#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qal n LYS 13 N 0.00 1.30 -2.94 5.56 5.02 -1.26 -5.09 118.16 120.75 2qal n LYS 13 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 2qal n LYS 13 Cb 0.00 -0.55 0.01 0.00 -0.02 0.00 0.00 35.03 34.47 2qal n LYS 13 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2qal n GLN 14 N -0.58 -2.26 0.07 1.97 1.13 -1.12 -4.95 117.38 111.64 2qal n GLN 14 Ca 0.00 2.01 -0.19 0.00 -1.94 0.00 0.00 57.00 56.88 2qal n GLN 14 Cb 0.05 -5.32 -0.14 0.00 0.11 0.00 0.00 30.24 24.93 2qal n GLN 14 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2qal h VAL 15 N 1.88 1.13 0.00 5.09 2.07 -1.29 -3.48 116.25 121.65 2qal h VAL 15 Ca -0.06 -2.74 0.00 0.00 0.82 0.00 0.00 66.70 64.72 2qal h VAL 15 Cb 1.04 2.79 0.00 0.00 -1.52 0.00 0.00 31.29 33.60 2qal h VAL 15 CO 0.21 0.83 0.00 -1.20 0.02 0.00 0.00 177.57 177.43 2qal n SER 16 N -3.50 0.00 -3.25 0.57 7.64 -0.96 -4.80 113.62 109.32 2qal n SER 16 Ca -0.18 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.74 2qal n SER 16 Cb 1.05 -0.70 -0.02 0.00 -1.01 0.00 0.00 64.21 63.53 2qal n SER 16 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2qal s ASP 17 N -1.80 -0.99 0.00 6.43 -4.77 -1.23 0.17 116.67 114.48 2qal s ASP 17 Ca 0.00 0.80 0.00 0.00 -3.30 0.00 0.00 52.55 50.05 2qal s ASP 17 Cb 0.00 1.90 0.00 0.00 -1.09 0.00 0.00 42.92 43.73 2qal s ASP 17 CO 0.00 -0.19 0.00 0.61 0.70 0.00 0.00 175.17 176.29 2qal n GLY 18 N 5.38 5.41 3.61 2.12 0.00 -1.16 -4.35 105.19 116.20 2qal n GLY 18 Ca -0.05 -1.34 -0.25 0.00 0.00 0.00 0.00 46.02 44.38 2qal n GLY 18 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qal s VAL 19 N 0.12 2.57 -0.30 1.61 -7.23 0.33 -1.43 120.40 116.07 2qal s VAL 19 Ca 0.00 -2.03 -0.00 0.00 -1.81 0.00 0.00 61.98 58.14 2qal s VAL 19 Cb 0.00 -2.75 0.10 0.00 0.56 0.00 0.00 36.38 34.28 2qal s VAL 19 CO 0.00 -0.21 0.08 0.00 -0.31 0.00 0.00 175.10 174.66 2qal s ALA 20 N -2.53 1.66 0.08 1.32 0.00 -1.01 -1.68 121.76 119.60 2qal s ALA 20 Ca 0.34 -1.68 -0.27 0.00 0.00 0.00 0.00 51.96 50.35 2qal s ALA 20 Cb 0.00 -1.62 -0.06 0.00 0.00 0.00 0.00 23.12 21.44 2qal s ALA 20 CO 0.19 -1.61 0.85 -1.01 0.00 0.00 0.00 175.76 174.17 2qal s HIS 21 N 1.55 3.78 -0.18 0.00 3.76 0.41 -0.18 115.29 124.43 2qal s HIS 21 Ca 0.08 1.62 0.00 0.00 -0.15 0.00 0.00 55.06 56.62 2qal s HIS 21 Cb -0.17 -2.92 0.04 0.00 1.11 0.00 0.00 32.58 30.64 2qal s HIS 21 CO -0.22 0.26 -0.07 0.42 -0.85 0.00 0.00 174.74 174.28 2qal s ILE 22 N -0.10 1.35 -0.93 0.60 1.01 0.87 -0.93 121.20 123.07 2qal s ILE 22 Ca 0.42 -0.83 -0.15 0.00 0.00 0.00 0.00 60.65 60.09 2qal s ILE 22 Cb -0.22 -1.50 0.19 0.00 0.01 0.00 0.00 42.46 40.94 2qal s ILE 22 CO 0.26 0.12 1.00 -2.28 0.00 0.00 0.00 174.94 174.04 2qal s HIS 23 N 1.52 3.54 -1.28 3.97 2.46 -0.24 -2.66 115.29 122.60 2qal s HIS 23 Ca -0.01 -1.83 -0.08 0.00 0.47 0.00 0.00 55.06 53.61 2qal s HIS 23 Cb -0.16 -4.05 -0.03 0.00 -0.13 0.00 0.00 32.58 28.22 2qal s HIS 23 CO -0.08 -1.22 2.82 0.00 -2.47 0.00 0.00 174.74 173.80 2qal n ALA 24 N 5.01 7.13 -1.67 1.58 0.00 -1.04 -2.71 120.51 128.81 2qal n ALA 24 Ca 0.21 -3.52 -0.36 0.00 0.00 0.00 0.00 53.44 49.77 2qal n ALA 24 Cb 0.47 -2.98 0.05 0.00 0.00 0.00 0.00 19.45 16.99 2qal n ALA 24 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qal s SER 25 N 1.41 4.86 0.53 0.00 1.04 -0.73 -3.35 113.70 117.47 2qal s SER 25 Ca 0.63 2.44 0.30 0.00 0.48 0.00 0.00 55.95 59.80 2qal s SER 25 Cb 0.21 -2.60 1.62 0.00 0.10 0.00 0.00 66.02 65.35 2qal s SER 25 CO -0.08 -1.82 1.90 -0.26 0.98 0.00 0.00 173.24 173.96 2qal h PHE 26 N 0.57 0.00 0.00 5.02 0.04 -1.93 -3.06 116.94 117.58 2qal h PHE 26 Ca -0.50 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.14 2qal h PHE 26 Cb 1.31 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.43 2qal h PHE 26 CO 0.45 0.00 -1.48 0.09 -0.60 0.00 0.00 178.31 176.78 2qal n ASN 27 N -2.66 3.34 -4.07 2.17 3.02 -1.26 -4.91 115.26 110.89 2qal n ASN 27 Ca -0.02 -0.03 -0.24 0.00 -0.03 0.00 0.00 54.58 54.26 2qal n ASN 27 Cb 0.20 0.19 -0.08 0.00 -0.61 0.00 0.00 39.78 39.47 2qal n ASN 27 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2qal s ASN 28 N -4.42 2.55 -0.25 6.41 3.04 -1.16 -3.73 114.94 117.37 2qal s ASN 28 Ca -0.08 -1.65 -0.02 0.00 0.04 0.00 0.00 52.86 51.15 2qal s ASN 28 Cb 0.03 0.46 0.14 0.00 -1.54 0.00 0.00 41.25 40.34 2qal s ASN 28 CO 0.23 -0.92 0.38 -0.89 -3.04 0.00 0.00 177.10 172.86 2qal s THR 29 N -3.28 -0.60 -0.06 -5.21 2.01 -1.26 -1.78 115.64 105.47 2qal s THR 29 Ca 0.27 -0.11 0.04 0.00 0.31 0.00 0.00 61.69 62.19 2qal s THR 29 Cb 0.03 -0.84 -0.02 0.00 0.01 0.00 0.00 72.50 71.68 2qal s THR 29 CO 0.16 -0.16 -0.17 0.27 -0.69 0.00 0.00 174.62 174.03 2qal s ILE 30 N 2.54 2.80 -0.18 1.82 -4.36 -1.10 0.24 121.20 122.96 2qal s ILE 30 Ca 0.12 -0.80 -0.01 0.00 -0.26 0.00 0.00 60.65 59.70 2qal s ILE 30 Cb -0.15 -2.09 0.00 0.00 1.25 0.00 0.00 42.46 41.47 2qal s ILE 30 CO -0.18 0.57 -0.13 0.68 0.24 0.00 0.00 174.94 176.12 2qal s VAL 31 N -0.42 2.73 -0.10 8.37 -7.23 0.13 -1.08 120.40 122.81 2qal s VAL 31 Ca 0.04 -0.73 0.04 0.00 -1.81 0.00 0.00 61.98 59.52 2qal s VAL 31 Cb -0.12 -2.18 -0.00 0.00 0.56 0.00 0.00 36.38 34.64 2qal s VAL 31 CO 0.02 0.50 -0.23 -0.89 -0.31 0.00 0.00 175.10 174.19 2qal s THR 32 N 1.08 2.15 -0.17 5.32 2.01 -0.11 -0.63 115.64 125.30 2qal s THR 32 Ca -0.00 -0.99 -0.05 0.00 0.31 0.00 0.00 61.69 60.96 2qal s THR 32 Cb -0.14 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 2qal s THR 32 CO -0.04 0.56 0.01 -0.63 -0.69 0.00 0.00 174.62 173.83 2qal s ILE 33 N 0.35 4.30 0.03 1.82 -1.09 0.71 -0.44 121.20 126.89 2qal s ILE 33 Ca -0.18 -0.21 -0.13 0.00 -2.23 0.00 0.00 60.65 57.90 2qal s ILE 33 Cb -0.18 -2.91 0.02 0.00 -1.58 0.00 0.00 42.46 37.81 2qal s ILE 33 CO 0.08 0.48 0.28 0.28 -1.23 0.00 0.00 174.94 174.83 2qal s THR 34 N 0.37 0.09 1.12 2.92 -1.32 -0.68 0.24 115.64 118.38 2qal s THR 34 Ca -0.01 -0.70 -0.12 0.00 -1.21 0.00 0.00 61.69 59.65 2qal s THR 34 Cb -0.13 -0.88 0.26 0.00 -1.51 0.00 0.00 72.50 70.23 2qal s THR 34 CO 0.02 -0.39 1.05 1.51 -2.21 0.00 0.00 174.62 174.60 2qal s ASP 35 N -1.96 1.29 0.00 8.08 1.47 -1.19 0.12 116.67 124.48 2qal s ASP 35 Ca -0.06 1.72 0.01 0.00 1.18 0.00 0.00 52.55 55.40 2qal s ASP 35 Cb -0.02 -2.41 0.09 0.00 -0.34 0.00 0.00 42.92 40.24 2qal s ASP 35 CO -0.02 -4.04 0.34 0.54 0.68 0.00 0.00 175.17 172.66 2qal n ARG 36 N -4.83 0.12 -0.10 2.11 1.74 -1.26 -1.87 116.66 112.58 2qal n ARG 36 Ca 0.05 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.89 2qal n ARG 36 Cb 0.53 -1.18 -0.12 0.00 -1.02 0.00 0.00 32.46 30.67 2qal n ARG 36 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2qal n GLN 37 N -0.68 0.62 0.00 5.56 1.13 -1.26 -5.01 117.38 117.73 2qal n GLN 37 Ca 0.01 0.38 0.00 0.00 -1.94 0.00 0.00 57.00 55.45 2qal n GLN 37 Cb 0.00 -1.64 0.00 0.00 0.11 0.00 0.00 30.24 28.71 2qal n GLN 37 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qal n GLY 38 N 1.58 1.22 3.55 1.08 0.00 -0.78 -5.08 105.19 106.76 2qal n GLY 38 Ca -0.40 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 2qal n GLY 38 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qal n ASN 39 N 0.00 2.39 -4.68 1.61 3.02 -1.26 -4.80 115.26 111.54 2qal n ASN 39 Ca 0.00 -0.31 -0.47 0.00 -0.03 0.00 0.00 54.58 53.77 2qal n ASN 39 Cb 0.00 -1.54 -0.04 0.00 -0.61 0.00 0.00 39.78 37.59 2qal n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qal n ALA 40 N 14.68 1.20 0.05 5.41 0.00 -1.26 -3.15 120.51 137.45 2qal n ALA 40 Ca 0.37 0.35 -0.23 0.00 0.00 0.00 0.00 53.44 53.94 2qal n ALA 40 Cb 0.49 -2.46 -0.15 0.00 0.00 0.00 0.00 19.45 17.34 2qal n ALA 40 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2qal h LEU 41 N 7.91 0.55 -7.00 0.00 3.38 -0.55 -3.48 115.31 116.12 2qal h LEU 41 Ca -0.47 -0.93 0.15 0.00 0.09 0.00 0.00 57.88 56.73 2qal h LEU 41 Cb 1.26 -0.18 -0.20 0.00 0.09 0.00 0.00 40.66 41.64 2qal h LEU 41 CO 0.92 1.77 0.63 -0.83 0.09 0.00 0.00 178.44 181.03 2qal s GLY 42 N -5.15 -0.31 0.16 0.83 0.00 -0.75 -4.87 107.32 97.22 2qal s GLY 42 Ca -0.18 1.63 -0.05 0.00 0.00 0.00 0.00 44.72 46.12 2qal s GLY 42 CO 0.82 0.66 0.18 0.66 0.00 0.00 0.00 173.10 175.42 2qal s TRP 43 N -2.15 0.72 0.03 1.90 1.48 -1.26 -0.20 118.94 119.46 2qal s TRP 43 Ca 0.04 -1.06 -0.16 0.00 -1.06 0.00 0.00 56.10 53.86 2qal s TRP 43 Cb -0.01 -0.30 0.03 0.00 -1.16 0.00 0.00 33.47 32.03 2qal s TRP 43 CO -0.04 -0.64 0.35 0.00 -4.06 0.00 0.00 176.95 172.56 2qal s ALA 44 N -4.04 -0.85 0.05 2.67 0.00 0.20 -4.80 121.76 114.98 2qal s ALA 44 Ca 0.24 0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.45 2qal s ALA 44 Cb 0.05 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 23.42 2qal s ALA 44 CO 0.04 -0.40 -0.10 -0.08 0.00 0.00 0.00 175.76 175.22 2qal s THR 45 N -2.25 0.76 0.03 0.00 -1.32 -1.26 0.21 115.64 111.81 2qal s THR 45 Ca -0.07 -1.07 -0.20 0.00 -1.21 0.00 0.00 61.69 59.14 2qal s THR 45 Cb -0.02 -0.77 -0.11 0.00 -1.51 0.00 0.00 72.50 70.09 2qal s THR 45 CO -0.01 -0.25 1.23 0.00 -2.21 0.00 0.00 174.62 173.37 2qal h ALA 46 N 4.60 -1.12 -1.03 11.08 0.00 -0.50 -1.82 119.26 130.47 2qal h ALA 46 Ca -0.37 -0.15 0.28 0.00 0.00 0.00 0.00 54.91 54.66 2qal h ALA 46 Cb 1.20 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 19.20 2qal h ALA 46 CO 0.42 -1.07 0.71 0.78 0.00 0.00 0.00 179.25 180.08 2qal h GLY 47 N -0.74 0.52 2.00 0.00 0.00 -1.80 0.70 103.07 103.75 2qal h GLY 47 Ca -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2qal h GLY 47 CO 0.12 -0.05 0.00 -1.33 0.00 0.00 0.00 176.54 175.28 2qal h GLY 48 N 0.19 0.00 -3.41 4.60 0.00 -1.82 -3.30 103.07 99.32 2qal h GLY 48 Ca 0.53 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.58 2qal h GLY 48 CO -0.13 0.00 0.35 1.44 0.00 0.00 0.00 176.54 178.21 2qal n SER 49 N -2.91 6.30 0.00 0.19 7.64 0.24 -4.97 113.62 120.11 2qal n SER 49 Ca 0.03 -2.96 0.00 0.00 1.01 0.00 0.00 58.87 56.95 2qal n SER 49 Cb 0.45 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 2qal n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qal n GLY 50 N 0.54 0.73 1.33 0.23 0.00 -1.24 -4.97 105.19 101.80 2qal n GLY 50 Ca 0.26 -1.18 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 2qal n GLY 50 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qal n PHE 51 N 0.00 -0.10 -4.51 1.61 1.16 -1.26 -4.89 117.46 109.47 2qal n PHE 51 Ca 0.00 0.39 -0.31 0.00 -1.87 0.00 0.00 57.45 55.65 2qal n PHE 51 Cb 0.00 -0.77 -0.05 0.00 -1.61 0.00 0.00 39.48 37.05 2qal n PHE 51 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 2qal s ARG 52 N -0.31 2.23 0.00 3.97 1.81 -1.26 -4.10 118.95 121.29 2qal s ARG 52 Ca 0.27 -2.32 0.00 0.00 -1.72 0.00 0.00 55.73 51.96 2qal s ARG 52 Cb -0.39 -1.69 0.00 0.00 -0.45 0.00 0.00 34.95 32.42 2qal s ARG 52 CO 0.22 -0.48 0.00 0.41 -0.68 0.00 0.00 175.30 174.77 2qal n GLY 53 N -1.45 1.89 0.23 -3.53 0.00 -1.26 -2.11 105.19 98.96 2qal n GLY 53 Ca -0.15 0.58 -0.10 0.00 0.00 0.00 0.00 46.02 46.35 2qal n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qal h SER 54 N 0.00 -0.56 0.77 1.61 4.64 -1.96 -2.92 113.55 115.12 2qal h SER 54 Ca 0.00 0.09 -0.09 0.00 -0.47 0.00 0.00 61.79 61.32 2qal h SER 54 Cb 0.00 0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 2qal h SER 54 CO 0.00 -0.24 -0.43 -0.09 -0.87 0.00 0.00 176.83 175.20 2qal h ARG 55 N -0.26 0.00 0.00 4.77 1.12 -1.78 -3.12 114.38 115.12 2qal h ARG 55 Ca 0.08 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.93 2qal h ARG 55 Cb 0.38 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.33 2qal h ARG 55 CO -0.23 0.43 -0.09 1.57 -3.11 0.00 0.00 179.97 178.54 2qal h LYS 56 N 0.00 0.00 -1.01 0.20 5.09 -1.33 -2.90 116.57 116.62 2qal h LYS 56 Ca -0.00 0.00 -0.52 0.00 0.09 0.00 0.00 60.65 60.21 2qal h LYS 56 Cb 0.93 0.00 -0.29 0.00 0.10 0.00 0.00 32.23 32.97 2qal h LYS 56 CO 0.06 0.09 0.67 0.45 -2.09 0.00 0.00 179.45 178.63 2qal n SER 57 N -3.34 4.45 -4.79 7.07 2.88 -1.18 -4.53 113.62 114.19 2qal n SER 57 Ca -0.01 -3.57 -0.22 0.00 -1.33 0.00 0.00 58.87 53.75 2qal n SER 57 Cb 0.28 -0.85 -0.05 0.00 -0.75 0.00 0.00 64.21 62.84 2qal n SER 57 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2qal s THR 58 N -3.41 3.24 0.19 2.46 -4.23 -1.09 -4.66 115.64 108.13 2qal s THR 58 Ca 0.56 -1.55 -0.12 0.00 -1.18 0.00 0.00 61.69 59.39 2qal s THR 58 Cb 0.46 -3.07 0.10 0.00 1.34 0.00 0.00 72.50 71.33 2qal s THR 58 CO 0.08 -0.18 1.84 1.55 -0.54 0.00 0.00 174.62 177.38 2qal h PRO 59 N 1.41 0.83 -0.63 3.99 0.13 -1.89 -2.61 132.00 133.22 2qal h PRO 59 Ca -0.44 -0.06 0.07 0.00 -0.87 0.00 0.00 66.00 64.70 2qal h PRO 59 Cb 1.25 -0.18 -0.06 0.00 0.13 0.00 0.00 31.00 32.14 2qal h PRO 59 CO 0.61 0.57 0.30 0.35 -0.23 0.00 0.00 178.00 179.61 2qal h PHE 60 N 0.84 0.55 -0.55 1.56 -0.00 -1.96 -2.86 116.94 114.51 2qal h PHE 60 Ca 0.22 0.03 0.07 0.00 -0.00 0.00 0.00 57.97 58.29 2qal h PHE 60 Cb -0.06 -0.15 -0.09 0.00 -0.00 0.00 0.00 35.95 35.65 2qal h PHE 60 CO -0.02 0.22 -0.54 0.00 -0.00 0.00 0.00 178.31 177.96 2qal h ALA 61 N 1.37 -0.64 -0.88 2.41 0.00 -1.70 0.14 119.26 119.96 2qal h ALA 61 Ca 0.30 0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.36 2qal h ALA 61 Cb 0.28 1.14 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 2qal h ALA 61 CO -0.23 -0.99 0.57 0.00 0.00 0.00 0.00 179.25 178.59 2qal h ALA 62 N 0.20 1.67 0.43 0.00 0.00 -1.53 -2.68 119.26 117.35 2qal h ALA 62 Ca 0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2qal h ALA 62 Cb 0.56 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2qal h ALA 62 CO -0.68 0.14 -0.43 0.37 0.00 0.00 0.00 179.25 178.65 2qal h GLN 63 N 0.84 -0.85 -0.19 0.00 4.15 -0.84 0.16 115.11 118.38 2qal h GLN 63 Ca 0.41 0.06 0.06 0.00 0.77 0.00 0.00 58.65 59.95 2qal h GLN 63 Cb 0.45 0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 2qal h GLN 63 CO -0.18 -0.56 0.19 -0.24 -1.93 0.00 0.00 178.83 176.10 2qal h VAL 64 N -0.88 0.58 0.09 2.39 3.04 -1.19 -2.06 116.25 118.22 2qal h VAL 64 Ca -0.04 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.64 2qal h VAL 64 Cb 0.78 0.86 0.00 0.00 -2.01 0.00 0.00 31.29 30.91 2qal h VAL 64 CO -0.06 0.00 -0.04 0.00 -1.01 0.00 0.00 177.57 176.45 2qal h ALA 65 N 1.81 -0.12 -0.11 3.17 0.00 -0.95 -2.46 119.26 120.61 2qal h ALA 65 Ca 0.09 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.76 2qal h ALA 65 Cb 0.46 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 2qal h ALA 65 CO -0.00 -0.23 -0.54 0.00 0.00 0.00 0.00 179.25 178.48 2qal h ALA 66 N -0.05 -0.91 -0.91 0.00 0.00 -0.04 0.16 119.26 117.52 2qal h ALA 66 Ca -0.01 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 54.96 2qal h ALA 66 Cb 0.59 1.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.31 2qal h ALA 66 CO 0.02 -1.10 0.58 1.05 0.00 0.00 0.00 179.25 179.81 2qal h GLU 67 N -0.60 0.79 0.00 0.00 4.11 -1.60 0.16 114.58 117.45 2qal h GLU 67 Ca 0.03 -0.05 -0.04 0.00 0.07 0.00 0.00 59.36 59.37 2qal h GLU 67 Cb 0.69 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2qal h GLU 67 CO -0.42 0.52 -0.19 -0.09 0.07 0.00 0.00 179.01 178.90 2qal h ARG 68 N 0.82 0.00 -0.04 1.06 2.43 -0.50 -2.34 114.38 115.79 2qal h ARG 68 Ca 0.44 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.47 2qal h ARG 68 Cb 0.56 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.12 2qal h ARG 68 CO -0.21 0.19 -0.52 0.00 -1.51 0.00 0.00 179.97 177.92 2qal h ALA 70 N 0.38 1.50 0.00 0.00 0.00 -1.07 -0.03 119.26 120.05 2qal h ALA 70 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2qal h ALA 70 Cb 1.21 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2qal h ALA 70 CO 0.11 0.42 0.00 -3.47 0.00 0.00 0.00 179.25 176.30 2qal n ASP 71 N -4.45 0.00 0.00 0.00 4.64 -0.91 -0.19 116.55 115.64 2qal n ASP 71 Ca 0.10 -0.05 0.00 0.00 -1.38 0.00 0.00 54.79 53.47 2qal n ASP 71 Cb 0.11 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.19 2qal n ASP 71 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2qal n ALA 72 N -0.90 3.00 0.41 -1.67 0.00 -0.07 -4.77 120.51 116.51 2qal n ALA 72 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.58 2qal n ALA 72 Cb 0.00 0.48 0.34 0.00 0.00 0.00 0.00 19.45 20.27 2qal n ALA 72 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2qal h VAL 73 N 0.00 0.00 0.00 0.00 -1.51 -1.11 -3.13 116.25 110.50 2qal h VAL 73 Ca 0.00 -0.68 -0.02 0.00 -1.23 0.00 0.00 66.70 64.77 2qal h VAL 73 Cb 0.91 1.65 -0.00 0.00 -2.13 0.00 0.00 31.29 31.72 2qal h VAL 73 CO 0.00 0.00 -0.10 0.11 -1.23 0.00 0.00 177.57 176.35 2qal h LYS 74 N 0.00 0.00 0.00 5.19 1.57 -0.83 0.30 116.57 122.80 2qal h LYS 74 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qal h LYS 74 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 2qal h LYS 74 CO 0.00 0.10 0.00 0.39 -0.57 0.00 0.00 179.45 179.37 2qal n GLU 75 N -3.55 0.06 -0.11 3.15 -0.58 -1.18 -1.75 120.64 116.67 2qal n GLU 75 Ca -0.02 0.29 0.06 0.00 -0.42 0.00 0.00 57.16 57.07 2qal n GLU 75 Cb 0.23 -1.62 0.21 0.00 -0.57 0.00 0.00 31.44 29.69 2qal n GLU 75 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2qal n TYR 76 N -1.73 0.30 -1.77 -0.32 4.02 0.10 -4.47 117.16 113.29 2qal n TYR 76 Ca 0.03 -0.15 -0.13 0.00 -0.01 0.00 0.00 57.90 57.65 2qal n TYR 76 Cb 0.20 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.49 2qal n TYR 76 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qal n GLY 77 N 0.97 0.65 3.71 2.72 0.00 -0.72 -0.99 105.19 111.53 2qal n GLY 77 Ca 0.11 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 2qal n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qal s ILE 78 N -2.54 3.15 -0.01 -0.61 -1.09 -1.25 -2.25 121.20 116.59 2qal s ILE 78 Ca 0.00 0.77 -0.01 0.00 -2.23 0.00 0.00 60.65 59.18 2qal s ILE 78 Cb 0.00 -3.50 -0.00 0.00 -1.58 0.00 0.00 42.46 37.38 2qal s ILE 78 CO 0.00 0.04 -0.03 0.29 -1.23 0.00 0.00 174.94 174.02 2qal n LYS 79 N 4.34 0.04 -3.84 2.79 4.76 0.45 -4.82 118.16 121.88 2qal n LYS 79 Ca 0.13 0.02 -0.21 0.00 -2.87 0.00 0.00 58.31 55.37 2qal n LYS 79 Cb 0.41 -0.39 -0.04 0.00 -1.84 0.00 0.00 35.03 33.17 2qal n LYS 79 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2qal s ASN 80 N -4.65 5.24 -0.20 4.39 6.03 0.60 -2.05 114.94 124.30 2qal s ASN 80 Ca -0.02 -0.52 -0.30 0.00 -1.03 0.00 0.00 52.86 50.99 2qal s ASN 80 Cb 0.00 -0.95 0.15 0.00 -3.03 0.00 0.00 41.25 37.42 2qal s ASN 80 CO 0.04 -0.35 1.15 -1.48 -2.03 0.00 0.00 177.10 174.43 2qal s LEU 81 N -3.98 -0.22 0.00 3.54 2.34 -0.43 -2.99 118.68 116.94 2qal s LEU 81 Ca 0.41 0.21 -0.08 0.00 0.06 0.00 0.00 54.13 54.73 2qal s LEU 81 Cb -0.05 1.53 0.17 0.00 -0.56 0.00 0.00 46.19 47.27 2qal s LEU 81 CO 0.26 -0.22 1.07 -0.62 -1.06 0.00 0.00 176.35 175.78 2qal n GLU 82 N 0.53 -0.62 -3.76 1.48 1.02 -0.52 -3.04 120.64 115.73 2qal n GLU 82 Ca -0.05 -2.19 -0.22 0.00 -0.02 0.00 0.00 57.16 54.68 2qal n GLU 82 Cb 0.58 -0.93 -0.18 0.00 -0.02 0.00 0.00 31.44 30.90 2qal n GLU 82 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2qal s VAL 83 N -3.24 0.25 -0.27 2.62 1.01 0.26 -2.40 120.40 118.63 2qal s VAL 83 Ca 0.65 0.19 -0.03 0.00 0.00 0.00 0.00 61.98 62.79 2qal s VAL 83 Cb -0.03 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 35.95 2qal s VAL 83 CO 0.44 0.24 -0.01 -0.32 0.00 0.00 0.00 175.10 175.45 2qal s MET 84 N 1.96 2.86 0.04 2.72 1.75 0.75 -1.35 119.30 128.03 2qal s MET 84 Ca 0.04 -0.98 0.08 0.00 -1.25 0.00 0.00 55.69 53.58 2qal s MET 84 Cb -0.12 -3.14 -0.03 0.00 2.84 0.00 0.00 34.83 34.38 2qal s MET 84 CO -0.04 -0.45 -0.24 0.08 -0.65 0.00 0.00 175.02 173.72 2qal s VAL 85 N 1.37 1.96 -0.18 10.11 1.01 -0.29 -0.09 120.40 134.29 2qal s VAL 85 Ca 0.00 -1.28 -0.16 0.00 0.00 0.00 0.00 61.98 60.54 2qal s VAL 85 Cb -0.17 -1.67 0.05 0.00 0.00 0.00 0.00 36.38 34.58 2qal s VAL 85 CO -0.02 0.34 0.47 -1.59 0.00 0.00 0.00 175.10 174.30 2qal s LYS 86 N -1.12 0.54 0.00 2.72 -2.85 -1.09 0.85 119.74 118.79 2qal s LYS 86 Ca 0.10 0.67 0.00 0.00 -1.00 0.00 0.00 55.97 55.74 2qal s LYS 86 Cb -0.09 0.25 0.00 0.00 -2.06 0.00 0.00 37.83 35.93 2qal s LYS 86 CO 0.02 -0.07 0.00 0.41 0.10 0.00 0.00 175.35 175.80 2qal n GLY 87 N 2.91 1.69 0.00 0.59 0.00 -1.26 -2.48 105.19 106.64 2qal n GLY 87 Ca -0.14 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2qal n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qal n PRO 88 N 1.63 1.09 -1.27 1.61 -0.04 -1.21 -4.64 135.00 132.18 2qal n PRO 88 Ca 0.00 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.61 2qal n PRO 88 Cb 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.40 2qal n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qal n GLY 89 N 4.98 -2.14 3.51 0.55 0.00 -1.25 -4.52 105.19 106.31 2qal n GLY 89 Ca 0.00 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 2qal n GLY 89 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qal s PRO 90 N -3.31 -1.96 0.00 1.61 0.04 -1.26 -3.45 135.00 126.66 2qal s PRO 90 Ca 0.00 -0.15 0.00 0.00 0.04 0.00 0.00 61.00 60.89 2qal s PRO 90 Cb 0.00 -1.52 0.00 0.00 0.04 0.00 0.00 34.50 33.02 2qal s PRO 90 CO 0.00 -4.18 0.00 0.41 0.04 0.00 0.00 177.00 173.27 2qal n GLY 91 N -0.41 0.02 0.22 0.56 0.00 -1.26 -4.74 105.19 99.58 2qal n GLY 91 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 2qal n GLY 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2qal h ARG 92 N 0.06 0.54 0.00 1.61 1.12 -1.79 -3.20 114.38 112.72 2qal h ARG 92 Ca 0.00 -0.31 -0.17 0.00 -1.11 0.00 0.00 59.98 58.39 2qal h ARG 92 Cb 0.50 0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 30.45 2qal h ARG 92 CO 0.00 0.91 -1.61 0.39 -3.11 0.00 0.00 179.97 176.55 2qal n GLU 93 N -3.98 0.26 -0.31 0.20 1.02 -1.26 -4.73 120.64 111.83 2qal n GLU 93 Ca -0.03 0.07 -0.10 0.00 -0.02 0.00 0.00 57.16 57.08 2qal n GLU 93 Cb 0.57 -1.15 -0.07 0.00 -0.02 0.00 0.00 31.44 30.77 2qal n GLU 93 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2qal h SER 94 N -0.08 -1.89 -0.99 1.62 0.87 -1.91 -0.22 113.55 110.94 2qal h SER 94 Ca -0.25 0.29 0.33 0.00 -1.23 0.00 0.00 61.79 60.94 2qal h SER 94 Cb 1.34 0.84 -0.18 0.00 -0.44 0.00 0.00 62.40 63.96 2qal h SER 94 CO -0.07 -0.30 0.26 0.00 -0.53 0.00 0.00 176.83 176.19 2qal h THR 95 N -0.14 0.02 0.46 2.23 1.03 -1.83 -0.19 112.91 114.49 2qal h THR 95 Ca 0.16 -0.01 -0.01 0.00 -0.01 0.00 0.00 66.41 66.54 2qal h THR 95 Cb 0.51 0.00 -0.01 0.00 -1.07 0.00 0.00 68.15 67.58 2qal h THR 95 CO -0.82 0.00 -0.33 0.40 -0.01 0.00 0.00 175.52 174.76 2qal h ILE 96 N 0.02 0.31 -0.09 0.00 2.04 -1.32 -1.14 117.51 117.34 2qal h ILE 96 Ca 0.71 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.59 2qal h ILE 96 Cb 1.66 0.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.99 2qal h ILE 96 CO -0.85 0.00 -0.54 0.03 0.00 0.00 0.00 178.15 176.79 2qal h ARG 97 N -0.78 -0.59 -0.79 2.37 3.08 -1.01 0.12 114.38 116.79 2qal h ARG 97 Ca -0.05 0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.17 2qal h ARG 97 Cb 0.66 0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.79 2qal h ARG 97 CO 0.02 -0.39 0.52 0.00 -1.07 0.00 0.00 179.97 179.04 2qal h ALA 98 N -0.32 1.94 -0.11 0.04 0.00 -1.51 0.53 119.26 119.84 2qal h ALA 98 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qal h ALA 98 Cb 0.70 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2qal h ALA 98 CO -0.41 -0.14 0.05 1.25 0.00 0.00 0.00 179.25 180.00 2qal h LEU 99 N 0.57 0.14 0.00 0.00 5.85 0.30 -0.81 115.31 121.36 2qal h LEU 99 Ca 0.38 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 2qal h LEU 99 Cb 0.69 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.68 2qal h LEU 99 CO -0.14 0.22 -0.00 -1.13 -0.34 0.00 0.00 178.44 177.05 2qal h ASN 100 N 0.05 -0.00 -0.56 1.25 -0.73 0.40 -3.20 115.58 112.79 2qal h ASN 100 Ca 0.04 -0.61 0.15 0.00 1.87 0.00 0.00 56.30 57.75 2qal h ASN 100 Cb 0.12 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.69 2qal h ASN 100 CO -0.00 0.61 0.40 0.00 -0.37 0.00 0.00 177.43 178.06 2qal h ALA 101 N 0.38 2.43 0.00 1.57 0.00 -0.02 0.13 119.26 123.75 2qal h ALA 101 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2qal h ALA 101 Cb 0.61 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2qal h ALA 101 CO 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 179.25 178.66 2qal n ALA 102 N -2.62 1.92 -1.15 0.00 0.00 -0.31 -4.76 120.51 113.59 2qal n ALA 102 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2qal n ALA 102 Cb 0.59 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.04 2qal n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qal n GLY 103 N -0.06 0.29 2.70 0.00 0.00 0.35 -5.08 105.19 103.39 2qal n GLY 103 Ca 0.00 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.47 2qal n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qal s PHE 104 N -2.77 0.03 -0.80 1.61 0.08 -0.63 -5.01 117.98 110.50 2qal s PHE 104 Ca 0.00 0.29 -0.25 0.00 0.12 0.00 0.00 56.93 57.09 2qal s PHE 104 Cb 0.00 -0.43 -0.04 0.00 -0.57 0.00 0.00 43.02 41.98 2qal s PHE 104 CO 0.00 -0.19 1.94 0.50 -0.10 0.00 0.00 175.22 177.37 2qal s ARG 105 N 2.07 2.55 0.59 0.44 6.06 -0.87 -4.68 118.95 125.11 2qal s ARG 105 Ca 0.03 0.04 -0.14 0.00 -2.50 0.00 0.00 55.73 53.16 2qal s ARG 105 Cb -0.12 -4.83 -0.04 0.00 0.06 0.00 0.00 34.95 30.02 2qal s ARG 105 CO -0.03 -3.20 1.03 -1.50 -2.50 0.00 0.00 175.30 169.10 2qal s ILE 106 N 9.90 4.24 0.06 4.11 2.07 -1.26 -1.31 121.20 139.01 2qal s ILE 106 Ca 0.70 0.94 0.00 0.00 -1.41 0.00 0.00 60.65 60.88 2qal s ILE 106 Cb -0.09 -3.58 0.00 0.00 0.13 0.00 0.00 42.46 38.92 2qal s ILE 106 CO 0.07 -0.74 0.00 0.35 -1.91 0.00 0.00 174.94 172.70 2qal n THR 107 N -2.23 0.04 -4.57 4.00 -2.24 -1.17 -4.88 114.28 103.23 2qal n THR 107 Ca 0.07 0.01 -0.30 0.00 -2.27 0.00 0.00 64.05 61.56 2qal n THR 107 Cb 0.54 -0.24 -0.12 0.00 -2.10 0.00 0.00 70.33 68.40 2qal n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2qal s ASN 108 N -4.36 3.86 -0.13 3.42 -0.87 -1.26 -5.02 114.94 110.58 2qal s ASN 108 Ca 0.00 -0.44 -0.03 0.00 -1.57 0.00 0.00 52.86 50.82 2qal s ASN 108 Cb 0.00 -0.62 0.05 0.00 -0.02 0.00 0.00 41.25 40.66 2qal s ASN 108 CO 0.00 0.24 0.04 -0.63 -2.57 0.00 0.00 177.10 174.18 2qal s ILE 109 N -0.98 0.29 0.01 0.60 1.01 -1.26 0.92 121.20 121.80 2qal s ILE 109 Ca 0.16 -0.15 0.05 0.00 0.00 0.00 0.00 60.65 60.70 2qal s ILE 109 Cb -0.11 -0.69 -0.02 0.00 0.01 0.00 0.00 42.46 41.66 2qal s ILE 109 CO 0.06 -0.03 -0.16 0.42 0.00 0.00 0.00 174.94 175.24 2qal s THR 110 N 1.98 1.24 -0.82 2.92 -4.23 -0.46 -5.00 115.64 111.27 2qal s THR 110 Ca 0.02 -0.81 -0.18 0.00 -1.18 0.00 0.00 61.69 59.54 2qal s THR 110 Cb -0.15 -1.06 0.14 0.00 1.34 0.00 0.00 72.50 72.77 2qal s THR 110 CO -0.07 0.23 0.96 -0.62 -0.54 0.00 0.00 174.62 174.59 2qal s ASP 111 N -0.67 6.54 0.00 3.99 2.15 -1.25 -1.14 116.67 126.29 2qal s ASP 111 Ca 0.05 -1.98 0.00 0.00 0.43 0.00 0.00 52.55 51.05 2qal s ASP 111 Cb -0.07 -2.34 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 2qal s ASP 111 CO 0.00 -1.00 0.46 1.33 -0.17 0.00 0.00 175.17 175.79 2qal n VAL 112 N 5.22 0.01 -1.68 1.11 0.24 0.25 -4.89 118.33 118.59 2qal n VAL 112 Ca 0.13 0.00 -0.48 0.00 -2.04 0.00 0.00 64.34 61.95 2qal n VAL 112 Cb 0.47 -0.46 -0.05 0.00 -1.47 0.00 0.00 33.84 32.33 2qal n VAL 112 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2qal n THR 113 N 0.04 0.37 -2.05 3.34 -1.04 -1.22 -4.82 114.28 108.90 2qal n THR 113 Ca 0.00 -0.07 -0.42 0.00 -2.04 0.00 0.00 64.05 61.52 2qal n THR 113 Cb 0.23 -1.70 -0.03 0.00 -1.82 0.00 0.00 70.33 67.01 2qal n THR 113 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2qal s PRO 114 N 2.95 4.22 -0.38 -2.82 0.04 -1.26 -4.96 135.00 132.79 2qal s PRO 114 Ca 0.88 2.17 0.01 0.00 0.04 0.00 0.00 61.00 64.10 2qal s PRO 114 Cb -0.72 -3.66 0.13 0.00 0.04 0.00 0.00 34.50 30.29 2qal s PRO 114 CO 0.48 -0.70 0.19 0.96 0.04 0.00 0.00 177.00 177.97 2qal s ILE 115 N 2.82 0.92 0.21 0.56 -5.25 -1.26 -5.05 121.20 114.15 2qal s ILE 115 Ca 0.70 -1.98 -0.30 0.00 -0.99 0.00 0.00 60.65 58.08 2qal s ILE 115 Cb -0.36 -1.66 -0.09 0.00 2.95 0.00 0.00 42.46 43.30 2qal s ILE 115 CO 0.30 -0.85 1.33 -2.16 -1.79 0.00 0.00 174.94 171.76 2qal s PRO 116 N 0.93 4.37 -0.35 0.37 0.04 -1.26 -4.89 135.00 134.21 2qal s PRO 116 Ca 0.15 2.09 -0.06 0.00 0.04 0.00 0.00 61.00 63.23 2qal s PRO 116 Cb -0.22 -3.18 -0.20 0.00 0.04 0.00 0.00 34.50 30.95 2qal s PRO 116 CO -0.08 -0.27 3.14 0.72 0.04 0.00 0.00 177.00 180.56 2qal n HIS 117 N 2.47 0.52 -2.06 0.56 8.25 -1.26 -4.60 115.22 119.11 2qal n HIS 117 Ca 0.06 -1.69 -0.00 0.00 -0.26 0.00 0.00 57.72 55.83 2qal n HIS 117 Cb 0.42 -1.66 0.00 0.00 1.12 0.00 0.00 29.99 29.87 2qal n HIS 117 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2qal n ASN 118 N 2.85 -4.77 0.00 0.41 5.03 -1.26 -5.09 115.26 112.42 2qal n ASN 118 Ca 0.46 0.66 0.00 0.00 0.87 0.00 0.00 54.58 56.57 2qal n ASN 118 Cb 0.67 -3.00 0.00 0.00 -1.02 0.00 0.00 39.78 36.43 2qal n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qal n GLY 119 N 0.32 0.70 3.80 7.41 0.00 -1.26 -5.10 105.19 111.05 2qal n GLY 119 Ca 0.00 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 2qal n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qal s ARG 121 N -2.93 3.96 0.74 0.00 3.52 -1.26 -5.02 118.95 117.97 2qal s ARG 121 Ca 0.61 0.86 -0.15 0.00 -0.13 0.00 0.00 55.73 56.92 2qal s ARG 121 Cb -0.14 -3.77 0.05 0.00 -1.56 0.00 0.00 34.95 29.52 2qal s ARG 121 CO 0.18 -0.96 1.25 -1.25 -0.81 0.00 0.00 175.30 173.71 2qal s PRO 122 N 3.66 1.98 0.31 5.12 0.04 -1.26 -4.95 135.00 139.90 2qal s PRO 122 Ca 0.43 1.90 -0.29 0.00 0.04 0.00 0.00 61.00 63.08 2qal s PRO 122 Cb -0.12 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.53 2qal s PRO 122 CO 0.18 -1.99 1.19 -1.25 0.04 0.00 0.00 177.00 175.17 2qal s PRO 123 N -3.83 4.47 0.00 0.56 0.04 -1.26 -5.01 135.00 129.97 2qal s PRO 123 Ca 0.77 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.79 2qal s PRO 123 Cb -0.33 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.12 2qal s PRO 123 CO 0.46 0.00 0.03 1.63 0.04 0.00 0.00 177.00 179.16 2qal n LYS 124 N 0.92 0.00 0.00 4.56 5.02 -1.26 -4.94 118.16 122.46 2qal n LYS 124 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2qal n LYS 124 Cb 0.44 -0.53 0.00 0.00 -0.02 0.00 0.00 35.03 34.92 2qal n LYS 124 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qal n LYS 125 N -0.03 0.00 0.00 1.97 5.02 -1.26 -4.96 118.16 118.90 2qal n LYS 125 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2qal n LYS 125 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2qal n LYS 125 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qal n ARG 126 N -0.08 0.00 -3.05 1.97 5.12 -1.26 -4.95 116.66 114.40 2qal n ARG 126 Ca 0.00 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.78 2qal n ARG 126 Cb 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.26 2qal n ARG 126 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 2qal s ARG 127 N 0.00 0.99 0.00 5.56 3.00 -1.26 -5.28 118.95 121.96 2qal s ARG 127 Ca 0.00 -1.53 0.00 0.00 -1.00 0.00 0.00 55.73 53.20 2qal s ARG 127 Cb 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 34.95 34.28 2qal s ARG 127 CO 0.00 -1.35 0.00 1.33 0.00 0.00 0.00 175.30 175.28