#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hkt n SER 44 N 0.00 0.00 -0.28 1.61 2.88 -1.26 -1.40 113.62 115.18 1hkt n SER 44 Ca 0.00 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.68 1hkt n SER 44 Cb 0.00 0.00 0.56 0.00 -0.75 0.00 0.00 64.21 64.02 1hkt n SER 44 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1hkt n GLY 45 N 0.00 -0.50 3.37 0.46 0.00 -1.26 -4.89 105.19 102.37 1hkt n GLY 45 Ca 0.00 -0.36 -0.51 0.00 0.00 0.00 0.00 46.02 45.14 1hkt n GLY 45 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1hkt n VAL 46 N -0.45 0.02 -0.56 1.61 0.31 -0.49 -4.88 118.33 113.89 1hkt n VAL 46 Ca 0.17 -0.07 -0.30 0.00 -0.01 0.00 0.00 64.34 64.13 1hkt n VAL 46 Cb 0.31 -0.76 0.27 0.00 -0.91 0.00 0.00 33.84 32.75 1hkt n VAL 46 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1hkt s PRO 47 N 7.14 -2.05 -1.30 5.55 0.05 -1.26 -4.63 135.00 138.50 1hkt s PRO 47 Ca 1.23 0.29 -0.18 0.00 0.05 0.00 0.00 61.00 62.39 1hkt s PRO 47 Cb -1.27 -1.47 0.08 0.00 0.05 0.00 0.00 34.50 31.88 1hkt s PRO 47 CO 0.56 -4.33 1.73 0.00 0.05 0.00 0.00 177.00 175.01 1hkt n ALA 48 N -5.27 3.63 -1.00 8.56 0.00 -1.26 -4.36 120.51 120.81 1hkt n ALA 48 Ca 0.10 -3.88 0.00 0.00 0.00 0.00 0.00 53.44 49.66 1hkt n ALA 48 Cb 0.58 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.46 1hkt n ALA 48 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1hkt n PHE 49 N 8.14 0.00 0.32 0.00 -0.00 -1.26 -4.83 117.46 119.83 1hkt n PHE 49 Ca 0.48 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 58.04 1hkt n PHE 49 Cb 0.46 0.00 0.59 0.00 -0.00 0.00 0.00 39.48 40.53 1hkt n PHE 49 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1hkt h LEU 50 N 0.00 0.00 0.03 -2.13 -0.00 -1.97 1.14 115.31 112.38 1hkt h LEU 50 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 57.88 57.62 1hkt h LEU 50 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.67 1hkt h LEU 50 CO 0.00 0.00 -1.16 0.00 -0.00 0.00 0.00 178.44 177.28 1hkt h ALA 51 N 1.02 0.17 -0.75 1.53 0.00 -1.90 -3.12 119.26 116.20 1hkt h ALA 51 Ca 0.00 -0.82 0.07 0.00 0.00 0.00 0.00 54.91 54.16 1hkt h ALA 51 Cb 0.96 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 1hkt h ALA 51 CO 0.00 0.90 0.43 0.87 0.00 0.00 0.00 179.25 181.45 1hkt h LYS 52 N 0.13 0.75 0.38 0.00 6.56 0.10 -0.50 116.57 123.99 1hkt h LYS 52 Ca -0.12 -0.04 -0.02 0.00 -1.06 0.00 0.00 60.65 59.40 1hkt h LYS 52 Cb 1.85 -0.17 0.00 0.00 -0.57 0.00 0.00 32.23 33.35 1hkt h LYS 52 CO 0.20 0.49 -0.18 -0.07 -2.06 0.00 0.00 179.45 177.83 1hkt h LEU 53 N 0.77 -0.43 -0.09 2.94 3.38 -1.55 0.25 115.31 120.58 1hkt h LEU 53 Ca 0.34 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1hkt h LEU 53 Cb 0.23 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1hkt h LEU 53 CO -0.20 -0.30 0.19 1.87 0.09 0.00 0.00 178.44 180.10 1hkt n TRP 54 N -3.42 0.05 0.00 1.13 -0.00 -1.13 -1.09 117.44 112.98 1hkt n TRP 54 Ca -0.06 0.02 0.00 0.00 -0.00 0.00 0.00 57.50 57.46 1hkt n TRP 54 Cb 0.20 -0.35 0.00 0.00 -0.00 0.00 0.00 31.31 31.16 1hkt n TRP 54 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1hkt n ARG 55 N -1.39 0.00 -0.09 5.87 5.12 -0.21 -4.41 116.66 121.55 1hkt n ARG 55 Ca -0.00 0.04 0.26 0.00 -1.93 0.00 0.00 57.85 56.22 1hkt n ARG 55 Cb 0.20 -0.35 0.68 0.00 -1.16 0.00 0.00 32.46 31.83 1hkt n ARG 55 CO 0.00 0.00 0.00 1.37 -1.93 0.00 0.00 177.63 177.07 1hkt h LEU 56 N 0.00 0.00 -9.99 0.55 8.10 -0.45 -3.27 115.31 110.25 1hkt h LEU 56 Ca 0.00 0.00 -0.51 0.00 0.11 0.00 0.00 57.88 57.48 1hkt h LEU 56 Cb 0.00 0.00 0.07 0.00 -0.44 0.00 0.00 40.66 40.29 1hkt h LEU 56 CO 0.00 0.00 0.51 -0.69 -4.11 0.00 0.00 178.44 174.15 1hkt s VAL 57 N -4.65 3.00 0.00 0.15 1.01 -0.25 -4.12 120.40 115.53 1hkt s VAL 57 Ca -0.04 0.79 0.00 0.00 0.00 0.00 0.00 61.98 62.72 1hkt s VAL 57 Cb 0.17 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 33.14 1hkt s VAL 57 CO 0.59 0.02 0.00 -0.67 0.00 0.00 0.00 175.10 175.04 1hkt n ASP 58 N -0.34 0.00 -3.92 3.32 -0.08 -1.26 -4.79 116.55 109.48 1hkt n ASP 58 Ca 0.06 0.00 -0.25 0.00 -1.51 0.00 0.00 54.79 53.09 1hkt n ASP 58 Cb 0.47 0.00 0.12 0.00 2.34 0.00 0.00 41.12 44.05 1hkt n ASP 58 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1hkt n ASP 59 N 1.12 -2.71 -0.54 1.67 2.03 -1.23 -4.45 116.55 112.43 1hkt n ASP 59 Ca 0.00 -0.20 0.00 0.00 0.52 0.00 0.00 54.79 55.11 1hkt n ASP 59 Cb 0.00 -0.75 0.00 0.00 -0.72 0.00 0.00 41.12 39.65 1hkt n ASP 59 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hkt n ALA 60 N -4.13 0.00 -2.27 -1.67 0.00 -1.26 -3.63 120.51 107.55 1hkt n ALA 60 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.06 1hkt n ALA 60 Cb 0.50 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.97 1hkt n ALA 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1hkt n ASP 61 N -3.42 7.44 -0.00 0.00 8.00 -1.26 -4.51 116.55 122.80 1hkt n ASP 61 Ca 0.00 -3.73 0.10 0.00 0.71 0.00 0.00 54.79 51.87 1hkt n ASP 61 Cb 0.00 -1.13 -0.12 0.00 -0.02 0.00 0.00 41.12 39.85 1hkt n ASP 61 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1hkt n THR 62 N -0.20 0.00 -1.56 -3.53 -2.24 -1.24 -4.80 114.28 100.71 1hkt n THR 62 Ca 0.51 -0.02 -0.14 0.00 -2.27 0.00 0.00 64.05 62.13 1hkt n THR 62 Cb 0.25 0.94 -0.11 0.00 -2.10 0.00 0.00 70.33 69.32 1hkt n THR 62 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1hkt n ASN 63 N -1.54 1.34 0.00 3.42 5.15 -1.26 -2.73 115.26 119.64 1hkt n ASN 63 Ca 0.04 -2.23 0.00 0.00 -0.60 0.00 0.00 54.58 51.79 1hkt n ASN 63 Cb 0.34 -1.69 0.00 0.00 -0.53 0.00 0.00 39.78 37.90 1hkt n ASN 63 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1hkt n ARG 64 N 8.19 0.00 0.00 1.20 0.63 -1.26 -4.90 116.66 120.52 1hkt n ARG 64 Ca 0.42 0.00 0.14 0.00 -0.92 0.00 0.00 57.85 57.49 1hkt n ARG 64 Cb 0.46 0.00 0.79 0.00 0.45 0.00 0.00 32.46 34.16 1hkt n ARG 64 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1hkt n LEU 65 N 0.00 0.00 -3.61 6.15 4.77 -1.11 -4.72 117.00 118.48 1hkt n LEU 65 Ca 0.00 0.18 -0.14 0.00 -0.03 0.00 0.00 56.01 56.02 1hkt n LEU 65 Cb 0.00 -0.18 -0.07 0.00 -2.33 0.00 0.00 43.42 40.84 1hkt n LEU 65 CO 0.00 -0.01 0.44 -0.51 -1.33 0.00 0.00 177.39 175.98 1hkt s ILE 66 N -2.36 0.00 0.18 -0.08 2.07 -1.15 -4.22 121.20 115.64 1hkt s ILE 66 Ca 0.34 0.00 -0.23 0.00 -1.41 0.00 0.00 60.65 59.35 1hkt s ILE 66 Cb 0.20 -1.00 0.06 0.00 0.13 0.00 0.00 42.46 41.85 1hkt s ILE 66 CO 0.41 0.00 0.63 0.00 -1.91 0.00 0.00 174.94 174.07 1hkt s TRP 68 N -3.78 3.14 -0.01 0.00 0.52 -1.26 -1.86 118.94 115.69 1hkt s TRP 68 Ca 0.03 1.39 0.01 0.00 0.02 0.00 0.00 56.10 57.56 1hkt s TRP 68 Cb -0.02 -2.88 -0.04 0.00 -1.15 0.00 0.00 33.47 29.38 1hkt s TRP 68 CO -0.09 -1.22 -0.01 0.95 0.02 0.00 0.00 176.95 176.60 1hkt s THR 69 N -3.06 4.11 0.00 2.01 -4.23 -1.10 -4.72 115.64 108.64 1hkt s THR 69 Ca 0.58 -0.60 0.00 0.00 -1.18 0.00 0.00 61.69 60.49 1hkt s THR 69 Cb -0.14 -2.82 0.00 0.00 1.34 0.00 0.00 72.50 70.88 1hkt s THR 69 CO 0.55 0.39 0.00 1.17 -0.54 0.00 0.00 174.62 176.19 1hkt n LYS 70 N 1.45 0.00 -3.15 3.99 4.81 -1.26 -3.56 118.16 120.44 1hkt n LYS 70 Ca -0.15 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.34 1hkt n LYS 70 Cb 0.53 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.58 1hkt n LYS 70 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 1hkt s ASP 71 N -4.00 -0.57 -1.38 3.14 1.47 -1.26 -4.96 116.67 109.10 1hkt s ASP 71 Ca 0.00 0.09 -0.06 0.00 1.18 0.00 0.00 52.55 53.76 1hkt s ASP 71 Cb 0.00 1.37 0.03 0.00 -0.34 0.00 0.00 42.92 43.99 1hkt s ASP 71 CO 0.00 -0.11 0.92 0.61 0.68 0.00 0.00 175.17 177.27 1hkt n GLY 72 N 5.18 -0.41 2.87 2.12 0.00 -1.26 -4.97 105.19 108.73 1hkt n GLY 72 Ca 0.08 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.15 1hkt n GLY 72 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1hkt s GLN 73 N -6.18 0.36 0.15 1.61 0.74 -1.23 -4.62 119.66 110.48 1hkt s GLN 73 Ca 0.33 0.22 0.00 0.00 0.05 0.00 0.00 55.36 55.96 1hkt s GLN 73 Cb -0.16 -0.48 0.00 0.00 1.10 0.00 0.00 33.01 33.47 1hkt s GLN 73 CO 0.79 -0.88 0.00 -1.13 -0.55 0.00 0.00 175.29 173.53 1hkt n SER 74 N 5.35 -2.63 -3.67 6.67 3.41 -1.26 -3.65 113.62 117.83 1hkt n SER 74 Ca -0.02 0.31 -0.13 0.00 -0.26 0.00 0.00 58.87 58.77 1hkt n SER 74 Cb 0.49 -1.41 -0.13 0.00 -0.26 0.00 0.00 64.21 62.90 1hkt n SER 74 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1hkt s PHE 75 N -2.34 -0.45 0.60 7.33 -0.12 -1.21 -2.72 117.98 119.07 1hkt s PHE 75 Ca 0.00 1.00 -0.01 0.00 -0.05 0.00 0.00 56.93 57.87 1hkt s PHE 75 Cb 0.00 0.01 0.05 0.00 -0.63 0.00 0.00 43.02 42.44 1hkt s PHE 75 CO 0.00 -0.35 0.85 0.54 -0.05 0.00 0.00 175.22 176.22 1hkt s VAL 76 N 2.26 2.53 -0.43 -2.49 0.11 -0.78 -3.67 120.40 117.93 1hkt s VAL 76 Ca -0.01 -0.55 0.05 0.00 -2.93 0.00 0.00 61.98 58.55 1hkt s VAL 76 Cb -0.12 -2.98 0.18 0.00 -1.53 0.00 0.00 36.38 31.94 1hkt s VAL 76 CO -0.09 0.00 0.45 -0.38 -3.33 0.00 0.00 175.10 171.75 1hkt n ILE 77 N -2.53 -0.91 0.00 7.04 5.41 -1.00 -2.91 119.36 124.45 1hkt n ILE 77 Ca 0.08 -2.98 0.00 0.00 1.00 0.00 0.00 62.75 60.85 1hkt n ILE 77 Cb 0.60 -1.10 0.00 0.00 -0.71 0.00 0.00 39.64 38.43 1hkt n ILE 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1hkt n GLN 78 N 2.68 0.00 -3.37 0.38 6.02 -1.26 -4.23 117.38 117.59 1hkt n GLN 78 Ca 0.26 0.46 -0.38 0.00 -0.01 0.00 0.00 57.00 57.33 1hkt n GLN 78 Cb 0.50 -0.78 -0.06 0.00 1.02 0.00 0.00 30.24 30.93 1hkt n GLN 78 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1hkt s ASN 79 N -2.38 6.88 0.00 1.08 -0.87 -1.26 -4.53 114.94 113.86 1hkt s ASN 79 Ca 0.00 1.05 0.22 0.00 -1.57 0.00 0.00 52.86 52.56 1hkt s ASN 79 Cb 0.00 -2.30 -0.13 0.00 -0.02 0.00 0.00 41.25 38.80 1hkt s ASN 79 CO 0.00 0.24 0.98 0.00 -2.57 0.00 0.00 177.10 175.75 1hkt n GLN 80 N 2.17 0.43 0.00 -0.60 6.02 -1.26 -4.15 117.38 119.99 1hkt n GLN 80 Ca -0.11 -0.35 0.00 0.00 -0.01 0.00 0.00 57.00 56.53 1hkt n GLN 80 Cb 0.52 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.28 1hkt n GLN 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hkt n ALA 81 N -0.98 0.00 0.00 -1.58 0.00 -1.26 -3.96 120.51 112.74 1hkt n ALA 81 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1hkt n ALA 81 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 1hkt n ALA 81 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1hkt n GLN 82 N -0.02 0.00 -0.02 0.00 6.02 -1.26 0.28 117.38 122.38 1hkt n GLN 82 Ca 0.00 0.23 0.12 0.00 -0.01 0.00 0.00 57.00 57.34 1hkt n GLN 82 Cb 0.00 -1.66 0.61 0.00 1.02 0.00 0.00 30.24 30.21 1hkt n GLN 82 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1hkt n PHE 83 N -1.19 0.04 -0.00 1.08 7.35 -1.25 -3.63 117.46 119.86 1hkt n PHE 83 Ca 0.00 -0.02 -0.01 0.00 -0.76 0.00 0.00 57.45 56.65 1hkt n PHE 83 Cb 0.16 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 39.98 1hkt n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1hkt n ALA 84 N -0.49 2.90 0.65 3.13 0.00 0.14 -4.49 120.51 122.36 1hkt n ALA 84 Ca 0.17 -0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.53 1hkt n ALA 84 Cb 0.17 0.45 0.04 0.00 0.00 0.00 0.00 19.45 20.10 1hkt n ALA 84 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1hkt n LYS 85 N -3.13 1.29 0.00 0.00 2.85 -1.23 -3.14 118.16 114.79 1hkt n LYS 85 Ca -0.03 -0.49 0.00 0.00 -1.05 0.00 0.00 58.31 56.75 1hkt n LYS 85 Cb 0.45 -1.27 0.00 0.00 -0.65 0.00 0.00 35.03 33.55 1hkt n LYS 85 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1hkt n GLU 86 N 0.21 0.00 0.00 -1.58 1.02 -1.24 -4.94 120.64 114.11 1hkt n GLU 86 Ca 0.09 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1hkt n GLU 86 Cb 0.63 -0.09 0.00 0.00 -0.02 0.00 0.00 31.44 31.97 1hkt n GLU 86 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1hkt n LEU 87 N 0.00 0.00 0.05 -4.62 4.77 -1.23 -4.89 117.00 111.07 1hkt n LEU 87 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 1hkt n LEU 87 Cb 0.49 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.44 1hkt n LEU 87 CO 0.00 0.00 -0.33 -0.07 -1.33 0.00 0.00 177.39 175.66 1hkt h LEU 88 N 0.00 0.29 -1.83 2.23 3.38 -1.80 -3.33 115.31 114.25 1hkt h LEU 88 Ca 0.00 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1hkt h LEU 88 Cb 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1hkt h LEU 88 CO 0.00 1.35 0.00 -0.81 0.09 0.00 0.00 178.44 179.07 1hkt n PRO 89 N -3.38 0.72 0.00 1.13 -0.04 -1.21 -2.38 135.00 129.84 1hkt n PRO 89 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 1hkt n PRO 89 Cb 1.03 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 33.32 1hkt n PRO 89 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1hkt n LEU 90 N 0.55 0.40 0.00 1.53 4.77 -1.25 -4.75 117.00 118.24 1hkt n LEU 90 Ca 0.00 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1hkt n LEU 90 Cb 0.33 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1hkt n LEU 90 CO 0.00 0.10 0.00 0.59 -1.33 0.00 0.00 177.39 176.75 1hkt n ASN 91 N -0.03 0.00 0.09 -1.43 3.02 -1.07 -4.91 115.26 110.94 1hkt n ASN 91 Ca 0.00 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.63 1hkt n ASN 91 Cb 0.20 0.14 -0.02 0.00 -0.61 0.00 0.00 39.78 39.50 1hkt n ASN 91 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1hkt h TYR 92 N 0.00 0.00 -2.81 3.10 -1.99 -1.80 -3.48 116.97 109.99 1hkt h TYR 92 Ca 0.00 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.66 1hkt h TYR 92 Cb 0.00 0.00 0.04 0.00 2.00 0.00 0.00 36.73 38.77 1hkt h TYR 92 CO 0.00 0.19 -0.16 1.17 -0.00 0.00 0.00 178.16 179.36 1hkt n LYS 93 N -2.77 -1.27 -3.61 4.88 0.00 -1.13 -5.04 118.16 109.21 1hkt n LYS 93 Ca -0.03 0.17 -0.08 0.00 0.00 0.00 0.00 58.31 58.38 1hkt n LYS 93 Cb 0.64 -3.11 -0.06 0.00 0.00 0.00 0.00 35.03 32.50 1hkt n LYS 93 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.40 174.02 1hkt s HIS 94 N -3.07 -0.32 -1.70 5.64 -3.43 -1.25 -4.99 115.29 106.16 1hkt s HIS 94 Ca 0.01 0.65 0.24 0.00 -0.80 0.00 0.00 55.06 55.15 1hkt s HIS 94 Cb -0.00 0.43 0.20 0.00 -1.43 0.00 0.00 32.58 31.78 1hkt s HIS 94 CO 0.15 -0.23 1.21 -1.71 -2.00 0.00 0.00 174.74 172.16 1hkt n ASN 95 N 1.24 1.47 -4.22 7.38 2.85 -1.26 -3.36 115.26 119.36 1hkt n ASN 95 Ca -0.10 -1.16 -0.34 0.00 -0.11 0.00 0.00 54.58 52.87 1hkt n ASN 95 Cb 0.57 0.46 0.11 0.00 1.24 0.00 0.00 39.78 42.17 1hkt n ASN 95 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 1hkt n ASN 96 N -0.56 -2.93 0.03 1.20 6.94 -1.26 -4.60 115.26 114.09 1hkt n ASN 96 Ca 0.09 0.05 0.00 0.00 -0.02 0.00 0.00 54.58 54.70 1hkt n ASN 96 Cb 0.40 -0.90 0.00 0.00 -2.36 0.00 0.00 39.78 36.92 1hkt n ASN 96 CO 0.00 0.00 0.00 0.80 -1.03 0.00 0.00 177.26 177.03 1hkt n MET 97 N -0.45 0.00 0.26 -3.83 1.56 -1.26 -4.76 117.12 108.63 1hkt n MET 97 Ca 0.01 0.00 0.13 0.00 -0.27 0.00 0.00 57.70 57.58 1hkt n MET 97 Cb 0.62 0.00 0.59 0.00 2.15 0.00 0.00 33.22 36.58 1hkt n MET 97 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1hkt h ALA 98 N 0.00 1.72 -0.16 -5.12 0.00 -1.99 1.15 119.26 114.86 1hkt h ALA 98 Ca 0.00 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.71 1hkt h ALA 98 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1hkt h ALA 98 CO 0.00 -0.63 -0.69 0.66 0.00 0.00 0.00 179.25 178.58 1hkt h SER 99 N 0.00 0.75 0.25 0.00 4.64 -1.99 -1.64 113.55 115.57 1hkt h SER 99 Ca 0.06 -0.47 -0.01 0.00 -0.47 0.00 0.00 61.79 60.91 1hkt h SER 99 Cb 1.19 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1hkt h SER 99 CO -0.00 1.23 -0.12 0.15 -0.87 0.00 0.00 176.83 177.22 1hkt h PHE 100 N 0.46 -0.31 -0.63 4.77 3.57 0.10 -2.53 116.94 122.38 1hkt h PHE 100 Ca -0.03 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.63 1hkt h PHE 100 Cb 1.29 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 40.10 1hkt h PHE 100 CO 0.06 0.05 0.44 0.82 -2.23 0.00 0.00 178.31 177.46 1hkt h ILE 101 N -0.75 0.74 0.00 1.41 2.04 -1.47 0.78 117.51 120.25 1hkt h ILE 101 Ca -0.03 -0.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.72 1hkt h ILE 101 Cb 0.50 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1hkt h ILE 101 CO 0.06 0.02 -0.28 -0.09 0.00 0.00 0.00 178.15 177.86 1hkt h ARG 102 N 0.13 0.00 0.00 2.37 1.12 -1.00 -1.91 114.38 115.08 1hkt h ARG 102 Ca 0.30 0.00 -0.10 0.00 -1.11 0.00 0.00 59.98 59.07 1hkt h ARG 102 Cb 1.02 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.96 1hkt h ARG 102 CO -0.04 0.28 -0.49 1.96 -3.11 0.00 0.00 179.97 178.57 1hkt h GLN 103 N 0.00 0.00 -0.31 0.20 1.08 0.96 -3.16 115.11 113.88 1hkt h GLN 103 Ca -0.00 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.09 1hkt h GLN 103 Cb 0.62 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.03 1hkt h GLN 103 CO 0.04 0.49 -0.24 -0.07 -0.95 0.00 0.00 178.83 178.10 1hkt h LEU 104 N 0.00 0.62 0.00 1.46 3.38 -0.54 -0.40 115.31 119.82 1hkt h LEU 104 Ca -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1hkt h LEU 104 Cb 1.38 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1hkt h LEU 104 CO 0.06 0.85 0.00 -0.46 0.09 0.00 0.00 178.44 178.98 1hkt n ASN 105 N -4.11 0.00 -0.04 -0.43 0.23 -1.11 -2.03 115.26 107.76 1hkt n ASN 105 Ca -0.00 -0.64 -0.18 0.00 -0.53 0.00 0.00 54.58 53.23 1hkt n ASN 105 Cb 0.42 -0.08 -0.14 0.00 -2.08 0.00 0.00 39.78 37.90 1hkt n ASN 105 CO 0.00 0.00 0.00 0.80 -0.93 0.00 0.00 177.26 177.13 1hkt n MET 106 N -1.08 0.71 0.22 -3.83 1.56 -0.20 -4.19 117.12 110.31 1hkt n MET 106 Ca 0.18 0.22 0.12 0.00 -0.27 0.00 0.00 57.70 57.95 1hkt n MET 106 Cb 0.13 -1.65 0.18 0.00 2.15 0.00 0.00 33.22 34.02 1hkt n MET 106 CO 0.00 0.00 0.00 1.88 -0.73 0.00 0.00 175.97 177.12 1hkt h TYR 107 N 0.04 0.00 0.00 1.12 0.05 -1.38 -3.21 116.97 113.59 1hkt h TYR 107 Ca -0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.32 1hkt h TYR 107 Cb 2.01 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.75 1hkt h TYR 107 CO 0.05 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.57 1hkt n GLY 108 N 1.09 0.72 2.89 3.88 0.00 -1.15 -4.66 105.19 107.96 1hkt n GLY 108 Ca 0.04 -0.02 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 1hkt n GLY 108 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1hkt n PHE 109 N 0.00 -3.04 -3.05 1.61 3.01 -0.86 -4.98 117.46 110.15 1hkt n PHE 109 Ca 0.00 -1.32 -0.15 0.00 1.01 0.00 0.00 57.45 56.99 1hkt n PHE 109 Cb 0.00 -0.54 -0.04 0.00 -0.01 0.00 0.00 39.48 38.89 1hkt n PHE 109 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 1hkt n HIS 110 N -2.47 -2.39 -2.58 1.38 -0.00 -1.08 -4.90 115.22 103.19 1hkt n HIS 110 Ca 0.12 -2.34 -0.40 0.00 0.46 0.00 0.00 57.72 55.57 1hkt n HIS 110 Cb 0.44 0.87 -0.05 0.00 -0.12 0.00 0.00 29.99 31.13 1hkt n HIS 110 CO 0.00 0.00 0.00 -1.59 0.46 0.00 0.00 176.34 175.21 1hkt s LYS 111 N 0.39 4.72 -1.03 1.57 -2.85 -1.26 -2.78 119.74 118.50 1hkt s LYS 111 Ca 0.32 1.68 -0.07 0.00 -1.00 0.00 0.00 55.97 56.90 1hkt s LYS 111 Cb 0.04 -3.23 0.26 0.00 -2.06 0.00 0.00 37.83 32.84 1hkt s LYS 111 CO -0.13 0.32 0.99 0.42 0.10 0.00 0.00 175.35 177.04 1hkt s ILE 112 N -1.10 5.48 0.00 3.79 1.01 -1.23 -4.91 121.20 124.23 1hkt s ILE 112 Ca 0.43 -3.49 -0.05 0.00 0.00 0.00 0.00 60.65 57.55 1hkt s ILE 112 Cb -0.30 -4.32 -0.21 0.00 0.01 0.00 0.00 42.46 37.65 1hkt s ILE 112 CO 0.37 -1.14 3.19 0.41 0.00 0.00 0.00 174.94 177.77 1hkt n THR 113 N 2.68 2.70 -3.11 2.92 -1.04 -1.26 -4.01 114.28 113.15 1hkt n THR 113 Ca 0.22 -1.24 -0.08 0.00 -2.04 0.00 0.00 64.05 60.91 1hkt n THR 113 Cb 0.39 -1.88 0.01 0.00 -1.82 0.00 0.00 70.33 67.03 1hkt n THR 113 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1hkt n SER 114 N 2.30 -6.83 -0.10 8.00 2.88 -1.26 -4.77 113.62 113.84 1hkt n SER 114 Ca 0.33 0.55 0.04 0.00 -1.33 0.00 0.00 58.87 58.46 1hkt n SER 114 Cb 0.80 -2.75 0.20 0.00 -0.75 0.00 0.00 64.21 61.71 1hkt n SER 114 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1hkt n ILE 115 N 0.77 0.06 -4.37 2.46 -0.00 -1.26 -4.87 119.36 112.15 1hkt n ILE 115 Ca -0.01 -0.07 -0.36 0.00 -0.00 0.00 0.00 62.75 62.31 1hkt n ILE 115 Cb 0.42 -0.04 -0.07 0.00 -0.00 0.00 0.00 39.64 39.94 1hkt n ILE 115 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 1hkt n ASP 116 N -0.43 -1.02 -4.56 7.28 5.75 -1.26 -4.79 116.55 117.52 1hkt n ASP 116 Ca 0.06 -1.20 -0.41 0.00 -0.01 0.00 0.00 54.79 53.23 1hkt n ASP 116 Cb 0.07 -1.92 -0.03 0.00 -1.03 0.00 0.00 41.12 38.21 1hkt n ASP 116 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1hkt s ASN 117 N -3.73 6.48 0.96 -1.12 2.20 -1.26 -4.88 114.94 113.59 1hkt s ASN 117 Ca 0.47 -1.40 0.00 0.00 -0.94 0.00 0.00 52.86 50.99 1hkt s ASN 117 Cb -0.27 -2.57 0.00 0.00 -2.00 0.00 0.00 41.25 36.41 1hkt s ASN 117 CO 0.99 -1.52 0.00 0.61 -2.94 0.00 0.00 177.10 174.24 1hkt n GLY 118 N 6.80 -0.12 7.00 0.45 0.00 -1.26 -4.86 105.19 113.20 1hkt n GLY 118 Ca 0.31 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1hkt n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hkt n GLY 119 N 0.00 1.80 3.56 -0.02 0.00 -1.26 -4.81 105.19 104.46 1hkt n GLY 119 Ca 0.00 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.45 1hkt n GLY 119 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1hkt s LEU 120 N 0.00 -0.69 0.00 0.99 0.05 -1.26 -5.10 118.68 112.68 1hkt s LEU 120 Ca 0.00 0.96 0.00 0.00 0.05 0.00 0.00 54.13 55.14 1hkt s LEU 120 Cb 0.00 2.50 0.00 0.00 -2.05 0.00 0.00 46.19 46.64 1hkt s LEU 120 CO 0.00 -0.48 0.00 0.54 -0.55 0.00 0.00 176.35 175.86 1hkt n ARG 121 N 1.52 0.00 -3.90 1.48 1.74 -1.26 -5.04 116.66 111.20 1hkt n ARG 121 Ca -0.17 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.66 1hkt n ARG 121 Cb 0.56 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.99 1hkt n ARG 121 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1hkt n PHE 122 N -1.26 -1.71 0.00 -1.55 3.01 -1.26 -4.92 117.46 109.77 1hkt n PHE 122 Ca 0.00 0.77 0.00 0.00 1.01 0.00 0.00 57.45 59.23 1hkt n PHE 122 Cb 0.00 -3.88 0.00 0.00 -0.01 0.00 0.00 39.48 35.59 1hkt n PHE 122 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1hkt n ASP 123 N -3.00 0.00 -0.86 4.37 9.92 -1.26 -4.91 116.55 120.82 1hkt n ASP 123 Ca -0.31 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 53.93 1hkt n ASP 123 Cb 0.68 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.15 1hkt n ASP 123 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 1hkt n ARG 124 N 0.00 0.07 -0.38 -1.24 1.85 -1.26 -4.94 116.66 110.76 1hkt n ARG 124 Ca 0.00 -0.35 0.00 0.00 -1.00 0.00 0.00 57.85 56.50 1hkt n ARG 124 Cb 0.00 0.45 0.00 0.00 -1.05 0.00 0.00 32.46 31.86 1hkt n ARG 124 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1hkt n ASP 125 N -0.08 -0.25 -4.58 2.89 5.75 -1.26 -4.98 116.55 114.05 1hkt n ASP 125 Ca -0.09 0.00 -0.21 0.00 -0.01 0.00 0.00 54.79 54.48 1hkt n ASP 125 Cb 0.44 -0.08 -0.09 0.00 -1.03 0.00 0.00 41.12 40.35 1hkt n ASP 125 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1hkt s GLU 126 N -1.21 1.75 -0.63 0.11 8.01 -1.26 -4.79 118.70 120.67 1hkt s GLU 126 Ca 0.00 -0.78 -0.27 0.00 0.01 0.00 0.00 54.97 53.93 1hkt s GLU 126 Cb 0.00 -5.10 -0.00 0.00 -4.31 0.00 0.00 34.13 24.72 1hkt s GLU 126 CO 0.00 -4.86 1.62 -1.50 0.01 0.00 0.00 175.26 170.53 1hkt s ILE 127 N 14.44 3.53 0.58 -1.63 2.07 -1.26 -4.64 121.20 134.30 1hkt s ILE 127 Ca 0.76 0.34 -0.01 0.00 -1.41 0.00 0.00 60.65 60.33 1hkt s ILE 127 Cb -0.03 -4.29 0.04 0.00 0.13 0.00 0.00 42.46 38.31 1hkt s ILE 127 CO 0.16 -1.21 0.83 -1.61 -1.91 0.00 0.00 174.94 171.20 1hkt s GLU 128 N 6.39 2.50 -0.32 3.50 2.02 -1.26 -2.37 118.70 129.17 1hkt s GLU 128 Ca 0.56 -0.62 0.02 0.00 0.02 0.00 0.00 54.97 54.95 1hkt s GLU 128 Cb -0.11 -2.41 0.16 0.00 0.10 0.00 0.00 34.13 31.86 1hkt s GLU 128 CO 0.20 -0.81 0.39 -0.06 0.02 0.00 0.00 175.26 175.00 1hkt s PHE 129 N -2.87 -0.78 -0.08 1.61 0.08 -1.24 -3.56 117.98 111.13 1hkt s PHE 129 Ca 0.57 -0.04 -0.18 0.00 0.12 0.00 0.00 56.93 57.40 1hkt s PHE 129 Cb -0.10 -0.25 -0.05 0.00 -0.57 0.00 0.00 43.02 42.05 1hkt s PHE 129 CO 0.40 -0.98 0.47 0.45 -0.10 0.00 0.00 175.22 175.46 1hkt s SER 130 N 2.22 6.74 -0.30 1.36 0.15 -1.12 -3.28 113.70 119.47 1hkt s SER 130 Ca 0.12 0.88 0.02 0.00 0.70 0.00 0.00 55.95 57.66 1hkt s SER 130 Cb -0.13 -2.29 0.15 0.00 -1.71 0.00 0.00 66.02 62.05 1hkt s SER 130 CO -0.24 0.08 0.38 -2.28 1.20 0.00 0.00 173.24 172.39 1hkt s HIS 131 N 0.19 -0.83 -0.46 3.44 2.46 -1.26 -2.63 115.29 116.20 1hkt s HIS 131 Ca 0.26 0.10 0.00 0.00 0.47 0.00 0.00 55.06 55.89 1hkt s HIS 131 Cb -0.16 -0.24 0.00 0.00 -0.13 0.00 0.00 32.58 32.05 1hkt s HIS 131 CO 0.12 -0.97 0.18 -0.35 -2.47 0.00 0.00 174.74 171.24 1hkt n PRO 132 N 5.23 0.23 -1.38 2.88 -0.05 -1.26 -2.07 135.00 138.59 1hkt n PRO 132 Ca 0.01 0.00 0.02 0.00 -0.05 0.00 0.00 63.50 63.48 1hkt n PRO 132 Cb 0.48 -1.26 0.00 0.00 -0.05 0.00 0.00 33.50 32.68 1hkt n PRO 132 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 175.50 176.64 1hkt n PHE 133 N 0.65 0.00 -2.75 0.54 3.72 -1.26 -4.87 117.46 113.50 1hkt n PHE 133 Ca 0.00 -0.48 -0.02 0.00 -0.05 0.00 0.00 57.45 56.90 1hkt n PHE 133 Cb 0.09 -0.03 0.09 0.00 -0.94 0.00 0.00 39.48 38.69 1hkt n PHE 133 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1hkt n PHE 134 N 0.39 -0.50 0.41 1.38 7.35 -0.88 -4.23 117.46 121.39 1hkt n PHE 134 Ca -0.00 -1.96 0.05 0.00 -0.76 0.00 0.00 57.45 54.78 1hkt n PHE 134 Cb 1.05 0.70 0.19 0.00 0.35 0.00 0.00 39.48 41.77 1hkt n PHE 134 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1hkt n LYS 135 N -1.04 2.45 0.00 -4.13 4.76 -1.26 -4.32 118.16 114.62 1hkt n LYS 135 Ca -0.05 -1.47 0.00 0.00 -2.87 0.00 0.00 58.31 53.92 1hkt n LYS 135 Cb 0.84 -1.61 0.00 0.00 -1.84 0.00 0.00 35.03 32.42 1hkt n LYS 135 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1hkt n ARG 136 N 0.44 0.00 0.00 1.97 0.63 -1.26 -4.68 116.66 113.76 1hkt n ARG 136 Ca 0.13 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.06 1hkt n ARG 136 Cb 0.53 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.44 1hkt n ARG 136 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 1hkt n ASN 137 N 1.96 -1.13 -3.19 6.15 0.23 -1.26 -4.49 115.26 113.53 1hkt n ASN 137 Ca 0.00 0.00 -0.17 0.00 -0.53 0.00 0.00 54.58 53.88 1hkt n ASN 137 Cb 0.00 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 37.71 1hkt n ASN 137 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1hkt n SER 138 N -1.70 -6.87 -3.45 0.53 7.64 -1.26 -4.65 113.62 103.87 1hkt n SER 138 Ca 0.00 0.03 -0.36 0.00 1.01 0.00 0.00 58.87 59.55 1hkt n SER 138 Cb 0.00 -3.90 -0.07 0.00 -1.01 0.00 0.00 64.21 59.23 1hkt n SER 138 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1hkt n PRO 139 N -0.88 0.79 -0.08 1.43 -0.05 -1.26 -3.03 135.00 131.92 1hkt n PRO 139 Ca -0.02 -1.31 0.00 0.00 -0.05 0.00 0.00 63.50 62.13 1hkt n PRO 139 Cb 0.56 -2.59 0.00 0.00 -0.05 0.00 0.00 33.50 31.42 1hkt n PRO 139 CO 0.00 0.00 0.00 1.97 -0.05 0.00 0.00 175.50 177.42 1hkt n PHE 140 N 7.40 0.00 -0.11 0.54 -1.74 -1.26 -5.00 117.46 117.29 1hkt n PHE 140 Ca 0.42 0.00 -0.20 0.00 -0.56 0.00 0.00 57.45 57.11 1hkt n PHE 140 Cb 0.33 0.13 -0.08 0.00 1.52 0.00 0.00 39.48 41.38 1hkt n PHE 140 CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1hkt n LEU 141 N 0.00 1.90 -0.24 5.98 4.77 -1.17 -4.38 117.00 123.86 1hkt n LEU 141 Ca 0.00 0.41 0.05 0.00 -0.03 0.00 0.00 56.01 56.44 1hkt n LEU 141 Cb 0.24 -0.86 0.17 0.00 -2.33 0.00 0.00 43.42 40.64 1hkt n LEU 141 CO 0.00 0.19 0.93 -0.07 -1.33 0.00 0.00 177.39 177.11 1hkt h LEU 142 N -1.00 -0.01 -3.67 2.23 3.38 -1.87 -0.34 115.31 114.04 1hkt h LEU 142 Ca -0.38 0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 1hkt h LEU 142 Cb 1.26 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.19 1hkt h LEU 142 CO -0.23 -0.04 -0.06 0.47 0.09 0.00 0.00 178.44 178.67 1hkt n ASP 143 N -5.16 3.92 0.00 -0.43 8.00 -1.26 -3.05 116.55 118.57 1hkt n ASP 143 Ca 0.14 -2.12 0.00 0.00 0.71 0.00 0.00 54.79 53.52 1hkt n ASP 143 Cb 0.45 -0.92 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 1hkt n ASP 143 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1hkt n GLN 144 N 2.04 0.00 -2.32 -1.24 7.27 -0.15 -5.06 117.38 117.93 1hkt n GLN 144 Ca 0.13 0.00 -0.41 0.00 0.07 0.00 0.00 57.00 56.79 1hkt n GLN 144 Cb 0.50 -0.22 -0.03 0.00 2.41 0.00 0.00 30.24 32.89 1hkt n GLN 144 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 1hkt s ILE 145 N -1.00 3.30 0.35 1.69 1.01 -1.17 -5.01 121.20 120.36 1hkt s ILE 145 Ca 0.00 1.19 -0.05 0.00 0.00 0.00 0.00 60.65 61.79 1hkt s ILE 145 Cb 0.00 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.73 1hkt s ILE 145 CO 0.00 0.24 0.53 -1.59 0.00 0.00 0.00 174.94 174.12 1hkt s LYS 146 N -0.91 1.98 0.00 2.79 0.00 -1.26 -5.03 119.74 117.31 1hkt s LYS 146 Ca 0.50 -1.71 -0.25 0.00 0.00 0.00 0.00 55.97 54.51 1hkt s LYS 146 Cb -0.35 0.48 -0.05 0.00 0.00 0.00 0.00 37.83 37.91 1hkt s LYS 146 CO 0.42 -0.84 0.77 0.50 0.00 0.00 0.00 175.35 176.20 1hkt s ARG 147 N -2.91 4.49 0.00 1.78 3.52 -1.26 -4.53 118.95 120.04 1hkt s ARG 147 Ca 0.28 1.06 0.00 0.00 -0.13 0.00 0.00 55.73 56.93 1hkt s ARG 147 Cb -0.01 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 29.98 1hkt s ARG 147 CO 0.19 0.17 0.20 1.17 -0.81 0.00 0.00 175.30 176.22