#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 -4.38 -0.63 1.61 7.64 -1.26 -4.43 113.62 112.17 1hkt n SER 44 Ca 0.00 0.07 -0.02 0.00 1.01 0.00 0.00 58.87 59.93 1hkt n SER 44 Cb 0.00 -2.89 -0.02 0.00 -1.01 0.00 0.00 64.21 60.29 1hkt n SER 44 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hkt n GLY 45 N 0.56 0.87 3.13 0.23 0.00 -1.26 -5.06 105.19 103.66 1hkt n GLY 45 Ca -0.03 -0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 1hkt n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hkt s VAL 46 N 0.00 3.45 -0.54 1.61 1.01 -1.26 -4.84 120.40 119.83 1hkt s VAL 46 Ca 0.00 -2.14 -0.26 0.00 0.00 0.00 0.00 61.98 59.58 1hkt s VAL 46 Cb 0.00 -3.34 -0.24 0.00 0.00 0.00 0.00 36.38 32.80 1hkt s VAL 46 CO -0.00 -0.73 1.81 -0.81 0.00 0.00 0.00 175.10 175.37 1hkt n PRO 47 N 4.49 0.83 0.00 2.72 -0.04 -1.26 -4.79 135.00 136.95 1hkt n PRO 47 Ca -0.02 -1.57 0.00 0.00 -0.04 0.00 0.00 63.50 61.87 1hkt n PRO 47 Cb 0.41 -2.91 0.00 0.00 -0.04 0.00 0.00 33.50 30.96 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 9.67 0.00 -0.74 0.55 0.00 -1.26 -4.50 120.51 124.23 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 -0.01 0.00 -0.00 -1.26 -3.17 117.46 113.02 1hkt n PHE 49 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.33 1hkt n PHE 49 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 39.48 39.42 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 0.11 -1.43 -2.13 3.38 -1.93 -2.15 115.31 111.16 1hkt h LEU 50 Ca 0.00 -0.12 0.19 0.00 0.09 0.00 0.00 57.88 58.03 1hkt h LEU 50 Cb 0.00 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.65 1hkt h LEU 50 CO 0.00 0.20 0.59 0.00 0.09 0.00 0.00 178.44 179.31 1hkt h ALA 51 N 0.91 2.08 -0.00 1.53 0.00 -1.85 -0.56 119.26 121.37 1hkt h ALA 51 Ca 0.03 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1hkt h ALA 51 Cb 0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1hkt h ALA 51 CO -0.00 -0.36 0.00 0.87 0.00 0.00 0.00 179.25 179.76 1hkt h LYS 52 N 0.49 0.01 -0.06 0.00 1.79 -1.65 -0.85 116.57 116.31 1hkt h LYS 52 Ca 0.47 -0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.95 1hkt h LYS 52 Cb 1.03 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.68 1hkt h LYS 52 CO -0.20 0.07 0.22 -0.07 -1.08 0.00 0.00 179.45 178.39 1hkt h LEU 53 N -0.05 0.00 0.15 2.94 3.38 -0.87 2.12 115.31 122.98 1hkt h LEU 53 Ca 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 1hkt h LEU 53 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1hkt h LEU 53 CO -0.00 0.00 -1.68 -0.25 0.09 0.00 0.00 178.44 176.60 1hkt h TRP 54 N 0.00 0.59 -0.04 1.13 7.01 -0.92 -2.70 115.95 121.03 1hkt h TRP 54 Ca 0.03 -0.43 0.00 0.00 2.11 0.00 0.00 58.89 60.60 1hkt h TRP 54 Cb 0.46 -0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.50 1hkt h TRP 54 CO 0.00 1.55 0.00 0.54 -2.79 0.00 0.00 178.44 177.74 1hkt n ARG 55 N -3.52 2.26 -0.05 2.65 3.00 -0.22 -4.17 116.66 116.61 1hkt n ARG 55 Ca -0.22 -1.83 -0.03 0.00 -0.01 0.00 0.00 57.85 55.77 1hkt n ARG 55 Cb 1.06 -1.46 -0.12 0.00 0.00 0.00 0.00 32.46 31.94 1hkt n ARG 55 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1hkt n LEU 56 N 1.22 0.00 0.00 0.55 0.00 0.70 -3.88 117.00 115.59 1hkt n LEU 56 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 56.01 56.28 1hkt n LEU 56 Cb 0.57 0.26 0.64 0.00 0.00 0.00 0.00 43.42 44.89 1hkt n LEU 56 CO 0.15 0.26 0.91 0.52 0.00 0.00 0.00 177.39 179.23 1hkt n VAL 57 N -2.40 0.19 0.00 1.96 0.31 -1.02 -4.75 118.33 112.62 1hkt n VAL 57 Ca -0.18 0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1hkt n VAL 57 Cb 0.81 -0.64 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 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 -1.25 0.00 -4.51 4.52 2.03 -1.26 -4.70 116.55 111.37 1hkt n ASP 58 Ca 0.13 0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.24 1hkt n ASP 58 Cb 0.18 0.00 -0.18 0.00 -0.72 0.00 0.00 41.12 40.40 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 -0.13 -0.58 0.00 1.67 9.92 -1.25 -4.54 116.55 121.64 1hkt n ASP 59 Ca 0.00 -0.82 0.00 0.00 -0.53 0.00 0.00 54.79 53.44 1hkt n ASP 59 Cb 0.00 -0.84 0.00 0.00 -0.64 0.00 0.00 41.12 39.64 1hkt n ASP 59 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1hkt n ALA 60 N 9.16 0.00 -3.09 2.24 0.00 -1.26 -4.46 120.51 123.10 1hkt n ALA 60 Ca 0.62 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.68 1hkt n ALA 60 Cb 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.66 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 2.77 5.72 -1.90 0.00 8.00 -1.26 -4.69 116.55 125.19 1hkt n ASP 61 Ca 0.00 -3.45 0.00 0.00 0.71 0.00 0.00 54.79 52.05 1hkt n ASP 61 Cb 0.00 -1.08 0.05 0.00 -0.02 0.00 0.00 41.12 40.07 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 1.04 0.93 -1.39 -3.53 -2.24 -1.26 -4.96 114.28 102.87 1hkt n THR 62 Ca 0.29 -2.23 -0.40 0.00 -2.27 0.00 0.00 64.05 59.44 1hkt n THR 62 Cb 0.35 0.76 -0.02 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 -0.18 4.46 0.00 3.42 2.85 -1.26 -2.97 115.26 121.57 1hkt n ASN 63 Ca 0.11 -2.69 0.00 0.00 -0.11 0.00 0.00 54.58 51.89 1hkt n ASN 63 Cb 0.96 -1.43 0.00 0.00 1.24 0.00 0.00 39.78 40.54 1hkt n ASN 63 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1hkt n ARG 64 N 5.70 0.00 0.09 1.20 0.63 -1.26 -4.93 116.66 118.09 1hkt n ARG 64 Ca 0.55 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 57.61 1hkt n ARG 64 Cb 0.34 0.00 0.45 0.00 0.45 0.00 0.00 32.46 33.70 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 0.65 -3.64 6.15 4.77 -1.21 -4.23 117.00 119.49 1hkt n LEU 65 Ca 0.00 0.57 -0.07 0.00 -0.03 0.00 0.00 56.01 56.47 1hkt n LEU 65 Cb 0.00 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 40.65 1hkt n LEU 65 CO 0.00 -0.18 0.41 -0.51 -1.33 0.00 0.00 177.39 175.78 1hkt s ILE 66 N -3.10 0.00 0.25 -0.08 2.07 -1.16 -4.27 121.20 114.92 1hkt s ILE 66 Ca 0.11 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.26 1hkt s ILE 66 Cb 0.13 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.71 1hkt s ILE 66 CO 0.57 0.00 0.39 0.00 -1.91 0.00 0.00 174.94 173.99 1hkt s TRP 68 N -3.92 3.82 0.44 0.00 0.52 -1.26 -1.06 118.94 117.48 1hkt s TRP 68 Ca 0.28 1.75 -0.00 0.00 0.02 0.00 0.00 56.10 58.14 1hkt s TRP 68 Cb 0.01 -2.99 -0.01 0.00 -1.15 0.00 0.00 33.47 29.33 1hkt s TRP 68 CO 0.11 0.26 0.67 0.95 0.02 0.00 0.00 176.95 178.96 1hkt s THR 69 N -0.19 4.17 0.00 2.01 -4.23 0.70 -3.87 115.64 114.22 1hkt s THR 69 Ca 0.44 -0.43 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 1hkt s THR 69 Cb -0.23 -3.55 0.00 0.00 1.34 0.00 0.00 72.50 70.06 1hkt s THR 69 CO 0.29 -0.40 0.00 0.29 -0.54 0.00 0.00 174.62 174.26 1hkt n LYS 70 N -2.07 -1.49 -3.58 3.99 4.76 -1.26 -2.03 118.16 116.48 1hkt n LYS 70 Ca 0.01 0.25 -0.20 0.00 -2.87 0.00 0.00 58.31 55.50 1hkt n LYS 70 Cb 0.57 -3.97 0.06 0.00 -1.84 0.00 0.00 35.03 29.86 1hkt n LYS 70 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1hkt n ASP 71 N 0.24 -2.23 0.00 4.39 8.00 -1.25 -4.37 116.55 121.32 1hkt n ASP 71 Ca 0.00 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.80 1hkt n ASP 71 Cb 0.25 -4.63 0.00 0.00 -0.02 0.00 0.00 41.12 36.72 1hkt n ASP 71 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hkt n GLY 72 N -1.41 0.31 3.06 0.44 0.00 -0.89 -5.13 105.19 101.57 1hkt n GLY 72 Ca -0.25 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 1hkt n GLY 72 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hkt s GLN 73 N 0.00 0.75 0.31 1.61 -1.52 -0.86 -4.48 119.66 115.47 1hkt s GLN 73 Ca 0.00 -0.49 0.00 0.00 -1.95 0.00 0.00 55.36 52.92 1hkt s GLN 73 Cb 0.00 -0.71 0.00 0.00 -0.22 0.00 0.00 33.01 32.08 1hkt s GLN 73 CO 0.00 0.18 0.00 0.43 -0.25 0.00 0.00 175.29 175.65 1hkt n SER 74 N 2.43 -5.99 -4.14 5.90 7.64 -1.26 -3.04 113.62 115.17 1hkt n SER 74 Ca -0.16 0.63 -0.11 0.00 1.01 0.00 0.00 58.87 60.24 1hkt n SER 74 Cb 0.56 -3.57 -0.09 0.00 -1.01 0.00 0.00 64.21 60.10 1hkt n SER 74 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1hkt s PHE 75 N -2.84 0.92 0.01 1.43 -0.71 -1.15 -0.22 117.98 115.42 1hkt s PHE 75 Ca 0.00 -1.18 -0.03 0.00 -1.04 0.00 0.00 56.93 54.67 1hkt s PHE 75 Cb 0.00 -0.34 -0.01 0.00 -1.21 0.00 0.00 43.02 41.46 1hkt s PHE 75 CO 0.00 -0.74 0.05 0.54 -1.34 0.00 0.00 175.22 173.73 1hkt s VAL 76 N -4.11 0.09 -0.81 -2.49 0.11 -0.22 -2.15 120.40 110.81 1hkt s VAL 76 Ca 0.34 -0.74 0.02 0.00 -2.93 0.00 0.00 61.98 58.66 1hkt s VAL 76 Cb 0.05 -0.32 0.31 0.00 -1.53 0.00 0.00 36.38 34.89 1hkt s VAL 76 CO 0.11 -0.41 1.27 -0.38 -3.33 0.00 0.00 175.10 172.36 1hkt n ILE 77 N 1.65 4.27 -0.36 7.04 5.41 -0.87 -1.81 119.36 134.69 1hkt n ILE 77 Ca -0.23 -5.71 -0.09 0.00 1.00 0.00 0.00 62.75 57.73 1hkt n ILE 77 Cb 0.56 -1.68 -0.08 0.00 -0.71 0.00 0.00 39.64 37.73 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 0.25 -0.36 -3.03 0.38 10.64 -1.26 -3.25 117.38 120.75 1hkt n GLN 78 Ca 0.35 1.30 -0.44 0.00 -1.83 0.00 0.00 57.00 56.38 1hkt n GLN 78 Cb 0.34 -1.91 -0.03 0.00 -0.86 0.00 0.00 30.24 27.78 1hkt n GLN 78 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 1hkt s ASN 79 N -5.42 6.44 0.00 2.61 3.04 -1.26 -4.21 114.94 116.14 1hkt s ASN 79 Ca -0.10 -1.78 0.05 0.00 0.04 0.00 0.00 52.86 51.06 1hkt s ASN 79 Cb 0.10 -2.35 0.28 0.00 -1.54 0.00 0.00 41.25 37.75 1hkt s ASN 79 CO 0.54 -1.07 1.05 0.00 -3.04 0.00 0.00 177.10 174.58 1hkt n GLN 80 N 6.31 0.85 0.00 0.43 10.64 -1.20 -3.83 117.38 130.58 1hkt n GLN 80 Ca 0.08 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.25 1hkt n GLN 80 Cb 0.46 -1.09 0.00 0.00 -0.86 0.00 0.00 30.24 28.75 1hkt n GLN 80 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1hkt n ALA 81 N -0.59 0.00 0.50 2.61 0.00 -1.26 -4.19 120.51 117.58 1hkt n ALA 81 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1hkt n ALA 81 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1hkt n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hkt n GLN 82 N 0.00 0.58 0.03 0.00 0.00 -1.26 -3.09 117.38 113.63 1hkt n GLN 82 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 57.00 56.97 1hkt n GLN 82 Cb 0.00 -1.21 -0.09 0.00 0.00 0.00 0.00 30.24 28.93 1hkt n GLN 82 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 1hkt h PHE 83 N 0.98 0.00 0.00 2.61 3.57 -1.73 -3.35 116.94 119.02 1hkt h PHE 83 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1hkt h PHE 83 Cb 0.58 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.32 1hkt h PHE 83 CO 0.03 0.75 -0.30 0.00 -2.23 0.00 0.00 178.31 176.56 1hkt h ALA 84 N 1.25 0.00 0.00 2.41 0.00 -1.77 -3.31 119.26 117.84 1hkt h ALA 84 Ca -0.17 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.32 1hkt h ALA 84 Cb 1.72 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 1hkt h ALA 84 CO 0.07 0.30 -0.08 0.36 0.00 0.00 0.00 179.25 179.89 1hkt n LYS 85 N -4.18 1.16 0.00 0.00 2.85 -1.26 -2.77 118.16 113.95 1hkt n LYS 85 Ca -0.04 -0.46 0.00 0.00 -1.05 0.00 0.00 58.31 56.76 1hkt n LYS 85 Cb 0.15 -1.61 0.00 0.00 -0.65 0.00 0.00 35.03 32.93 1hkt n LYS 85 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1hkt n GLU 86 N 2.30 0.14 0.00 -1.58 4.07 -1.26 -4.97 120.64 119.34 1hkt n GLU 86 Ca 0.20 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.30 1hkt n GLU 86 Cb 0.54 -0.13 0.00 0.00 -0.06 0.00 0.00 31.44 31.79 1hkt n GLU 86 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1hkt n LEU 87 N -0.45 0.00 0.07 4.31 4.77 -1.19 -4.74 117.00 119.78 1hkt n LEU 87 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 1hkt n LEU 87 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1hkt n LEU 87 CO 0.00 0.00 0.21 -0.07 -1.33 0.00 0.00 177.39 176.20 1hkt h LEU 88 N 0.00 0.41 -0.77 2.23 3.38 -1.73 -3.28 115.31 115.56 1hkt h LEU 88 Ca 0.00 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.54 1hkt h LEU 88 Cb 0.42 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1hkt h LEU 88 CO 0.00 1.13 -0.11 -0.65 0.09 0.00 0.00 178.44 178.91 1hkt h PRO 89 N 0.18 0.82 -0.98 1.13 0.11 -1.75 0.20 132.00 131.71 1hkt h PRO 89 Ca -0.06 -0.28 -0.16 0.00 0.11 0.00 0.00 66.00 65.61 1hkt h PRO 89 Cb 1.55 -0.07 -0.09 0.00 0.11 0.00 0.00 31.00 32.50 1hkt h PRO 89 CO 0.15 0.89 0.20 1.28 -0.21 0.00 0.00 178.00 180.31 1hkt n LEU 90 N -4.16 4.09 0.00 2.35 4.32 -1.24 -3.26 117.00 119.10 1hkt n LEU 90 Ca 0.01 -2.12 0.00 0.00 -0.02 0.00 0.00 56.01 53.89 1hkt n LEU 90 Cb 0.37 -0.61 0.00 0.00 -1.62 0.00 0.00 43.42 41.56 1hkt n LEU 90 CO 0.43 0.65 0.00 0.59 -1.22 0.00 0.00 177.39 177.84 1hkt n ASN 91 N -0.04 0.00 -0.62 -1.43 4.13 -0.89 -4.91 115.26 111.50 1hkt n ASN 91 Ca 0.19 0.00 0.08 0.00 1.68 0.00 0.00 54.58 56.53 1hkt n ASN 91 Cb 0.87 0.06 0.25 0.00 -1.54 0.00 0.00 39.78 39.42 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 -1.34 0.37 0.00 3.10 4.01 -0.04 -4.94 117.16 118.31 1hkt n TYR 92 Ca 0.00 -0.19 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 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 0.47 0.00 -1.54 -0.72 3.00 -0.59 -4.83 118.16 113.94 1hkt n LYS 93 Ca 0.14 0.00 -0.51 0.00 -0.00 0.00 0.00 58.31 57.94 1hkt n LYS 93 Cb 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.30 1hkt n LYS 93 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1hkt n HIS 94 N 0.00 0.97 -3.94 5.64 1.44 -1.26 -4.10 115.22 113.98 1hkt n HIS 94 Ca 0.00 0.78 -0.35 0.00 -2.01 0.00 0.00 57.72 56.14 1hkt n HIS 94 Cb 0.00 -2.21 -0.08 0.00 0.12 0.00 0.00 29.99 27.82 1hkt n HIS 94 CO 0.00 0.00 0.00 1.21 -2.81 0.00 0.00 176.34 174.74 1hkt s ASN 95 N -0.09 5.92 0.08 4.39 2.47 -1.26 -4.51 114.94 121.93 1hkt s ASN 95 Ca 0.76 0.21 -0.27 0.00 0.42 0.00 0.00 52.86 53.99 1hkt s ASN 95 Cb -0.94 -1.97 0.09 0.00 -1.45 0.00 0.00 41.25 36.97 1hkt s ASN 95 CO 0.53 0.25 1.14 0.54 -3.72 0.00 0.00 177.10 175.84 1hkt s ASN 96 N -0.06 -0.06 0.00 -4.21 6.03 -1.26 -5.09 114.94 110.28 1hkt s ASN 96 Ca 0.08 -0.35 0.00 0.00 -1.03 0.00 0.00 52.86 51.56 1hkt s ASN 96 Cb -0.12 0.33 0.00 0.00 -3.03 0.00 0.00 41.25 38.43 1hkt s ASN 96 CO 0.01 -0.63 0.00 0.80 -2.03 0.00 0.00 177.10 175.25 1hkt n MET 97 N -0.60 0.00 0.08 3.55 1.56 -1.26 -4.68 117.12 115.77 1hkt n MET 97 Ca -0.05 0.00 0.20 0.00 -0.27 0.00 0.00 57.70 57.58 1hkt n MET 97 Cb 0.61 0.00 0.63 0.00 2.15 0.00 0.00 33.22 36.61 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 0.05 2.16 0.13 -5.12 0.00 -1.99 0.87 119.26 115.35 1hkt h ALA 98 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.61 1hkt h ALA 98 Cb 0.00 0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.84 1hkt h ALA 98 CO 0.00 -0.88 -1.23 0.77 0.00 0.00 0.00 179.25 177.91 1hkt h SER 99 N 0.00 0.63 -0.31 0.00 0.02 -1.99 -2.31 113.55 109.58 1hkt h SER 99 Ca 0.21 -0.62 -0.14 0.00 -0.84 0.00 0.00 61.79 60.41 1hkt h SER 99 Cb 1.51 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.83 1hkt h SER 99 CO -0.00 1.46 -0.31 0.15 -1.14 0.00 0.00 176.83 176.98 1hkt h PHE 100 N 0.16 0.97 -0.48 3.45 3.57 0.43 -2.81 116.94 122.24 1hkt h PHE 100 Ca -0.16 -0.26 -0.12 0.00 3.53 0.00 0.00 57.97 60.96 1hkt h PHE 100 Cb 1.92 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 40.43 1hkt h PHE 100 CO 0.09 1.03 -0.16 0.82 -2.23 0.00 0.00 178.31 177.86 1hkt h ILE 101 N 0.70 1.27 -0.45 1.41 2.04 -1.23 -1.95 117.51 119.30 1hkt h ILE 101 Ca 0.08 -1.31 0.12 0.00 1.00 0.00 0.00 64.86 64.75 1hkt h ILE 101 Cb 0.86 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 1hkt h ILE 101 CO 0.08 0.45 0.32 -0.09 0.00 0.00 0.00 178.15 178.91 1hkt h ARG 102 N 0.80 0.04 0.01 2.37 2.43 -1.25 0.29 114.38 119.07 1hkt h ARG 102 Ca 0.12 -0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 59.08 1hkt h ARG 102 Cb 0.73 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 1hkt h ARG 102 CO 0.06 0.02 -0.90 1.96 -1.51 0.00 0.00 179.97 179.60 1hkt h GLN 103 N 0.04 0.23 -0.52 0.20 4.20 -1.12 -2.60 115.11 115.54 1hkt h GLN 103 Ca 0.21 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 1hkt h GLN 103 Cb 0.81 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.64 1hkt h GLN 103 CO -0.01 0.99 0.18 -0.07 -0.67 0.00 0.00 178.83 179.25 1hkt h LEU 104 N 0.12 0.74 0.00 1.46 3.38 0.12 -0.62 115.31 120.52 1hkt h LEU 104 Ca -0.05 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1hkt h LEU 104 Cb 1.54 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1hkt h LEU 104 CO 0.14 0.73 0.00 -3.20 0.09 0.00 0.00 178.44 176.20 1hkt n ASN 105 N -4.50 0.00 0.03 -0.43 2.85 -0.65 -2.53 115.26 110.03 1hkt n ASN 105 Ca 0.02 -0.17 -0.11 0.00 -0.11 0.00 0.00 54.58 54.21 1hkt n ASN 105 Cb 0.18 -0.24 -0.14 0.00 1.24 0.00 0.00 39.78 40.82 1hkt n ASN 105 CO 0.00 0.00 0.00 -0.03 -2.11 0.00 0.00 177.26 175.12 1hkt h MET 106 N 0.00 0.08 0.16 1.20 4.05 -0.71 -3.36 114.93 116.36 1hkt h MET 106 Ca 0.00 -0.14 -0.24 0.00 -0.28 0.00 0.00 59.70 59.04 1hkt h MET 106 Cb 0.19 0.05 0.03 0.00 -0.80 0.00 0.00 31.60 31.07 1hkt h MET 106 CO 0.00 0.85 -1.03 1.88 0.23 0.00 0.00 176.91 178.83 1hkt h TYR 107 N 0.02 0.73 0.00 1.39 0.05 -1.33 -3.15 116.97 114.67 1hkt h TYR 107 Ca -0.20 -0.51 0.00 0.00 0.05 0.00 0.00 58.73 58.07 1hkt h TYR 107 Cb 1.95 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 39.65 1hkt h TYR 107 CO 0.02 1.39 0.00 0.41 -1.05 0.00 0.00 178.16 178.93 1hkt n GLY 108 N 1.61 0.00 3.92 3.88 0.00 -1.20 -4.51 105.19 108.89 1hkt n GLY 108 Ca -0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 2.57 -0.47 1.61 0.40 -1.05 -4.94 117.98 116.10 1hkt s PHE 109 Ca 0.00 0.57 0.06 0.00 -0.60 0.00 0.00 56.93 56.95 1hkt s PHE 109 Cb 0.00 -3.60 0.18 0.00 0.51 0.00 0.00 43.02 40.12 1hkt s PHE 109 CO 0.00 -1.94 0.54 1.58 0.70 0.00 0.00 175.22 176.10 1hkt n HIS 110 N -3.36 -2.41 -2.22 0.36 -0.00 -1.25 -4.85 115.22 101.49 1hkt n HIS 110 Ca 0.10 -2.33 -0.41 0.00 0.46 0.00 0.00 57.72 55.54 1hkt n HIS 110 Cb 0.61 0.88 -0.03 0.00 -0.12 0.00 0.00 29.99 31.33 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 0.45 4.40 -1.33 1.57 -2.85 -1.26 -3.78 119.74 116.95 1hkt s LYS 111 Ca 0.32 2.05 -0.06 0.00 -1.00 0.00 0.00 55.97 57.27 1hkt s LYS 111 Cb 0.02 -3.18 0.12 0.00 -2.06 0.00 0.00 37.83 32.73 1hkt s LYS 111 CO -0.13 -0.22 2.29 -0.89 0.10 0.00 0.00 175.35 176.50 1hkt n ILE 112 N 2.39 5.00 -2.45 3.79 2.08 -1.24 -4.24 119.36 124.69 1hkt n ILE 112 Ca 0.05 -4.27 -0.03 0.00 0.56 0.00 0.00 62.75 59.06 1hkt n ILE 112 Cb 0.43 -2.16 0.05 0.00 -0.75 0.00 0.00 39.64 37.21 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 2.17 0.09 -1.78 1.39 5.66 -1.26 -4.87 114.28 115.67 1hkt n THR 113 Ca 0.58 -0.81 -0.35 0.00 -3.05 0.00 0.00 64.05 60.42 1hkt n THR 113 Cb 0.27 0.86 0.06 0.00 -1.55 0.00 0.00 70.33 69.96 1hkt n THR 113 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1hkt s SER 114 N -1.32 4.83 0.00 1.09 0.15 -1.26 -4.80 113.70 112.39 1hkt s SER 114 Ca 0.08 2.35 0.00 0.00 0.70 0.00 0.00 55.95 59.09 1hkt s SER 114 Cb 0.29 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 1hkt s SER 114 CO -0.08 -1.84 0.56 2.30 1.20 0.00 0.00 173.24 175.38 1hkt n ILE 115 N -2.05 0.30 0.24 6.45 -5.35 -1.26 -1.48 119.36 116.20 1hkt n ILE 115 Ca 0.13 0.08 0.12 0.00 -0.27 0.00 0.00 62.75 62.81 1hkt n ILE 115 Cb 0.50 -1.08 0.54 0.00 -1.74 0.00 0.00 39.64 37.86 1hkt n ILE 115 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 1hkt h ASP 116 N 0.00 0.00 -2.73 7.28 1.82 -2.03 -3.44 116.42 117.31 1hkt h ASP 116 Ca 0.00 0.00 0.11 0.00 -0.39 0.00 0.00 57.03 56.75 1hkt h ASP 116 Cb 0.00 0.00 -0.28 0.00 0.68 0.00 0.00 39.33 39.73 1hkt h ASP 116 CO 0.00 0.15 0.52 0.21 -1.61 0.00 0.00 179.24 178.51 1hkt s ASN 117 N -6.04 -0.38 -0.28 2.28 3.84 -0.55 -5.17 114.94 108.64 1hkt s ASN 117 Ca 0.01 0.68 -0.22 0.00 0.21 0.00 0.00 52.86 53.54 1hkt s ASN 117 Cb 0.10 0.88 0.10 0.00 -0.55 0.00 0.00 41.25 41.77 1hkt s ASN 117 CO 0.61 -0.11 0.83 -0.83 -2.79 0.00 0.00 177.10 174.80 1hkt s GLY 118 N 0.63 -0.39 0.35 1.21 0.00 -1.26 -4.37 107.32 103.49 1hkt s GLY 118 Ca -0.01 2.45 0.24 0.00 0.00 0.00 0.00 44.72 47.39 1hkt s GLY 118 CO -0.11 2.04 1.57 -1.33 0.00 0.00 0.00 173.10 175.27 1hkt h GLY 119 N 5.40 0.00 -5.73 0.20 0.00 -1.99 -3.48 103.07 97.48 1hkt h GLY 119 Ca -0.29 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 46.78 1hkt h GLY 119 CO 0.11 0.00 -0.69 1.04 0.00 0.00 0.00 176.54 177.00 1hkt n LEU 120 N -2.83 -4.91 0.00 3.11 4.77 -1.26 -5.00 117.00 110.88 1hkt n LEU 120 Ca 0.04 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 1hkt n LEU 120 Cb 0.51 -2.91 0.00 0.00 -2.33 0.00 0.00 43.42 38.69 1hkt n LEU 120 CO 0.34 -0.07 0.00 0.54 -1.33 0.00 0.00 177.39 176.87 1hkt n ARG 121 N -3.11 0.00 -3.12 3.23 1.74 -1.26 -5.12 116.66 109.02 1hkt n ARG 121 Ca -0.07 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.94 1hkt n ARG 121 Cb 0.59 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 32.05 1hkt n ARG 121 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1hkt n PHE 122 N 0.00 -2.03 -1.83 -1.55 7.35 -1.26 -5.08 117.46 113.06 1hkt n PHE 122 Ca 0.00 -1.41 -0.39 0.00 -0.76 0.00 0.00 57.45 54.89 1hkt n PHE 122 Cb 0.00 0.70 -0.03 0.00 0.35 0.00 0.00 39.48 40.51 1hkt n PHE 122 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1hkt s ASP 123 N -2.59 5.18 0.00 -2.13 2.15 -1.26 -4.23 116.67 113.79 1hkt s ASP 123 Ca 0.12 0.97 0.00 0.00 0.43 0.00 0.00 52.55 54.07 1hkt s ASP 123 Cb -0.04 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 1hkt s ASP 123 CO 0.09 -2.33 0.00 0.54 -0.17 0.00 0.00 175.17 173.30 1hkt n ARG 124 N 8.91 0.00 -2.55 4.34 1.74 -1.26 -4.97 116.66 122.87 1hkt n ARG 124 Ca 0.27 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.31 1hkt n ARG 124 Cb 0.51 -0.03 0.07 0.00 -1.02 0.00 0.00 32.46 31.99 1hkt n ARG 124 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1hkt n ASP 125 N -1.03 -1.38 0.00 0.55 8.00 -1.26 -4.84 116.55 116.60 1hkt n ASP 125 Ca 0.00 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.50 1hkt n ASP 125 Cb 0.00 0.84 0.00 0.00 -0.02 0.00 0.00 41.12 41.94 1hkt n ASP 125 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1hkt n GLU 126 N -0.69 2.46 -0.52 -1.24 1.02 -1.26 -4.44 120.64 115.97 1hkt n GLU 126 Ca -0.13 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 56.95 1hkt n GLU 126 Cb 0.75 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 32.11 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 0.00 0.00 -3.36 -3.67 3.06 -1.26 -4.61 119.36 109.52 1hkt n ILE 127 Ca 0.00 -0.19 -0.33 0.00 -2.50 0.00 0.00 62.75 59.73 1hkt n ILE 127 Cb 0.00 0.00 -0.06 0.00 0.54 0.00 0.00 39.64 40.12 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 2.45 3.87 -0.08 9.51 -1.05 -1.26 -2.06 118.70 130.09 1hkt s GLU 128 Ca 0.36 0.39 0.01 0.00 -0.15 0.00 0.00 54.97 55.57 1hkt s GLU 128 Cb -0.23 -2.67 0.02 0.00 -0.44 0.00 0.00 34.13 30.81 1hkt s GLU 128 CO 0.15 0.33 -0.07 -0.06 0.95 0.00 0.00 175.26 176.56 1hkt s PHE 129 N -1.77 1.16 -0.17 4.83 0.08 -0.91 -3.61 117.98 117.59 1hkt s PHE 129 Ca 0.46 -0.45 -0.07 0.00 0.12 0.00 0.00 56.93 56.99 1hkt s PHE 129 Cb -0.12 -0.97 0.07 0.00 -0.57 0.00 0.00 43.02 41.43 1hkt s PHE 129 CO 0.20 -0.33 0.37 0.45 -0.10 0.00 0.00 175.22 175.81 1hkt s SER 130 N 1.25 -0.23 -0.05 1.36 0.15 -1.25 -2.95 113.70 111.98 1hkt s SER 130 Ca -0.05 0.83 -0.15 0.00 0.70 0.00 0.00 55.95 57.29 1hkt s SER 130 Cb -0.14 0.94 0.03 0.00 -1.71 0.00 0.00 66.02 65.14 1hkt s SER 130 CO -0.02 -0.21 0.34 -1.38 1.20 0.00 0.00 173.24 173.17 1hkt s HIS 131 N 2.03 -0.27 0.00 3.44 -3.43 -1.26 -3.97 115.29 111.83 1hkt s HIS 131 Ca -0.05 0.52 0.00 0.00 -0.80 0.00 0.00 55.06 54.74 1hkt s HIS 131 Cb -0.11 0.12 0.00 0.00 -1.43 0.00 0.00 32.58 31.17 1hkt s HIS 131 CO -0.12 -0.34 0.47 -0.35 -2.00 0.00 0.00 174.74 172.40 1hkt n PRO 132 N 1.75 0.24 -0.78 -0.38 -0.04 -1.26 -3.19 135.00 131.34 1hkt n PRO 132 Ca -0.19 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.26 1hkt n PRO 132 Cb 0.56 -1.38 -0.01 0.00 -0.04 0.00 0.00 33.50 32.63 1hkt n PRO 132 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1hkt n PHE 133 N 1.82 0.00 -3.05 0.54 3.72 -1.26 -5.01 117.46 114.22 1hkt n PHE 133 Ca 0.00 -0.19 -0.13 0.00 -0.05 0.00 0.00 57.45 57.07 1hkt n PHE 133 Cb 0.12 0.16 -0.04 0.00 -0.94 0.00 0.00 39.48 38.79 1hkt n PHE 133 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1hkt s PHE 134 N 0.00 -0.52 0.14 1.38 5.36 -1.19 -4.23 117.98 118.92 1hkt s PHE 134 Ca 0.06 -1.23 0.02 0.00 -0.96 0.00 0.00 56.93 54.82 1hkt s PHE 134 Cb 0.06 -0.19 -0.01 0.00 -0.34 0.00 0.00 43.02 42.55 1hkt s PHE 134 CO -0.03 -1.09 0.06 1.63 -1.46 0.00 0.00 175.22 174.33 1hkt n LYS 135 N 3.03 0.72 -0.00 10.12 4.76 -1.26 -4.30 118.16 131.23 1hkt n LYS 135 Ca 0.22 -1.23 -0.00 0.00 -2.87 0.00 0.00 58.31 54.43 1hkt n LYS 135 Cb 0.52 0.71 -0.00 0.00 -1.84 0.00 0.00 35.03 34.42 1hkt n LYS 135 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 1hkt h ARG 136 N 0.00 -0.00 0.00 1.97 2.43 -1.99 -3.47 114.38 113.32 1hkt h ARG 136 Ca -0.11 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1hkt h ARG 136 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1hkt h ARG 136 CO 0.17 -0.00 0.00 0.27 -1.51 0.00 0.00 179.97 178.90 1hkt n ASN 137 N -2.09 -1.03 -3.36 -3.80 6.94 -1.26 -4.46 115.26 106.19 1hkt n ASN 137 Ca -0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.43 1hkt n ASN 137 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1hkt n ASN 137 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1hkt n SER 138 N -1.54 -6.49 -1.50 0.53 7.64 -1.26 -4.72 113.62 106.28 1hkt n SER 138 Ca 0.00 -0.38 0.00 0.00 1.01 0.00 0.00 58.87 59.50 1hkt n SER 138 Cb 0.00 -3.62 0.00 0.00 -1.01 0.00 0.00 64.21 59.58 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 -1.87 0.53 0.00 1.43 -0.04 -1.26 -2.61 135.00 131.18 1hkt n PRO 139 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1hkt n PRO 139 Cb 0.59 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 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 1.41 0.00 -0.04 0.54 -1.74 -1.26 -4.83 117.46 111.54 1hkt n PHE 140 Ca 0.00 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.76 1hkt n PHE 140 Cb 0.27 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.19 1hkt n PHE 140 CO 0.00 0.00 0.00 -0.07 -0.56 0.00 0.00 176.76 176.13 1hkt h LEU 141 N 0.00 0.22 -0.68 5.98 3.38 -1.80 -3.16 115.31 119.24 1hkt h LEU 141 Ca 0.00 -0.47 0.15 0.00 0.09 0.00 0.00 57.88 57.64 1hkt h LEU 141 Cb 0.23 -0.06 -0.12 0.00 0.09 0.00 0.00 40.66 40.80 1hkt h LEU 141 CO 0.00 0.65 -0.01 -0.07 0.09 0.00 0.00 178.44 179.10 1hkt h LEU 142 N -0.21 -0.33 -2.70 1.67 3.38 -1.83 0.32 115.31 115.60 1hkt h LEU 142 Ca 0.01 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1hkt h LEU 142 Cb 0.58 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1hkt h LEU 142 CO 0.02 -0.15 0.00 -0.67 0.09 0.00 0.00 178.44 177.73 1hkt n ASP 143 N -5.32 2.69 0.00 -0.43 2.03 -1.19 -2.62 116.55 111.71 1hkt n ASP 143 Ca 0.11 -1.60 0.00 0.00 0.52 0.00 0.00 54.79 53.82 1hkt n ASP 143 Cb 0.40 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 40.28 1hkt n ASP 143 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1hkt n GLN 144 N 1.19 2.67 -2.38 -0.67 7.27 0.11 -5.07 117.38 120.52 1hkt n GLN 144 Ca 0.00 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.65 1hkt n GLN 144 Cb 0.32 -0.44 -0.03 0.00 2.41 0.00 0.00 30.24 32.50 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 -0.50 3.91 0.12 1.69 1.01 -1.08 -4.99 121.20 121.36 1hkt s ILE 145 Ca 0.00 1.37 -0.01 0.00 0.00 0.00 0.00 60.65 62.00 1hkt s ILE 145 Cb 0.00 -3.88 0.01 0.00 0.01 0.00 0.00 42.46 38.60 1hkt s ILE 145 CO 0.00 0.10 0.18 2.29 0.00 0.00 0.00 174.94 177.51 1hkt n LYS 146 N 4.01 0.26 -2.87 2.79 -0.00 -1.26 -5.06 118.16 116.02 1hkt n LYS 146 Ca 0.10 -0.92 -0.28 0.00 -0.00 0.00 0.00 58.31 57.21 1hkt n LYS 146 Cb 0.46 0.91 -0.01 0.00 -0.00 0.00 0.00 35.03 36.39 1hkt n LYS 146 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1hkt s ARG 147 N -2.24 3.59 0.00 -1.58 3.52 -1.26 -4.35 118.95 116.63 1hkt s ARG 147 Ca 0.09 0.15 0.00 0.00 -0.13 0.00 0.00 55.73 55.84 1hkt s ARG 147 Cb -0.01 -2.45 0.00 0.00 -1.56 0.00 0.00 34.95 30.93 1hkt s ARG 147 CO 0.07 -0.07 0.00 1.17 -0.81 0.00 0.00 175.30 175.65