#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 0.00 1.61 2.88 -1.26 -3.57 113.62 113.29 1hkt n SER 44 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1hkt n SER 44 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 -1.52 3.36 0.46 0.00 -1.26 -4.57 105.19 101.67 1hkt n GLY 45 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.20 0.07 -1.05 1.61 0.31 -1.23 -4.71 118.33 112.11 1hkt n VAL 46 Ca 0.00 -0.13 -0.40 0.00 -0.01 0.00 0.00 64.34 63.80 1hkt n VAL 46 Cb 0.00 -1.03 -0.08 0.00 -0.91 0.00 0.00 33.84 31.82 1hkt n VAL 46 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1hkt n PRO 47 N 7.93 0.90 0.00 5.55 -0.04 -1.26 -3.45 135.00 144.63 1hkt n PRO 47 Ca 0.50 -1.61 0.00 0.00 -0.04 0.00 0.00 63.50 62.35 1hkt n PRO 47 Cb 0.09 -2.93 0.00 0.00 -0.04 0.00 0.00 33.50 30.62 1hkt n PRO 47 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hkt n ALA 48 N 9.62 0.00 -0.87 0.55 0.00 -1.26 -4.52 120.51 124.03 1hkt n ALA 48 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1hkt n ALA 48 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 0.00 0.00 -0.04 0.00 7.35 -1.26 -3.12 117.46 120.38 1hkt n PHE 49 Ca 0.00 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.60 1hkt n PHE 49 Cb 0.00 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 39.81 1hkt n PHE 49 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1hkt h LEU 50 N 0.00 0.02 -0.99 -2.13 3.38 -1.93 -1.25 115.31 112.41 1hkt h LEU 50 Ca 0.00 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1hkt h LEU 50 Cb 0.00 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1hkt h LEU 50 CO 0.00 0.04 -0.06 0.00 0.09 0.00 0.00 178.44 178.51 1hkt h ALA 51 N 1.15 1.16 0.00 1.53 0.00 -1.86 -2.17 119.26 119.07 1hkt h ALA 51 Ca 0.09 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1hkt h ALA 51 Cb 0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1hkt h ALA 51 CO -0.12 0.54 -0.13 0.87 0.00 0.00 0.00 179.25 180.40 1hkt h LYS 52 N 0.61 0.00 0.04 0.00 1.57 -1.56 -2.63 116.57 114.60 1hkt h LYS 52 Ca 0.12 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1hkt h LYS 52 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1hkt h LYS 52 CO 0.03 0.13 -0.02 -0.07 -0.57 0.00 0.00 179.45 178.95 1hkt h LEU 53 N 0.00 -0.05 -0.79 2.94 3.38 -0.58 -1.82 115.31 118.38 1hkt h LEU 53 Ca -0.00 -0.28 0.19 0.00 0.09 0.00 0.00 57.88 57.88 1hkt h LEU 53 Cb 0.25 0.01 -0.13 0.00 0.09 0.00 0.00 40.66 40.88 1hkt h LEU 53 CO 0.02 0.26 0.13 -0.50 0.09 0.00 0.00 178.44 178.44 1hkt h TRP 54 N -0.36 0.18 0.00 1.13 4.06 -1.41 1.54 115.95 121.08 1hkt h TRP 54 Ca -0.01 0.05 -0.04 0.00 2.06 0.00 0.00 58.89 60.96 1hkt h TRP 54 Cb 0.33 0.05 -0.01 0.00 -1.00 0.00 0.00 29.16 28.53 1hkt h TRP 54 CO 0.03 -0.19 -0.17 0.00 -3.56 0.00 0.00 178.44 174.55 1hkt h ARG 55 N 0.19 0.00 0.11 0.49 2.47 -1.43 -2.83 114.38 113.38 1hkt h ARG 55 Ca 0.46 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.89 1hkt h ARG 55 Cb 0.85 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.20 1hkt h ARG 55 CO -0.62 0.17 -1.23 1.25 0.56 0.00 0.00 179.97 180.11 1hkt h LEU 56 N 0.00 0.85 -4.85 3.04 5.85 0.29 -3.19 115.31 117.30 1hkt h LEU 56 Ca -0.00 -0.78 -0.55 0.00 0.84 0.00 0.00 57.88 57.39 1hkt h LEU 56 Cb 0.57 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 1hkt h LEU 56 CO 0.02 1.59 2.07 0.52 -0.34 0.00 0.00 178.44 182.30 1hkt n VAL 57 N -3.78 4.09 0.00 1.05 0.31 0.87 -4.24 118.33 116.63 1hkt n VAL 57 Ca -0.13 -2.78 0.00 0.00 -0.01 0.00 0.00 64.34 61.42 1hkt n VAL 57 Cb 0.98 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.69 1hkt n VAL 57 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1hkt n ASP 58 N 2.55 -0.05 -4.53 4.52 2.03 -1.25 -4.91 116.55 114.91 1hkt n ASP 58 Ca 0.63 0.02 -0.47 0.00 0.52 0.00 0.00 54.79 55.48 1hkt n ASP 58 Cb 0.44 0.28 -0.03 0.00 -0.72 0.00 0.00 41.12 41.09 1hkt n ASP 58 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1hkt n ASP 59 N -2.00 0.59 -1.99 1.67 8.00 -1.20 -4.95 116.55 116.66 1hkt n ASP 59 Ca 0.00 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.66 1hkt n ASP 59 Cb 0.00 -1.17 0.00 0.00 -0.02 0.00 0.00 41.12 39.93 1hkt n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hkt n ALA 60 N 0.53 0.00 -0.71 2.24 0.00 -1.26 -4.15 120.51 117.15 1hkt n ALA 60 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1hkt n ALA 60 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.72 1hkt n ALA 60 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1hkt n ASP 61 N 0.00 -3.30 0.00 0.00 2.03 -1.26 -4.48 116.55 109.53 1hkt n ASP 61 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1hkt n ASP 61 Cb 0.00 -2.78 0.00 0.00 -0.72 0.00 0.00 41.12 37.62 1hkt n ASP 61 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1hkt n THR 62 N -1.70 0.00 -0.83 5.18 -2.24 -1.26 -5.05 114.28 108.38 1hkt n THR 62 Ca 0.00 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.46 1hkt n THR 62 Cb 0.28 1.16 0.14 0.00 -2.10 0.00 0.00 70.33 69.81 1hkt n THR 62 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1hkt n ASN 63 N 0.00 -0.31 0.00 3.42 3.02 -1.26 -1.43 115.26 118.69 1hkt n ASN 63 Ca 0.00 0.44 0.00 0.00 -0.03 0.00 0.00 54.58 54.99 1hkt n ASN 63 Cb 0.46 -1.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.23 1hkt n ASN 63 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1hkt n ARG 64 N -3.13 0.00 -0.02 3.52 1.85 -1.26 -4.46 116.66 113.17 1hkt n ARG 64 Ca 0.11 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.84 1hkt n ARG 64 Cb 0.52 -1.34 -0.14 0.00 -1.05 0.00 0.00 32.46 30.45 1hkt n ARG 64 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1hkt n LEU 65 N 0.00 1.28 -3.63 2.89 4.77 -0.52 -3.50 117.00 118.29 1hkt n LEU 65 Ca 0.00 0.33 -0.12 0.00 -0.03 0.00 0.00 56.01 56.19 1hkt n LEU 65 Cb 0.00 -0.14 -0.07 0.00 -2.33 0.00 0.00 43.42 40.88 1hkt n LEU 65 CO 0.00 0.52 0.42 -0.51 -1.33 0.00 0.00 177.39 176.48 1hkt s ILE 66 N -2.58 0.00 0.32 -0.08 2.07 -0.68 -4.25 121.20 115.99 1hkt s ILE 66 Ca -0.10 0.00 -0.16 0.00 -1.41 0.00 0.00 60.65 58.99 1hkt s ILE 66 Cb 0.08 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.69 1hkt s ILE 66 CO 0.81 0.00 0.68 0.00 -1.91 0.00 0.00 174.94 174.51 1hkt s TRP 68 N -3.28 3.40 0.00 0.00 0.52 -1.26 -1.51 118.94 116.80 1hkt s TRP 68 Ca 0.17 1.41 0.00 0.00 0.02 0.00 0.00 56.10 57.70 1hkt s TRP 68 Cb -0.04 -2.72 0.00 0.00 -1.15 0.00 0.00 33.47 29.56 1hkt s TRP 68 CO 0.10 -0.18 0.00 0.25 0.02 0.00 0.00 176.95 177.15 1hkt n THR 69 N -1.06 0.00 0.00 2.01 -2.24 -1.19 -4.76 114.28 107.05 1hkt n THR 69 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1hkt n THR 69 Cb 0.54 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1hkt n THR 69 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1hkt n LYS 70 N 0.00 0.39 -1.26 -0.78 5.02 -1.26 -4.50 118.16 115.77 1hkt n LYS 70 Ca 0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 1hkt n LYS 70 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 1hkt n LYS 70 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1hkt n ASP 71 N -1.05 1.77 -2.33 4.39 5.68 -1.26 -3.76 116.55 119.99 1hkt n ASP 71 Ca 0.00 -2.57 -0.04 0.00 -0.50 0.00 0.00 54.79 51.69 1hkt n ASP 71 Cb 0.00 -1.24 0.02 0.00 -1.14 0.00 0.00 41.12 38.76 1hkt n ASP 71 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hkt n GLY 72 N 5.42 -0.46 2.68 6.12 0.00 -1.26 -5.03 105.19 112.66 1hkt n GLY 72 Ca 0.45 0.15 -0.15 0.00 0.00 0.00 0.00 46.02 46.47 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 -3.34 0.87 1.16 1.61 2.00 -1.25 -4.43 119.66 116.29 1hkt s GLN 73 Ca 0.11 -1.26 0.00 0.00 -2.00 0.00 0.00 55.36 52.21 1hkt s GLN 73 Cb -0.01 -0.66 0.00 0.00 0.80 0.00 0.00 33.01 33.14 1hkt s GLN 73 CO 0.38 -1.30 0.00 -1.13 -0.50 0.00 0.00 175.29 172.74 1hkt n SER 74 N 3.42 0.00 -3.61 6.67 3.41 -1.26 -4.30 113.62 117.95 1hkt n SER 74 Ca 0.19 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.66 1hkt n SER 74 Cb 0.50 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.39 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 0.00 1.07 0.09 7.33 -0.71 -1.21 -3.16 117.98 121.39 1hkt s PHE 75 Ca 0.00 -1.27 -0.05 0.00 -1.04 0.00 0.00 56.93 54.57 1hkt s PHE 75 Cb 0.00 -0.24 -0.02 0.00 -1.21 0.00 0.00 43.02 41.55 1hkt s PHE 75 CO 0.00 -0.96 0.11 0.54 -1.34 0.00 0.00 175.22 173.57 1hkt s VAL 76 N -3.54 0.16 -0.42 -2.49 0.11 -0.57 -2.02 120.40 111.63 1hkt s VAL 76 Ca 0.33 -1.49 0.09 0.00 -2.93 0.00 0.00 61.98 57.98 1hkt s VAL 76 Cb 0.02 -1.51 0.29 0.00 -1.53 0.00 0.00 36.38 33.65 1hkt s VAL 76 CO 0.18 -0.73 0.64 -0.38 -3.33 0.00 0.00 175.10 171.48 1hkt n ILE 77 N -0.02 -0.00 -0.40 7.04 5.41 -0.74 -2.47 119.36 128.19 1hkt n ILE 77 Ca -0.13 -4.42 -0.07 0.00 1.00 0.00 0.00 62.75 59.12 1hkt n ILE 77 Cb 0.62 -1.34 -0.05 0.00 -0.71 0.00 0.00 39.64 38.17 1hkt n ILE 77 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 176.55 176.61 1hkt h GLN 78 N 3.60 -0.01 -6.75 0.38 3.07 -1.79 -3.39 115.11 110.22 1hkt h GLN 78 Ca 0.10 0.00 -0.49 0.00 0.09 0.00 0.00 58.65 58.34 1hkt h GLN 78 Cb 0.87 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.42 1hkt h GLN 78 CO 0.53 -0.01 0.36 1.21 0.09 0.00 0.00 178.83 181.02 1hkt s ASN 79 N -5.43 7.60 -0.12 0.06 3.84 -1.23 -4.77 114.94 114.90 1hkt s ASN 79 Ca -0.13 1.98 -0.03 0.00 0.21 0.00 0.00 52.86 54.89 1hkt s ASN 79 Cb 0.14 -2.61 -0.06 0.00 -0.55 0.00 0.00 41.25 38.17 1hkt s ASN 79 CO 0.66 0.12 -0.13 0.00 -2.79 0.00 0.00 177.10 174.95 1hkt n GLN 80 N 1.50 0.27 0.00 0.43 3.00 -1.26 -4.31 117.38 117.01 1hkt n GLN 80 Ca -0.02 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1hkt n GLN 80 Cb 0.47 -1.06 0.00 0.00 0.00 0.00 0.00 30.24 29.65 1hkt n GLN 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1hkt n ALA 81 N -3.22 -0.20 0.00 -1.58 0.00 -1.26 -2.83 120.51 111.43 1hkt n ALA 81 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1hkt n ALA 81 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.14 1hkt n ALA 81 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1hkt n GLN 82 N -1.34 0.00 0.00 0.00 0.00 -1.26 -0.22 117.38 114.56 1hkt n GLN 82 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.00 57.12 1hkt n GLN 82 Cb 0.00 -1.49 0.13 0.00 0.00 0.00 0.00 30.24 28.88 1hkt n GLN 82 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1hkt n PHE 83 N -0.96 0.00 -0.04 3.69 7.35 -1.13 -4.56 117.46 121.82 1hkt n PHE 83 Ca 0.00 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.61 1hkt n PHE 83 Cb 0.00 -0.01 -0.03 0.00 0.35 0.00 0.00 39.48 39.79 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 0.44 2.51 0.61 3.13 0.00 0.69 -4.33 120.51 123.57 1hkt n ALA 84 Ca 0.12 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1hkt n ALA 84 Cb 0.49 0.40 0.00 0.00 0.00 0.00 0.00 19.45 20.35 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 -3.33 0.61 0.00 0.00 0.00 -1.20 -3.20 118.16 111.04 1hkt n LYS 85 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 1hkt n LYS 85 Cb 0.61 -1.20 0.00 0.00 -0.00 0.00 0.00 35.03 34.44 1hkt n LYS 85 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1hkt n GLU 86 N 0.70 0.13 -0.07 -1.58 1.02 -1.26 -4.94 120.64 114.64 1hkt n GLU 86 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 1hkt n GLU 86 Cb 0.30 -0.06 -0.15 0.00 -0.02 0.00 0.00 31.44 31.51 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 -0.42 0.00 0.04 -4.62 4.77 -1.23 -4.56 117.00 110.98 1hkt n LEU 87 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 1hkt n LEU 87 Cb 0.00 0.32 -0.14 0.00 -2.33 0.00 0.00 43.42 41.27 1hkt n LEU 87 CO 0.00 0.32 -0.39 -0.07 -1.33 0.00 0.00 177.39 175.92 1hkt h LEU 88 N 0.00 0.27 0.00 2.23 3.38 -1.80 -3.45 115.31 115.93 1hkt h LEU 88 Ca -0.35 -0.41 -0.22 0.00 0.09 0.00 0.00 57.88 56.99 1hkt h LEU 88 Cb 1.77 -0.09 0.10 0.00 0.09 0.00 0.00 40.66 42.53 1hkt h LEU 88 CO 0.02 1.35 0.12 -0.81 0.09 0.00 0.00 178.44 179.21 1hkt n PRO 89 N -3.35 -1.69 -0.63 1.13 -0.05 -1.25 -0.75 135.00 128.41 1hkt n PRO 89 Ca -0.17 -1.02 -0.02 0.00 -0.05 0.00 0.00 63.50 62.25 1hkt n PRO 89 Cb 1.04 -0.85 -0.01 0.00 -0.05 0.00 0.00 33.50 33.63 1hkt n PRO 89 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 175.50 176.73 1hkt n LEU 90 N 0.00 0.16 0.00 1.53 4.77 -1.26 -4.21 117.00 117.99 1hkt n LEU 90 Ca 0.09 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 1hkt n LEU 90 Cb 0.32 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.02 1hkt n LEU 90 CO 0.23 -0.43 0.00 0.59 -1.33 0.00 0.00 177.39 176.44 1hkt n ASN 91 N 0.98 0.00 -0.51 -1.43 4.13 -1.23 -4.90 115.26 112.30 1hkt n ASN 91 Ca -0.02 0.00 0.12 0.00 1.68 0.00 0.00 54.58 56.36 1hkt n ASN 91 Cb 0.23 0.16 0.46 0.00 -1.54 0.00 0.00 39.78 39.09 1hkt n ASN 91 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1hkt n TYR 92 N -1.94 0.10 0.00 3.10 4.01 0.07 -4.95 117.16 117.55 1hkt n TYR 92 Ca 0.00 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1hkt n TYR 92 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1hkt n TYR 92 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1hkt n LYS 93 N 0.24 0.00 -0.65 -0.72 4.81 -1.17 -4.88 118.16 115.79 1hkt n LYS 93 Ca 0.18 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.37 1hkt n LYS 93 Cb 0.34 0.00 0.13 0.00 0.02 0.00 0.00 35.03 35.52 1hkt n LYS 93 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 1hkt n HIS 94 N 0.00 -1.84 -0.96 5.64 1.44 -1.26 -4.52 115.22 113.72 1hkt n HIS 94 Ca 0.00 0.17 0.00 0.00 -2.01 0.00 0.00 57.72 55.88 1hkt n HIS 94 Cb 0.00 -1.44 0.00 0.00 0.12 0.00 0.00 29.99 28.67 1hkt n HIS 94 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 1hkt n ASN 95 N -0.50 0.00 -4.66 4.39 5.15 -1.26 -3.82 115.26 114.57 1hkt n ASN 95 Ca 0.03 -0.46 -0.40 0.00 -0.60 0.00 0.00 54.58 53.15 1hkt n ASN 95 Cb 0.48 0.00 0.02 0.00 -0.53 0.00 0.00 39.78 39.75 1hkt n ASN 95 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1hkt n ASN 96 N 0.00 1.73 0.00 1.20 0.23 -1.26 -4.73 115.26 112.44 1hkt n ASN 96 Ca 0.00 1.00 0.00 0.00 -0.53 0.00 0.00 54.58 55.05 1hkt n ASN 96 Cb 0.11 -1.44 0.00 0.00 -2.08 0.00 0.00 39.78 36.38 1hkt n ASN 96 CO 0.00 0.00 0.00 0.80 -0.93 0.00 0.00 177.26 177.13 1hkt n MET 97 N -0.29 0.00 -0.50 -3.83 1.56 -1.26 -3.71 117.12 109.09 1hkt n MET 97 Ca 0.10 0.02 0.44 0.00 -0.27 0.00 0.00 57.70 57.98 1hkt n MET 97 Cb 0.42 -0.26 0.78 0.00 2.15 0.00 0.00 33.22 36.31 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 -2.00 3.48 -0.14 -5.12 0.00 -1.98 1.07 119.26 114.57 1hkt h ALA 98 Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1hkt h ALA 98 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1hkt h ALA 98 CO 0.00 -1.95 -0.41 1.03 0.00 0.00 0.00 179.25 177.92 1hkt h SER 99 N 0.00 0.60 -0.01 0.00 0.87 -1.98 -2.58 113.55 110.45 1hkt h SER 99 Ca 0.74 -0.60 0.03 0.00 -1.23 0.00 0.00 61.79 60.73 1hkt h SER 99 Cb 3.02 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 64.77 1hkt h SER 99 CO -0.01 1.09 -0.16 0.15 -0.53 0.00 0.00 176.83 177.37 1hkt h PHE 100 N 0.13 -0.41 -0.48 2.24 3.57 0.11 0.34 116.94 122.44 1hkt h PHE 100 Ca -0.01 0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.64 1hkt h PHE 100 Cb 1.03 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 1hkt h PHE 100 CO 0.11 -0.23 0.45 0.82 -2.23 0.00 0.00 178.31 177.22 1hkt h ILE 101 N -0.26 0.46 -0.81 1.41 2.04 -1.32 0.85 117.51 119.87 1hkt h ILE 101 Ca 0.05 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.94 1hkt h ILE 101 Cb 0.33 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1hkt h ILE 101 CO -0.16 0.00 0.54 -0.09 0.00 0.00 0.00 178.15 178.44 1hkt h ARG 102 N 0.00 1.03 -0.40 2.37 9.65 0.09 -1.05 114.38 126.07 1hkt h ARG 102 Ca 0.23 -0.06 -0.14 0.00 -1.10 0.00 0.00 59.98 58.91 1hkt h ARG 102 Cb 1.13 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 29.46 1hkt h ARG 102 CO -0.00 0.68 -0.30 1.96 2.80 0.00 0.00 179.97 185.11 1hkt h GLN 103 N 1.06 0.87 -0.68 0.20 4.20 0.90 -2.46 115.11 119.20 1hkt h GLN 103 Ca 0.31 -0.40 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1hkt h GLN 103 Cb -0.05 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.69 1hkt h GLN 103 CO -0.08 1.05 0.40 -0.07 -0.67 0.00 0.00 178.83 179.45 1hkt h LEU 104 N 0.73 0.82 0.00 1.46 3.38 -0.95 0.85 115.31 121.61 1hkt h LEU 104 Ca 0.08 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1hkt h LEU 104 Cb 0.86 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1hkt h LEU 104 CO 0.08 0.66 0.00 0.59 0.09 0.00 0.00 178.44 179.85 1hkt n ASN 105 N -4.54 0.00 -0.07 -0.43 5.03 -0.65 -1.66 115.26 112.93 1hkt n ASN 105 Ca 0.05 -1.29 -0.15 0.00 0.87 0.00 0.00 54.58 54.07 1hkt n ASN 105 Cb 0.07 0.00 -0.14 0.00 -1.02 0.00 0.00 39.78 38.69 1hkt n ASN 105 CO 0.00 0.00 0.00 0.80 -1.83 0.00 0.00 177.26 176.23 1hkt n MET 106 N -0.83 0.68 0.10 3.52 1.56 0.23 -4.44 117.12 117.95 1hkt n MET 106 Ca 0.15 0.16 -0.23 0.00 -0.27 0.00 0.00 57.70 57.51 1hkt n MET 106 Cb 0.07 -1.61 -0.15 0.00 2.15 0.00 0.00 33.22 33.68 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 0.02 0.79 0.00 1.12 0.05 -1.32 -3.01 116.97 114.62 1hkt h TYR 107 Ca -0.49 -0.58 0.00 0.00 0.05 0.00 0.00 58.73 57.71 1hkt h TYR 107 Cb 2.04 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 39.74 1hkt h TYR 107 CO 0.03 1.46 0.00 0.41 -1.05 0.00 0.00 178.16 179.01 1hkt n GLY 108 N 1.70 0.00 3.89 3.88 0.00 -1.15 -4.60 105.19 108.91 1hkt n GLY 108 Ca -0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 1hkt n GLY 108 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hkt s PHE 109 N 0.00 2.96 -0.24 1.61 0.40 -0.66 -4.89 117.98 117.15 1hkt s PHE 109 Ca 0.00 0.80 -0.03 0.00 -0.60 0.00 0.00 56.93 57.10 1hkt s PHE 109 Cb 0.00 -3.43 0.13 0.00 0.51 0.00 0.00 43.02 40.23 1hkt s PHE 109 CO 0.00 -1.76 0.36 -1.58 0.70 0.00 0.00 175.22 172.94 1hkt s HIS 110 N -3.52 -0.77 -0.09 0.36 2.46 -0.77 -4.70 115.29 108.25 1hkt s HIS 110 Ca 0.62 0.74 -0.24 0.00 0.47 0.00 0.00 55.06 56.64 1hkt s HIS 110 Cb -0.11 -0.03 -0.03 0.00 -0.13 0.00 0.00 32.58 32.27 1hkt s HIS 110 CO 0.50 -0.72 0.75 -1.59 -2.47 0.00 0.00 174.74 171.21 1hkt s LYS 111 N 2.52 4.40 -0.81 2.88 -2.85 -1.26 0.10 119.74 124.72 1hkt s LYS 111 Ca 0.12 0.94 -0.08 0.00 -1.00 0.00 0.00 55.97 55.94 1hkt s LYS 111 Cb -0.15 -3.49 -0.18 0.00 -2.06 0.00 0.00 37.83 31.95 1hkt s LYS 111 CO -0.16 -0.06 3.30 -0.89 0.10 0.00 0.00 175.35 177.64 1hkt n ILE 112 N 4.07 3.66 -3.12 3.79 2.08 -1.03 -4.80 119.36 124.01 1hkt n ILE 112 Ca 0.01 -2.03 -0.01 0.00 0.56 0.00 0.00 62.75 61.27 1hkt n ILE 112 Cb 0.51 -2.31 0.00 0.00 -0.75 0.00 0.00 39.64 37.09 1hkt n ILE 112 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 1hkt n THR 113 N 3.04 0.00 -1.54 1.39 5.66 -1.26 -4.76 114.28 116.80 1hkt n THR 113 Ca 0.61 -0.13 -0.19 0.00 -3.05 0.00 0.00 64.05 61.29 1hkt n THR 113 Cb 0.58 0.13 -0.08 0.00 -1.55 0.00 0.00 70.33 69.40 1hkt n THR 113 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1hkt n SER 114 N -1.11 -5.41 0.00 1.09 2.88 -1.26 -4.31 113.62 105.50 1hkt n SER 114 Ca -0.01 0.46 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 1hkt n SER 114 Cb 0.08 -4.55 0.00 0.00 -0.75 0.00 0.00 64.21 58.99 1hkt n SER 114 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1hkt n ILE 115 N -2.40 0.00 -0.71 2.46 3.06 -1.26 -4.96 119.36 115.55 1hkt n ILE 115 Ca -0.19 0.00 -0.05 0.00 -2.50 0.00 0.00 62.75 60.01 1hkt n ILE 115 Cb 0.64 0.00 -0.06 0.00 0.54 0.00 0.00 39.64 40.76 1hkt n ILE 115 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 1hkt n ASP 116 N -0.01 5.40 -3.33 9.51 2.03 -1.26 -4.74 116.55 124.15 1hkt n ASP 116 Ca 0.00 -2.49 -0.11 0.00 0.52 0.00 0.00 54.79 52.72 1hkt n ASP 116 Cb 0.00 -1.22 0.01 0.00 -0.72 0.00 0.00 41.12 39.19 1hkt n ASP 116 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1hkt n ASN 117 N 1.76 -6.71 0.00 1.67 2.85 -1.26 -4.56 115.26 109.00 1hkt n ASN 117 Ca 0.17 -0.45 0.00 0.00 -0.11 0.00 0.00 54.58 54.19 1hkt n ASN 117 Cb 0.64 -4.18 0.00 0.00 1.24 0.00 0.00 39.78 37.49 1hkt n ASN 117 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1hkt n GLY 118 N -1.69 2.60 0.00 8.20 0.00 -1.26 -4.89 105.19 108.15 1hkt n GLY 118 Ca -0.10 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 2.07 0.00 -0.02 0.00 -1.26 -4.81 105.19 101.17 1hkt n GLY 119 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1hkt n GLY 119 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hkt n LEU 120 N 0.00 0.00 0.00 0.99 4.77 -1.26 -5.01 117.00 116.49 1hkt n LEU 120 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1hkt n LEU 120 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1hkt n LEU 120 CO 0.00 0.00 0.00 -1.14 -1.33 0.00 0.00 177.39 174.92 1hkt n ARG 121 N 0.00 0.00 -3.51 3.23 0.63 -1.26 -5.12 116.66 110.63 1hkt n ARG 121 Ca 0.00 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.87 1hkt n ARG 121 Cb 0.00 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 32.84 1hkt n ARG 121 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 1hkt s PHE 122 N -0.14 -1.00 0.01 -0.14 5.36 -1.26 -5.07 117.98 115.73 1hkt s PHE 122 Ca 0.00 1.51 -0.00 0.00 -0.96 0.00 0.00 56.93 57.48 1hkt s PHE 122 Cb 0.00 0.35 0.00 0.00 -0.34 0.00 0.00 43.02 43.03 1hkt s PHE 122 CO 0.00 -0.62 0.00 -0.40 -1.46 0.00 0.00 175.22 172.74 1hkt n ASP 123 N 5.40 -4.07 0.00 6.13 5.68 -1.26 -4.87 116.55 123.55 1hkt n ASP 123 Ca -0.07 1.37 0.00 0.00 -0.50 0.00 0.00 54.79 55.59 1hkt n ASP 123 Cb 0.50 -3.09 0.00 0.00 -1.14 0.00 0.00 41.12 37.39 1hkt n ASP 123 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1hkt n ARG 124 N 1.94 0.00 -0.87 0.11 5.12 -1.26 -4.93 116.66 116.77 1hkt n ARG 124 Ca -0.00 0.00 0.03 0.00 -1.93 0.00 0.00 57.85 55.95 1hkt n ARG 124 Cb 0.00 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.34 1hkt n ARG 124 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1hkt n ASP 125 N 0.00 0.77 -4.76 0.55 9.92 -1.26 -4.93 116.55 116.84 1hkt n ASP 125 Ca 0.00 -2.27 -0.41 0.00 -0.53 0.00 0.00 54.79 51.58 1hkt n ASP 125 Cb 0.00 -0.29 -0.01 0.00 -0.64 0.00 0.00 41.12 40.18 1hkt n ASP 125 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1hkt n GLU 126 N -0.03 2.66 -1.50 -1.24 1.02 -1.26 -4.65 120.64 115.64 1hkt n GLU 126 Ca 0.06 0.94 -0.22 0.00 -0.02 0.00 0.00 57.16 57.92 1hkt n GLU 126 Cb 0.88 -2.68 -0.23 0.00 -0.02 0.00 0.00 31.44 29.39 1hkt n GLU 126 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 1hkt n ILE 127 N 1.10 0.00 -3.25 -3.67 3.06 -1.26 -4.79 119.36 110.55 1hkt n ILE 127 Ca 0.04 -0.50 -0.45 0.00 -2.50 0.00 0.00 62.75 59.34 1hkt n ILE 127 Cb 0.38 -0.04 -0.05 0.00 0.54 0.00 0.00 39.64 40.46 1hkt n ILE 127 CO 0.00 0.00 0.00 -1.83 -2.50 0.00 0.00 176.55 172.22 1hkt s GLU 128 N 7.03 3.02 0.01 9.51 -1.05 -1.26 -1.78 118.70 134.18 1hkt s GLU 128 Ca 1.30 -1.44 -0.30 0.00 -0.15 0.00 0.00 54.97 54.38 1hkt s GLU 128 Cb -0.83 -4.24 -0.04 0.00 -0.44 0.00 0.00 34.13 28.58 1hkt s GLU 128 CO 0.56 -1.33 1.16 -0.06 0.95 0.00 0.00 175.26 176.54 1hkt s PHE 129 N 2.05 3.40 -0.14 4.83 0.08 -0.86 -2.47 117.98 124.87 1hkt s PHE 129 Ca 0.07 1.34 -0.04 0.00 0.12 0.00 0.00 56.93 58.43 1hkt s PHE 129 Cb -0.26 -3.37 -0.03 0.00 -0.57 0.00 0.00 43.02 38.79 1hkt s PHE 129 CO 0.06 -1.07 -0.02 0.45 -0.10 0.00 0.00 175.22 174.54 1hkt s SER 130 N 1.18 4.98 -0.25 1.36 0.15 0.12 -3.32 113.70 117.91 1hkt s SER 130 Ca 0.57 -0.04 -0.02 0.00 0.70 0.00 0.00 55.95 57.15 1hkt s SER 130 Cb -0.26 -1.71 0.13 0.00 -1.71 0.00 0.00 66.02 62.47 1hkt s SER 130 CO 0.27 0.22 0.35 -2.28 1.20 0.00 0.00 173.24 173.00 1hkt s HIS 131 N 0.05 -0.73 -1.01 3.44 2.46 -1.26 -1.86 115.29 116.38 1hkt s HIS 131 Ca 0.01 0.55 0.00 0.00 0.47 0.00 0.00 55.06 56.09 1hkt s HIS 131 Cb -0.13 -0.12 0.00 0.00 -0.13 0.00 0.00 32.58 32.20 1hkt s HIS 131 CO 0.02 -0.77 0.04 -2.30 -2.47 0.00 0.00 174.74 169.26 1hkt n PRO 132 N 5.35 0.07 -2.73 2.88 -0.02 -1.26 -2.30 135.00 137.00 1hkt n PRO 132 Ca -0.03 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.42 1hkt n PRO 132 Cb 0.49 -1.03 0.09 0.00 -0.02 0.00 0.00 33.50 33.03 1hkt n PRO 132 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1hkt n PHE 133 N 0.45 -0.52 -2.71 6.00 3.72 -1.26 -4.91 117.46 118.24 1hkt n PHE 133 Ca 0.00 -2.07 -0.06 0.00 -0.05 0.00 0.00 57.45 55.27 1hkt n PHE 133 Cb 0.02 0.66 0.08 0.00 -0.94 0.00 0.00 39.48 39.30 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 -0.83 -0.62 -1.40 1.38 7.35 -0.97 -4.62 117.46 117.75 1hkt n PHE 134 Ca -0.03 -2.20 0.00 0.00 -0.76 0.00 0.00 57.45 54.47 1hkt n PHE 134 Cb 0.84 0.66 0.00 0.00 0.35 0.00 0.00 39.48 41.33 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 -0.60 1.33 0.00 -4.13 4.01 -1.26 -4.10 118.16 113.40 1hkt n LYS 135 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1hkt n LYS 135 Cb 0.84 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.36 1hkt n LYS 135 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1hkt n ARG 136 N -0.43 0.00 0.00 1.97 3.00 -1.26 -4.94 116.66 115.00 1hkt n ARG 136 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1hkt n ARG 136 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 32.46 32.11 1hkt n ARG 136 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1hkt n ASN 137 N -0.37 0.00 -3.37 6.15 3.02 -1.26 -4.70 115.26 114.73 1hkt n ASN 137 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.43 1hkt n ASN 137 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1hkt n ASN 137 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1hkt n SER 138 N 0.00 -6.51 -1.75 6.41 3.41 -1.26 -4.74 113.62 109.19 1hkt n SER 138 Ca 0.00 -0.43 -0.01 0.00 -0.26 0.00 0.00 58.87 58.17 1hkt n SER 138 Cb 0.00 -3.69 -0.01 0.00 -0.26 0.00 0.00 64.21 60.25 1hkt n SER 138 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1hkt n PRO 139 N -2.04 0.70 0.00 4.33 -0.04 -1.26 -2.86 135.00 133.83 1hkt n PRO 139 Ca -0.13 -0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.25 1hkt n PRO 139 Cb 0.59 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 1hkt n PRO 139 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1hkt n PHE 140 N 1.81 0.00 -0.96 0.54 -1.74 -1.26 -4.90 117.46 110.95 1hkt n PHE 140 Ca 0.03 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.78 1hkt n PHE 140 Cb 0.34 0.03 -0.04 0.00 1.52 0.00 0.00 39.48 41.33 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 5.89 0.00 5.98 4.77 -1.14 -3.72 117.00 128.79 1hkt n LEU 141 Ca 0.00 -3.23 0.00 0.00 -0.03 0.00 0.00 56.01 52.75 1hkt n LEU 141 Cb 0.34 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.23 1hkt n LEU 141 CO 0.00 1.41 -0.14 0.18 -1.33 0.00 0.00 177.39 177.50 1hkt n LEU 142 N 1.29 0.83 -1.69 2.23 4.77 -1.26 -4.54 117.00 118.63 1hkt n LEU 142 Ca 0.30 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.26 1hkt n LEU 142 Cb 0.64 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.70 1hkt n LEU 142 CO 0.21 0.14 0.94 0.47 -1.33 0.00 0.00 177.39 177.82 1hkt n ASP 143 N -1.76 4.34 -0.84 -1.43 8.00 -1.24 -3.07 116.55 120.56 1hkt n ASP 143 Ca 0.00 -2.18 -0.02 0.00 0.71 0.00 0.00 54.79 53.30 1hkt n ASP 143 Cb 0.14 -0.97 -0.02 0.00 -0.02 0.00 0.00 41.12 40.25 1hkt n ASP 143 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hkt n GLN 144 N 1.80 0.00 -4.59 -1.24 0.00 -1.26 -5.11 117.38 106.97 1hkt n GLN 144 Ca 0.07 -0.81 -0.23 0.00 0.00 0.00 0.00 57.00 56.04 1hkt n GLN 144 Cb 0.48 0.13 -0.14 0.00 0.00 0.00 0.00 30.24 30.70 1hkt n GLN 144 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1hkt s ILE 145 N 0.00 1.24 0.25 -0.39 1.01 -1.17 -5.15 121.20 116.99 1hkt s ILE 145 Ca 0.05 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 59.76 1hkt s ILE 145 Cb 0.06 -1.06 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 1hkt s ILE 145 CO -0.03 0.22 0.44 -1.59 0.00 0.00 0.00 174.94 173.99 1hkt s LYS 146 N -0.70 1.55 -0.27 2.79 0.00 -1.26 -5.11 119.74 116.73 1hkt s LYS 146 Ca 0.05 -1.34 -0.17 0.00 0.00 0.00 0.00 55.97 54.51 1hkt s LYS 146 Cb -0.07 0.45 -0.03 0.00 0.00 0.00 0.00 37.83 38.18 1hkt s LYS 146 CO 0.00 -0.63 0.47 0.50 0.00 0.00 0.00 175.35 175.69 1hkt s ARG 147 N -3.93 4.04 0.00 1.78 3.52 -1.26 -4.49 118.95 118.62 1hkt s ARG 147 Ca 0.25 0.23 0.00 0.00 -0.13 0.00 0.00 55.73 56.08 1hkt s ARG 147 Cb 0.00 -3.66 0.00 0.00 -1.56 0.00 0.00 34.95 29.74 1hkt s ARG 147 CO 0.10 -0.34 0.00 1.17 -0.81 0.00 0.00 175.30 175.43