#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1swa h ILE 17 N 0.00 0.79 -2.23 -0.61 2.04 -1.97 -3.47 117.51 112.07 1swa h ILE 17 Ca 0.00 -2.34 -0.59 0.00 1.00 0.00 0.00 64.86 62.94 1swa h ILE 17 Cb 0.00 2.52 0.05 0.00 -0.74 0.00 0.00 36.82 38.65 1swa h ILE 17 CO 0.00 0.74 0.80 0.41 0.00 0.00 0.00 178.15 180.10 1swa n THR 18 N -3.78 0.04 -0.45 -0.27 -1.04 -1.26 -4.76 114.28 102.76 1swa n THR 18 Ca -0.30 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 1swa n THR 18 Cb 0.95 -1.53 0.00 0.00 -1.82 0.00 0.00 70.33 67.93 1swa n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1swa n GLY 19 N 3.44 0.73 3.49 3.41 0.00 0.24 -5.00 105.19 111.50 1swa n GLY 19 Ca 0.17 -1.71 -0.34 0.00 0.00 0.00 0.00 46.02 44.14 1swa n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1swa s THR 20 N -3.20 3.92 0.03 2.61 2.01 -1.26 -1.01 115.64 118.74 1swa s THR 20 Ca 0.00 -0.34 0.06 0.00 0.31 0.00 0.00 61.69 61.71 1swa s THR 20 Cb 0.00 -2.73 -0.02 0.00 0.01 0.00 0.00 72.50 69.76 1swa s THR 20 CO 0.00 0.48 -0.17 0.26 -0.69 0.00 0.00 174.62 174.50 1swa s TRP 21 N 0.46 1.48 -0.06 4.92 0.52 0.56 -4.62 118.94 122.22 1swa s TRP 21 Ca -0.03 -0.35 0.05 0.00 0.02 0.00 0.00 56.10 55.79 1swa s TRP 21 Cb -0.14 -0.89 -0.00 0.00 -1.15 0.00 0.00 33.47 31.28 1swa s TRP 21 CO 0.03 0.05 -0.20 0.71 0.02 0.00 0.00 176.95 177.56 1swa s TYR 22 N -0.76 2.01 0.00 -1.98 2.02 -0.52 -0.64 117.35 117.49 1swa s TYR 22 Ca 0.05 -0.63 0.00 0.00 -0.37 0.00 0.00 57.07 56.12 1swa s TYR 22 Cb -0.08 -1.35 0.00 0.00 -0.40 0.00 0.00 41.96 40.14 1swa s TYR 22 CO 0.01 -0.22 0.00 0.27 -1.57 0.00 0.00 175.55 174.05 1swa n ASN 23 N 3.17 0.00 -1.28 2.29 6.94 -0.59 -1.83 115.26 123.96 1swa n ASN 23 Ca -0.18 -0.53 0.11 0.00 -0.02 0.00 0.00 54.58 53.95 1swa n ASN 23 Cb 0.53 0.00 0.30 0.00 -2.36 0.00 0.00 39.78 38.25 1swa n ASN 23 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1swa n GLN 24 N -0.53 2.85 -0.27 -3.83 0.00 -1.26 -3.95 117.38 110.38 1swa n GLN 24 Ca 0.00 -2.61 0.07 0.00 0.00 0.00 0.00 57.00 54.46 1swa n GLN 24 Cb 0.00 -1.56 0.19 0.00 0.00 0.00 0.00 30.24 28.87 1swa n GLN 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1swa n LEU 25 N 1.43 3.26 0.00 2.61 4.77 -1.26 -4.95 117.00 122.86 1swa n LEU 25 Ca 0.23 -2.33 0.00 0.00 -0.03 0.00 0.00 56.01 53.88 1swa n LEU 25 Cb 0.62 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1swa n LEU 25 CO 0.16 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 1swa n GLY 26 N 0.20 0.89 3.78 -0.72 0.00 -1.25 -5.03 105.19 103.05 1swa n GLY 26 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1swa n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1swa s SER 27 N -2.78 6.46 -0.03 1.61 0.01 -1.26 -4.91 113.70 112.80 1swa s SER 27 Ca 0.00 2.20 0.01 0.00 1.31 0.00 0.00 55.95 59.47 1swa s SER 27 Cb 0.00 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.66 1swa s SER 27 CO 0.00 -0.71 -0.02 -0.89 0.41 0.00 0.00 173.24 172.04 1swa s THR 28 N -1.57 0.29 0.05 1.44 2.01 -0.98 -1.54 115.64 115.33 1swa s THR 28 Ca 0.60 0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.65 1swa s THR 28 Cb -0.26 -0.36 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1swa s THR 28 CO 0.32 0.16 -0.12 0.72 -0.69 0.00 0.00 174.62 175.02 1swa s PHE 29 N 0.90 1.05 -0.20 4.92 -0.71 0.19 -1.82 117.98 122.31 1swa s PHE 29 Ca -0.10 -0.39 -0.04 0.00 -1.04 0.00 0.00 56.93 55.36 1swa s PHE 29 Cb -0.13 -0.61 -0.02 0.00 -1.21 0.00 0.00 43.02 41.05 1swa s PHE 29 CO -0.01 0.01 -0.03 0.42 -1.34 0.00 0.00 175.22 174.28 1swa s ILE 30 N -1.02 3.67 0.05 -4.49 1.09 -0.38 -0.32 121.20 119.80 1swa s ILE 30 Ca -0.02 -0.41 0.04 0.00 -1.10 0.00 0.00 60.65 59.17 1swa s ILE 30 Cb -0.08 -2.65 -0.02 0.00 -1.06 0.00 0.00 42.46 38.64 1swa s ILE 30 CO 0.01 0.44 -0.12 0.54 -0.10 0.00 0.00 174.94 175.70 1swa s VAL 31 N 1.09 0.96 -0.23 2.92 0.11 -0.18 -1.53 120.40 123.55 1swa s VAL 31 Ca 0.02 -1.11 -0.03 0.00 -2.93 0.00 0.00 61.98 57.92 1swa s VAL 31 Cb -0.15 -0.92 0.00 0.00 -1.53 0.00 0.00 36.38 33.78 1swa s VAL 31 CO 0.01 -0.17 -0.05 -0.89 -3.33 0.00 0.00 175.10 170.67 1swa s THR 32 N -1.11 3.23 -0.61 5.04 2.01 0.07 -0.60 115.64 123.69 1swa s THR 32 Ca -0.02 -0.64 -0.18 0.00 0.31 0.00 0.00 61.69 61.16 1swa s THR 32 Cb -0.09 -2.51 0.12 0.00 0.01 0.00 0.00 72.50 70.03 1swa s THR 32 CO 0.01 0.36 0.66 0.00 -0.69 0.00 0.00 174.62 174.97 1swa s ALA 33 N 1.44 3.54 0.50 7.40 0.00 -1.26 -1.21 121.76 132.17 1swa s ALA 33 Ca 0.04 -2.44 -0.20 0.00 0.00 0.00 0.00 51.96 49.37 1swa s ALA 33 Cb -0.15 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.43 1swa s ALA 33 CO -0.04 -2.26 1.08 0.20 0.00 0.00 0.00 175.76 174.74 1swa s GLY 34 N 3.51 2.58 0.58 0.00 0.00 0.91 -4.86 107.32 110.03 1swa s GLY 34 Ca 0.10 0.71 0.35 0.00 0.00 0.00 0.00 44.72 45.89 1swa s GLY 34 CO 0.03 1.06 2.10 0.00 0.00 0.00 0.00 173.10 176.29 1swa h ALA 35 N 1.47 1.04 0.00 3.20 0.00 -1.98 0.70 119.26 123.69 1swa h ALA 35 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1swa h ALA 35 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1swa h ALA 35 CO 0.58 0.04 0.00 -0.40 0.00 0.00 0.00 179.25 179.47 1swa n ASP 36 N -3.18 0.00 0.00 0.00 5.75 -1.26 -4.90 116.55 112.96 1swa n ASP 36 Ca -0.01 0.43 0.00 0.00 -0.01 0.00 0.00 54.79 55.21 1swa n ASP 36 Cb 0.23 -0.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.85 1swa n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1swa n GLY 37 N 1.34 1.03 3.81 6.12 0.00 0.24 -4.96 105.19 112.76 1swa n GLY 37 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 1swa n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1swa s ALA 38 N -2.00 3.28 -0.20 4.61 0.00 -1.24 -1.70 121.76 124.51 1swa s ALA 38 Ca 0.00 0.32 -0.01 0.00 0.00 0.00 0.00 51.96 52.27 1swa s ALA 38 Cb 0.00 -3.00 0.01 0.00 0.00 0.00 0.00 23.12 20.13 1swa s ALA 38 CO 0.00 0.24 -0.12 -0.51 0.00 0.00 0.00 175.76 175.37 1swa s LEU 39 N -2.27 2.53 0.01 0.00 1.02 -0.27 -0.06 118.68 119.63 1swa s LEU 39 Ca 0.49 -0.56 -0.00 0.00 0.02 0.00 0.00 54.13 54.09 1swa s LEU 39 Cb -0.16 -1.60 -0.01 0.00 0.02 0.00 0.00 46.19 44.44 1swa s LEU 39 CO 0.21 -0.02 -0.00 0.42 0.02 0.00 0.00 176.35 176.98 1swa s THR 40 N 1.37 0.04 0.00 5.49 -4.23 -0.35 -1.13 115.64 116.83 1swa s THR 40 Ca 0.05 -0.36 0.00 0.00 -1.18 0.00 0.00 61.69 60.20 1swa s THR 40 Cb -0.14 -0.12 0.00 0.00 1.34 0.00 0.00 72.50 73.58 1swa s THR 40 CO -0.08 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.41 1swa n GLY 41 N 2.48 0.93 2.97 3.99 0.00 -1.08 -0.75 105.19 113.73 1swa n GLY 41 Ca -0.17 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.12 1swa n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1swa s THR 42 N -1.80 0.81 -0.21 2.61 2.01 -0.58 -0.62 115.64 117.86 1swa s THR 42 Ca 0.00 -0.31 -0.05 0.00 0.31 0.00 0.00 61.69 61.64 1swa s THR 42 Cb 0.00 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.73 1swa s THR 42 CO 0.00 0.28 0.00 -0.47 -0.69 0.00 0.00 174.62 173.74 1swa s TYR 43 N 0.62 3.03 -0.45 4.92 6.14 0.28 -1.25 117.35 130.64 1swa s TYR 43 Ca -0.10 -0.53 -0.08 0.00 0.64 0.00 0.00 57.07 56.99 1swa s TYR 43 Cb -0.13 -2.10 0.11 0.00 0.42 0.00 0.00 41.96 40.26 1swa s TYR 43 CO 0.02 -0.30 0.31 -1.21 0.64 0.00 0.00 175.55 175.00 1swa s GLU 44 N 1.14 2.39 0.41 4.97 2.02 -0.75 0.11 118.70 129.00 1swa s GLU 44 Ca 0.03 -1.74 0.23 0.00 0.02 0.00 0.00 54.97 53.50 1swa s GLU 44 Cb -0.14 -3.84 1.23 0.00 0.10 0.00 0.00 34.13 31.48 1swa s GLU 44 CO 0.01 -1.14 1.71 0.66 0.02 0.00 0.00 175.26 176.53 1swa h SER 45 N 8.36 0.36 -2.88 -0.19 4.64 -1.30 -2.60 113.55 119.94 1swa h SER 45 Ca -0.20 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1swa h SER 45 Cb 1.07 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1swa h SER 45 CO 0.82 -0.02 0.00 -3.20 -0.87 0.00 0.00 176.83 173.55 1swa n ASN 49 N -4.65 -0.94 0.06 4.97 4.05 -1.26 -4.79 115.26 112.69 1swa n ASN 49 Ca 0.30 0.00 0.11 0.00 0.45 0.00 0.00 54.58 55.44 1swa n ASN 49 Cb 1.09 0.72 -0.03 0.00 1.23 0.00 0.00 39.78 42.79 1swa n ASN 49 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1swa n ALA 50 N 0.03 2.81 0.35 5.20 0.00 -1.26 -3.66 120.51 123.99 1swa n ALA 50 Ca 0.00 -0.34 0.14 0.00 0.00 0.00 0.00 53.44 53.24 1swa n ALA 50 Cb 0.00 -0.99 0.42 0.00 0.00 0.00 0.00 19.45 18.88 1swa n ALA 50 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1swa h GLU 51 N 0.00 0.00 -0.55 0.00 5.08 -2.02 -3.11 114.58 113.98 1swa h GLU 51 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1swa h GLU 51 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1swa h GLU 51 CO 0.00 0.00 0.00 0.43 -1.00 0.00 0.00 179.01 178.44 1swa n SER 52 N -2.77 3.66 -4.78 1.42 7.64 -1.24 -4.80 113.62 112.75 1swa n SER 52 Ca 0.03 -2.11 -0.36 0.00 1.01 0.00 0.00 58.87 57.44 1swa n SER 52 Cb 0.39 -0.40 -0.07 0.00 -1.01 0.00 0.00 64.21 63.12 1swa n SER 52 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1swa s ARG 53 N -1.20 3.97 0.04 1.43 0.52 -1.18 -0.90 118.95 121.64 1swa s ARG 53 Ca 0.39 -0.10 0.03 0.00 -0.52 0.00 0.00 55.73 55.53 1swa s ARG 53 Cb 0.22 -3.34 -0.02 0.00 0.52 0.00 0.00 34.95 32.32 1swa s ARG 53 CO 0.24 0.45 -0.10 0.71 0.02 0.00 0.00 175.30 176.62 1swa s TYR 54 N -0.09 0.86 0.10 -0.53 1.51 0.31 -4.80 117.35 114.70 1swa s TYR 54 Ca 0.12 -0.41 -0.31 0.00 -1.01 0.00 0.00 57.07 55.47 1swa s TYR 54 Cb -0.12 -0.51 -0.07 0.00 -0.11 0.00 0.00 41.96 41.16 1swa s TYR 54 CO 0.02 -0.02 1.26 0.08 -1.11 0.00 0.00 175.55 175.78 1swa s VAL 55 N -1.10 3.70 0.15 0.71 1.01 -1.26 -0.55 120.40 123.05 1swa s VAL 55 Ca -0.05 1.25 0.07 0.00 0.00 0.00 0.00 61.98 63.26 1swa s VAL 55 Cb -0.09 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 1swa s VAL 55 CO 0.01 0.12 -0.03 -1.48 0.00 0.00 0.00 175.10 173.71 1swa s LEU 56 N 0.85 3.25 -0.22 3.92 0.05 0.21 -4.29 118.68 122.45 1swa s LEU 56 Ca 0.60 -0.38 -0.18 0.00 0.05 0.00 0.00 54.13 54.22 1swa s LEU 56 Cb -0.33 -1.95 0.06 0.00 -2.05 0.00 0.00 46.19 41.93 1swa s LEU 56 CO 0.31 0.12 0.57 0.28 -0.55 0.00 0.00 176.35 177.08 1swa s THR 57 N -1.56 -0.00 0.00 5.48 -1.32 -0.93 -2.62 115.64 114.69 1swa s THR 57 Ca 0.26 0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.75 1swa s THR 57 Cb -0.10 -0.81 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 1swa s THR 57 CO 0.17 0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.20 1swa n GLY 58 N 3.22 1.94 3.06 6.08 0.00 -0.29 -1.35 105.19 117.85 1swa n GLY 58 Ca -0.16 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1swa n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1swa s ARG 59 N -0.40 0.53 0.06 1.61 1.81 -0.42 -1.11 118.95 121.02 1swa s ARG 59 Ca 0.00 -0.81 -0.02 0.00 -1.72 0.00 0.00 55.73 53.17 1swa s ARG 59 Cb 0.00 -0.20 -0.03 0.00 -0.45 0.00 0.00 34.95 34.27 1swa s ARG 59 CO 0.00 0.02 0.02 1.52 -0.68 0.00 0.00 175.30 176.18 1swa s TYR 60 N -1.73 0.47 -0.48 -0.53 1.13 -0.69 -1.12 117.35 114.40 1swa s TYR 60 Ca -0.08 -0.99 -0.29 0.00 -1.41 0.00 0.00 57.07 54.30 1swa s TYR 60 Cb -0.08 -0.33 0.02 0.00 -1.10 0.00 0.00 41.96 40.47 1swa s TYR 60 CO -0.01 -0.42 1.25 0.34 -2.51 0.00 0.00 175.55 174.20 1swa s ASP 61 N -2.92 6.47 0.00 -0.18 2.15 0.13 -4.73 116.67 117.60 1swa s ASP 61 Ca 0.08 0.49 0.29 0.00 0.43 0.00 0.00 52.55 53.85 1swa s ASP 61 Cb 0.07 -2.55 1.38 0.00 -0.30 0.00 0.00 42.92 41.52 1swa s ASP 61 CO -0.09 -1.38 1.93 -1.54 -0.17 0.00 0.00 175.17 173.92 1swa n SER 62 N 8.38 0.63 -3.19 -0.34 3.41 -1.26 -3.97 113.62 117.28 1swa n SER 62 Ca 0.13 -0.98 -0.23 0.00 -0.26 0.00 0.00 58.87 57.53 1swa n SER 62 Cb 0.49 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.35 1swa n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1swa n ALA 63 N -0.64 2.37 -1.23 7.33 0.00 -1.26 -5.04 120.51 122.05 1swa n ALA 63 Ca 0.19 -3.41 -0.29 0.00 0.00 0.00 0.00 53.44 49.92 1swa n ALA 63 Cb 0.25 -0.83 0.15 0.00 0.00 0.00 0.00 19.45 19.02 1swa n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1swa s PRO 64 N -1.41 0.87 0.56 0.00 0.04 -1.25 -5.00 135.00 128.80 1swa s PRO 64 Ca 0.36 0.62 -0.19 0.00 0.04 0.00 0.00 61.00 61.83 1swa s PRO 64 Cb 0.20 -1.78 -0.05 0.00 0.04 0.00 0.00 34.50 32.91 1swa s PRO 64 CO -0.10 -2.46 1.13 0.00 0.04 0.00 0.00 177.00 175.61 1swa s ALA 65 N -2.99 2.66 -0.37 8.56 0.00 -1.26 -4.98 121.76 123.38 1swa s ALA 65 Ca 0.64 0.79 0.06 0.00 0.00 0.00 0.00 51.96 53.45 1swa s ALA 65 Cb -0.18 -3.35 0.44 0.00 0.00 0.00 0.00 23.12 20.03 1swa s ALA 65 CO 0.57 -0.84 1.17 2.41 0.00 0.00 0.00 175.76 179.07 1swa n THR 66 N -1.45 2.48 -0.89 0.00 -1.04 -1.26 -4.61 114.28 107.51 1swa n THR 66 Ca 0.11 -4.55 0.08 0.00 -2.04 0.00 0.00 64.05 57.66 1swa n THR 66 Cb 0.51 -1.20 0.12 0.00 -1.82 0.00 0.00 70.33 67.94 1swa n THR 66 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1swa n ASP 67 N -0.60 2.35 0.00 8.00 5.68 -1.26 -4.95 116.55 125.77 1swa n ASP 67 Ca 0.42 -2.90 0.00 0.00 -0.50 0.00 0.00 54.79 51.81 1swa n ASP 67 Cb 0.81 -0.36 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 1swa n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1swa n GLY 68 N -1.24 0.64 3.75 6.12 0.00 -1.26 -5.07 105.19 108.13 1swa n GLY 68 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1swa n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1swa s SER 69 N -2.95 4.14 0.69 1.61 0.01 -1.26 -5.05 113.70 110.89 1swa s SER 69 Ca 0.00 1.70 0.01 0.00 1.31 0.00 0.00 55.95 58.97 1swa s SER 69 Cb 0.00 -2.39 0.12 0.00 0.21 0.00 0.00 66.02 63.96 1swa s SER 69 CO 0.00 -2.25 0.96 -0.83 0.41 0.00 0.00 173.24 171.53 1swa s GLY 70 N -3.41 1.76 -0.41 3.44 0.00 -1.26 -4.91 107.32 102.53 1swa s GLY 70 Ca 0.62 -1.78 -0.15 0.00 0.00 0.00 0.00 44.72 43.40 1swa s GLY 70 CO 0.56 -1.24 0.33 -1.59 0.00 0.00 0.00 173.10 171.16 1swa s THR 71 N -3.06 5.22 0.34 0.90 2.01 -0.25 -4.80 115.64 116.00 1swa s THR 71 Ca 0.65 -0.56 -0.28 0.00 0.31 0.00 0.00 61.69 61.82 1swa s THR 71 Cb -0.05 -3.94 -0.10 0.00 0.01 0.00 0.00 72.50 68.41 1swa s THR 71 CO 0.43 -0.32 1.30 0.00 -0.69 0.00 0.00 174.62 175.34 1swa s ALA 72 N 1.79 3.45 0.30 7.40 0.00 -1.26 -1.17 121.76 132.27 1swa s ALA 72 Ca 0.07 1.24 -0.18 0.00 0.00 0.00 0.00 51.96 53.08 1swa s ALA 72 Cb -0.18 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.49 1swa s ALA 72 CO 0.11 -0.66 0.70 -0.48 0.00 0.00 0.00 175.76 175.43 1swa s LEU 73 N -1.91 -0.10 -0.12 0.00 2.34 -1.00 0.21 118.68 118.10 1swa s LEU 73 Ca 0.50 -0.79 -0.30 0.00 0.06 0.00 0.00 54.13 53.60 1swa s LEU 73 Cb -0.39 2.61 0.12 0.00 -0.56 0.00 0.00 46.19 47.97 1swa s LEU 73 CO 0.52 -1.40 0.96 -0.83 -1.06 0.00 0.00 176.35 174.54 1swa s GLY 74 N -2.97 -0.33 0.20 -3.48 0.00 -0.28 -2.17 107.32 98.29 1swa s GLY 74 Ca 0.14 1.71 -0.10 0.00 0.00 0.00 0.00 44.72 46.47 1swa s GLY 74 CO 0.09 0.83 0.36 0.66 0.00 0.00 0.00 173.10 175.03 1swa s TRP 75 N -1.69 0.45 0.01 1.90 -2.14 -0.60 -1.30 118.94 115.57 1swa s TRP 75 Ca 0.00 -0.80 0.02 0.00 2.66 0.00 0.00 56.10 57.99 1swa s TRP 75 Cb -0.01 0.00 -0.01 0.00 -3.10 0.00 0.00 33.47 30.36 1swa s TRP 75 CO -0.01 -0.83 -0.08 0.99 -2.66 0.00 0.00 176.95 174.36 1swa s THR 76 N -4.01 0.62 -0.13 0.66 2.01 -0.46 -1.11 115.64 113.22 1swa s THR 76 Ca 0.22 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 61.68 1swa s THR 76 Cb 0.02 -0.56 0.02 0.00 0.01 0.00 0.00 72.50 71.99 1swa s THR 76 CO 0.05 0.03 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.18 1swa s VAL 77 N -0.50 1.48 -0.15 3.82 1.01 -0.19 -2.19 120.40 123.68 1swa s VAL 77 Ca -0.00 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.20 1swa s VAL 77 Cb -0.05 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1swa s VAL 77 CO 0.00 0.44 0.49 0.00 0.00 0.00 0.00 175.10 176.04 1swa s ALA 78 N 1.29 3.50 -1.24 5.51 0.00 -1.26 -1.28 121.76 128.28 1swa s ALA 78 Ca -0.00 -0.27 -0.08 0.00 0.00 0.00 0.00 51.96 51.61 1swa s ALA 78 Cb -0.14 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.24 1swa s ALA 78 CO -0.06 -0.17 2.84 0.91 0.00 0.00 0.00 175.76 179.28 1swa n TRP 79 N 4.11 2.12 -4.47 0.00 7.02 -0.63 -4.77 117.44 120.80 1swa n TRP 79 Ca -0.06 -2.72 -0.22 0.00 -1.02 0.00 0.00 57.50 53.48 1swa n TRP 79 Cb 0.51 -2.08 -0.16 0.00 -2.42 0.00 0.00 31.31 27.16 1swa n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1swa s LYS 80 N 0.63 1.27 0.00 -0.99 2.20 -1.26 0.02 119.74 121.60 1swa s LYS 80 Ca 0.64 -0.34 0.00 0.00 -0.36 0.00 0.00 55.97 55.90 1swa s LYS 80 Cb 0.22 -1.12 0.00 0.00 -1.51 0.00 0.00 37.83 35.41 1swa s LYS 80 CO -0.08 0.07 0.00 0.27 -0.36 0.00 0.00 175.35 175.26 1swa n ASN 81 N 3.54 0.72 0.00 1.43 0.23 -0.86 -4.77 115.26 115.56 1swa n ASN 81 Ca -0.21 -0.49 0.11 0.00 -0.53 0.00 0.00 54.58 53.46 1swa n ASN 81 Cb 0.53 0.00 0.59 0.00 -2.08 0.00 0.00 39.78 38.82 1swa n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1swa n ASN 82 N -1.13 0.00 -0.04 0.53 5.03 -1.26 -3.86 115.26 114.54 1swa n ASN 82 Ca 0.00 -0.12 -0.05 0.00 0.87 0.00 0.00 54.58 55.28 1swa n ASN 82 Cb 0.00 -0.25 -0.04 0.00 -1.02 0.00 0.00 39.78 38.47 1swa n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1swa n TYR 83 N -1.25 0.00 -3.85 3.10 4.01 -1.26 -5.11 117.16 112.80 1swa n TYR 83 Ca 0.12 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.76 1swa n TYR 83 Cb 0.17 -0.29 -0.05 0.00 -0.31 0.00 0.00 39.34 38.86 1swa n TYR 83 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1swa s ARG 84 N -2.15 1.36 -0.10 -0.72 1.70 -1.25 -5.16 118.95 112.64 1swa s ARG 84 Ca -0.08 -1.02 -0.04 0.00 -0.47 0.00 0.00 55.73 54.11 1swa s ARG 84 Cb 0.02 0.47 0.05 0.00 -0.57 0.00 0.00 34.95 34.93 1swa s ARG 84 CO 0.19 -0.56 0.21 1.21 -1.08 0.00 0.00 175.30 175.27 1swa s ASN 85 N -2.93 0.34 0.00 -2.89 3.84 -1.26 -2.03 114.94 110.01 1swa s ASN 85 Ca 0.14 0.45 0.26 0.00 0.21 0.00 0.00 52.86 53.92 1swa s ASN 85 Cb 0.00 0.44 0.54 0.00 -0.55 0.00 0.00 41.25 41.68 1swa s ASN 85 CO 0.00 -0.22 1.45 0.00 -2.79 0.00 0.00 177.10 175.54 1swa n ALA 86 N 5.02 2.81 -3.86 1.71 0.00 0.10 -4.98 120.51 121.30 1swa n ALA 86 Ca -0.11 -0.55 -0.30 0.00 0.00 0.00 0.00 53.44 52.48 1swa n ALA 86 Cb 0.50 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 18.98 1swa n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1swa n HIS 87 N 0.36 -1.72 -3.61 0.00 8.25 -1.26 -4.83 115.22 112.41 1swa n HIS 87 Ca 0.14 0.56 -0.08 0.00 -0.26 0.00 0.00 57.72 58.09 1swa n HIS 87 Cb 0.45 -3.52 -0.02 0.00 1.12 0.00 0.00 29.99 28.02 1swa n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1swa s SER 88 N -3.94 -0.36 0.00 0.41 1.04 -1.26 -1.03 113.70 108.56 1swa s SER 88 Ca 0.23 -0.21 -0.06 0.00 0.48 0.00 0.00 55.95 56.40 1swa s SER 88 Cb -0.09 0.53 -0.00 0.00 0.10 0.00 0.00 66.02 66.56 1swa s SER 88 CO 0.89 -0.92 0.11 0.00 0.98 0.00 0.00 173.24 174.31 1swa s ALA 89 N -3.48 -0.26 -0.10 5.32 0.00 0.11 -1.61 121.76 121.74 1swa s ALA 89 Ca 0.07 -0.16 0.03 0.00 0.00 0.00 0.00 51.96 51.90 1swa s ALA 89 Cb -0.02 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 1swa s ALA 89 CO -0.05 -0.19 -0.19 0.99 0.00 0.00 0.00 175.76 176.32 1swa s THR 90 N -1.27 2.52 -0.11 0.00 2.01 -0.41 -0.33 115.64 118.04 1swa s THR 90 Ca -0.14 -0.87 0.02 0.00 0.31 0.00 0.00 61.69 61.02 1swa s THR 90 Cb -0.07 -2.00 -0.01 0.00 0.01 0.00 0.00 72.50 70.43 1swa s THR 90 CO 0.01 0.55 -0.20 0.42 -0.69 0.00 0.00 174.62 174.72 1swa s THR 91 N 0.17 2.45 -0.14 -0.82 -4.23 -0.40 -1.02 115.64 111.66 1swa s THR 91 Ca -0.11 -0.88 -0.04 0.00 -1.18 0.00 0.00 61.69 59.49 1swa s THR 91 Cb -0.16 -1.98 -0.03 0.00 1.34 0.00 0.00 72.50 71.67 1swa s THR 91 CO 0.06 0.54 -0.01 0.26 -0.54 0.00 0.00 174.62 174.94 1swa s TRP 92 N 0.38 3.11 -0.09 3.99 0.51 -0.27 -1.20 118.94 125.38 1swa s TRP 92 Ca -0.15 -0.07 0.03 0.00 -2.12 0.00 0.00 56.10 53.78 1swa s TRP 92 Cb -0.17 -1.93 0.01 0.00 -0.81 0.00 0.00 33.47 30.57 1swa s TRP 92 CO 0.07 0.15 -0.16 0.45 -0.51 0.00 0.00 176.95 176.95 1swa s SER 93 N -0.00 2.31 0.00 2.95 0.15 -0.15 -1.56 113.70 117.39 1swa s SER 93 Ca 0.03 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.27 1swa s SER 93 Cb -0.13 -1.05 0.00 0.00 -1.71 0.00 0.00 66.02 63.13 1swa s SER 93 CO 0.02 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.13 1swa n GLY 94 N 3.86 1.66 3.16 9.45 0.00 -0.92 -1.13 105.19 121.27 1swa n GLY 94 Ca -0.21 -0.58 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 1swa n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1swa s GLN 95 N 1.23 0.48 -0.10 1.61 -2.07 -0.48 -2.37 119.66 117.96 1swa s GLN 95 Ca 0.00 -0.07 -0.22 0.00 -1.82 0.00 0.00 55.36 53.24 1swa s GLN 95 Cb 0.00 0.21 -0.04 0.00 -1.09 0.00 0.00 33.01 32.10 1swa s GLN 95 CO 0.00 -0.11 0.65 -0.47 -1.32 0.00 0.00 175.29 174.04 1swa s TYR 96 N -0.84 3.53 -0.24 9.60 5.04 -0.31 -1.66 117.35 132.47 1swa s TYR 96 Ca -0.09 1.14 -0.02 0.00 -2.44 0.00 0.00 57.07 55.66 1swa s TYR 96 Cb -0.05 -2.76 0.02 0.00 0.35 0.00 0.00 41.96 39.52 1swa s TYR 96 CO 0.02 0.06 -0.07 0.08 -1.34 0.00 0.00 175.55 174.29 1swa s VAL 97 N 0.96 2.85 0.00 3.14 1.01 0.87 -1.09 120.40 128.15 1swa s VAL 97 Ca 0.34 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1swa s VAL 97 Cb -0.17 -2.41 0.00 0.00 0.00 0.00 0.00 36.38 33.80 1swa s VAL 97 CO 0.15 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.11 1swa n GLY 98 N 4.68 0.44 2.73 4.51 0.00 -1.26 -1.54 105.19 114.74 1swa n GLY 98 Ca -0.17 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1swa n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1swa n GLY 99 N 5.00 -0.94 0.00 -0.02 0.00 -1.26 -4.40 105.19 103.57 1swa n GLY 99 Ca 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1swa n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1swa n ALA 100 N 1.38 0.00 -3.54 4.61 0.00 -1.26 -3.41 120.51 118.29 1swa n ALA 100 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1swa n ALA 100 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 1swa n ALA 100 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1swa s GLU 101 N 0.00 2.98 0.74 0.00 -6.30 -1.26 -5.11 118.70 109.75 1swa s GLU 101 Ca 0.00 -0.89 -0.16 0.00 -2.50 0.00 0.00 54.97 51.42 1swa s GLU 101 Cb 0.00 -3.09 -0.02 0.00 0.00 0.00 0.00 34.13 31.02 1swa s GLU 101 CO 0.00 -0.38 0.64 0.00 0.02 0.00 0.00 175.26 175.54 1swa n ALA 102 N 4.74 -1.24 -3.18 6.30 0.00 -1.22 -4.95 120.51 120.96 1swa n ALA 102 Ca -0.16 -0.25 -0.12 0.00 0.00 0.00 0.00 53.44 52.90 1swa n ALA 102 Cb 0.48 -1.92 -0.09 0.00 0.00 0.00 0.00 19.45 17.92 1swa n ALA 102 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1swa s ARG 103 N -2.97 0.59 -0.21 0.00 0.52 -0.59 -4.27 118.95 112.01 1swa s ARG 103 Ca 0.67 -0.29 0.02 0.00 -0.52 0.00 0.00 55.73 55.61 1swa s ARG 103 Cb -0.34 0.25 0.04 0.00 0.52 0.00 0.00 34.95 35.42 1swa s ARG 103 CO 0.57 -0.15 -0.16 0.42 0.02 0.00 0.00 175.30 175.99 1swa s ILE 104 N -1.37 2.10 -0.20 1.52 1.01 -0.55 -0.09 121.20 123.62 1swa s ILE 104 Ca -0.14 -1.24 -0.12 0.00 0.00 0.00 0.00 60.65 59.14 1swa s ILE 104 Cb -0.06 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.32 1swa s ILE 104 CO 0.03 0.29 0.23 0.20 0.00 0.00 0.00 174.94 175.69 1swa s ASN 105 N 1.21 6.29 0.08 3.58 0.01 -0.66 -0.33 114.94 125.13 1swa s ASN 105 Ca -0.01 0.33 0.00 0.00 -0.71 0.00 0.00 52.86 52.47 1swa s ASN 105 Cb -0.16 -2.15 -0.04 0.00 0.41 0.00 0.00 41.25 39.31 1swa s ASN 105 CO -0.09 0.08 -0.03 0.42 -1.51 0.00 0.00 177.10 175.97 1swa s THR 106 N 0.73 0.40 0.03 1.60 -4.23 -0.08 -1.38 115.64 112.72 1swa s THR 106 Ca 0.12 -1.88 0.07 0.00 -1.18 0.00 0.00 61.69 58.83 1swa s THR 106 Cb -0.13 -1.67 -0.03 0.00 1.34 0.00 0.00 72.50 72.01 1swa s THR 106 CO 0.03 -0.86 -0.18 -1.10 -0.54 0.00 0.00 174.62 171.97 1swa s GLN 107 N -3.90 2.11 0.20 3.99 -0.21 -0.28 -1.94 119.66 119.62 1swa s GLN 107 Ca 0.12 -0.96 0.06 0.00 0.02 0.00 0.00 55.36 54.60 1swa s GLN 107 Cb 0.07 -2.21 -0.05 0.00 1.00 0.00 0.00 33.01 31.82 1swa s GLN 107 CO -0.06 0.55 -0.10 1.67 -2.12 0.00 0.00 175.29 175.23 1swa s TRP 108 N -0.91 1.55 -0.10 0.91 1.48 0.16 -0.98 118.94 121.06 1swa s TRP 108 Ca 0.14 -0.71 0.02 0.00 -1.06 0.00 0.00 56.10 54.49 1swa s TRP 108 Cb -0.11 -0.80 0.01 0.00 -1.16 0.00 0.00 33.47 31.42 1swa s TRP 108 CO 0.05 0.18 -0.17 -0.51 -4.06 0.00 0.00 176.95 172.45 1swa s LEU 109 N -3.28 1.80 -0.21 -4.66 1.43 -0.34 -1.80 118.68 111.62 1swa s LEU 109 Ca 0.22 -0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 1swa s LEU 109 Cb 0.02 -1.12 -0.01 0.00 0.03 0.00 0.00 46.19 45.11 1swa s LEU 109 CO 0.05 0.05 -0.05 -0.22 0.23 0.00 0.00 176.35 176.41 1swa s LEU 110 N 0.81 2.91 -0.11 1.79 2.96 0.17 -1.27 118.68 125.94 1swa s LEU 110 Ca -0.10 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.47 1swa s LEU 110 Cb -0.16 -1.73 -0.00 0.00 0.50 0.00 0.00 46.19 44.80 1swa s LEU 110 CO 0.01 0.01 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.94 1swa s THR 111 N 1.32 2.27 0.03 3.68 2.01 0.55 -0.88 115.64 124.61 1swa s THR 111 Ca 0.04 -0.94 0.03 0.00 0.31 0.00 0.00 61.69 61.13 1swa s THR 111 Cb -0.14 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.44 1swa s THR 111 CO -0.02 0.55 -0.03 -0.44 -0.69 0.00 0.00 174.62 173.99 1swa s SER 112 N 0.37 4.90 0.02 3.53 0.01 -0.97 0.07 113.70 121.63 1swa s SER 112 Ca -0.17 -0.12 -0.30 0.00 1.31 0.00 0.00 55.95 56.67 1swa s SER 112 Cb -0.17 -1.19 -0.05 0.00 0.21 0.00 0.00 66.02 64.82 1swa s SER 112 CO 0.08 0.24 1.21 -0.83 0.41 0.00 0.00 173.24 174.36 1swa s GLY 113 N -1.77 2.27 0.08 3.44 0.00 -0.20 -4.86 107.32 106.28 1swa s GLY 113 Ca 0.21 0.77 -0.00 0.00 0.00 0.00 0.00 44.72 45.70 1swa s GLY 113 CO 0.12 2.13 -0.02 -0.51 0.00 0.00 0.00 173.10 174.82 1swa s THR 114 N 1.54 0.33 0.70 0.90 -4.23 -1.26 -5.01 115.64 108.61 1swa s THR 114 Ca 0.58 -1.86 -0.10 0.00 -1.18 0.00 0.00 61.69 59.13 1swa s THR 114 Cb -0.28 -1.68 0.03 0.00 1.34 0.00 0.00 72.50 71.92 1swa s THR 114 CO 0.27 -0.86 1.06 0.42 -0.54 0.00 0.00 174.62 174.97 1swa s THR 115 N -3.86 3.02 0.35 3.99 -4.23 -1.26 -4.91 115.64 108.74 1swa s THR 115 Ca 0.12 0.16 0.16 0.00 -1.18 0.00 0.00 61.69 60.94 1swa s THR 115 Cb 0.07 -3.30 0.34 0.00 1.34 0.00 0.00 72.50 70.95 1swa s THR 115 CO -0.06 -0.36 1.65 -0.33 -0.54 0.00 0.00 174.62 174.98 1swa h GLU 116 N -0.63 0.28 0.00 3.99 5.08 -2.03 -0.23 114.58 121.04 1swa h GLU 116 Ca -0.45 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 1swa h GLU 116 Cb 1.28 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1swa h GLU 116 CO 0.63 0.18 -0.16 0.00 -1.00 0.00 0.00 179.01 178.67 1swa h ALA 117 N 1.86 0.93 -0.29 3.43 0.00 -2.07 -2.83 119.26 120.29 1swa h ALA 117 Ca 0.75 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1swa h ALA 117 Cb 1.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1swa h ALA 117 CO -0.62 0.19 0.00 0.09 0.00 0.00 0.00 179.25 178.92 1swa n ASN 118 N -3.18 3.58 0.26 0.00 3.02 -0.12 -4.61 115.26 114.20 1swa n ASN 118 Ca 0.02 -2.67 0.11 0.00 -0.03 0.00 0.00 54.58 52.01 1swa n ASN 118 Cb 0.51 -0.44 0.71 0.00 -0.61 0.00 0.00 39.78 39.96 1swa n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1swa h ALA 119 N 1.89 1.55 0.00 5.41 0.00 -1.23 -2.08 119.26 124.80 1swa h ALA 119 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1swa h ALA 119 Cb 1.21 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1swa h ALA 119 CO 0.15 0.11 -0.32 0.11 0.00 0.00 0.00 179.25 179.30 1swa h TRP 120 N 0.00 0.00 -0.43 0.00 5.08 -1.82 -3.00 115.95 115.77 1swa h TRP 120 Ca -0.00 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 59.80 1swa h TRP 120 Cb 0.19 0.00 -0.10 0.00 -3.00 0.00 0.00 29.16 26.25 1swa h TRP 120 CO 0.00 0.32 0.06 0.36 -1.28 0.00 0.00 178.44 177.90 1swa n LYS 121 N -3.52 2.38 0.18 0.12 2.85 -0.79 -4.68 118.16 114.69 1swa n LYS 121 Ca -0.00 -3.06 0.11 0.00 -1.05 0.00 0.00 58.31 54.31 1swa n LYS 121 Cb 0.47 -1.90 0.10 0.00 -0.65 0.00 0.00 35.03 33.05 1swa n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1swa h SER 122 N 1.39 0.00 -3.22 -5.58 4.64 -1.52 -3.46 113.55 105.80 1swa h SER 122 Ca 0.21 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.88 1swa h SER 122 Cb 1.79 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.54 1swa h SER 122 CO 0.45 0.04 -0.86 -0.89 -0.87 0.00 0.00 176.83 174.70 1swa s THR 123 N -3.24 1.91 -0.01 2.95 2.01 -1.26 -2.30 115.64 115.70 1swa s THR 123 Ca 0.04 -0.89 -0.06 0.00 0.31 0.00 0.00 61.69 61.09 1swa s THR 123 Cb 0.07 -1.70 -0.05 0.00 0.01 0.00 0.00 72.50 70.83 1swa s THR 123 CO 0.71 0.52 0.25 -0.76 -0.69 0.00 0.00 174.62 174.65 1swa s LEU 124 N 0.87 4.37 0.04 4.42 1.43 -0.06 -4.94 118.68 124.81 1swa s LEU 124 Ca -0.07 0.53 0.06 0.00 -1.03 0.00 0.00 54.13 53.63 1swa s LEU 124 Cb -0.15 -2.60 -0.02 0.00 0.03 0.00 0.00 46.19 43.45 1swa s LEU 124 CO -0.02 0.27 -0.18 0.54 0.23 0.00 0.00 176.35 177.19 1swa s VAL 125 N -1.27 1.42 0.08 -1.59 0.11 -1.26 -0.65 120.40 117.24 1swa s VAL 125 Ca 0.26 -1.10 -0.05 0.00 -2.93 0.00 0.00 61.98 58.16 1swa s VAL 125 Cb -0.13 -1.25 0.02 0.00 -1.53 0.00 0.00 36.38 33.48 1swa s VAL 125 CO 0.15 0.13 0.27 0.61 -3.33 0.00 0.00 175.10 172.93 1swa n GLY 126 N 1.89 1.36 3.17 6.54 0.00 -0.74 -4.99 105.19 112.42 1swa n GLY 126 Ca -0.17 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 1swa n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1swa s HIS 127 N -5.80 0.21 -0.16 1.61 -3.43 -1.26 0.41 115.29 106.86 1swa s HIS 127 Ca 0.06 -0.62 -0.21 0.00 -0.80 0.00 0.00 55.06 53.49 1swa s HIS 127 Cb -0.01 -0.12 0.05 0.00 -1.43 0.00 0.00 32.58 31.07 1swa s HIS 127 CO 0.02 -0.48 0.56 0.34 -2.00 0.00 0.00 174.74 173.18 1swa s ASP 128 N -2.70 -0.56 -0.11 7.38 -1.08 -0.82 -4.91 116.67 113.87 1swa s ASP 128 Ca 0.03 0.93 0.03 0.00 -0.52 0.00 0.00 52.55 53.03 1swa s ASP 128 Cb 0.04 0.94 -0.00 0.00 -1.46 0.00 0.00 42.92 42.44 1swa s ASP 128 CO -0.09 -0.31 -0.22 -0.89 0.52 0.00 0.00 175.17 174.18 1swa s THR 129 N -0.18 2.22 0.10 1.71 2.01 -1.26 -0.90 115.64 119.35 1swa s THR 129 Ca -0.04 -0.95 0.06 0.00 0.31 0.00 0.00 61.69 61.07 1swa s THR 129 Cb -0.03 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 1swa s THR 129 CO 0.03 0.55 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.09 1swa s PHE 130 N 0.43 2.82 0.17 4.92 0.40 0.56 -4.47 117.98 122.81 1swa s PHE 130 Ca -0.16 -0.11 0.01 0.00 -0.60 0.00 0.00 56.93 56.07 1swa s PHE 130 Cb -0.17 -1.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.85 1swa s PHE 130 CO 0.07 0.45 0.03 0.95 0.70 0.00 0.00 175.22 177.41 1swa s THR 131 N -1.27 0.49 -1.52 0.64 -4.23 -0.76 -1.48 115.64 107.50 1swa s THR 131 Ca 0.23 -1.96 0.27 0.00 -1.18 0.00 0.00 61.69 59.05 1swa s THR 131 Cb -0.11 -2.16 0.28 0.00 1.34 0.00 0.00 72.50 71.85 1swa s THR 131 CO 0.15 -0.42 1.66 0.29 -0.54 0.00 0.00 174.62 175.77 1swa n LYS 132 N -0.22 0.57 0.00 3.99 5.02 -1.26 -1.44 118.16 124.81 1swa n LYS 132 Ca -0.05 -0.28 0.00 0.00 -2.02 0.00 0.00 58.31 55.96 1swa n LYS 132 Cb 0.64 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 1swa n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16