8 s LEU 137 Ca 0.26 0.58 -0.29 0.00 0.02 0.00 0.00 54.13 54.70 1im8 s LEU 137 Cb 0.19 -3.28 -0.12 0.00 0.02 0.00 0.00 46.19 43.00 1im8 s LEU 137 CO 0.44 0.06 1.38 -0.81 0.02 0.00 0.00 176.35 177.44 1im8 n PRO 138 N 0.13 2.26 -0.32 1.29 -0.04 -1.26 -4.84 135.00 132.23 1im8 n PRO 138 Ca -0.03 0.80 0.33 0.00 -0.04 0.00 0.00 63.50 64.56 1im8 n PRO 138 Cb 0.52 -2.44 0.71 0.00 -0.04 0.00 0.00 33.50 32.24 1im8 n PRO 138 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1im8 h PRO 139 N 3.22 0.07 0.00 0.54 0.13 -1.92 -1.80 132.00 132.23 1im8 h PRO 139 Ca -0.47 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1im8 h PRO 139 Cb 1.27 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1im8 h PRO 139 CO 0.67 0.04 0.00 1.05 -0.23 0.00 0.00 178.00 179.54 1im8 h GLU 140 N 0.07 0.00 0.00 0.86 4.11 -2.02 -3.08 114.58 114.52 1im8 h GLU 140 Ca 0.57 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.00 1im8 h GLU 140 Cb 2.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.38 1im8 h GLU 140 CO -0.06 0.00 -1.41 -0.25 0.07 0.00 0.00 179.01 177.35 1im8 n ASP 141 N -2.85 0.69 -0.18 3.06 10.43 -0.68 -4.55 116.55 122.48 1im8 n ASP 141 Ca 0.00 -0.46 -0.02 0.00 2.57 0.00 0.00 54.79 56.88 1im8 n ASP 141 Cb 0.22 1.46 0.08 0.00 1.84 0.00 0.00 41.12 44.73 1im8 n ASP 141 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 1im8 h ARG 142 N 0.00 0.38 -0.49 -1.24 3.08 -1.56 0.90 114.38 115.45 1im8 h ARG 142 Ca 0.00 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 59.92 1im8 h ARG 142 Cb 0.68 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 1im8 h ARG 142 CO 0.00 0.25 -0.11 0.82 -1.07 0.00 0.00 179.97 179.86 1im8 h ILE 143 N 0.39 1.27 -0.66 2.04 2.04 -1.80 -1.03 117.51 119.75 1im8 h ILE 143 Ca 0.27 -1.25 0.08 0.00 1.00 0.00 0.00 64.86 64.96 1im8 h ILE 143 Cb 0.30 1.06 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 1im8 h ILE 143 CO -0.27 0.43 0.33 0.00 0.00 0.00 0.00 178.15 178.65 1im8 h ALA 144 N 0.89 0.90 -0.25 1.87 0.00 -1.58 -0.85 119.26 120.24 1im8 h ALA 144 Ca 0.13 0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 1im8 h ALA 144 Cb 0.67 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1im8 h ALA 144 CO 0.05 -0.05 -0.43 1.25 0.00 0.00 0.00 179.25 180.07 1im8 h LEU 145 N 0.58 0.66 -0.91 0.00 5.85 -0.49 -1.61 115.31 119.40 1im8 h LEU 145 Ca 0.32 -0.30 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 1im8 h LEU 145 Cb 0.30 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1im8 h LEU 145 CO -0.24 1.00 -0.48 -0.07 -0.34 0.00 0.00 178.44 178.32 1im8 h LEU 146 N 0.50 0.17 -0.30 2.25 3.38 -0.69 -2.09 115.31 118.54 1im8 h LEU 146 Ca 0.04 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1im8 h LEU 146 Cb 0.95 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1im8 h LEU 146 CO 0.09 0.63 -0.24 0.74 0.09 0.00 0.00 178.44 179.74 1im8 h THR 147 N 0.13 1.30 -0.62 0.22 2.02 -1.06 0.17 112.91 115.06 1im8 h THR 147 Ca 0.01 -1.40 0.04 0.00 0.77 0.00 0.00 66.41 65.83 1im8 h THR 147 Cb 0.89 1.53 -0.04 0.00 -1.74 0.00 0.00 68.15 68.78 1im8 h THR 147 CO 0.07 0.45 0.37 0.50 0.37 0.00 0.00 175.52 177.28 1im8 h LYS 148 N 0.45 0.69 -0.13 6.66 3.64 -0.99 -1.32 116.57 125.57 1im8 h LYS 148 Ca 0.05 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1im8 h LYS 148 Cb 0.80 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 1im8 h LYS 148 CO 0.06 0.45 0.05 0.82 -2.27 0.00 0.00 179.45 178.57 1im8 h ILE 149 N 0.71 1.15 -0.67 2.00 2.04 -1.18 0.57 117.51 122.13 1im8 h ILE 149 Ca 0.26 -0.43 0.07 0.00 1.00 0.00 0.00 64.86 65.76 1im8 h ILE 149 Cb 0.08 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 1im8 h ILE 149 CO -0.13 0.13 0.35 0.22 0.00 0.00 0.00 178.15 178.72 1im8 h TYR 150 N 0.05 0.63 -0.53 1.37 3.20 -0.80 0.58 116.97 121.47 1im8 h TYR 150 Ca 0.04 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.82 1im8 h TYR 150 Cb 0.16 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 1im8 h TYR 150 CO -0.02 0.27 -0.14 0.93 -1.64 0.00 0.00 178.16 177.56 1im8 h GLU 151 N 0.62 1.03 0.00 1.82 5.08 -1.04 -3.05 114.58 119.04 1im8 h GLU 151 Ca 0.31 -0.40 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 1im8 h GLU 151 Cb 0.26 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1im8 h GLU 151 CO -0.22 1.09 -0.23 0.78 -1.00 0.00 0.00 179.01 179.43 1im8 h GLY 152 N 0.91 0.00 -1.91 -3.84 0.00 0.25 -3.45 103.07 95.03 1im8 h GLY 152 Ca 0.13 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.99 1im8 h GLY 152 CO 0.06 0.00 0.37 1.08 0.00 0.00 0.00 176.54 178.05 1im8 s LEU 153 N -6.70 3.72 0.53 3.11 1.43 0.09 -2.23 118.68 118.64 1im8 s LEU 153 Ca 0.01 1.78 -0.04 0.00 -1.03 0.00 0.00 54.13 54.85 1im8 s LEU 153 Cb 0.10 -4.54 -0.00 0.00 0.03 0.00 0.00 46.19 41.77 1im8 s LEU 153 CO 0.64 -0.76 0.82 0.20 0.23 0.00 0.00 176.35 177.48 1im8 s ASN 154 N -2.46 5.81 0.27 2.29 0.01 0.10 -4.81 114.94 116.15 1im8 s ASN 154 Ca 0.64 0.66 -0.29 0.00 -0.71 0.00 0.00 52.86 53.15 1im8 s ASN 154 Cb -0.14 -1.79 -0.14 0.00 0.41 0.00 0.00 41.25 39.59 1im8 s ASN 154 CO 0.26 -0.86 1.17 -2.65 -1.51 0.00 0.00 177.10 173.50 1im8 n PRO 155 N -2.38 1.62 -1.09 -0.60 -0.02 -1.26 -0.39 135.00 130.88 1im8 n PRO 155 Ca 0.03 0.57 -0.03 0.00 -2.02 0.00 0.00 63.50 62.05 1im8 n PRO 155 Cb 0.57 -2.06 -0.01 0.00 -0.02 0.00 0.00 33.50 31.98 1im8 n PRO 155 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1im8 n ASN 156 N 1.42 -4.84 -4.85 2.55 4.05 -1.26 -5.01 115.26 107.32 1im8 n ASN 156 Ca 0.10 0.07 -0.30 0.00 0.45 0.00 0.00 54.58 54.90 1im8 n ASN 156 Cb 0.32 -2.60 0.07 0.00 1.23 0.00 0.00 39.78 38.79 1im8 n ASN 156 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1im8 s GLY 157 N -2.19 1.62 0.12 8.20 0.00 0.48 -4.72 107.32 110.83 1im8 s GLY 157 Ca 0.00 -0.30 0.10 0.00 0.00 0.00 0.00 44.72 44.53 1im8 s GLY 157 CO 0.00 0.10 -0.26 0.14 0.00 0.00 0.00 173.10 173.08 1im8 s VAL 158 N -3.28 2.17 -0.18 1.40 1.01 -0.78 -1.15 120.40 119.59 1im8 s VAL 158 Ca 0.60 -1.71 -0.00 0.00 0.00 0.00 0.00 61.98 60.87 1im8 s VAL 158 Cb -0.13 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 34.34 1im8 s VAL 158 CO 0.53 0.08 -0.15 -0.22 0.00 0.00 0.00 175.10 175.33 1im8 s LEU 159 N -2.00 2.41 -0.27 3.92 2.96 0.39 -0.69 118.68 125.41 1im8 s LEU 159 Ca 0.13 -0.53 -0.08 0.00 -0.22 0.00 0.00 54.13 53.43 1im8 s LEU 159 Cb -0.10 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 1im8 s LEU 159 CO 0.06 0.03 0.09 -0.69 -1.32 0.00 0.00 176.35 174.51 1im8 s VAL 160 N 1.14 4.32 -0.24 1.68 1.01 0.62 -1.47 120.40 127.46 1im8 s VAL 160 Ca 0.01 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1im8 s VAL 160 Cb -0.14 -3.08 0.04 0.00 0.00 0.00 0.00 36.38 33.20 1im8 s VAL 160 CO -0.06 0.26 -0.11 -0.22 0.00 0.00 0.00 175.10 174.97 1im8 s LEU 161 N 1.60 3.03 -0.06 3.92 2.96 -1.26 -0.39 118.68 128.47 1im8 s LEU 161 Ca 0.06 -1.03 0.00 0.00 -0.22 0.00 0.00 54.13 52.94 1im8 s LEU 161 Cb -0.16 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.93 1im8 s LEU 161 CO 0.04 -0.12 -0.04 -0.44 -1.32 0.00 0.00 176.35 174.46 1im8 s SER 162 N 1.23 4.84 0.13 3.68 0.01 -0.17 -4.42 113.70 119.00 1im8 s SER 162 Ca -0.02 0.02 -0.24 0.00 1.31 0.00 0.00 55.95 57.02 1im8 s SER 162 Cb -0.17 -1.26 0.08 0.00 0.21 0.00 0.00 66.02 64.88 1im8 s SER 162 CO -0.07 0.36 0.65 -0.70 0.41 0.00 0.00 173.24 173.89 1im8 s GLU 163 N -0.92 1.19 0.03 12.44 2.56 -0.51 -0.71 118.70 132.77 1im8 s GLU 163 Ca 0.13 -0.43 -0.23 0.00 0.00 0.00 0.00 54.97 54.44 1im8 s GLU 163 Cb -0.11 0.55 -0.06 0.00 2.00 0.00 0.00 34.13 36.51 1im8 s GLU 163 CO 0.03 -0.52 0.69 0.21 -0.56 0.00 0.00 175.26 175.10 1im8 s LYS 164 N -3.61 4.41 0.28 4.30 2.20 -1.26 -2.20 119.74 123.86 1im8 s LYS 164 Ca 0.02 0.92 0.08 0.00 -0.36 0.00 0.00 55.97 56.62 1im8 s LYS 164 Cb -0.01 -3.35 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 1im8 s LYS 164 CO -0.12 0.34 0.14 -0.06 -0.36 0.00 0.00 175.35 175.29 1im8 s PHE 165 N -0.20 2.89 0.28 4.03 0.40 0.10 -4.45 117.98 121.03 1im8 s PHE 165 Ca 0.35 -0.21 0.09 0.00 -0.60 0.00 0.00 56.93 56.56 1im8 s PHE 165 Cb -0.20 -1.42 -0.04 0.00 0.51 0.00 0.00 43.02 41.87 1im8 s PHE 165 CO 0.20 0.48 0.04 -0.98 0.70 0.00 0.00 175.22 175.67 1im8 s ARG 166 N -3.81 2.35 -0.01 0.44 1.70 -1.00 -4.86 118.95 113.76 1im8 s ARG 166 Ca 0.34 -1.43 0.06 0.00 -0.47 0.00 0.00 55.73 54.23 1im8 s ARG 166 Cb -0.06 -2.19 -0.01 0.00 -0.57 0.00 0.00 34.95 32.12 1im8 s ARG 166 CO 0.23 0.31 -0.18 -0.06 -1.08 0.00 0.00 175.30 174.52 1im8 s PHE 167 N -2.34 1.65 0.10 5.89 0.40 -1.26 -4.12 117.98 118.29 1im8 s PHE 167 Ca 0.33 -0.31 -0.32 0.00 -0.60 0.00 0.00 56.93 56.03 1im8 s PHE 167 Cb -0.05 -1.06 -0.13 0.00 0.51 0.00 0.00 43.02 42.28 1im8 s PHE 167 CO 0.21 -0.03 1.60 1.49 0.70 0.00 0.00 175.22 179.19 1im8 h GLU 168 N 5.69 -0.74 -6.13 0.44 4.57 -2.00 -3.39 114.58 113.02 1im8 h GLU 168 Ca -0.37 0.05 -0.58 0.00 -1.18 0.00 0.00 59.36 57.28 1im8 h GLU 168 Cb 1.15 0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.89 1im8 h GLU 168 CO 0.48 -0.50 1.37 0.34 -1.18 0.00 0.00 179.01 179.53 1im8 s ASP 169 N -4.57 5.66 0.50 1.04 -1.08 -1.26 -4.86 116.67 112.10 1im8 s ASP 169 Ca -0.17 1.50 0.16 0.00 -0.52 0.00 0.00 52.55 53.53 1im8 s ASP 169 Cb 0.06 -2.52 1.20 0.00 -1.46 0.00 0.00 42.92 40.20 1im8 s ASP 169 CO 0.63 -1.86 2.09 0.71 0.52 0.00 0.00 175.17 177.26 1im8 h THR 170 N 6.97 0.96 -0.17 1.71 1.35 -1.99 0.72 112.91 122.45 1im8 h THR 170 Ca -0.36 -0.05 -0.08 0.00 -0.55 0.00 0.00 66.41 65.37 1im8 h THR 170 Cb 1.20 0.81 -0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1im8 h THR 170 CO 1.01 0.02 -0.21 0.11 -0.25 0.00 0.00 175.52 176.20 1im8 h LYS 171 N 0.13 0.45 -0.67 4.72 1.79 -1.94 -1.07 116.57 119.98 1im8 h LYS 171 Ca 0.10 -0.25 -0.04 0.00 -2.18 0.00 0.00 60.65 58.28 1im8 h LYS 171 Cb 0.23 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.87 1im8 h LYS 171 CO -0.01 0.83 0.27 0.82 -1.08 0.00 0.00 179.45 180.27 1im8 h ILE 172 N 0.09 1.24 -0.84 1.86 2.04 -1.82 0.23 117.51 120.31 1im8 h ILE 172 Ca 0.02 -0.76 0.01 0.00 1.00 0.00 0.00 64.86 65.13 1im8 h ILE 172 Cb 0.77 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 1im8 h ILE 172 CO 0.05 0.30 0.56 -1.13 0.00 0.00 0.00 178.15 177.93 1im8 h ASN 173 N 0.95 0.97 -0.28 1.72 -0.00 -0.75 -0.45 115.58 117.74 1im8 h ASN 173 Ca 0.22 -0.02 -0.14 0.00 -0.00 0.00 0.00 56.30 56.36 1im8 h ASN 173 Cb 0.21 -0.24 -0.01 0.00 -0.00 0.00 0.00 38.32 38.28 1im8 h ASN 173 CO -0.02 0.70 -0.35 0.45 -0.00 0.00 0.00 177.43 178.21 1im8 h HIS 174 N 1.14 0.96 0.09 0.67 3.86 -0.87 -1.09 115.15 119.91 1im8 h HIS 174 Ca 0.31 -0.27 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1im8 h HIS 174 Cb -0.13 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.13 1im8 h HIS 174 CO -0.01 1.05 -0.04 1.25 0.86 0.00 0.00 177.93 181.03 1im8 h LEU 175 N 0.68 -0.10 -0.83 2.43 6.46 -0.21 0.43 115.31 124.16 1im8 h LEU 175 Ca 0.06 -0.13 -0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1im8 h LEU 175 Cb 0.91 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.83 1im8 h LEU 175 CO 0.08 0.07 0.40 -0.07 -0.62 0.00 0.00 178.44 178.30 1im8 h LEU 176 N -0.27 1.08 -0.77 2.25 3.38 -1.13 0.19 115.31 120.05 1im8 h LEU 176 Ca -0.01 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1im8 h LEU 176 Cb 0.23 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1im8 h LEU 176 CO 0.02 0.91 0.47 0.40 0.09 0.00 0.00 178.44 180.33 1im8 h ILE 177 N 1.18 1.21 -0.49 1.22 2.04 -1.04 -1.55 117.51 120.07 1im8 h ILE 177 Ca 0.28 -0.46 -0.09 0.00 1.00 0.00 0.00 64.86 65.60 1im8 h ILE 177 Cb 0.11 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 1im8 h ILE 177 CO -0.04 0.22 -0.05 -0.78 0.00 0.00 0.00 178.15 177.50 1im8 h ASP 178 N 1.05 0.84 -0.48 1.72 -0.00 0.02 -1.54 116.42 118.03 1im8 h ASP 178 Ca 0.28 -0.24 -0.10 0.00 -0.00 0.00 0.00 57.03 56.97 1im8 h ASP 178 Cb -0.05 -0.23 -0.02 0.00 -0.00 0.00 0.00 39.33 39.03 1im8 h ASP 178 CO -0.05 0.94 -0.06 -0.07 -0.00 0.00 0.00 179.24 179.99 1im8 h LEU 179 N 0.79 0.92 -0.42 2.28 3.38 -0.24 -2.47 115.31 119.54 1im8 h LEU 179 Ca 0.14 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1im8 h LEU 179 Cb 0.55 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1im8 h LEU 179 CO 0.03 1.01 0.09 -0.74 0.09 0.00 0.00 178.44 178.92 1im8 h HIS 180 N 0.84 0.72 -0.57 1.13 2.76 -1.05 -2.00 115.15 116.98 1im8 h HIS 180 Ca 0.15 -0.09 0.04 0.00 -2.20 0.00 0.00 60.37 58.27 1im8 h HIS 180 Cb 0.58 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 29.31 1im8 h HIS 180 CO 0.04 0.69 0.38 0.45 -1.30 0.00 0.00 177.93 178.18 1im8 h HIS 181 N 0.54 0.60 -0.02 5.26 3.86 -1.05 0.23 115.15 124.57 1im8 h HIS 181 Ca 0.13 0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.24 1im8 h HIS 181 Cb 0.34 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 1im8 h HIS 181 CO 0.02 0.34 -0.51 0.37 0.86 0.00 0.00 177.93 179.01 1im8 h GLN 182 N 0.61 0.05 -0.19 2.45 4.15 -1.09 0.99 115.11 122.09 1im8 h GLN 182 Ca 0.24 -0.03 -0.15 0.00 0.77 0.00 0.00 58.65 59.48 1im8 h GLN 182 Cb 0.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.86 1im8 h GLN 182 CO -0.07 0.55 -0.45 0.35 -1.93 0.00 0.00 178.83 177.28 1im8 h PHE 183 N 0.04 0.81 -0.35 3.99 3.57 0.08 0.19 116.94 125.27 1im8 h PHE 183 Ca -0.00 -0.31 -0.01 0.00 3.53 0.00 0.00 57.97 61.17 1im8 h PHE 183 Cb 0.91 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 1im8 h PHE 183 CO 0.00 1.08 0.16 0.87 -2.23 0.00 0.00 178.31 178.20 1im8 h LYS 184 N 0.31 0.52 -0.66 1.11 1.57 -0.64 -2.04 116.57 116.74 1im8 h LYS 184 Ca -0.00 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1im8 h LYS 184 Cb 1.07 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.25 1im8 h LYS 184 CO 0.10 0.47 0.41 -0.09 -0.57 0.00 0.00 179.45 179.77 1im8 h ARG 185 N 0.43 0.89 0.00 3.15 2.43 -0.74 0.16 114.38 120.71 1im8 h ARG 185 Ca 0.12 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1im8 h ARG 185 Cb 0.13 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1im8 h ARG 185 CO -0.01 0.63 -0.03 0.00 -1.51 0.00 0.00 179.97 179.04 1im8 h ALA 186 N 1.21 1.10 -0.21 2.80 0.00 -0.20 -1.54 119.26 122.43 1im8 h ALA 186 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1im8 h ALA 186 Cb -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1im8 h ALA 186 CO -0.05 0.04 0.00 0.09 0.00 0.00 0.00 179.25 179.33 1im8 n ASN 187 N -3.27 2.92 -1.48 0.00 3.02 -0.70 -4.97 115.26 110.77 1im8 n ASN 187 Ca -0.02 -1.86 -0.11 0.00 -0.03 0.00 0.00 54.58 52.56 1im8 n ASN 187 Cb 0.18 -0.13 0.01 0.00 -0.61 0.00 0.00 39.78 39.23 1im8 n ASN 187 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1im8 n GLY 188 N 1.13 0.05 0.41 7.41 0.00 -0.54 -4.89 105.19 108.76 1im8 n GLY 188 Ca 0.14 -0.37 0.21 0.00 0.00 0.00 0.00 46.02 46.00 1im8 n GLY 188 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1im8 h TYR 189 N -0.48 0.45 0.00 1.61 3.20 -1.25 -0.28 116.97 120.21 1im8 h TYR 189 Ca -0.26 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.63 1im8 h TYR 189 Cb 1.18 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.31 1im8 h TYR 189 CO 0.26 0.11 0.00 1.03 -1.64 0.00 0.00 178.16 177.93 1im8 h SER 190 N 0.33 0.00 0.17 -2.11 0.87 -1.90 -2.27 113.55 108.64 1im8 h SER 190 Ca 0.46 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.91 1im8 h SER 190 Cb 1.25 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.20 1im8 h SER 190 CO -0.15 0.00 -0.39 -0.08 -0.53 0.00 0.00 176.83 175.68 1im8 h GLU 191 N 0.00 0.29 -6.63 2.24 4.81 -1.42 -3.44 114.58 110.44 1im8 h GLU 191 Ca 0.00 -0.13 -0.53 0.00 -0.13 0.00 0.00 59.36 58.57 1im8 h GLU 191 Cb 0.02 -0.01 0.04 0.00 0.63 0.00 0.00 28.75 29.43 1im8 h GLU 191 CO 0.00 0.64 0.73 -0.51 -0.73 0.00 0.00 179.01 179.14 1im8 s LEU 192 N -8.33 4.39 0.42 1.64 1.43 -0.86 -4.89 118.68 112.49 1im8 s LEU 192 Ca -0.05 2.46 0.10 0.00 -1.03 0.00 0.00 54.13 55.60 1im8 s LEU 192 Cb 0.13 -3.60 0.94 0.00 0.03 0.00 0.00 46.19 43.69 1im8 s LEU 192 CO 0.78 -0.65 2.04 -0.08 0.23 0.00 0.00 176.35 178.66 1im8 h GLU 193 N 6.07 0.46 0.00 1.70 4.57 -1.89 -1.70 114.58 123.79 1im8 h GLU 193 Ca -0.44 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 1im8 h GLU 193 Cb 1.21 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.70 1im8 h GLU 193 CO 0.83 0.31 -0.09 1.55 -1.18 0.00 0.00 179.01 180.42 1im8 n VAL 194 N -4.48 0.37 -0.31 0.32 3.14 -1.26 -4.34 118.33 111.77 1im8 n VAL 194 Ca 0.05 -0.19 0.12 0.00 -2.96 0.00 0.00 64.34 61.36 1im8 n VAL 194 Cb 0.17 -0.47 0.26 0.00 -1.06 0.00 0.00 33.84 32.73 1im8 n VAL 194 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 1im8 h SER 195 N 0.00 -0.31 -0.10 6.55 4.64 -1.57 -1.01 113.55 121.76 1im8 h SER 195 Ca 0.00 0.24 -0.02 0.00 -0.47 0.00 0.00 61.79 61.53 1im8 h SER 195 Cb 0.66 0.39 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1im8 h SER 195 CO 0.00 -0.26 -0.02 -0.61 -0.87 0.00 0.00 176.83 175.07 1im8 h GLN 196 N 0.09 0.19 0.00 4.77 4.15 -1.80 0.51 115.11 123.02 1im8 h GLN 196 Ca 0.54 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.81 1im8 h GLN 196 Cb 1.08 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.75 1im8 h GLN 196 CO -0.78 0.50 -0.38 0.87 -1.93 0.00 0.00 178.83 177.12 1im8 h LYS 197 N -0.13 0.00 -0.12 1.69 1.57 -1.74 -0.43 116.57 117.41 1im8 h LYS 197 Ca 0.03 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 1im8 h LYS 197 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1im8 h LYS 197 CO 0.01 0.38 -0.31 -0.09 -0.57 0.00 0.00 179.45 178.87 1im8 h ARG 198 N 0.00 0.42 -0.39 3.15 1.12 -1.13 0.56 114.38 118.11 1im8 h ARG 198 Ca -0.00 -0.29 -0.03 0.00 -1.11 0.00 0.00 59.98 58.55 1im8 h ARG 198 Cb 0.69 0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.67 1im8 h ARG 198 CO 0.05 0.91 0.14 1.15 -3.11 0.00 0.00 179.97 179.10 1im8 h THR 199 N 0.01 1.16 0.11 0.20 2.02 -0.69 -0.33 112.91 115.39 1im8 h THR 199 Ca -0.00 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1im8 h THR 199 Cb 0.92 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1im8 h THR 199 CO 0.07 0.20 -0.05 0.00 0.37 0.00 0.00 175.52 176.10 1im8 h ALA 200 N 1.60 -0.15 -0.79 6.16 0.00 -0.95 -3.02 119.26 122.12 1im8 h ALA 200 Ca 0.13 -0.25 0.21 0.00 0.00 0.00 0.00 54.91 55.01 1im8 h ALA 200 Cb 0.15 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1im8 h ALA 200 CO -0.01 -0.28 0.56 1.25 0.00 0.00 0.00 179.25 180.76 1im8 h LEU 201 N -0.75 0.09 0.00 0.00 6.46 -0.62 -0.84 115.31 119.66 1im8 h LEU 201 Ca -0.01 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1im8 h LEU 201 Cb 0.55 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1im8 h LEU 201 CO 0.02 0.04 -0.25 1.21 -0.62 0.00 0.00 178.44 178.85 1im8 n GLU 202 N -4.35 0.08 0.00 1.25 2.13 -0.16 -3.59 120.64 116.00 1im8 n GLU 202 Ca 0.16 0.04 0.12 0.00 0.66 0.00 0.00 57.16 58.14 1im8 n GLU 202 Cb 0.79 -1.57 0.08 0.00 0.27 0.00 0.00 31.44 31.01 1im8 n GLU 202 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1im8 n ASN 203 N -1.69 2.00 -3.61 4.31 5.03 -0.33 -4.91 115.26 116.06 1im8 n ASN 203 Ca 0.06 -1.49 -0.35 0.00 0.87 0.00 0.00 54.58 53.67 1im8 n ASN 203 Cb 0.36 0.36 -0.03 0.00 -1.02 0.00 0.00 39.78 39.46 1im8 n ASN 203 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 1im8 n VAL 204 N 0.06 4.13 -3.42 2.41 0.31 -1.16 -5.10 118.33 115.56 1im8 n VAL 204 Ca 0.10 -5.66 -0.20 0.00 -0.01 0.00 0.00 64.34 58.58 1im8 n VAL 204 Cb 0.47 -1.92 -0.10 0.00 -0.91 0.00 0.00 33.84 31.38 1im8 n VAL 204 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1im8 s ARG 206 N -3.01 0.40 0.33 5.55 0.52 -1.26 -5.13 118.95 116.35 1im8 s ARG 206 Ca 0.38 -0.48 -0.04 0.00 -0.52 0.00 0.00 55.73 55.07 1im8 s ARG 206 Cb 0.14 -0.80 -0.05 0.00 0.52 0.00 0.00 34.95 34.76 1im8 s ARG 206 CO 0.00 -1.09 0.59 0.95 0.02 0.00 0.00 175.30 175.78 1im8 s THR 207 N 1.98 5.02 0.27 0.02 -4.23 -1.26 -4.90 115.64 112.54 1im8 s THR 207 Ca 0.12 -0.02 0.10 0.00 -1.18 0.00 0.00 61.69 60.72 1im8 s THR 207 Cb -0.15 -3.78 -0.05 0.00 1.34 0.00 0.00 72.50 69.86 1im8 s THR 207 CO -0.23 -0.45 -0.08 -1.81 -0.54 0.00 0.00 174.62 171.51 1im8 s ASP 208 N -3.46 4.19 0.76 3.99 -0.00 -1.26 -4.69 116.67 116.20 1im8 s ASP 208 Ca 0.44 -0.78 -0.11 0.00 -0.00 0.00 0.00 52.55 52.10 1im8 s ASP 208 Cb -0.10 -0.65 0.05 0.00 -0.00 0.00 0.00 42.92 42.22 1im8 s ASP 208 CO 0.33 0.02 1.08 -0.94 -0.00 0.00 0.00 175.17 175.66 1im8 s SER 209 N -3.58 4.81 0.24 0.27 1.04 -1.26 -2.38 113.70 112.83 1im8 s SER 209 Ca 0.31 1.46 -0.06 0.00 0.48 0.00 0.00 55.95 58.14 1im8 s SER 209 Cb -0.06 -2.25 0.23 0.00 0.10 0.00 0.00 66.02 64.04 1im8 s SER 209 CO 0.18 -1.79 1.86 0.40 0.98 0.00 0.00 173.24 174.86 1im8 h ILE 210 N -0.96 1.26 -0.58 -1.02 2.04 -1.98 -1.71 117.51 114.55 1im8 h ILE 210 Ca -0.46 -0.65 -0.07 0.00 1.00 0.00 0.00 64.86 64.68 1im8 h ILE 210 Cb 1.24 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1im8 h ILE 210 CO 0.58 0.29 0.10 -0.08 0.00 0.00 0.00 178.15 179.04 1im8 h GLU 211 N 1.23 0.93 -0.17 2.37 4.81 -1.94 -1.18 114.58 120.63 1im8 h GLU 211 Ca 0.31 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1im8 h GLU 211 Cb 0.05 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1im8 h GLU 211 CO -0.05 0.86 0.09 1.15 -0.73 0.00 0.00 179.01 180.33 1im8 h THR 212 N 0.88 1.09 -0.81 0.32 2.02 -1.71 -1.63 112.91 113.07 1im8 h THR 212 Ca 0.18 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 67.13 1im8 h THR 212 Cb 0.38 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 1im8 h THR 212 CO 0.01 0.09 0.53 0.45 0.37 0.00 0.00 175.52 176.97 1im8 h HIS 213 N 0.18 1.01 -0.49 3.16 3.86 -1.02 -0.92 115.15 120.92 1im8 h HIS 213 Ca 0.06 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1im8 h HIS 213 Cb 0.06 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.16 1im8 h HIS 213 CO -0.04 0.62 0.26 0.87 0.86 0.00 0.00 177.93 180.50 1im8 h LYS 214 N 1.08 0.69 -0.02 2.45 1.57 -0.89 -1.72 116.57 119.72 1im8 h LYS 214 Ca 0.31 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1im8 h LYS 214 Cb -0.08 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 1im8 h LYS 214 CO -0.08 0.54 0.00 0.28 -0.57 0.00 0.00 179.45 179.62 1im8 h VAL 215 N 0.65 1.24 -0.47 0.50 2.07 -1.08 -1.48 116.25 117.68 1im8 h VAL 215 Ca 0.17 -0.71 0.08 0.00 0.82 0.00 0.00 66.70 67.06 1im8 h VAL 215 Cb 0.06 1.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.45 1im8 h VAL 215 CO -0.03 0.19 0.06 -0.09 0.02 0.00 0.00 177.57 177.72 1im8 h ARG 216 N -0.26 0.18 -0.66 1.57 2.43 -1.13 0.65 114.38 117.16 1im8 h ARG 216 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1im8 h ARG 216 Cb 0.30 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.78 1im8 h ARG 216 CO 0.00 0.12 0.35 -0.07 -1.51 0.00 0.00 179.97 178.86 1im8 h LEU 217 N 0.19 0.83 -0.67 3.80 3.38 -1.22 -1.83 115.31 119.79 1im8 h LEU 217 Ca 0.23 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1im8 h LEU 217 Cb 0.32 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1im8 h LEU 217 CO -0.33 0.70 0.33 0.11 0.09 0.00 0.00 178.44 179.33 1im8 h LYS 218 N 0.90 0.96 -0.07 1.13 1.57 -0.30 -2.81 116.57 117.95 1im8 h LYS 218 Ca 0.23 -0.14 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 1im8 h LYS 218 Cb 0.06 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1im8 h LYS 218 CO -0.04 0.75 -0.36 -0.91 -0.57 0.00 0.00 179.45 178.32 1im8 h ASN 219 N 0.92 0.14 0.82 0.86 2.35 -0.73 -0.83 115.58 119.12 1im8 h ASN 219 Ca 0.23 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1im8 h ASN 219 Cb 0.11 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1im8 h ASN 219 CO -0.03 0.50 0.00 0.52 -1.65 0.00 0.00 177.43 176.77 1im8 n VAL 220 N -4.08 0.79 0.00 2.81 0.31 -0.70 -4.90 118.33 112.56 1im8 n VAL 220 Ca -0.01 0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 1im8 n VAL 220 Cb 0.43 -1.03 0.00 0.00 -0.91 0.00 0.00 33.84 32.32 1im8 n VAL 220 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1im8 n GLY 221 N 0.24 1.92 3.65 2.92 0.00 -0.31 -4.95 105.19 108.66 1im8 n GLY 221 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 1im8 n GLY 221 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1im8 n PHE 222 N 0.00 1.83 -0.02 1.61 3.01 -1.08 -4.96 117.46 117.85 1im8 n PHE 222 Ca 0.00 0.61 -0.13 0.00 1.01 0.00 0.00 57.45 58.95 1im8 n PHE 222 Cb 0.00 -2.34 -0.10 0.00 -0.01 0.00 0.00 39.48 37.02 1im8 n PHE 222 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1im8 h SER 223 N 2.40 -0.03 -3.45 4.37 0.02 -0.90 -3.43 113.55 112.53 1im8 h SER 223 Ca -0.43 -0.65 -0.66 0.00 -0.84 0.00 0.00 61.79 59.21 1im8 h SER 223 Cb 1.31 0.01 -0.23 0.00 0.14 0.00 0.00 62.40 63.62 1im8 h SER 223 CO 0.62 0.66 -0.72 -1.10 -1.14 0.00 0.00 176.83 175.15 1im8 s GLN 224 N -3.25 3.27 -0.09 3.45 -0.21 -0.96 -4.97 119.66 116.90 1im8 s GLN 224 Ca -0.16 -0.61 -0.03 0.00 0.02 0.00 0.00 55.36 54.58 1im8 s GLN 224 Cb -0.00 -2.69 0.05 0.00 1.00 0.00 0.00 33.01 31.37 1im8 s GLN 224 CO 0.63 0.35 0.14 0.08 -2.12 0.00 0.00 175.29 174.37 1im8 s VAL 225 N 0.03 -0.23 -0.16 1.09 1.01 -1.26 -0.63 120.40 120.25 1im8 s VAL 225 Ca -0.02 0.31 -0.25 0.00 0.00 0.00 0.00 61.98 62.02 1im8 s VAL 225 Cb -0.14 -0.31 0.06 0.00 0.00 0.00 0.00 36.38 35.99 1im8 s VAL 225 CO 0.04 0.11 0.63 -0.70 0.00 0.00 0.00 175.10 175.17 1im8 s GLU 226 N 2.27 0.85 -0.07 2.72 2.56 -0.16 -5.00 118.70 121.87 1im8 s GLU 226 Ca 0.04 0.59 -0.30 0.00 0.00 0.00 0.00 54.97 55.30 1im8 s GLU 226 Cb -0.12 0.40 -0.03 0.00 2.00 0.00 0.00 34.13 36.38 1im8 s GLU 226 CO -0.06 -0.18 1.20 -1.17 -0.56 0.00 0.00 175.26 174.50 1im8 s LEU 227 N -0.31 4.27 -0.01 2.70 2.96 -1.26 -0.61 118.68 126.43 1im8 s LEU 227 Ca -0.05 1.80 0.08 0.00 -0.22 0.00 0.00 54.13 55.74 1im8 s LEU 227 Cb -0.03 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 43.00 1im8 s LEU 227 CO 0.04 -0.60 0.25 -2.67 -1.32 0.00 0.00 176.35 172.06 1im8 n TRP 228 N 5.31 0.00 -3.86 5.38 4.27 -0.61 -4.95 117.44 122.98 1im8 n TRP 228 Ca 0.11 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.61 1im8 n TRP 228 Cb 0.46 -0.09 -0.11 0.00 -1.36 0.00 0.00 31.31 30.21 1im8 n TRP 228 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 1im8 s PHE 229 N -2.12 -0.04 -0.14 -2.67 5.36 -0.97 -4.98 117.98 112.42 1im8 s PHE 229 Ca 0.00 0.08 -0.25 0.00 -0.96 0.00 0.00 56.93 55.80 1im8 s PHE 229 Cb 0.05 -0.01 0.06 0.00 -0.34 0.00 0.00 43.02 42.79 1im8 s PHE 229 CO 0.32 -0.19 0.63 -1.14 -1.46 0.00 0.00 175.22 173.38 1im8 s GLN 230 N -0.74 0.86 -0.28 10.12 0.74 -1.26 -1.25 119.66 127.85 1im8 s GLN 230 Ca -0.08 0.54 0.00 0.00 0.05 0.00 0.00 55.36 55.87 1im8 s GLN 230 Cb -0.05 0.41 0.17 0.00 1.10 0.00 0.00 33.01 34.64 1im8 s GLN 230 CO 0.01 -0.19 0.49 0.00 -0.55 0.00 0.00 175.29 175.04 1im8 n PHE 232 N 5.39 0.00 -1.16 0.00 0.99 -1.26 -2.55 117.46 118.87 1im8 n PHE 232 Ca -0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.35 1im8 n PHE 232 Cb 0.51 0.00 0.25 0.00 -1.00 0.00 0.00 39.48 39.24 1im8 n PHE 232 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.76 177.03 1im8 n ASN 233 N 7.02 4.10 -4.31 4.37 6.94 -1.26 -4.92 115.26 127.19 1im8 n ASN 233 Ca 0.00 -3.40 -0.21 0.00 -0.02 0.00 0.00 54.58 50.95 1im8 n ASN 233 Cb 0.00 -0.74 -0.11 0.00 -2.36 0.00 0.00 39.78 36.57 1im8 n ASN 233 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1im8 s PHE 234 N -3.11 1.71 -0.01 -2.53 0.40 -1.06 0.01 117.98 113.39 1im8 s PHE 234 Ca 0.53 -0.50 -0.06 0.00 -0.60 0.00 0.00 56.93 56.31 1im8 s PHE 234 Cb 0.44 -0.86 0.02 0.00 0.51 0.00 0.00 43.02 43.13 1im8 s PHE 234 CO 0.10 0.28 0.25 0.41 0.70 0.00 0.00 175.22 176.96 1im8 n GLY 235 N 0.32 0.47 3.58 4.36 0.00 -0.93 0.01 105.19 113.00 1im8 n GLY 235 Ca -0.14 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 1im8 n GLY 235 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1im8 s SER 236 N -1.55 0.63 -0.22 1.61 0.15 -0.38 -1.43 113.70 112.52 1im8 s SER 236 Ca 0.06 -1.37 -0.23 0.00 0.70 0.00 0.00 55.95 55.11 1im8 s SER 236 Cb -0.00 0.72 0.06 0.00 -1.71 0.00 0.00 66.02 65.09 1im8 s SER 236 CO -0.00 -1.40 0.64 -0.63 1.20 0.00 0.00 173.24 173.05 1im8 s ILE 238 N -2.88 0.00 -0.05 6.45 1.01 0.22 -1.58 121.20 124.38 1im8 s ILE 238 Ca 0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 60.65 60.89 1im8 s ILE 238 Cb -0.02 -0.90 0.03 0.00 0.01 0.00 0.00 42.46 41.58 1im8 s ILE 238 CO 0.17 -0.01 0.02 0.00 0.00 0.00 0.00 174.94 175.13 1im8 s ALA 239 N 0.15 0.42 -0.16 9.38 0.00 -0.54 -0.99 121.76 130.01 1im8 s ALA 239 Ca -0.01 0.07 -0.03 0.00 0.00 0.00 0.00 51.96 51.98 1im8 s ALA 239 Cb -0.04 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.48 1im8 s ALA 239 CO 0.02 -0.35 -0.05 0.08 0.00 0.00 0.00 175.76 175.45 1im8 s VAL 240 N 1.76 3.69 -2.00 0.00 1.01 0.20 -0.46 120.40 124.59 1im8 s VAL 240 Ca 0.01 -0.42 0.06 0.00 0.00 0.00 0.00 61.98 61.62 1im8 s VAL 240 Cb -0.13 -2.62 0.16 0.00 0.00 0.00 0.00 36.38 33.79 1im8 s VAL 240 CO -0.03 0.48 0.80 1.17 0.00 0.00 0.00 175.10 177.52