#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1im8 s ILE 18 N 0.00 0.84 -1.21 -2.13 1.01 -1.26 -5.06 121.20 113.38 1im8 s ILE 18 Ca 0.00 -2.00 -0.12 0.00 0.00 0.00 0.00 60.65 58.53 1im8 s ILE 18 Cb 0.00 -2.64 0.19 0.00 0.01 0.00 0.00 42.46 40.02 1im8 s ILE 18 CO 0.00 0.00 1.49 0.49 0.00 0.00 0.00 174.94 176.92 1im8 n PHE 19 N -0.68 4.48 -2.66 3.97 3.01 -1.26 -4.77 117.46 119.56 1im8 n PHE 19 Ca -0.02 -3.28 -0.13 0.00 1.01 0.00 0.00 57.45 55.02 1im8 n PHE 19 Cb 0.66 -2.04 0.06 0.00 -0.01 0.00 0.00 39.48 38.15 1im8 n PHE 19 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1im8 n ASP 20 N 4.73 0.99 -0.30 4.37 3.85 -1.26 -4.67 116.55 124.26 1im8 n ASP 20 Ca 0.35 -1.79 0.14 0.00 -0.71 0.00 0.00 54.79 52.79 1im8 n ASP 20 Cb 0.40 -0.35 0.31 0.00 -1.35 0.00 0.00 41.12 40.13 1im8 n ASP 20 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1im8 h GLU 21 N 0.00 0.25 -0.09 0.11 4.39 -1.94 0.64 114.58 117.93 1im8 h GLU 21 Ca -0.19 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.48 1im8 h GLU 21 Cb 0.76 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.35 1im8 h GLU 21 CO 0.23 0.16 -0.01 -0.91 -1.16 0.00 0.00 179.01 177.32 1im8 h ASN 22 N 0.25 0.17 -0.60 1.42 -0.26 -1.96 -2.04 115.58 112.56 1im8 h ASN 22 Ca 0.57 -0.34 -0.05 0.00 -0.56 0.00 0.00 56.30 55.92 1im8 h ASN 22 Cb 1.15 -0.05 -0.03 0.00 -1.06 0.00 0.00 38.32 38.33 1im8 h ASN 22 CO -0.62 0.47 0.19 0.58 -1.06 0.00 0.00 177.43 176.98 1im8 h VAL 23 N -0.13 1.24 -0.23 2.81 2.07 -1.70 -2.23 116.25 118.09 1im8 h VAL 23 Ca 0.03 -0.83 0.05 0.00 0.82 0.00 0.00 66.70 66.77 1im8 h VAL 23 Cb 0.38 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1im8 h VAL 23 CO 0.01 0.31 0.16 0.00 0.02 0.00 0.00 177.57 178.07 1im8 h ALA 24 N 1.06 2.09 0.05 1.67 0.00 -0.83 -0.43 119.26 122.86 1im8 h ALA 24 Ca 0.19 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 1im8 h ALA 24 Cb 0.29 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1im8 h ALA 24 CO -0.01 -0.14 -0.44 1.49 0.00 0.00 0.00 179.25 180.16 1im8 h GLU 25 N 0.10 0.21 -0.00 0.00 4.22 -0.79 -3.32 114.58 115.00 1im8 h GLU 25 Ca 0.10 -0.29 0.00 0.00 0.08 0.00 0.00 59.36 59.25 1im8 h GLU 25 Cb 0.28 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1im8 h GLU 25 CO -0.01 1.08 -0.12 1.55 -2.18 0.00 0.00 179.01 179.33 1im8 n VAL 26 N -4.36 0.00 -0.25 0.32 3.14 -0.94 -4.57 118.33 111.68 1im8 n VAL 26 Ca -0.11 -0.06 0.00 0.00 -2.96 0.00 0.00 64.34 61.21 1im8 n VAL 26 Cb 0.63 -0.10 0.07 0.00 -1.06 0.00 0.00 33.84 33.38 1im8 n VAL 26 CO 0.00 0.00 0.00 0.15 -6.46 0.00 0.00 176.83 170.52 1im8 h PHE 27 N 0.53 -0.50 -0.89 1.45 3.57 -1.18 -1.69 116.94 118.23 1im8 h PHE 27 Ca 0.00 0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.58 1im8 h PHE 27 Cb 0.37 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 1im8 h PHE 27 CO 0.00 -0.33 0.58 -1.00 -2.23 0.00 0.00 178.31 175.33 1im8 h PRO 28 N -0.03 1.18 -1.48 6.41 0.13 -1.86 -0.78 132.00 135.58 1im8 h PRO 28 Ca 0.34 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 1im8 h PRO 28 Cb 0.55 -0.26 0.00 0.00 0.13 0.00 0.00 31.00 31.41 1im8 h PRO 28 CO -0.76 0.79 0.00 -3.47 -0.23 0.00 0.00 178.00 174.33 1im8 n ASP 29 N -4.39 2.73 0.00 1.44 2.03 -0.64 -2.24 116.55 115.48 1im8 n ASP 29 Ca 0.10 -1.65 0.00 0.00 0.52 0.00 0.00 54.79 53.77 1im8 n ASP 29 Cb 0.03 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.92 1im8 n ASP 29 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1im8 n ILE 31 N 0.92 0.00 -0.05 5.18 3.06 -0.30 -2.03 119.36 126.14 1im8 n ILE 31 Ca 0.00 0.00 -0.12 0.00 -2.50 0.00 0.00 62.75 60.13 1im8 n ILE 31 Cb 0.37 0.00 -0.06 0.00 0.54 0.00 0.00 39.64 40.49 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 0.30 0.00 9.51 5.75 -1.67 -0.89 115.11 128.11 1im8 h GLN 32 Ca 0.00 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.40 1im8 h GLN 32 Cb 0.00 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.53 1im8 h GLN 32 CO 0.00 0.54 0.00 0.54 -2.65 0.00 0.00 178.83 177.26 1im8 n ARG 33 N -4.72 0.14 -0.00 1.69 1.74 -0.86 -4.13 116.66 110.52 1im8 n ARG 33 Ca -0.05 0.21 0.03 0.00 -0.77 0.00 0.00 57.85 57.28 1im8 n ARG 33 Cb 0.23 -1.70 -0.05 0.00 -1.02 0.00 0.00 32.46 29.93 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 -1.94 3.38 -4.27 0.55 3.41 -1.11 -4.29 113.62 109.33 1im8 n SER 34 Ca 0.05 -0.02 -0.41 0.00 -0.26 0.00 0.00 58.87 58.23 1im8 n SER 34 Cb 0.32 1.29 -0.10 0.00 -0.26 0.00 0.00 64.21 65.47 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 -2.43 4.30 0.11 -3.33 1.01 -0.36 -4.92 120.40 114.77 1im8 s VAL 35 Ca -0.02 -1.40 -0.31 0.00 0.00 0.00 0.00 61.98 60.25 1im8 s VAL 35 Cb 0.04 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 32.70 1im8 s VAL 35 CO 0.28 -0.53 1.64 -2.16 0.00 0.00 0.00 175.10 174.33 1im8 s PRO 36 N 1.44 4.20 0.00 2.72 0.04 -1.26 -1.62 135.00 140.51 1im8 s PRO 36 Ca 0.03 2.37 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1im8 s PRO 36 Cb -0.23 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 30.86 1im8 s PRO 36 CO 0.02 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 176.77 1im8 n GLY 37 N 3.94 0.85 0.38 0.56 0.00 -1.26 -4.69 105.19 104.96 1im8 n GLY 37 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.15 -0.91 1.61 3.20 -1.65 -0.31 116.97 117.76 1im8 h TYR 38 Ca 0.00 0.10 0.05 0.00 3.14 0.00 0.00 58.73 62.01 1im8 h TYR 38 Cb 0.00 0.62 -0.06 0.00 1.54 0.00 0.00 36.73 38.84 1im8 h TYR 38 CO 0.00 -0.40 0.59 1.03 -1.64 0.00 0.00 178.16 177.74 1im8 h SER 39 N -0.08 0.95 -0.03 -2.11 0.87 -1.93 -2.38 113.55 108.85 1im8 h SER 39 Ca 0.27 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.75 1im8 h SER 39 Cb 0.56 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1im8 h SER 39 CO -0.86 0.63 -0.24 0.78 -0.53 0.00 0.00 176.83 176.62 1im8 h ASN 40 N 1.10 0.44 -0.63 6.23 2.35 -1.49 -2.27 115.58 121.31 1im8 h ASN 40 Ca 0.38 -0.14 -0.07 0.00 -0.55 0.00 0.00 56.30 55.92 1im8 h ASN 40 Cb 0.08 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 1im8 h ASN 40 CO -0.14 0.68 0.11 0.40 -1.65 0.00 0.00 177.43 176.82 1im8 h ILE 41 N 0.39 1.26 -0.42 2.81 2.04 -0.95 0.61 117.51 123.25 1im8 h ILE 41 Ca 0.06 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 1im8 h ILE 41 Cb 0.63 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1im8 h ILE 41 CO 0.05 0.37 0.19 0.40 0.00 0.00 0.00 178.15 179.15 1im8 h ILE 42 N 0.95 1.19 -0.30 -0.67 1.08 -1.12 0.40 117.51 119.04 1im8 h ILE 42 Ca 0.19 -0.55 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1im8 h ILE 42 Cb 0.42 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 1im8 h ILE 42 CO 0.01 0.21 0.17 0.74 -0.69 0.00 0.00 178.15 178.59 1im8 h THR 43 N 0.53 1.12 -0.57 -0.27 2.02 -1.15 -2.48 112.91 112.11 1im8 h THR 43 Ca 0.14 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 67.00 1im8 h THR 43 Cb 0.15 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 1im8 h THR 43 CO -0.02 0.12 0.24 0.00 0.37 0.00 0.00 175.52 176.24 1im8 h ALA 44 N 1.05 1.36 -0.77 6.16 0.00 -0.48 -1.66 119.26 124.91 1im8 h ALA 44 Ca 0.11 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1im8 h ALA 44 Cb 0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1im8 h ALA 44 CO -0.02 0.49 0.51 0.82 0.00 0.00 0.00 179.25 181.05 1im8 h ILE 45 N 0.81 1.12 0.00 0.00 2.04 0.23 0.28 117.51 121.98 1im8 h ILE 45 Ca 0.20 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1im8 h ILE 45 Cb 0.14 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.31 1im8 h ILE 45 CO -0.02 0.17 0.00 0.61 0.00 0.00 0.00 178.15 178.91 1im8 n GLY 46 N -1.42 0.28 0.26 5.37 0.00 -0.62 -0.96 105.19 108.09 1im8 n GLY 46 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 0.67 0.00 0.00 0.99 4.77 0.97 -1.79 117.00 122.60 1im8 n LEU 48 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 1im8 n LEU 48 Cb 0.06 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.26 1im8 n LEU 48 CO 0.00 0.00 0.59 0.00 -1.33 0.00 0.00 177.39 176.65 1im8 h ALA 49 N 0.00 0.85 -0.41 -1.18 0.00 -1.29 0.30 119.26 117.54 1im8 h ALA 49 Ca 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1im8 h ALA 49 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1im8 h ALA 49 CO 0.00 0.65 0.16 1.49 0.00 0.00 0.00 179.25 181.55 1im8 h GLU 50 N 0.44 0.61 -0.23 0.00 4.81 -1.44 -0.86 114.58 117.92 1im8 h GLU 50 Ca 0.04 -0.11 -0.15 0.00 -0.13 0.00 0.00 59.36 59.00 1im8 h GLU 50 Cb 0.92 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1im8 h GLU 50 CO 0.08 0.58 -0.44 0.00 -0.73 0.00 0.00 179.01 178.50 1im8 h ARG 51 N 0.51 0.70 0.00 1.92 2.47 -1.76 -3.39 114.38 114.83 1im8 h ARG 51 Ca 0.14 -0.45 0.00 0.00 -1.26 0.00 0.00 59.98 58.41 1im8 h ARG 51 Cb 0.19 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 1im8 h ARG 51 CO -0.01 1.07 -1.85 1.19 0.56 0.00 0.00 179.97 180.93 1im8 n PHE 52 N -4.18 0.00 -2.65 3.04 3.01 0.10 -4.94 117.46 111.85 1im8 n PHE 52 Ca -0.05 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 57.98 1im8 n PHE 52 Cb 0.56 -0.43 -0.02 0.00 -0.01 0.00 0.00 39.48 39.58 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 -3.39 4.58 0.29 -4.37 1.01 -0.33 -4.86 120.40 113.33 1im8 s VAL 53 Ca -0.06 1.84 0.01 0.00 0.00 0.00 0.00 61.98 63.76 1im8 s VAL 53 Cb 0.13 -4.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1im8 s VAL 53 CO 0.86 -0.36 0.48 0.42 0.00 0.00 0.00 175.10 176.49 1im8 s THR 54 N 3.47 5.15 0.94 3.92 -4.23 -1.26 -4.86 115.64 118.77 1im8 s THR 54 Ca 0.45 -0.51 -0.10 0.00 -1.18 0.00 0.00 61.69 60.34 1im8 s THR 54 Cb -0.13 -3.83 0.16 0.00 1.34 0.00 0.00 72.50 70.04 1im8 s THR 54 CO 0.12 -0.42 1.12 0.00 -0.54 0.00 0.00 174.62 174.90 1im8 n ALA 55 N -1.42 -1.01 -1.80 3.99 0.00 -1.26 -3.23 120.51 115.77 1im8 n ALA 55 Ca -0.05 -0.60 -0.18 0.00 0.00 0.00 0.00 53.44 52.61 1im8 n ALA 55 Cb 0.56 -2.18 -0.05 0.00 0.00 0.00 0.00 19.45 17.78 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 -4.24 -4.78 -4.51 0.00 8.00 -0.35 -4.95 116.55 105.72 1im8 n ASP 56 Ca 0.11 0.32 -0.28 0.00 0.71 0.00 0.00 54.79 55.65 1im8 n ASP 56 Cb 0.52 -4.20 -0.09 0.00 -0.02 0.00 0.00 41.12 37.33 1im8 n ASP 56 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1im8 s SER 57 N -2.34 3.41 0.16 -2.24 1.04 -1.18 -4.95 113.70 107.61 1im8 s SER 57 Ca 0.00 -1.54 0.07 0.00 0.48 0.00 0.00 55.95 54.96 1im8 s SER 57 Cb 0.00 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.28 1im8 s SER 57 CO 0.00 -0.74 -0.01 0.20 0.98 0.00 0.00 173.24 173.67 1im8 s ASN 58 N -3.70 4.75 -0.14 7.02 0.02 0.18 -2.06 114.94 121.02 1im8 s ASN 58 Ca 0.22 -0.39 0.01 0.00 -1.02 0.00 0.00 52.86 51.69 1im8 s ASN 58 Cb 0.05 -1.01 0.02 0.00 0.02 0.00 0.00 41.25 40.33 1im8 s ASN 58 CO 0.11 0.10 -0.16 -0.69 0.02 0.00 0.00 177.10 176.49 1im8 s VAL 59 N -1.67 1.65 -0.09 1.60 1.01 0.13 -1.77 120.40 121.26 1im8 s VAL 59 Ca 0.27 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 1im8 s VAL 59 Cb -0.10 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 1im8 s VAL 59 CO 0.18 0.47 0.00 -0.31 0.00 0.00 0.00 175.10 175.44 1im8 s TYR 60 N 1.22 3.16 -0.31 5.22 1.51 -1.26 -0.49 117.35 126.40 1im8 s TYR 60 Ca -0.00 0.17 0.03 0.00 -1.01 0.00 0.00 57.07 56.26 1im8 s TYR 60 Cb -0.14 -1.80 0.09 0.00 -0.11 0.00 0.00 41.96 40.00 1im8 s TYR 60 CO -0.07 0.44 0.03 0.34 -1.11 0.00 0.00 175.55 175.18 1im8 s ASP 61 N -0.80 4.52 -0.33 2.29 2.15 -0.37 -1.33 116.67 122.80 1im8 s ASP 61 Ca 0.12 -1.88 -0.23 0.00 0.43 0.00 0.00 52.55 50.99 1im8 s ASP 61 Cb -0.11 -1.45 0.00 0.00 -0.30 0.00 0.00 42.92 41.06 1im8 s ASP 61 CO 0.02 -0.35 0.77 -0.76 -0.17 0.00 0.00 175.17 174.69 1im8 s LEU 62 N 1.09 4.11 -0.15 -1.34 1.43 0.53 -1.43 118.68 122.91 1im8 s LEU 62 Ca 0.06 0.54 -0.01 0.00 -1.03 0.00 0.00 54.13 53.70 1im8 s LEU 62 Cb -0.19 -3.03 -0.01 0.00 0.03 0.00 0.00 46.19 42.99 1im8 s LEU 62 CO -0.10 -0.64 0.14 0.61 0.23 0.00 0.00 176.35 176.58 1im8 n GLY 63 N 4.33 0.23 0.06 -3.19 0.00 0.25 -4.28 105.19 102.60 1im8 n GLY 63 Ca 0.03 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.92 0.00 -0.01 0.00 7.64 -1.26 -1.14 113.62 116.93 1im8 n SER 65 Ca 0.05 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.07 1im8 n SER 65 Cb 0.32 0.00 0.53 0.00 -1.01 0.00 0.00 64.21 64.05 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 11.85 0.08 -1.43 1.43 5.12 -1.26 -4.32 116.66 128.13 1im8 n ARG 66 Ca 0.00 -0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 1im8 n ARG 66 Cb 0.00 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 29.80 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 1.47 0.97 0.13 -0.13 0.00 -0.29 -4.48 105.19 102.86 1im8 n GLY 67 Ca 0.08 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 0.17 -0.38 4.61 0.00 -1.93 -1.59 119.26 120.15 1im8 h ALA 68 Ca 0.00 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 1im8 h ALA 68 Cb 0.64 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1im8 h ALA 68 CO 0.00 0.11 -0.28 0.00 0.00 0.00 0.00 179.25 179.07 1im8 h ALA 69 N 0.54 0.79 -0.42 0.00 0.00 -1.93 -1.56 119.26 116.67 1im8 h ALA 69 Ca 0.01 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1im8 h ALA 69 Cb 0.76 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1im8 h ALA 69 CO 0.04 0.65 0.25 1.15 0.00 0.00 0.00 179.25 181.34 1im8 h THR 70 N 0.69 1.14 -0.03 0.00 2.02 -1.88 -0.98 112.91 113.86 1im8 h THR 70 Ca 0.08 -0.33 -0.14 0.00 0.77 0.00 0.00 66.41 66.79 1im8 h THR 70 Cb 0.82 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 1im8 h THR 70 CO 0.07 0.14 -0.62 -0.07 0.37 0.00 0.00 175.52 175.41 1im8 h LEU 71 N 0.56 0.12 -0.57 2.58 3.38 -1.20 -0.82 115.31 119.37 1im8 h LEU 71 Ca 0.15 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1im8 h LEU 71 Cb 0.01 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1im8 h LEU 71 CO -0.03 0.71 -0.01 -1.28 0.09 0.00 0.00 178.44 177.93 1im8 h SER 72 N 0.08 0.99 0.00 -0.43 0.87 -0.95 -1.03 113.55 113.08 1im8 h SER 72 Ca -0.01 -0.31 -0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1im8 h SER 72 Cb 1.12 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 1im8 h SER 72 CO 0.09 1.06 -0.00 0.00 -0.53 0.00 0.00 176.83 177.44 1im8 h ALA 73 N 0.97 -0.00 -0.84 6.23 0.00 -1.08 -3.11 119.26 121.43 1im8 h ALA 73 Ca 0.16 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 54.99 1im8 h ALA 73 Cb 0.55 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.26 1im8 h ALA 73 CO 0.03 -0.30 0.45 -0.09 0.00 0.00 0.00 179.25 179.34 1im8 h ARG 74 N -0.40 0.68 0.00 0.00 2.43 -1.02 -1.03 114.38 115.04 1im8 h ARG 74 Ca -0.00 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1im8 h ARG 74 Cb 0.40 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1im8 h ARG 74 CO 0.00 0.45 -0.01 0.00 -1.51 0.00 0.00 179.97 178.90 1im8 h ARG 75 N 0.70 0.00 -0.39 0.20 3.08 -1.21 -3.07 114.38 113.69 1im8 h ARG 75 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.48 1im8 h ARG 75 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1im8 h ARG 75 CO -0.31 0.01 0.00 0.09 -1.07 0.00 0.00 179.97 178.69 1im8 n ASN 76 N -3.11 3.05 -4.63 7.04 3.02 -0.43 -4.95 115.26 115.24 1im8 n ASN 76 Ca -0.00 -1.99 -0.38 0.00 -0.03 0.00 0.00 54.58 52.17 1im8 n ASN 76 Cb 0.26 -0.26 -0.09 0.00 -0.61 0.00 0.00 39.78 39.08 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 -1.00 5.24 -0.35 2.41 1.01 -0.96 -3.73 121.20 123.82 1im8 s ILE 77 Ca 0.26 0.46 0.10 0.00 0.00 0.00 0.00 60.65 61.47 1im8 s ILE 77 Cb 0.14 -3.64 0.45 0.00 0.01 0.00 0.00 42.46 39.42 1im8 s ILE 77 CO 0.18 0.23 1.11 0.59 0.00 0.00 0.00 174.94 177.06 1im8 n ASN 78 N 4.88 3.88 -4.22 3.58 3.02 -1.26 -5.02 115.26 120.12 1im8 n ASN 78 Ca -0.11 -3.36 -0.24 0.00 -0.03 0.00 0.00 54.58 50.85 1im8 n ASN 78 Cb 0.51 -0.43 -0.14 0.00 -0.61 0.00 0.00 39.78 39.11 1im8 n ASN 78 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1im8 s GLN 79 N -3.53 1.24 0.74 3.52 -1.52 -1.26 -5.06 119.66 113.79 1im8 s GLN 79 Ca 0.43 -0.90 -0.11 0.00 -1.95 0.00 0.00 55.36 52.83 1im8 s GLN 79 Cb 0.40 -1.33 0.04 0.00 -0.22 0.00 0.00 33.01 31.90 1im8 s GLN 79 CO -0.06 0.34 1.08 -1.25 -0.25 0.00 0.00 175.29 175.15 1im8 s PRO 80 N -1.20 2.55 -1.56 2.91 0.04 -1.26 -4.23 135.00 132.25 1im8 s PRO 80 Ca 0.06 0.76 -0.14 0.00 0.04 0.00 0.00 61.00 61.72 1im8 s PRO 80 Cb -0.09 -1.96 0.09 0.00 0.04 0.00 0.00 34.50 32.59 1im8 s PRO 80 CO 0.02 -1.32 0.91 -1.71 0.04 0.00 0.00 177.00 174.94 1im8 n ASN 81 N -3.25 -4.14 -4.72 6.66 5.15 -1.26 -1.21 115.26 112.49 1im8 n ASN 81 Ca 0.07 -0.84 -0.34 0.00 -0.60 0.00 0.00 54.58 52.87 1im8 n ASN 81 Cb 0.55 -3.62 -0.09 0.00 -0.53 0.00 0.00 39.78 36.09 1im8 n ASN 81 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1im8 s VAL 82 N -3.34 4.44 -0.00 3.44 1.01 -1.26 -2.27 120.40 122.42 1im8 s VAL 82 Ca 0.62 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 62.30 1im8 s VAL 82 Cb -0.32 -2.94 -0.01 0.00 0.00 0.00 0.00 36.38 33.11 1im8 s VAL 82 CO 0.85 0.49 -0.13 -0.75 0.00 0.00 0.00 175.10 175.57 1im8 s LYS 83 N -1.26 1.00 -0.07 2.72 2.20 -0.87 -4.28 119.74 119.18 1im8 s LYS 83 Ca 0.17 -0.48 0.02 0.00 -0.36 0.00 0.00 55.97 55.32 1im8 s LYS 83 Cb -0.12 -0.97 -0.03 0.00 -1.51 0.00 0.00 37.83 35.21 1im8 s LYS 83 CO 0.07 0.26 -0.10 0.42 -0.36 0.00 0.00 175.35 175.64 1im8 s ILE 84 N -0.35 3.40 -0.18 5.43 1.01 -0.84 -0.69 121.20 128.98 1im8 s ILE 84 Ca 0.04 -0.59 -0.01 0.00 0.00 0.00 0.00 60.65 60.10 1im8 s ILE 84 Cb -0.05 -2.37 0.05 0.00 0.01 0.00 0.00 42.46 40.10 1im8 s ILE 84 CO -0.00 0.59 -0.03 -0.63 0.00 0.00 0.00 174.94 174.87 1im8 s ILE 85 N -0.69 1.03 -0.07 2.92 1.01 0.36 -0.92 121.20 124.84 1im8 s ILE 85 Ca 0.10 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 60.01 1im8 s ILE 85 Cb -0.11 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 1im8 s ILE 85 CO 0.01 0.00 0.06 -0.83 0.00 0.00 0.00 174.94 174.18 1im8 s GLY 86 N 1.65 1.98 -0.04 6.18 0.00 -0.08 -1.24 107.32 115.77 1im8 s GLY 86 Ca -0.01 -0.78 0.03 0.00 0.00 0.00 0.00 44.72 43.95 1im8 s GLY 86 CO -0.07 -0.58 -0.10 -0.42 0.00 0.00 0.00 173.10 171.93 1im8 s ILE 87 N -1.01 0.89 -0.19 0.90 1.01 -0.52 -0.19 121.20 122.09 1im8 s ILE 87 Ca 0.17 -0.40 -0.09 0.00 0.00 0.00 0.00 60.65 60.32 1im8 s ILE 87 Cb -0.12 -0.80 0.07 0.00 0.01 0.00 0.00 42.46 41.62 1im8 s ILE 87 CO 0.06 0.28 0.44 -0.62 0.00 0.00 0.00 174.94 175.10 1im8 s ASP 88 N 0.32 -0.52 0.00 3.58 2.15 -0.76 0.86 116.67 122.31 1im8 s ASP 88 Ca -0.06 0.97 0.28 0.00 0.43 0.00 0.00 52.55 54.17 1im8 s ASP 88 Cb -0.11 0.93 1.67 0.00 -0.30 0.00 0.00 42.92 45.11 1im8 s ASP 88 CO 0.01 -0.20 2.02 -0.46 -0.17 0.00 0.00 175.17 176.37 1im8 n ASN 89 N 4.46 0.00 -4.61 -0.34 2.04 -0.59 -3.25 115.26 112.97 1im8 n ASN 89 Ca -0.21 -0.93 -0.38 0.00 -0.44 0.00 0.00 54.58 52.62 1im8 n ASN 89 Cb 0.55 0.00 -0.09 0.00 -2.53 0.00 0.00 39.78 37.70 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 -1.97 6.20 0.17 0.53 0.15 -1.26 -4.80 113.70 112.72 1im8 s SER 90 Ca 0.42 0.22 -0.13 0.00 0.70 0.00 0.00 55.95 57.16 1im8 s SER 90 Cb 0.19 -2.18 0.07 0.00 -1.71 0.00 0.00 66.02 62.39 1im8 s SER 90 CO 0.32 -0.12 1.75 -0.61 1.20 0.00 0.00 173.24 175.79 1im8 h GLN 91 N 8.08 0.81 -0.43 5.44 5.75 -1.87 -0.56 115.11 132.33 1im8 h GLN 91 Ca -0.33 -0.12 0.00 0.00 -0.15 0.00 0.00 58.65 58.05 1im8 h GLN 91 Cb 1.17 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.57 1im8 h GLN 91 CO 0.63 0.66 0.00 -0.35 -2.65 0.00 0.00 178.83 177.12 1im8 n PRO 92 N -4.55 0.00 0.00 -2.39 -0.04 -1.26 -1.07 135.00 125.68 1im8 n PRO 92 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1im8 n PRO 92 Cb 0.12 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 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 0.57 0.00 -0.02 0.52 0.31 -0.22 -3.33 118.33 116.16 1im8 n VAL 94 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.17 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 -0.08 -1.32 0.00 0.00 176.83 175.43 1im8 h GLU 95 N 0.00 0.56 0.00 5.55 4.81 -1.37 -2.58 114.58 121.54 1im8 h GLU 95 Ca 0.00 -0.46 -0.05 0.00 -0.13 0.00 0.00 59.36 58.72 1im8 h GLU 95 Cb 0.00 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1im8 h GLU 95 CO 0.00 1.09 -0.24 0.00 -0.73 0.00 0.00 179.01 179.13 1im8 h ARG 96 N 0.17 0.00 0.59 1.92 3.08 -1.82 -2.37 114.38 115.94 1im8 h ARG 96 Ca -0.04 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 1im8 h ARG 96 Cb 1.20 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.25 1im8 h ARG 96 CO 0.11 0.24 -0.28 0.00 -1.07 0.00 0.00 179.97 178.97 1im8 h ARG 98 N -1.21 0.83 -0.20 0.00 3.08 -1.48 -0.68 114.38 114.72 1im8 h ARG 98 Ca -0.08 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 59.78 1im8 h ARG 98 Cb 0.61 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1im8 h ARG 98 CO 0.13 0.55 -0.44 0.37 -1.07 0.00 0.00 179.97 179.52 1im8 h GLN 99 N 0.86 0.64 -0.81 0.04 4.15 -1.44 -0.96 115.11 117.59 1im8 h GLN 99 Ca 0.47 -0.43 0.07 0.00 0.77 0.00 0.00 58.65 59.53 1im8 h GLN 99 Cb 0.53 0.06 -0.05 0.00 0.21 0.00 0.00 27.48 28.22 1im8 h GLN 99 CO -0.29 1.05 0.53 1.25 -1.93 0.00 0.00 178.83 179.44 1im8 h HIS 100 N 0.33 0.89 0.02 3.99 2.76 -0.23 -2.69 115.15 120.22 1im8 h HIS 100 Ca 0.00 0.02 -0.26 0.00 -2.20 0.00 0.00 60.37 57.93 1im8 h HIS 100 Cb 1.04 -0.29 0.02 0.00 1.55 0.00 0.00 27.41 29.73 1im8 h HIS 100 CO 0.09 0.47 -1.03 0.82 -1.30 0.00 0.00 177.93 176.98 1im8 h ILE 101 N 0.88 1.30 0.00 6.26 2.04 -1.07 -3.18 117.51 123.74 1im8 h ILE 101 Ca 0.35 -2.26 0.00 0.00 1.00 0.00 0.00 64.86 63.95 1im8 h ILE 101 Cb 0.24 2.46 0.00 0.00 -0.74 0.00 0.00 36.82 38.78 1im8 h ILE 101 CO -0.12 0.69 0.00 0.00 0.00 0.00 0.00 178.15 178.72 1im8 n ALA 102 N -2.65 1.33 0.99 1.87 0.00 -0.37 -2.19 120.51 119.48 1im8 n ALA 102 Ca -0.11 0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.49 1im8 n ALA 102 Cb 0.88 -1.19 0.61 0.00 0.00 0.00 0.00 19.45 19.75 1im8 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1im8 n ALA 103 N -1.58 2.31 -3.08 0.00 0.00 -1.11 -4.75 120.51 112.30 1im8 n ALA 103 Ca 0.01 -0.10 -0.29 0.00 0.00 0.00 0.00 53.44 53.07 1im8 n ALA 103 Cb 0.10 -1.46 -0.17 0.00 0.00 0.00 0.00 19.45 17.92 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 -2.99 2.06 0.32 0.00 1.51 -0.93 -5.12 117.35 112.20 1im8 s TYR 104 Ca 0.14 -0.72 -0.17 0.00 -1.01 0.00 0.00 57.07 55.31 1im8 s TYR 104 Cb 0.19 -1.40 -0.09 0.00 -0.11 0.00 0.00 41.96 40.55 1im8 s TYR 104 CO 0.52 -0.28 0.77 -1.58 -1.11 0.00 0.00 175.55 173.87 1im8 s HIS 105 N 0.21 3.43 -0.16 2.71 2.46 -1.26 -5.00 115.29 117.68 1im8 s HIS 105 Ca -0.11 1.32 -0.31 0.00 0.47 0.00 0.00 55.06 56.44 1im8 s HIS 105 Cb -0.15 -2.60 0.14 0.00 -0.13 0.00 0.00 32.58 29.84 1im8 s HIS 105 CO 0.05 0.12 1.07 0.45 -2.47 0.00 0.00 174.74 173.96 1im8 s SER 106 N -2.12 -0.28 0.00 9.88 0.15 -1.26 -5.00 113.70 115.07 1im8 s SER 106 Ca 0.53 0.22 0.22 0.00 0.70 0.00 0.00 55.95 57.61 1im8 s SER 106 Cb -0.12 0.25 0.65 0.00 -1.71 0.00 0.00 66.02 65.09 1im8 s SER 106 CO 0.18 -0.32 1.50 -0.62 1.20 0.00 0.00 173.24 175.18 1im8 n GLU 107 N 0.41 1.94 -3.55 5.44 1.02 -1.26 -4.75 120.64 119.90 1im8 n GLU 107 Ca -0.07 -1.42 -0.40 0.00 -0.02 0.00 0.00 57.16 55.25 1im8 n GLU 107 Cb 0.59 -1.43 -0.11 0.00 -0.02 0.00 0.00 31.44 30.47 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 -1.73 5.14 0.55 -3.67 1.01 -1.26 -5.01 121.20 116.23 1im8 s ILE 108 Ca 0.34 -0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.47 1im8 s ILE 108 Cb 0.19 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.93 1im8 s ILE 108 CO 0.28 -0.04 1.12 -2.16 0.00 0.00 0.00 174.94 174.13 1im8 s PRO 109 N 1.69 3.35 -0.05 2.79 0.04 -1.26 -4.92 135.00 136.65 1im8 s PRO 109 Ca 0.06 1.56 0.01 0.00 0.04 0.00 0.00 61.00 62.67 1im8 s PRO 109 Cb -0.18 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.38 1im8 s PRO 109 CO 0.10 -0.84 -0.04 0.08 0.04 0.00 0.00 177.00 176.34 1im8 s VAL 110 N -1.85 0.52 -0.16 -0.36 1.01 -1.26 -1.99 120.40 116.32 1im8 s VAL 110 Ca 0.72 -0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.60 1im8 s VAL 110 Cb -0.23 -0.57 -0.00 0.00 0.00 0.00 0.00 36.38 35.58 1im8 s VAL 110 CO 0.28 0.23 -0.14 -0.70 0.00 0.00 0.00 175.10 174.76 1im8 s GLU 111 N 1.08 3.23 -0.18 2.72 2.12 -0.10 -4.99 118.70 122.58 1im8 s GLU 111 Ca -0.08 -0.74 -0.03 0.00 0.36 0.00 0.00 54.97 54.48 1im8 s GLU 111 Cb -0.14 -2.66 -0.02 0.00 0.26 0.00 0.00 34.13 31.58 1im8 s GLU 111 CO -0.01 -0.00 -0.06 0.42 -0.54 0.00 0.00 175.26 175.07 1im8 s ILE 112 N 0.86 3.44 0.08 -3.70 1.01 -1.26 -0.90 121.20 120.74 1im8 s ILE 112 Ca -0.04 -0.50 0.07 0.00 0.00 0.00 0.00 60.65 60.18 1im8 s ILE 112 Cb -0.15 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 1im8 s ILE 112 CO -0.01 0.47 -0.12 -0.76 0.00 0.00 0.00 174.94 174.52 1im8 s LEU 113 N 0.86 2.93 -0.96 2.97 1.43 0.73 -4.95 118.68 121.69 1im8 s LEU 113 Ca -0.02 -0.39 -0.09 0.00 -1.03 0.00 0.00 54.13 52.61 1im8 s LEU 113 Cb -0.15 -1.73 0.24 0.00 0.03 0.00 0.00 46.19 44.58 1im8 s LEU 113 CO 0.01 0.21 0.92 0.00 0.23 0.00 0.00 176.35 177.71 1im8 s ASN 115 N 1.33 1.14 -0.28 0.00 0.01 -1.20 -4.87 114.94 111.07 1im8 s ASN 115 Ca 0.25 -1.58 -0.14 0.00 -0.71 0.00 0.00 52.86 50.68 1im8 s ASN 115 Cb -0.10 0.57 -0.04 0.00 0.41 0.00 0.00 41.25 42.09 1im8 s ASN 115 CO -0.09 -1.12 0.34 -0.62 -1.51 0.00 0.00 177.10 174.11 1im8 s ASP 116 N -3.28 6.21 0.61 -1.22 3.68 -1.26 -1.54 116.67 119.86 1im8 s ASP 116 Ca 0.36 0.16 0.26 0.00 2.13 0.00 0.00 52.55 55.47 1im8 s ASP 116 Cb 0.02 -2.19 1.05 0.00 -1.45 0.00 0.00 42.92 40.34 1im8 s ASP 116 CO 0.22 -0.19 1.46 0.40 0.13 0.00 0.00 175.17 177.19 1im8 h ILE 117 N 5.41 0.09 0.00 4.11 2.04 -1.97 0.21 117.51 127.40 1im8 h ILE 117 Ca -0.32 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.54 1im8 h ILE 117 Cb 1.16 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1im8 h ILE 117 CO 0.64 0.00 0.00 0.54 0.00 0.00 0.00 178.15 179.33 1im8 n ARG 118 N -3.32 0.18 0.00 2.37 1.74 -1.26 -3.42 116.66 112.95 1im8 n ARG 118 Ca 0.18 0.34 0.05 0.00 -0.77 0.00 0.00 57.85 57.65 1im8 n ARG 118 Cb 1.27 -1.80 -0.05 0.00 -1.02 0.00 0.00 32.46 30.86 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 -2.14 0.00 -2.14 -1.55 8.25 0.06 -5.00 115.22 112.71 1im8 n HIS 119 Ca 0.03 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.18 1im8 n HIS 119 Cb 0.28 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.38 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 -1.88 4.66 0.20 1.59 -7.23 -1.22 -5.05 120.40 111.47 1im8 s VAL 120 Ca 0.05 0.96 -0.11 0.00 -1.81 0.00 0.00 61.98 61.07 1im8 s VAL 120 Cb 0.08 -3.81 -0.07 0.00 0.56 0.00 0.00 36.38 33.14 1im8 s VAL 120 CO 0.40 -0.94 0.55 -0.70 -0.31 0.00 0.00 175.10 174.10 1im8 s GLU 121 N -4.70 3.85 -0.10 4.82 2.12 -1.26 -5.07 118.70 118.37 1im8 s GLU 121 Ca 0.56 0.34 -0.00 0.00 0.36 0.00 0.00 54.97 56.23 1im8 s GLU 121 Cb -0.11 -2.74 0.02 0.00 0.26 0.00 0.00 34.13 31.57 1im8 s GLU 121 CO 0.44 0.37 -0.07 0.42 -0.54 0.00 0.00 175.26 175.88 1im8 s ILE 122 N -1.70 0.94 0.00 -3.70 1.01 -1.26 -5.13 121.20 111.36 1im8 s ILE 122 Ca 0.44 -0.25 -0.10 0.00 0.00 0.00 0.00 60.65 60.74 1im8 s ILE 122 Cb -0.12 -0.96 0.01 0.00 0.01 0.00 0.00 42.46 41.39 1im8 s ILE 122 CO 0.20 0.35 0.19 -1.59 0.00 0.00 0.00 174.94 174.09 1im8 s LYS 123 N 1.58 0.56 -1.63 2.79 -2.85 -1.26 -4.12 119.74 114.82 1im8 s LYS 123 Ca 0.02 -0.36 -0.15 0.00 -1.00 0.00 0.00 55.97 54.48 1im8 s LYS 123 Cb -0.13 0.24 0.12 0.00 -2.06 0.00 0.00 37.83 36.00 1im8 s LYS 123 CO -0.06 -0.14 0.79 -1.71 0.10 0.00 0.00 175.35 174.32 1im8 n ASN 124 N 1.32 -3.26 -4.83 0.03 5.15 -1.04 -4.62 115.26 108.01 1im8 n ASN 124 Ca -0.22 -0.96 -0.38 0.00 -0.60 0.00 0.00 54.58 52.43 1im8 n ASN 124 Cb 0.56 -3.06 -0.06 0.00 -0.53 0.00 0.00 39.78 36.68 1im8 n ASN 124 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1im8 s ALA 125 N -3.38 3.71 -1.63 5.20 0.00 -0.91 -0.64 121.76 124.11 1im8 s ALA 125 Ca 0.63 -0.31 0.21 0.00 0.00 0.00 0.00 51.96 52.48 1im8 s ALA 125 Cb -0.33 -2.33 0.66 0.00 0.00 0.00 0.00 23.12 21.12 1im8 s ALA 125 CO 0.90 0.44 1.56 -1.13 0.00 0.00 0.00 175.76 177.53 1im8 n SER 126 N 2.14 4.22 -3.64 0.00 3.41 -0.73 -0.76 113.62 118.26 1im8 n SER 126 Ca -0.14 -2.16 -0.08 0.00 -0.26 0.00 0.00 58.87 56.23 1im8 n SER 126 Cb 0.53 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.89 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 -1.31 0.00 -0.15 -3.33 1.01 0.10 -0.98 120.40 115.74 1im8 s VAL 128 Ca 0.49 0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.49 1im8 s VAL 128 Cb 0.28 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.67 1im8 s VAL 128 CO 0.30 0.00 -0.21 -0.63 0.00 0.00 0.00 175.10 174.56 1im8 s ILE 129 N 0.41 2.12 -0.60 2.22 1.01 -0.44 -0.53 121.20 125.39 1im8 s ILE 129 Ca 0.01 -0.95 0.04 0.00 0.00 0.00 0.00 60.65 59.76 1im8 s ILE 129 Cb -0.05 -1.86 0.16 0.00 0.01 0.00 0.00 42.46 40.71 1im8 s ILE 129 CO -0.08 0.54 0.39 -0.76 0.00 0.00 0.00 174.94 175.03 1im8 s LEU 130 N 0.98 4.10 -0.92 2.97 1.43 -0.44 -0.35 118.68 126.45 1im8 s LEU 130 Ca -0.03 -3.42 -0.16 0.00 -1.03 0.00 0.00 54.13 49.49 1im8 s LEU 130 Cb -0.15 -1.45 0.18 0.00 0.03 0.00 0.00 46.19 44.80 1im8 s LEU 130 CO -0.05 -0.15 1.01 0.21 0.23 0.00 0.00 176.35 177.59 1im8 s ASN 131 N -0.80 6.75 -0.72 2.29 2.47 -1.26 -1.96 114.94 121.71 1im8 s ASN 131 Ca 0.23 -2.46 -0.04 0.00 0.42 0.00 0.00 52.86 51.01 1im8 s ASN 131 Cb -0.11 -2.31 0.00 0.00 -1.45 0.00 0.00 41.25 37.38 1im8 s ASN 131 CO -0.11 -0.80 0.58 0.49 -3.72 0.00 0.00 177.10 173.54 1im8 n PHE 132 N 5.25 -1.45 -0.01 0.43 3.01 0.37 -4.92 117.46 120.14 1im8 n PHE 132 Ca 0.21 0.50 -0.01 0.00 1.01 0.00 0.00 57.45 59.15 1im8 n PHE 132 Cb 0.47 -3.07 -0.02 0.00 -0.01 0.00 0.00 39.48 36.85 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 -3.83 0.16 -0.15 4.37 -1.04 -1.26 -4.71 114.28 107.82 1im8 n THR 133 Ca -0.00 -0.08 0.06 0.00 -2.04 0.00 0.00 64.05 61.99 1im8 n THR 133 Cb 0.54 -0.80 0.37 0.00 -1.82 0.00 0.00 70.33 68.61 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 0.00 0.63 -2.77 -4.42 5.85 -1.87 -0.52 115.31 112.21 1im8 h LEU 134 Ca -0.06 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 1im8 h LEU 134 Cb 1.12 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 1im8 h LEU 134 CO -0.00 0.42 -0.00 0.06 -0.34 0.00 0.00 178.44 178.57 1im8 h GLN 135 N 0.72 0.00 -0.01 1.25 3.07 -1.89 -0.61 115.11 117.64 1im8 h GLN 135 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.03 1im8 h GLN 135 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.77 1im8 h GLN 135 CO -0.09 0.00 -0.02 1.19 0.09 0.00 0.00 178.83 180.01 1im8 n PHE 136 N -3.21 0.00 -3.67 0.06 3.01 -0.20 -4.47 117.46 108.98 1im8 n PHE 136 Ca -0.03 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.15 1im8 n PHE 136 Cb 0.10 -0.01 -0.03 0.00 -0.01 0.00 0.00 39.48 39.52 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 -2.04 4.23 0.34 4.37 1.02 -0.24 -5.04 118.68 121.33 1im8 s LEU 137 Ca 0.38 0.45 -0.29 0.00 0.02 0.00 0.00 54.13 54.69 1im8 s LEU 137 Cb 0.21 -3.21 -0.11 0.00 0.02 0.00 0.00 46.19 43.10 1im8 s LEU 137 CO 0.35 -0.03 1.41 -2.84 0.02 0.00 0.00 176.35 175.26 1im8 s PRO 138 N -3.19 4.23 0.40 1.29 0.01 -1.26 -4.86 135.00 131.62 1im8 s PRO 138 Ca 0.39 2.40 0.19 0.00 0.01 0.00 0.00 61.00 63.99 1im8 s PRO 138 Cb -0.11 -3.03 1.12 0.00 0.01 0.00 0.00 34.50 32.49 1im8 s PRO 138 CO 0.28 -0.37 1.76 -1.35 0.01 0.00 0.00 177.00 177.33 1im8 h PRO 139 N 3.37 0.36 0.00 5.54 0.10 -1.92 0.25 132.00 139.71 1im8 h PRO 139 Ca -0.50 -0.02 0.00 0.00 0.10 0.00 0.00 66.00 65.58 1im8 h PRO 139 Cb 1.23 -0.08 0.00 0.00 0.10 0.00 0.00 31.00 32.25 1im8 h PRO 139 CO 0.66 0.24 0.00 -0.85 0.10 0.00 0.00 178.00 178.15 1im8 n GLU 140 N -4.65 0.49 -0.00 1.05 0.28 -1.26 -2.76 120.64 113.79 1im8 n GLU 140 Ca 0.26 0.04 0.09 0.00 -0.16 0.00 0.00 57.16 57.39 1im8 n GLU 140 Cb 0.92 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 32.18 1im8 n GLU 140 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1im8 n ASP 141 N -1.14 0.83 -0.08 -1.84 8.00 0.89 -4.64 116.55 118.57 1im8 n ASP 141 Ca 0.13 -0.76 -0.07 0.00 0.71 0.00 0.00 54.79 54.80 1im8 n ASP 141 Cb 0.12 1.15 0.11 0.00 -0.02 0.00 0.00 41.12 42.47 1im8 n ASP 141 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1im8 h ARG 142 N 0.00 0.75 -0.37 -1.24 3.08 -1.53 -2.74 114.38 112.34 1im8 h ARG 142 Ca 0.00 -0.29 -0.16 0.00 0.07 0.00 0.00 59.98 59.60 1im8 h ARG 142 Cb 0.50 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1im8 h ARG 142 CO 0.00 0.89 -0.40 0.82 -1.07 0.00 0.00 179.97 180.21 1im8 h ILE 143 N 0.67 1.27 -0.40 2.04 2.04 -1.82 -1.76 117.51 119.55 1im8 h ILE 143 Ca 0.10 -1.57 -0.03 0.00 1.00 0.00 0.00 64.86 64.36 1im8 h ILE 143 Cb 0.69 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 1im8 h ILE 143 CO 0.05 0.52 0.14 0.00 0.00 0.00 0.00 178.15 178.87 1im8 h ALA 144 N 0.81 0.52 0.08 1.87 0.00 -1.85 0.20 119.26 120.88 1im8 h ALA 144 Ca 0.06 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1im8 h ALA 144 Cb 0.98 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1im8 h ALA 144 CO 0.10 0.15 -0.04 1.25 0.00 0.00 0.00 179.25 180.70 1im8 h LEU 145 N 0.50 -0.09 -1.92 0.00 5.85 -1.42 -0.19 115.31 118.04 1im8 h LEU 145 Ca 0.13 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1im8 h LEU 145 Cb 0.22 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 1im8 h LEU 145 CO -0.01 -0.01 -0.08 -0.07 -0.34 0.00 0.00 178.44 177.93 1im8 h LEU 146 N -0.16 0.00 -0.16 2.25 3.38 -1.16 0.88 115.31 120.33 1im8 h LEU 146 Ca -0.01 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 1im8 h LEU 146 Cb 0.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.89 1im8 h LEU 146 CO 0.02 0.08 -0.63 0.74 0.09 0.00 0.00 178.44 178.74 1im8 h THR 147 N 0.00 1.31 -0.63 0.22 2.02 -0.24 0.64 112.91 116.22 1im8 h THR 147 Ca -0.00 -1.86 -0.08 0.00 0.77 0.00 0.00 66.41 65.24 1im8 h THR 147 Cb 0.16 2.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.54 1im8 h THR 147 CO 0.01 0.58 0.10 0.50 0.37 0.00 0.00 175.52 177.08 1im8 h LYS 148 N 0.40 1.04 -0.29 6.66 3.64 0.03 -0.37 116.57 127.68 1im8 h LYS 148 Ca -0.03 -0.27 -0.04 0.00 -1.27 0.00 0.00 60.65 59.03 1im8 h LYS 148 Cb 1.26 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 1im8 h LYS 148 CO 0.13 0.96 0.01 0.82 -2.27 0.00 0.00 179.45 179.11 1im8 h ILE 149 N 0.98 1.25 -0.74 2.00 2.04 -0.80 0.11 117.51 122.35 1im8 h ILE 149 Ca 0.19 -0.89 0.02 0.00 1.00 0.00 0.00 64.86 65.19 1im8 h ILE 149 Cb 0.43 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 1im8 h ILE 149 CO 0.01 0.29 0.47 0.22 0.00 0.00 0.00 178.15 179.14 1im8 h TYR 150 N 0.30 0.89 -0.13 1.37 3.20 -0.55 -2.37 116.97 119.66 1im8 h TYR 150 Ca 0.08 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.85 1im8 h TYR 150 Cb 0.40 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1im8 h TYR 150 CO 0.03 0.52 -0.47 0.93 -1.64 0.00 0.00 178.16 177.54 1im8 h GLU 151 N 0.93 0.34 0.00 1.82 4.39 -0.79 -3.03 114.58 118.25 1im8 h GLU 151 Ca 0.29 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1im8 h GLU 151 Cb -0.02 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 1im8 h GLU 151 CO -0.09 0.74 0.00 0.41 -1.16 0.00 0.00 179.01 178.91 1im8 n GLY 152 N 0.00 -1.46 3.82 -3.84 0.00 0.00 -4.81 105.19 98.90 1im8 n GLY 152 Ca -0.02 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 1im8 n GLY 152 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1im8 s LEU 153 N -3.98 4.20 0.76 0.99 1.43 -0.93 -2.13 118.68 119.02 1im8 s LEU 153 Ca 0.09 1.46 -0.10 0.00 -1.03 0.00 0.00 54.13 54.55 1im8 s LEU 153 Cb 0.13 -3.92 0.06 0.00 0.03 0.00 0.00 46.19 42.49 1im8 s LEU 153 CO 0.49 -0.11 1.12 0.20 0.23 0.00 0.00 176.35 178.28 1im8 s ASN 154 N -1.92 4.74 0.37 2.29 0.01 0.06 -4.83 114.94 115.66 1im8 s ASN 154 Ca 0.50 0.74 -0.28 0.00 -0.71 0.00 0.00 52.86 53.11 1im8 s ASN 154 Cb -0.14 -1.33 -0.11 0.00 0.41 0.00 0.00 41.25 40.08 1im8 s ASN 154 CO 0.19 -1.72 1.39 -2.65 -1.51 0.00 0.00 177.10 172.79 1im8 n PRO 155 N -3.15 2.38 -0.90 -0.60 -0.02 -1.26 -0.89 135.00 130.55 1im8 n PRO 155 Ca 0.08 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 1im8 n PRO 155 Cb 0.60 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1im8 n PRO 155 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1im8 n ASN 156 N 0.55 -2.01 -4.77 2.55 3.02 -1.26 -4.99 115.26 108.34 1im8 n ASN 156 Ca 0.03 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.27 1im8 n ASN 156 Cb 0.38 -1.28 0.09 0.00 -0.61 0.00 0.00 39.78 38.36 1im8 n ASN 156 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1im8 s GLY 157 N -2.00 1.67 -0.03 7.41 0.00 -0.07 -4.64 107.32 109.66 1im8 s GLY 157 Ca 0.00 0.25 0.04 0.00 0.00 0.00 0.00 44.72 45.01 1im8 s GLY 157 CO 0.00 0.59 -0.16 0.14 0.00 0.00 0.00 173.10 173.67 1im8 s VAL 158 N -2.92 1.31 -0.21 1.40 1.01 -0.15 -0.29 120.40 120.55 1im8 s VAL 158 Ca 0.61 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 1im8 s VAL 158 Cb -0.17 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1im8 s VAL 158 CO 0.56 0.38 0.01 -0.22 0.00 0.00 0.00 175.10 175.82 1im8 s LEU 159 N -0.11 3.24 -0.27 3.92 2.96 -0.36 0.00 118.68 128.07 1im8 s LEU 159 Ca 0.00 -0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 53.59 1im8 s LEU 159 Cb -0.09 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 1im8 s LEU 159 CO 0.01 0.04 0.14 -0.69 -1.32 0.00 0.00 176.35 174.53 1im8 s VAL 160 N 1.15 4.88 -0.29 1.68 1.01 0.31 -1.18 120.40 127.96 1im8 s VAL 160 Ca 0.03 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.03 1im8 s VAL 160 Cb -0.14 -3.32 0.08 0.00 0.00 0.00 0.00 36.38 32.99 1im8 s VAL 160 CO 0.01 0.27 -0.03 -0.22 0.00 0.00 0.00 175.10 175.13 1im8 s LEU 161 N 1.69 3.92 -0.15 3.92 2.96 -1.26 -1.33 118.68 128.44 1im8 s LEU 161 Ca 0.07 -1.72 -0.12 0.00 -0.22 0.00 0.00 54.13 52.14 1im8 s LEU 161 Cb -0.16 -1.54 -0.05 0.00 0.50 0.00 0.00 46.19 44.95 1im8 s LEU 161 CO 0.08 -0.28 0.23 -0.44 -1.32 0.00 0.00 176.35 174.61 1im8 s SER 162 N 1.05 6.39 0.19 3.68 0.01 -0.83 -4.38 113.70 119.81 1im8 s SER 162 Ca 0.00 0.45 -0.09 0.00 1.31 0.00 0.00 55.95 57.63 1im8 s SER 162 Cb -0.19 -2.14 -0.01 0.00 0.21 0.00 0.00 66.02 63.88 1im8 s SER 162 CO -0.07 0.19 0.32 -1.61 0.41 0.00 0.00 173.24 172.48 1im8 s GLU 163 N 0.08 1.25 -0.13 12.44 0.41 -0.19 -0.48 118.70 132.08 1im8 s GLU 163 Ca 0.14 -1.23 -0.16 0.00 -0.41 0.00 0.00 54.97 53.31 1im8 s GLU 163 Cb -0.12 0.39 -0.04 0.00 -1.78 0.00 0.00 34.13 32.57 1im8 s GLU 163 CO 0.03 -0.47 0.38 0.21 -0.49 0.00 0.00 175.26 174.92 1im8 s LYS 164 N -4.00 4.27 0.18 1.61 2.20 -1.26 -2.04 119.74 120.70 1im8 s LYS 164 Ca 0.21 0.27 0.05 0.00 -0.36 0.00 0.00 55.97 56.14 1im8 s LYS 164 Cb 0.03 -3.42 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 1im8 s LYS 164 CO 0.03 0.23 0.18 -0.06 -0.36 0.00 0.00 175.35 175.38 1im8 s PHE 165 N 0.44 3.22 0.21 4.03 0.40 0.98 -4.37 117.98 122.89 1im8 s PHE 165 Ca 0.21 -0.01 0.07 0.00 -0.60 0.00 0.00 56.93 56.60 1im8 s PHE 165 Cb -0.14 -1.52 -0.04 0.00 0.51 0.00 0.00 43.02 41.83 1im8 s PHE 165 CO 0.07 0.52 0.08 -0.98 0.70 0.00 0.00 175.22 175.61 1im8 s ARG 166 N -3.29 2.62 -0.14 0.44 1.70 -0.81 -4.83 118.95 114.64 1im8 s ARG 166 Ca 0.32 -1.10 0.02 0.00 -0.47 0.00 0.00 55.73 54.49 1im8 s ARG 166 Cb -0.10 -2.43 0.02 0.00 -0.57 0.00 0.00 34.95 31.86 1im8 s ARG 166 CO 0.25 0.43 -0.18 -0.06 -1.08 0.00 0.00 175.30 174.66 1im8 s PHE 167 N -1.95 2.40 0.33 5.89 0.40 -1.26 -3.77 117.98 120.03 1im8 s PHE 167 Ca 0.30 -1.26 0.12 0.00 -0.60 0.00 0.00 56.93 55.49 1im8 s PHE 167 Cb -0.09 -1.68 0.97 0.00 0.51 0.00 0.00 43.02 42.73 1im8 s PHE 167 CO 0.21 -0.62 1.71 1.49 0.70 0.00 0.00 175.22 178.71 1im8 h GLU 168 N 7.61 0.47 -6.30 0.44 4.57 -1.99 -3.37 114.58 116.00 1im8 h GLU 168 Ca -0.36 -0.03 -0.53 0.00 -1.18 0.00 0.00 59.36 57.26 1im8 h GLU 168 Cb 1.17 -0.11 -0.07 0.00 -0.16 0.00 0.00 28.75 29.58 1im8 h GLU 168 CO 0.55 0.31 1.11 0.34 -1.18 0.00 0.00 179.01 180.14 1im8 s ASP 169 N -5.11 6.02 0.28 1.04 -1.08 -1.26 -4.91 116.67 111.66 1im8 s ASP 169 Ca -0.10 -0.28 -0.05 0.00 -0.52 0.00 0.00 52.55 51.60 1im8 s ASP 169 Cb 0.28 -2.55 0.55 0.00 -1.46 0.00 0.00 42.92 39.74 1im8 s ASP 169 CO 0.80 -1.91 1.58 0.74 0.52 0.00 0.00 175.17 176.89 1im8 h THR 170 N 6.19 0.07 -0.60 1.71 2.02 -1.99 0.13 112.91 120.43 1im8 h THR 170 Ca -0.28 -0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.83 1im8 h THR 170 Cb 1.07 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1im8 h THR 170 CO 1.26 0.00 0.10 0.11 0.37 0.00 0.00 175.52 177.37 1im8 h LYS 171 N 0.01 0.99 -0.42 6.66 1.57 -1.93 -1.97 116.57 121.49 1im8 h LYS 171 Ca 0.51 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.93 1im8 h LYS 171 Cb 0.90 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 1im8 h LYS 171 CO -0.93 0.93 -0.11 0.82 -0.57 0.00 0.00 179.45 179.60 1im8 h ILE 172 N 0.90 1.27 -0.99 1.86 2.04 -1.31 -1.27 117.51 120.00 1im8 h ILE 172 Ca 0.18 -1.21 0.09 0.00 1.00 0.00 0.00 64.86 64.92 1im8 h ILE 172 Cb 0.41 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 37.62 1im8 h ILE 172 CO 0.01 0.41 0.64 -1.13 0.00 0.00 0.00 178.15 178.08 1im8 h ASN 173 N 0.63 0.98 -0.02 1.72 -1.24 -0.67 0.62 115.58 117.60 1im8 h ASN 173 Ca 0.10 0.02 -0.23 0.00 0.71 0.00 0.00 56.30 56.91 1im8 h ASN 173 Cb 0.64 -0.18 0.01 0.00 0.73 0.00 0.00 38.32 39.52 1im8 h ASN 173 CO 0.04 0.58 -0.85 0.45 -1.29 0.00 0.00 177.43 176.37 1im8 h HIS 174 N 1.08 0.96 -0.45 0.67 3.86 -1.11 -0.84 115.15 119.31 1im8 h HIS 174 Ca 0.46 -0.45 0.04 0.00 -1.16 0.00 0.00 60.37 59.25 1im8 h HIS 174 Cb 0.31 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.60 1im8 h HIS 174 CO -0.00 1.28 0.22 -0.07 0.86 0.00 0.00 177.93 180.21 1im8 h LEU 175 N 0.45 0.31 -0.46 2.43 3.38 -0.29 -0.56 115.31 120.57 1im8 h LEU 175 Ca -0.07 0.03 -0.16 0.00 0.09 0.00 0.00 57.88 57.77 1im8 h LEU 175 Cb 1.47 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 1im8 h LEU 175 CO 0.17 0.22 -0.41 -0.07 0.09 0.00 0.00 178.44 178.43 1im8 h LEU 176 N 0.44 0.88 -1.06 1.67 3.38 -0.86 -2.16 115.31 117.60 1im8 h LEU 176 Ca 0.20 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1im8 h LEU 176 Cb 0.12 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1im8 h LEU 176 CO -0.15 1.18 0.47 0.40 0.09 0.00 0.00 178.44 180.43 1im8 h ILE 177 N 0.67 1.23 -0.31 1.22 2.04 -0.83 0.53 117.51 122.06 1im8 h ILE 177 Ca 0.05 -0.54 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1im8 h ILE 177 Cb 0.99 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1im8 h ILE 177 CO 0.09 0.25 0.13 -0.78 0.00 0.00 0.00 178.15 177.85 1im8 h ASP 178 N 1.13 0.42 -0.65 1.72 -0.00 -0.93 0.22 116.42 118.33 1im8 h ASP 178 Ca 0.29 -0.16 -0.02 0.00 -0.00 0.00 0.00 57.03 57.15 1im8 h ASP 178 Cb -0.01 -0.11 -0.03 0.00 -0.00 0.00 0.00 39.33 39.18 1im8 h ASP 178 CO -0.05 0.46 0.35 -0.07 -0.00 0.00 0.00 179.24 179.93 1im8 h LEU 179 N 0.35 0.84 -0.74 2.28 3.38 -0.90 0.39 115.31 120.91 1im8 h LEU 179 Ca 0.10 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1im8 h LEU 179 Cb 0.17 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1im8 h LEU 179 CO -0.01 0.69 0.19 -0.74 0.09 0.00 0.00 178.44 178.66 1im8 h HIS 180 N 0.94 1.20 -0.09 1.13 2.76 -0.29 -1.57 115.15 119.23 1im8 h HIS 180 Ca 0.24 -0.14 -0.11 0.00 -2.20 0.00 0.00 60.37 58.16 1im8 h HIS 180 Cb 0.05 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 28.65 1im8 h HIS 180 CO 0.01 0.96 -0.45 0.45 -1.30 0.00 0.00 177.93 177.60 1im8 h HIS 181 N 1.10 0.26 -0.61 5.26 3.86 0.12 -1.43 115.15 123.71 1im8 h HIS 181 Ca 0.23 -0.08 -0.07 0.00 -1.16 0.00 0.00 60.37 59.30 1im8 h HIS 181 Cb 0.35 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.74 1im8 h HIS 181 CO 0.03 0.63 0.11 0.37 0.86 0.00 0.00 177.93 179.93 1im8 h GLN 182 N 0.18 0.98 -0.22 2.45 4.15 0.11 -2.10 115.11 120.66 1im8 h GLN 182 Ca 0.01 -0.24 -0.04 0.00 0.77 0.00 0.00 58.65 59.15 1im8 h GLN 182 Cb 0.87 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.42 1im8 h GLN 182 CO 0.07 0.90 -0.01 0.35 -1.93 0.00 0.00 178.83 178.21 1im8 h PHE 183 N 0.93 0.43 -0.98 3.99 3.57 -1.00 -0.89 116.94 122.99 1im8 h PHE 183 Ca 0.19 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.64 1im8 h PHE 183 Cb 0.39 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 1im8 h PHE 183 CO 0.03 0.59 0.65 0.87 -2.23 0.00 0.00 178.31 178.21 1im8 h LYS 184 N 0.15 1.25 -0.06 1.11 1.57 -1.16 -1.93 116.57 117.50 1im8 h LYS 184 Ca 0.06 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1im8 h LYS 184 Cb 0.42 -0.28 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 1im8 h LYS 184 CO 0.01 0.82 -0.02 0.00 -0.57 0.00 0.00 179.45 179.69 1im8 h ARG 185 N 1.28 0.11 -0.90 3.15 3.08 -1.26 0.20 114.38 120.05 1im8 h ARG 185 Ca 0.38 -0.05 0.22 0.00 0.07 0.00 0.00 59.98 60.60 1im8 h ARG 185 Cb -0.07 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.92 1im8 h ARG 185 CO -0.10 0.48 0.61 0.00 -1.07 0.00 0.00 179.97 179.89 1im8 h ALA 186 N 0.63 2.40 -0.10 0.04 0.00 -0.89 0.84 119.26 122.18 1im8 h ALA 186 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1im8 h ALA 186 Cb 0.45 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1im8 h ALA 186 CO 0.01 -0.68 0.00 0.09 0.00 0.00 0.00 179.25 178.67 1im8 n ASN 187 N -4.44 2.20 -2.44 0.00 3.02 -0.75 -4.95 115.26 107.89 1im8 n ASN 187 Ca 0.19 -1.74 -0.15 0.00 -0.03 0.00 0.00 54.58 52.85 1im8 n ASN 187 Cb 0.78 -0.06 0.05 0.00 -0.61 0.00 0.00 39.78 39.95 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 1.26 0.01 0.28 7.41 0.00 0.29 -4.93 105.19 109.50 1im8 n GLY 188 Ca 0.17 -0.09 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.67 0.77 0.00 1.61 3.20 -0.83 -2.30 116.97 117.74 1im8 h TYR 189 Ca -0.36 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.54 1im8 h TYR 189 Cb 1.23 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.26 1im8 h TYR 189 CO 0.31 0.37 0.00 -1.13 -1.64 0.00 0.00 178.16 176.07 1im8 n SER 190 N -4.74 0.00 0.25 -2.11 3.41 -1.26 -1.59 113.62 107.58 1im8 n SER 190 Ca 0.10 0.39 0.13 0.00 -0.26 0.00 0.00 58.87 59.23 1im8 n SER 190 Cb 0.18 -0.41 0.59 0.00 -0.26 0.00 0.00 64.21 64.31 1im8 n SER 190 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1im8 h GLU 191 N 0.00 0.00 -6.80 4.33 4.81 -1.80 -3.44 114.58 111.69 1im8 h GLU 191 Ca 0.00 0.00 -0.50 0.00 -0.13 0.00 0.00 59.36 58.73 1im8 h GLU 191 Cb 0.05 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.44 1im8 h GLU 191 CO 0.00 0.13 0.45 -0.51 -0.73 0.00 0.00 179.01 178.35 1im8 s LEU 192 N -6.63 4.57 0.15 1.64 1.43 -0.62 -4.95 118.68 114.27 1im8 s LEU 192 Ca 0.00 2.22 -0.15 0.00 -1.03 0.00 0.00 54.13 55.16 1im8 s LEU 192 Cb 0.10 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.72 1im8 s LEU 192 CO 0.59 -0.09 1.74 -0.08 0.23 0.00 0.00 176.35 178.74 1im8 h GLU 193 N 3.88 0.62 0.00 1.70 4.57 -1.90 -2.29 114.58 121.17 1im8 h GLU 193 Ca -0.46 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 57.63 1im8 h GLU 193 Cb 1.21 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 1im8 h GLU 193 CO 0.67 0.51 0.00 1.55 -1.18 0.00 0.00 179.01 180.56 1im8 n VAL 194 N -4.68 1.15 -0.33 0.32 3.14 -1.26 -4.17 118.33 112.49 1im8 n VAL 194 Ca 0.01 0.34 0.09 0.00 -2.96 0.00 0.00 64.34 61.82 1im8 n VAL 194 Cb 0.10 -1.20 0.20 0.00 -1.06 0.00 0.00 33.84 31.87 1im8 n VAL 194 CO 0.00 0.00 0.00 -1.28 -6.46 0.00 0.00 176.83 169.09 1im8 h SER 195 N 0.00 -0.67 0.20 6.55 0.87 -1.70 -0.76 113.55 118.03 1im8 h SER 195 Ca 0.00 0.28 -0.28 0.00 -1.23 0.00 0.00 61.79 60.56 1im8 h SER 195 Cb 0.21 0.53 0.03 0.00 -0.44 0.00 0.00 62.40 62.72 1im8 h SER 195 CO 0.00 -0.32 -1.25 1.56 -0.53 0.00 0.00 176.83 176.29 1im8 h GLN 196 N 0.01 0.42 -0.43 2.24 4.20 -1.81 -1.35 115.11 118.39 1im8 h GLN 196 Ca 0.51 -0.71 0.02 0.00 0.06 0.00 0.00 58.65 58.53 1im8 h GLN 196 Cb 0.92 0.26 -0.03 0.00 0.30 0.00 0.00 27.48 28.93 1im8 h GLN 196 CO -0.93 1.34 0.26 0.87 -0.67 0.00 0.00 178.83 179.70 1im8 h LYS 197 N -0.09 0.50 -0.17 1.46 1.57 -1.80 0.14 116.57 118.18 1im8 h LYS 197 Ca -0.23 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.55 1im8 h LYS 197 Cb 1.93 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 34.10 1im8 h LYS 197 CO 0.20 0.33 -0.02 -0.09 -0.57 0.00 0.00 179.45 179.30 1im8 h ARG 198 N 0.52 0.02 -0.06 3.15 1.12 -1.21 -1.17 114.38 116.75 1im8 h ARG 198 Ca 0.17 -0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 59.01 1im8 h ARG 198 Cb -0.00 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 29.95 1im8 h ARG 198 CO -0.07 0.01 -0.10 1.15 -3.11 0.00 0.00 179.97 177.85 1im8 h THR 199 N 0.02 1.11 -0.34 0.20 2.02 -0.58 -1.65 112.91 113.69 1im8 h THR 199 Ca 0.08 -0.48 -0.15 0.00 0.77 0.00 0.00 66.41 66.63 1im8 h THR 199 Cb 0.11 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1im8 h THR 199 CO -0.16 0.15 -0.38 0.00 0.37 0.00 0.00 175.52 175.50 1im8 h ALA 200 N 1.82 0.69 -0.15 6.16 0.00 0.16 -2.89 119.26 125.06 1im8 h ALA 200 Ca 0.02 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 1im8 h ALA 200 Cb 0.23 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1im8 h ALA 200 CO 0.01 0.67 0.09 1.25 0.00 0.00 0.00 179.25 181.27 1im8 h LEU 201 N 0.66 0.18 -1.56 0.00 5.85 -0.32 -2.55 115.31 117.57 1im8 h LEU 201 Ca 0.06 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1im8 h LEU 201 Cb 0.94 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 1im8 h LEU 201 CO 0.09 0.18 0.34 -0.33 -0.34 0.00 0.00 178.44 178.38 1im8 h GLU 202 N 0.16 0.56 -0.38 1.25 5.08 -1.39 -1.69 114.58 118.17 1im8 h GLU 202 Ca 0.05 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1im8 h GLU 202 Cb 0.04 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1im8 h GLU 202 CO -0.01 0.37 0.26 -0.91 -1.00 0.00 0.00 179.01 177.72 1im8 h ASN 203 N 0.58 0.37 -3.85 1.42 2.35 -1.24 -3.46 115.58 111.75 1im8 h ASN 203 Ca 0.21 -0.01 -0.76 0.00 -0.55 0.00 0.00 56.30 55.19 1im8 h ASN 203 Cb 0.10 -0.09 -0.29 0.00 0.05 0.00 0.00 38.32 38.09 1im8 h ASN 203 CO -0.05 0.26 0.02 -0.69 -1.65 0.00 0.00 177.43 175.32 1im8 s VAL 204 N -5.41 5.12 -0.33 2.81 1.01 -0.64 -5.13 120.40 117.84 1im8 s VAL 204 Ca -0.08 -2.81 -0.00 0.00 0.00 0.00 0.00 61.98 59.09 1im8 s VAL 204 Cb 0.18 -4.18 0.13 0.00 0.00 0.00 0.00 36.38 32.51 1im8 s VAL 204 CO 0.72 -1.02 0.24 -0.13 0.00 0.00 0.00 175.10 174.92 1im8 s ARG 206 N -0.18 0.45 0.33 2.72 0.52 -1.26 -5.10 118.95 116.43 1im8 s ARG 206 Ca 0.20 -0.87 -0.01 0.00 -0.52 0.00 0.00 55.73 54.53 1im8 s ARG 206 Cb -0.12 -1.04 -0.04 0.00 0.52 0.00 0.00 34.95 34.27 1im8 s ARG 206 CO -0.08 -1.14 0.54 0.95 0.02 0.00 0.00 175.30 175.60 1im8 s THR 207 N 1.57 5.10 0.27 0.02 -4.23 -1.26 -4.87 115.64 112.23 1im8 s THR 207 Ca 0.14 -0.35 0.09 0.00 -1.18 0.00 0.00 61.69 60.39 1im8 s THR 207 Cb -0.18 -3.83 -0.04 0.00 1.34 0.00 0.00 72.50 69.78 1im8 s THR 207 CO -0.13 -0.49 0.03 -1.81 -0.54 0.00 0.00 174.62 171.67 1im8 s ASP 208 N -3.82 4.68 0.83 3.99 -0.00 -1.26 -4.69 116.67 116.40 1im8 s ASP 208 Ca 0.41 -0.60 -0.12 0.00 -0.00 0.00 0.00 52.55 52.23 1im8 s ASP 208 Cb -0.10 -0.91 0.10 0.00 -0.00 0.00 0.00 42.92 42.01 1im8 s ASP 208 CO 0.35 -0.01 1.20 -0.94 -0.00 0.00 0.00 175.17 175.76 1im8 s SER 209 N -3.70 4.29 0.20 0.27 1.04 -1.25 -1.92 113.70 112.63 1im8 s SER 209 Ca 0.32 0.69 -0.06 0.00 0.48 0.00 0.00 55.95 57.38 1im8 s SER 209 Cb -0.06 -1.11 0.15 0.00 0.10 0.00 0.00 66.02 65.09 1im8 s SER 209 CO 0.21 -2.03 1.63 0.40 0.98 0.00 0.00 173.24 174.43 1im8 h ILE 210 N -1.14 1.27 -0.66 -1.02 2.04 -1.97 -2.40 117.51 113.63 1im8 h ILE 210 Ca -0.46 -1.26 -0.07 0.00 1.00 0.00 0.00 64.86 64.07 1im8 h ILE 210 Cb 1.31 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 38.42 1im8 h ILE 210 CO 0.61 0.43 0.13 -0.08 0.00 0.00 0.00 178.15 179.25 1im8 h GLU 211 N 0.79 1.06 -0.46 2.37 4.81 -1.93 -1.48 114.58 119.74 1im8 h GLU 211 Ca 0.12 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1im8 h GLU 211 Cb 0.67 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1im8 h GLU 211 CO 0.05 0.95 0.23 1.15 -0.73 0.00 0.00 179.01 180.66 1im8 h THR 212 N 1.00 1.18 -0.38 0.32 2.02 -1.88 -0.95 112.91 114.22 1im8 h THR 212 Ca 0.20 -0.51 0.02 0.00 0.77 0.00 0.00 66.41 66.89 1im8 h THR 212 Cb 0.39 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1im8 h THR 212 CO 0.01 0.20 0.23 0.45 0.37 0.00 0.00 175.52 176.77 1im8 h HIS 213 N 0.61 0.42 -0.03 3.16 3.86 -1.08 -2.23 115.15 119.86 1im8 h HIS 213 Ca 0.16 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.38 1im8 h HIS 213 Cb 0.11 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.44 1im8 h HIS 213 CO -0.01 0.25 0.01 0.87 0.86 0.00 0.00 177.93 179.91 1im8 h LYS 214 N 0.46 0.05 -0.89 2.45 1.57 -1.09 -1.08 116.57 118.03 1im8 h LYS 214 Ca 0.15 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.97 1im8 h LYS 214 Cb 0.00 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 1im8 h LYS 214 CO -0.07 0.23 0.58 0.28 -0.57 0.00 0.00 179.45 179.91 1im8 h VAL 215 N -0.15 1.10 -0.19 0.50 2.07 -1.08 -0.35 116.25 118.15 1im8 h VAL 215 Ca 0.01 -0.36 -0.19 0.00 0.82 0.00 0.00 66.70 66.97 1im8 h VAL 215 Cb 0.21 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 1im8 h VAL 215 CO -0.00 0.19 -0.65 -0.09 0.02 0.00 0.00 177.57 177.04 1im8 h ARG 216 N 1.05 0.72 -0.33 1.57 2.43 -1.31 -0.63 114.38 117.89 1im8 h ARG 216 Ca 0.37 -0.51 -0.05 0.00 -0.81 0.00 0.00 59.98 58.97 1im8 h ARG 216 Cb 0.13 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1im8 h ARG 216 CO -0.13 1.13 -0.00 -0.07 -1.51 0.00 0.00 179.97 179.39 1im8 h LEU 217 N 0.52 0.57 -1.04 3.80 3.38 -0.72 -1.98 115.31 119.83 1im8 h LEU 217 Ca -0.02 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1im8 h LEU 217 Cb 1.25 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 1im8 h LEU 217 CO 0.13 0.74 0.40 0.11 0.09 0.00 0.00 178.44 179.92 1im8 h LYS 218 N 0.39 1.07 0.00 1.13 1.57 -0.99 -2.65 116.57 117.09 1im8 h LYS 218 Ca 0.09 -0.13 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 1im8 h LYS 218 Cb 0.45 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1im8 h LYS 218 CO 0.02 0.80 -0.39 -0.91 -0.57 0.00 0.00 179.45 178.40 1im8 h ASN 219 N 1.08 0.00 0.74 0.86 -0.26 -0.80 -0.79 115.58 116.40 1im8 h ASN 219 Ca 0.27 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.97 1im8 h ASN 219 Cb 0.05 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.31 1im8 h ASN 219 CO -0.04 0.39 -0.16 0.58 -1.06 0.00 0.00 177.43 177.13 1im8 h VAL 220 N 0.00 0.48 0.00 2.81 2.07 -1.02 -3.47 116.25 117.13 1im8 h VAL 220 Ca -0.00 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1im8 h VAL 220 Cb 0.71 1.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1im8 h VAL 220 CO 0.05 0.16 0.00 0.61 0.02 0.00 0.00 177.57 178.41 1im8 n GLY 221 N -0.15 1.22 3.76 2.17 0.00 -0.30 -4.99 105.19 106.89 1im8 n GLY 221 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 2.88 0.02 1.61 3.01 -1.13 -4.92 117.46 118.92 1im8 n PHE 222 Ca 0.00 0.39 -0.09 0.00 1.01 0.00 0.00 57.45 58.76 1im8 n PHE 222 Cb 0.00 -2.55 -0.07 0.00 -0.01 0.00 0.00 39.48 36.86 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 3.60 -0.13 -3.28 4.37 0.02 -1.59 -3.41 113.55 113.13 1im8 h SER 223 Ca -0.49 -0.37 -0.65 0.00 -0.84 0.00 0.00 61.79 59.44 1im8 h SER 223 Cb 1.24 0.03 -0.17 0.00 0.14 0.00 0.00 62.40 63.64 1im8 h SER 223 CO 0.70 0.49 -0.61 -1.10 -1.14 0.00 0.00 176.83 175.17 1im8 s GLN 224 N -2.75 3.51 -0.10 3.45 1.11 -1.11 -4.97 119.66 118.81 1im8 s GLN 224 Ca -0.11 -0.41 -0.03 0.00 0.01 0.00 0.00 55.36 54.82 1im8 s GLN 224 Cb -0.00 -2.97 0.05 0.00 -1.01 0.00 0.00 33.01 29.07 1im8 s GLN 224 CO 0.39 0.44 0.16 0.08 0.01 0.00 0.00 175.29 176.37 1im8 s VAL 225 N -0.14 -0.25 -0.07 1.09 1.01 -1.26 -0.10 120.40 120.67 1im8 s VAL 225 Ca 0.05 0.30 -0.25 0.00 0.00 0.00 0.00 61.98 62.08 1im8 s VAL 225 Cb -0.12 -0.33 0.06 0.00 0.00 0.00 0.00 36.38 35.98 1im8 s VAL 225 CO 0.02 0.10 0.57 -0.70 0.00 0.00 0.00 175.10 175.10 1im8 s GLU 226 N 2.29 0.90 0.02 2.72 2.56 -0.59 -5.00 118.70 121.60 1im8 s GLU 226 Ca 0.03 0.25 -0.30 0.00 0.00 0.00 0.00 54.97 54.96 1im8 s GLU 226 Cb -0.12 0.42 -0.04 0.00 2.00 0.00 0.00 34.13 36.38 1im8 s GLU 226 CO -0.06 -0.25 1.09 -1.17 -0.56 0.00 0.00 175.26 174.31 1im8 s LEU 227 N -0.94 4.36 0.00 2.70 2.96 -1.26 -0.81 118.68 125.68 1im8 s LEU 227 Ca -0.10 1.82 0.02 0.00 -0.22 0.00 0.00 54.13 55.65 1im8 s LEU 227 Cb -0.02 -3.57 0.02 0.00 0.50 0.00 0.00 46.19 43.11 1im8 s LEU 227 CO 0.07 -0.38 0.60 -2.67 -1.32 0.00 0.00 176.35 172.65 1im8 n TRP 228 N 4.01 0.01 -3.59 5.38 4.27 -0.44 -4.94 117.44 122.14 1im8 n TRP 228 Ca 0.08 -0.05 -0.16 0.00 -3.89 0.00 0.00 57.50 53.48 1im8 n TRP 228 Cb 0.49 -0.01 -0.07 0.00 -1.36 0.00 0.00 31.31 30.36 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 -0.22 -0.74 -0.13 -2.67 5.36 -1.09 -4.98 117.98 113.52 1im8 s PHE 229 Ca 0.02 1.61 -0.29 0.00 -0.96 0.00 0.00 56.93 57.31 1im8 s PHE 229 Cb 0.01 0.32 0.09 0.00 -0.34 0.00 0.00 43.02 43.11 1im8 s PHE 229 CO 0.02 -0.47 0.79 -1.14 -1.46 0.00 0.00 175.22 172.96 1im8 s GLN 230 N -0.24 0.86 -0.25 10.12 0.74 -1.26 -1.51 119.66 128.12 1im8 s GLN 230 Ca -0.04 0.39 -0.02 0.00 0.05 0.00 0.00 55.36 55.73 1im8 s GLN 230 Cb -0.03 0.41 0.13 0.00 1.10 0.00 0.00 33.01 34.62 1im8 s GLN 230 CO 0.05 -0.23 0.36 0.00 -0.55 0.00 0.00 175.29 174.91 1im8 n PHE 232 N 5.35 0.00 -0.72 0.00 0.99 -1.26 -2.22 117.46 119.60 1im8 n PHE 232 Ca -0.03 0.00 0.02 0.00 -0.00 0.00 0.00 57.45 57.43 1im8 n PHE 232 Cb 0.50 0.00 0.32 0.00 -1.00 0.00 0.00 39.48 39.30 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 6.43 4.93 -4.27 4.37 6.94 -1.26 -4.87 115.26 127.52 1im8 n ASN 233 Ca 0.00 -2.92 -0.24 0.00 -0.02 0.00 0.00 54.58 51.40 1im8 n ASN 233 Cb 0.00 -0.69 -0.13 0.00 -2.36 0.00 0.00 39.78 36.60 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 -2.61 1.76 0.04 -2.53 0.40 -0.94 -0.01 117.98 114.08 1im8 s PHE 234 Ca 0.48 -0.40 -0.05 0.00 -0.60 0.00 0.00 56.93 56.36 1im8 s PHE 234 Cb 0.38 -0.99 0.02 0.00 0.51 0.00 0.00 43.02 42.93 1im8 s PHE 234 CO 0.13 0.16 0.26 0.41 0.70 0.00 0.00 175.22 176.89 1im8 n GLY 235 N 1.34 1.08 3.48 4.36 0.00 -0.86 -0.81 105.19 113.78 1im8 n GLY 235 Ca -0.19 -0.97 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 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 -1.61 1.00 -0.22 1.61 0.15 -0.57 -1.02 113.70 113.03 1im8 s SER 236 Ca 0.06 -1.52 -0.20 0.00 0.70 0.00 0.00 55.95 54.99 1im8 s SER 236 Cb -0.01 0.67 0.06 0.00 -1.71 0.00 0.00 66.02 65.03 1im8 s SER 236 CO 0.01 -1.31 0.59 -0.63 1.20 0.00 0.00 173.24 173.11 1im8 s ILE 238 N -3.01 -0.00 -0.11 6.45 1.01 0.01 -1.33 121.20 124.21 1im8 s ILE 238 Ca 0.31 0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.97 1im8 s ILE 238 Cb -0.00 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 41.66 1im8 s ILE 238 CO 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 174.94 175.03 1im8 s ALA 239 N 0.41 1.56 -0.20 9.38 0.00 -0.32 -1.54 121.76 131.04 1im8 s ALA 239 Ca -0.01 -0.67 -0.07 0.00 0.00 0.00 0.00 51.96 51.21 1im8 s ALA 239 Cb -0.04 -0.87 -0.03 0.00 0.00 0.00 0.00 23.12 22.17 1im8 s ALA 239 CO -0.01 -0.22 0.05 0.08 0.00 0.00 0.00 175.76 175.66 1im8 s VAL 240 N 1.28 4.44 -2.00 0.00 1.01 0.85 -1.22 120.40 124.77 1im8 s VAL 240 Ca -0.01 -0.15 0.19 0.00 0.00 0.00 0.00 61.98 62.01 1im8 s VAL 240 Cb -0.14 -3.02 0.54 0.00 0.00 0.00 0.00 36.38 33.76 1im8 s VAL 240 CO -0.05 0.42 1.53 1.17 0.00 0.00 0.00 175.10 178.17