#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sws h ILE 17 N 0.00 1.28 -2.79 -0.61 2.04 -1.97 -3.45 117.51 112.00 1sws h ILE 17 Ca 0.00 -1.67 -0.57 0.00 1.00 0.00 0.00 64.86 63.62 1sws h ILE 17 Cb 0.00 1.55 0.08 0.00 -0.74 0.00 0.00 36.82 37.71 1sws h ILE 17 CO 0.00 0.55 0.72 0.41 0.00 0.00 0.00 178.15 179.83 1sws n THR 18 N -4.02 0.82 -0.86 -0.27 -1.04 -1.26 -4.80 114.28 102.86 1sws n THR 18 Ca -0.03 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 1sws n THR 18 Cb 0.60 -1.64 0.00 0.00 -1.82 0.00 0.00 70.33 67.47 1sws n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sws n GLY 19 N 2.38 0.63 3.46 3.41 0.00 0.05 -5.00 105.19 110.12 1sws n GLY 19 Ca 0.12 -1.73 -0.34 0.00 0.00 0.00 0.00 46.02 44.07 1sws n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sws s THR 20 N -2.83 3.70 0.01 2.61 2.01 -1.26 -1.89 115.64 117.98 1sws s THR 20 Ca 0.00 -0.42 0.08 0.00 0.31 0.00 0.00 61.69 61.66 1sws s THR 20 Cb 0.00 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.87 1sws s THR 20 CO 0.00 0.49 -0.25 0.26 -0.69 0.00 0.00 174.62 174.43 1sws s TRP 21 N 0.48 2.25 0.01 4.92 0.52 0.11 -4.42 118.94 122.81 1sws s TRP 21 Ca -0.04 -0.42 0.07 0.00 0.02 0.00 0.00 56.10 55.73 1sws s TRP 21 Cb -0.15 -1.41 -0.02 0.00 -1.15 0.00 0.00 33.47 30.74 1sws s TRP 21 CO 0.03 0.02 -0.21 0.71 0.02 0.00 0.00 176.95 177.52 1sws s TYR 22 N -0.67 1.86 0.05 -1.98 1.51 0.14 -0.30 117.35 117.96 1sws s TYR 22 Ca 0.10 -0.36 0.09 0.00 -1.01 0.00 0.00 57.07 55.89 1sws s TYR 22 Cb -0.10 -1.16 -0.03 0.00 -0.11 0.00 0.00 41.96 40.56 1sws s TYR 22 CO 0.00 0.02 -0.26 1.21 -1.11 0.00 0.00 175.55 175.41 1sws s ASN 23 N -0.77 3.18 0.22 2.29 3.84 -0.05 -0.79 114.94 122.87 1sws s ASN 23 Ca 0.08 -0.60 0.00 0.00 0.21 0.00 0.00 52.86 52.55 1sws s ASN 23 Cb -0.08 -0.29 0.53 0.00 -0.55 0.00 0.00 41.25 40.85 1sws s ASN 23 CO 0.00 0.25 1.14 0.00 -2.79 0.00 0.00 177.10 175.71 1sws n GLN 24 N 1.72 -0.06 0.00 0.43 10.64 -1.26 0.16 117.38 129.02 1sws n GLN 24 Ca -0.17 1.10 0.10 0.00 -1.83 0.00 0.00 57.00 56.20 1sws n GLN 24 Cb 0.52 -1.73 0.59 0.00 -0.86 0.00 0.00 30.24 28.76 1sws n GLN 24 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1sws n LEU 25 N -5.03 0.00 0.00 2.61 4.77 -1.26 -4.81 117.00 113.28 1sws n LEU 25 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1sws n LEU 25 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1sws n LEU 25 CO -0.06 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.61 1sws n GLY 26 N 0.34 0.66 3.88 -0.72 0.00 0.43 -5.06 105.19 104.72 1sws n GLY 26 Ca 0.15 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 1sws n GLY 26 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1sws s SER 27 N -2.46 6.56 0.08 1.61 1.04 -1.18 -4.91 113.70 114.44 1sws s SER 27 Ca 0.00 0.88 0.01 0.00 0.48 0.00 0.00 55.95 57.32 1sws s SER 27 Cb 0.00 -2.21 -0.04 0.00 0.10 0.00 0.00 66.02 63.87 1sws s SER 27 CO 0.00 -0.14 -0.05 0.28 0.98 0.00 0.00 173.24 174.31 1sws s THR 28 N -1.94 0.52 0.07 2.02 -1.32 -0.91 -0.87 115.64 113.21 1sws s THR 28 Ca 0.47 -1.84 -0.08 0.00 -1.21 0.00 0.00 61.69 59.03 1sws s THR 28 Cb -0.11 -1.55 -0.00 0.00 -1.51 0.00 0.00 72.50 69.32 1sws s THR 28 CO 0.25 -0.89 0.17 0.72 -2.21 0.00 0.00 174.62 172.65 1sws s PHE 29 N -3.58 0.16 -0.19 9.09 -0.12 0.59 -0.68 117.98 123.26 1sws s PHE 29 Ca 0.09 -0.55 0.01 0.00 -0.05 0.00 0.00 56.93 56.43 1sws s PHE 29 Cb 0.05 -0.09 0.02 0.00 -0.63 0.00 0.00 43.02 42.38 1sws s PHE 29 CO -0.06 -0.49 -0.19 0.42 -0.05 0.00 0.00 175.22 174.84 1sws s ILE 30 N -3.51 2.06 0.05 -4.49 1.09 -0.11 0.07 121.20 116.36 1sws s ILE 30 Ca 0.02 -0.98 0.04 0.00 -1.10 0.00 0.00 60.65 58.63 1sws s ILE 30 Cb 0.03 -1.88 -0.02 0.00 -1.06 0.00 0.00 42.46 39.53 1sws s ILE 30 CO -0.09 0.50 -0.11 0.68 -0.10 0.00 0.00 174.94 175.81 1sws s VAL 31 N 1.28 0.85 -0.19 2.92 -7.23 -0.79 -1.19 120.40 116.05 1sws s VAL 31 Ca 0.04 -1.06 -0.02 0.00 -1.81 0.00 0.00 61.98 59.13 1sws s VAL 31 Cb -0.14 -0.83 -0.00 0.00 0.56 0.00 0.00 36.38 35.97 1sws s VAL 31 CO -0.12 -0.19 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.48 1sws s THR 32 N -1.11 2.92 -0.38 5.32 2.01 -0.06 -0.77 115.64 123.57 1sws s THR 32 Ca -0.04 -0.66 -0.19 0.00 0.31 0.00 0.00 61.69 61.12 1sws s THR 32 Cb -0.09 -2.28 0.01 0.00 0.01 0.00 0.00 72.50 70.14 1sws s THR 32 CO 0.01 0.48 0.53 0.00 -0.69 0.00 0.00 174.62 174.95 1sws s ALA 33 N 1.21 3.44 0.44 7.40 0.00 -1.26 -2.53 121.76 130.45 1sws s ALA 33 Ca 0.02 -1.12 -0.04 0.00 0.00 0.00 0.00 51.96 50.82 1sws s ALA 33 Cb -0.14 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 1sws s ALA 33 CO -0.04 -1.40 0.71 0.20 0.00 0.00 0.00 175.76 175.24 1sws s GLY 34 N 1.82 1.49 0.16 0.00 0.00 -0.32 -4.88 107.32 105.58 1sws s GLY 34 Ca 0.19 -0.60 0.18 0.00 0.00 0.00 0.00 44.72 44.49 1sws s GLY 34 CO 0.15 -0.46 1.57 0.00 0.00 0.00 0.00 173.10 174.35 1sws n ALA 35 N -2.04 1.54 0.24 3.20 0.00 -1.26 -1.78 120.51 120.41 1sws n ALA 35 Ca -0.01 0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.62 1sws n ALA 35 Cb 0.55 -1.30 0.40 0.00 0.00 0.00 0.00 19.45 19.10 1sws n ALA 35 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1sws h ASP 36 N 0.00 0.00 0.00 0.00 -0.00 -1.99 -3.46 116.42 110.97 1sws h ASP 36 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1sws h ASP 36 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.59 1sws h ASP 36 CO 0.00 0.01 0.00 0.61 -0.00 0.00 0.00 179.24 179.86 1sws n GLY 37 N 0.62 0.77 3.82 -0.78 0.00 -0.74 -4.95 105.19 103.95 1sws n GLY 37 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1sws n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sws s ALA 38 N -2.11 3.11 -0.12 4.61 0.00 -1.25 -1.24 121.76 124.76 1sws s ALA 38 Ca 0.00 0.33 0.01 0.00 0.00 0.00 0.00 51.96 52.29 1sws s ALA 38 Cb 0.00 -3.07 0.02 0.00 0.00 0.00 0.00 23.12 20.07 1sws s ALA 38 CO 0.00 0.17 -0.12 -0.51 0.00 0.00 0.00 175.76 175.31 1sws s LEU 39 N -3.10 1.49 0.03 0.00 1.02 -0.51 -1.18 118.68 116.44 1sws s LEU 39 Ca 0.60 -0.38 0.03 0.00 0.02 0.00 0.00 54.13 54.40 1sws s LEU 39 Cb -0.10 -0.98 -0.02 0.00 0.02 0.00 0.00 46.19 45.11 1sws s LEU 39 CO 0.14 -0.06 -0.09 0.42 0.02 0.00 0.00 176.35 176.78 1sws s THR 40 N 1.37 0.69 -3.06 5.49 -4.23 -1.05 -1.20 115.64 113.66 1sws s THR 40 Ca 0.00 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.60 1sws s THR 40 Cb -0.13 -0.69 0.00 0.00 1.34 0.00 0.00 72.50 73.02 1sws s THR 40 CO -0.06 -0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 1sws n GLY 41 N 1.85 -0.58 3.04 3.99 0.00 -1.08 -0.88 105.19 111.53 1sws n GLY 41 Ca -0.20 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 1sws n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sws s THR 42 N -3.59 0.47 -0.18 2.61 -4.23 -0.33 -0.99 115.64 109.40 1sws s THR 42 Ca 0.00 -1.01 -0.01 0.00 -1.18 0.00 0.00 61.69 59.49 1sws s THR 42 Cb 0.00 -0.54 -0.01 0.00 1.34 0.00 0.00 72.50 73.29 1sws s THR 42 CO 0.00 -0.37 -0.11 -0.47 -0.54 0.00 0.00 174.62 173.13 1sws s TYR 43 N -1.32 2.86 0.28 3.99 6.14 -0.38 -0.94 117.35 127.99 1sws s TYR 43 Ca -0.10 -0.96 0.02 0.00 0.64 0.00 0.00 57.07 56.67 1sws s TYR 43 Cb -0.10 -1.96 -0.05 0.00 0.42 0.00 0.00 41.96 40.27 1sws s TYR 43 CO 0.00 -0.47 0.09 -1.21 0.64 0.00 0.00 175.55 174.61 1sws s GLU 44 N 0.98 1.51 0.13 4.97 2.02 0.14 -1.44 118.70 127.01 1sws s GLU 44 Ca -0.01 -1.83 -0.13 0.00 0.02 0.00 0.00 54.97 53.02 1sws s GLU 44 Cb -0.15 -0.41 -0.04 0.00 0.10 0.00 0.00 34.13 33.63 1sws s GLU 44 CO -0.01 -0.29 1.48 0.00 0.02 0.00 0.00 175.26 176.46 1sws h ALA 50 N 2.28 0.54 0.00 5.21 0.00 -2.07 -2.42 119.26 122.79 1sws h ALA 50 Ca -0.38 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1sws h ALA 50 Cb 1.25 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1sws h ALA 50 CO 0.62 0.54 0.00 -0.85 0.00 0.00 0.00 179.25 179.56 1sws n GLU 51 N -4.20 0.10 -0.50 0.00 0.00 -1.26 -1.91 120.64 112.87 1sws n GLU 51 Ca -0.02 0.35 0.08 0.00 0.00 0.00 0.00 57.16 57.57 1sws n GLU 51 Cb 0.46 -1.70 0.28 0.00 0.00 0.00 0.00 31.44 30.48 1sws n GLU 51 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1sws n SER 52 N -1.89 4.14 -4.61 -1.84 7.64 -1.26 -4.75 113.62 111.05 1sws n SER 52 Ca 0.03 -2.78 -0.35 0.00 1.01 0.00 0.00 58.87 56.78 1sws n SER 52 Cb 0.20 -0.52 -0.10 0.00 -1.01 0.00 0.00 64.21 62.77 1sws n SER 52 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1sws s ARG 53 N -2.41 3.94 0.11 1.43 3.52 -0.80 -4.24 118.95 120.49 1sws s ARG 53 Ca 0.42 -0.35 0.08 0.00 -0.13 0.00 0.00 55.73 55.75 1sws s ARG 53 Cb 0.32 -3.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.38 1sws s ARG 53 CO 0.13 0.16 -0.20 0.71 -0.81 0.00 0.00 175.30 175.28 1sws s TYR 54 N 0.71 1.76 0.21 5.12 1.51 -0.52 -4.83 117.35 121.31 1sws s TYR 54 Ca 0.04 -0.42 -0.30 0.00 -1.01 0.00 0.00 57.07 55.38 1sws s TYR 54 Cb -0.13 -0.96 -0.08 0.00 -0.11 0.00 0.00 41.96 40.68 1sws s TYR 54 CO 0.02 0.21 1.13 0.08 -1.11 0.00 0.00 175.55 175.88 1sws s VAL 55 N -1.24 3.65 0.09 0.71 1.01 -1.26 -1.25 120.40 122.11 1sws s VAL 55 Ca 0.07 1.48 0.10 0.00 0.00 0.00 0.00 61.98 63.62 1sws s VAL 55 Cb -0.10 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 1sws s VAL 55 CO 0.04 0.28 -0.26 -1.48 0.00 0.00 0.00 175.10 173.68 1sws s LEU 56 N -0.66 2.24 -0.01 3.92 0.05 -0.16 -4.47 118.68 119.59 1sws s LEU 56 Ca 0.49 -0.66 -0.11 0.00 0.05 0.00 0.00 54.13 53.89 1sws s LEU 56 Cb -0.31 -1.22 0.01 0.00 -2.05 0.00 0.00 46.19 42.63 1sws s LEU 56 CO 0.37 0.21 0.24 0.28 -0.55 0.00 0.00 176.35 176.90 1sws s THR 57 N -0.94 0.06 0.00 5.48 -1.32 -0.61 -2.63 115.64 115.68 1sws s THR 57 Ca 0.12 -0.52 0.00 0.00 -1.21 0.00 0.00 61.69 60.08 1sws s THR 57 Cb -0.10 -0.52 0.00 0.00 -1.51 0.00 0.00 72.50 70.37 1sws s THR 57 CO 0.04 -0.29 0.00 0.61 -2.21 0.00 0.00 174.62 172.77 1sws n GLY 58 N 1.49 1.58 3.02 6.08 0.00 -0.34 -0.70 105.19 116.32 1sws n GLY 58 Ca -0.21 -0.82 -0.08 0.00 0.00 0.00 0.00 46.02 44.90 1sws n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sws s ARG 59 N -0.73 0.41 0.12 1.61 1.81 -0.68 -1.42 118.95 120.07 1sws s ARG 59 Ca 0.00 -0.79 -0.03 0.00 -1.72 0.00 0.00 55.73 53.19 1sws s ARG 59 Cb 0.00 0.14 -0.03 0.00 -0.45 0.00 0.00 34.95 34.61 1sws s ARG 59 CO 0.00 -0.07 0.10 1.52 -0.68 0.00 0.00 175.30 176.17 1sws s TYR 60 N -2.20 0.66 -0.41 -0.53 1.13 -0.37 -1.56 117.35 114.07 1sws s TYR 60 Ca -0.09 -1.07 -0.29 0.00 -1.41 0.00 0.00 57.07 54.21 1sws s TYR 60 Cb -0.05 -0.35 0.02 0.00 -1.10 0.00 0.00 41.96 40.49 1sws s TYR 60 CO -0.04 -0.54 1.16 0.34 -2.51 0.00 0.00 175.55 173.97 1sws s ASP 61 N -3.00 6.69 0.00 -0.18 2.15 -0.36 -4.64 116.67 117.33 1sws s ASP 61 Ca 0.19 0.73 0.11 0.00 0.43 0.00 0.00 52.55 54.00 1sws s ASP 61 Cb 0.07 -2.55 0.33 0.00 -0.30 0.00 0.00 42.92 40.47 1sws s ASP 61 CO -0.01 -1.15 1.27 -1.54 -0.17 0.00 0.00 175.17 173.56 1sws n SER 62 N 7.64 1.73 -3.11 -0.34 3.41 -1.26 -3.99 113.62 117.71 1sws n SER 62 Ca 0.13 -1.97 -0.20 0.00 -0.26 0.00 0.00 58.87 56.57 1sws n SER 62 Cb 0.48 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 64.19 1sws n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sws n ALA 63 N 0.44 1.65 -1.22 7.33 0.00 -1.26 -5.05 120.51 122.39 1sws n ALA 63 Ca 0.11 -3.03 -0.29 0.00 0.00 0.00 0.00 53.44 50.23 1sws n ALA 63 Cb 0.28 -0.93 0.16 0.00 0.00 0.00 0.00 19.45 18.96 1sws n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1sws s PRO 64 N -1.13 0.80 0.82 0.00 0.04 -1.26 -5.01 135.00 129.27 1sws s PRO 64 Ca 0.35 0.60 -0.13 0.00 0.04 0.00 0.00 61.00 61.86 1sws s PRO 64 Cb 0.22 -1.77 0.09 0.00 0.04 0.00 0.00 34.50 33.08 1sws s PRO 64 CO -0.12 -2.50 1.19 0.00 0.04 0.00 0.00 177.00 175.62 1sws s ALA 65 N -2.99 1.78 -0.25 8.56 0.00 -1.26 -4.98 121.76 122.63 1sws s ALA 65 Ca 0.64 0.80 0.11 0.00 0.00 0.00 0.00 51.96 53.51 1sws s ALA 65 Cb -0.18 -3.48 0.45 0.00 0.00 0.00 0.00 23.12 19.91 1sws s ALA 65 CO 0.57 -2.37 1.19 0.25 0.00 0.00 0.00 175.76 175.41 1sws n THR 66 N -3.46 2.20 -0.59 0.00 -2.24 -1.26 -4.64 114.28 104.29 1sws n THR 66 Ca 0.13 -3.62 0.10 0.00 -2.27 0.00 0.00 64.05 58.39 1sws n THR 66 Cb 0.51 -0.53 0.36 0.00 -2.10 0.00 0.00 70.33 68.56 1sws n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1sws n ASP 67 N -0.78 4.67 0.00 3.42 5.68 -1.26 -4.90 116.55 123.37 1sws n ASP 67 Ca 0.31 -2.37 0.00 0.00 -0.50 0.00 0.00 54.79 52.22 1sws n ASP 67 Cb 0.87 -0.57 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 1sws n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1sws n GLY 68 N 1.24 0.65 3.85 6.12 0.00 -1.26 -5.07 105.19 110.72 1sws n GLY 68 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 1sws n GLY 68 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1sws s SER 69 N -1.92 5.81 0.96 1.61 1.04 -1.26 -5.05 113.70 114.90 1sws s SER 69 Ca 0.00 1.43 -0.13 0.00 0.48 0.00 0.00 55.95 57.73 1sws s SER 69 Cb 0.00 -2.39 0.20 0.00 0.10 0.00 0.00 66.02 63.93 1sws s SER 69 CO 0.00 -1.14 1.18 0.61 0.98 0.00 0.00 173.24 174.87 1sws n GLY 70 N -2.54 -1.20 3.42 7.32 0.00 -1.26 -4.84 105.19 106.09 1sws n GLY 70 Ca 0.07 -1.75 -0.39 0.00 0.00 0.00 0.00 46.02 43.94 1sws n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sws s THR 71 N -3.56 4.64 0.30 2.61 2.01 -0.55 -4.78 115.64 116.32 1sws s THR 71 Ca 0.68 -0.59 -0.29 0.00 0.31 0.00 0.00 61.69 61.80 1sws s THR 71 Cb -0.02 -3.46 -0.10 0.00 0.01 0.00 0.00 72.50 68.93 1sws s THR 71 CO 0.47 -0.06 1.22 0.00 -0.69 0.00 0.00 174.62 175.56 1sws s ALA 72 N 1.60 3.46 0.27 7.40 0.00 -1.26 -1.05 121.76 132.18 1sws s ALA 72 Ca 0.04 1.11 -0.15 0.00 0.00 0.00 0.00 51.96 52.96 1sws s ALA 72 Cb -0.18 -3.42 0.01 0.00 0.00 0.00 0.00 23.12 19.53 1sws s ALA 72 CO 0.07 -0.44 0.56 -0.48 0.00 0.00 0.00 175.76 175.46 1sws s LEU 73 N -1.58 0.18 0.01 0.00 0.05 -0.61 -1.22 118.68 115.51 1sws s LEU 73 Ca 0.47 -0.88 -0.28 0.00 0.05 0.00 0.00 54.13 53.50 1sws s LEU 73 Cb -0.36 2.06 0.09 0.00 -2.05 0.00 0.00 46.19 45.93 1sws s LEU 73 CO 0.48 -1.23 0.78 -0.83 -0.55 0.00 0.00 176.35 175.00 1sws s GLY 74 N -3.00 -0.50 0.17 -3.48 0.00 -0.60 -1.44 107.32 98.46 1sws s GLY 74 Ca 0.19 1.06 -0.18 0.00 0.00 0.00 0.00 44.72 45.79 1sws s GLY 74 CO 0.09 0.49 0.52 0.66 0.00 0.00 0.00 173.10 174.86 1sws s TRP 75 N -2.68 -0.23 0.02 1.90 -2.14 -0.48 -1.69 118.94 113.65 1sws s TRP 75 Ca -0.00 -0.08 0.06 0.00 2.66 0.00 0.00 56.10 58.74 1sws s TRP 75 Cb -0.01 0.41 -0.02 0.00 -3.10 0.00 0.00 33.47 30.75 1sws s TRP 75 CO -0.05 -0.87 -0.19 0.99 -2.66 0.00 0.00 176.95 174.18 1sws s THR 76 N -3.83 1.48 -0.09 0.66 2.01 0.13 -0.73 115.64 115.26 1sws s THR 76 Ca 0.06 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 61.05 1sws s THR 76 Cb -0.01 -1.28 0.02 0.00 0.01 0.00 0.00 72.50 71.25 1sws s THR 76 CO -0.07 0.24 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.33 1sws s VAL 77 N -0.68 0.99 -0.20 3.82 1.01 -0.65 -1.58 120.40 123.12 1sws s VAL 77 Ca 0.06 -0.31 -0.21 0.00 0.00 0.00 0.00 61.98 61.53 1sws s VAL 77 Cb -0.08 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.29 1sws s VAL 77 CO 0.01 0.35 0.65 0.00 0.00 0.00 0.00 175.10 176.11 1sws s ALA 78 N 1.40 3.54 -0.45 5.51 0.00 -1.26 -0.38 121.76 130.12 1sws s ALA 78 Ca -0.01 -0.25 -0.07 0.00 0.00 0.00 0.00 51.96 51.63 1sws s ALA 78 Cb -0.13 -2.99 -0.20 0.00 0.00 0.00 0.00 23.12 19.79 1sws s ALA 78 CO -0.05 -0.57 3.39 0.91 0.00 0.00 0.00 175.76 179.45 1sws n TRP 79 N 5.07 0.74 -4.76 0.00 7.02 -0.30 -4.76 117.44 120.45 1sws n TRP 79 Ca -0.01 -1.94 -0.26 0.00 -1.02 0.00 0.00 57.50 54.26 1sws n TRP 79 Cb 0.50 -1.81 -0.17 0.00 -2.42 0.00 0.00 31.31 27.41 1sws n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1sws s LYS 80 N 1.07 1.99 0.09 -0.99 2.36 -1.26 -1.64 119.74 121.37 1sws s LYS 80 Ca 0.67 -0.55 0.02 0.00 -2.55 0.00 0.00 55.97 53.56 1sws s LYS 80 Cb 0.29 -1.61 -0.01 0.00 -1.05 0.00 0.00 37.83 35.45 1sws s LYS 80 CO -0.03 0.10 0.07 0.27 1.55 0.00 0.00 175.35 177.31 1sws n ASN 81 N 3.62 -0.03 0.00 1.43 0.23 0.30 -4.81 115.26 116.01 1sws n ASN 81 Ca -0.21 -1.59 0.10 0.00 -0.53 0.00 0.00 54.58 52.34 1sws n ASN 81 Cb 0.52 0.43 0.52 0.00 -2.08 0.00 0.00 39.78 39.17 1sws n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1sws n ASN 82 N -2.54 0.00 -0.07 0.53 3.02 -1.26 -3.42 115.26 111.51 1sws n ASN 82 Ca 0.02 -0.20 -0.10 0.00 -0.03 0.00 0.00 54.58 54.26 1sws n ASN 82 Cb 0.16 -0.19 -0.06 0.00 -0.61 0.00 0.00 39.78 39.08 1sws n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1sws n TYR 83 N -1.19 0.00 -3.98 3.10 4.01 -1.26 -5.08 117.16 112.76 1sws n TYR 83 Ca 0.11 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.77 1sws n TYR 83 Cb 0.12 -0.54 -0.09 0.00 -0.31 0.00 0.00 39.34 38.52 1sws n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1sws s ARG 84 N -2.28 0.64 -0.19 -0.72 0.52 -1.22 -5.15 118.95 110.55 1sws s ARG 84 Ca -0.19 -0.97 -0.04 0.00 -0.52 0.00 0.00 55.73 54.01 1sws s ARG 84 Cb 0.05 0.24 0.10 0.00 0.52 0.00 0.00 34.95 35.86 1sws s ARG 84 CO 0.32 -0.16 0.27 1.21 0.02 0.00 0.00 175.30 176.96 1sws s ASN 85 N -2.56 0.84 -0.03 0.23 3.84 -1.26 -0.54 114.94 115.46 1sws s ASN 85 Ca 0.01 0.10 0.20 0.00 0.21 0.00 0.00 52.86 53.38 1sws s ASN 85 Cb 0.03 0.64 0.63 0.00 -0.55 0.00 0.00 41.25 42.01 1sws s ASN 85 CO -0.08 -0.30 1.53 0.00 -2.79 0.00 0.00 177.10 175.46 1sws n ALA 86 N 5.34 2.58 -3.89 1.71 0.00 -0.65 -4.95 120.51 120.65 1sws n ALA 86 Ca -0.05 -1.29 -0.35 0.00 0.00 0.00 0.00 53.44 51.74 1sws n ALA 86 Cb 0.50 -0.97 0.02 0.00 0.00 0.00 0.00 19.45 19.00 1sws n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1sws n HIS 87 N 1.40 -1.66 -3.72 0.00 -0.00 -1.26 -4.87 115.22 105.11 1sws n HIS 87 Ca 0.24 0.39 -0.02 0.00 -0.00 0.00 0.00 57.72 58.32 1sws n HIS 87 Cb 0.66 -3.25 -0.01 0.00 -0.00 0.00 0.00 29.99 27.39 1sws n HIS 87 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1sws s SER 88 N -3.70 -0.15 -0.01 0.41 1.04 -1.26 -1.50 113.70 108.52 1sws s SER 88 Ca 0.37 -0.33 -0.08 0.00 0.48 0.00 0.00 55.95 56.39 1sws s SER 88 Cb -0.16 0.41 0.01 0.00 0.10 0.00 0.00 66.02 66.37 1sws s SER 88 CO 0.91 -0.75 0.17 0.00 0.98 0.00 0.00 173.24 174.55 1sws s ALA 89 N -3.07 -0.42 -0.01 5.32 0.00 -0.04 -1.15 121.76 122.38 1sws s ALA 89 Ca 0.12 0.02 0.07 0.00 0.00 0.00 0.00 51.96 52.18 1sws s ALA 89 Cb 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 1sws s ALA 89 CO 0.00 -0.20 -0.24 0.99 0.00 0.00 0.00 175.76 176.32 1sws s THR 90 N -1.20 1.86 -0.02 0.00 2.01 0.48 -1.11 115.64 117.67 1sws s THR 90 Ca -0.13 -1.02 0.08 0.00 0.31 0.00 0.00 61.69 60.93 1sws s THR 90 Cb -0.06 -1.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.88 1sws s THR 90 CO 0.02 0.51 -0.26 0.42 -0.69 0.00 0.00 174.62 174.62 1sws s THR 91 N -0.56 2.05 -0.12 -0.82 -4.23 0.34 -1.63 115.64 110.66 1sws s THR 91 Ca 0.09 -1.11 0.02 0.00 -1.18 0.00 0.00 61.69 59.51 1sws s THR 91 Cb -0.09 -1.70 -0.00 0.00 1.34 0.00 0.00 72.50 72.05 1sws s THR 91 CO -0.01 0.57 -0.19 0.26 -0.54 0.00 0.00 174.62 174.71 1sws s TRP 92 N -0.61 2.68 -0.10 3.99 0.51 0.09 -1.47 118.94 124.02 1sws s TRP 92 Ca 0.10 -0.95 0.03 0.00 -2.12 0.00 0.00 56.10 53.16 1sws s TRP 92 Cb -0.10 -1.79 0.01 0.00 -0.81 0.00 0.00 33.47 30.78 1sws s TRP 92 CO -0.01 -0.38 -0.19 0.45 -0.51 0.00 0.00 176.95 176.31 1sws s SER 93 N 0.46 2.66 0.00 2.95 0.15 -0.32 -1.38 113.70 118.22 1sws s SER 93 Ca -0.13 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.04 1sws s SER 93 Cb -0.17 -1.21 0.00 0.00 -1.71 0.00 0.00 66.02 62.93 1sws s SER 93 CO 0.06 0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.18 1sws n GLY 94 N 3.90 1.42 3.06 9.45 0.00 -0.52 -1.31 105.19 121.18 1sws n GLY 94 Ca -0.20 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.08 1sws n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sws s GLN 95 N 0.79 0.53 -0.18 1.61 -2.07 -0.70 -1.57 119.66 118.06 1sws s GLN 95 Ca 0.00 -1.00 -0.13 0.00 -1.82 0.00 0.00 55.36 52.41 1sws s GLN 95 Cb 0.00 0.10 -0.05 0.00 -1.09 0.00 0.00 33.01 31.98 1sws s GLN 95 CO 0.00 -0.07 0.25 -0.47 -1.32 0.00 0.00 175.29 173.68 1sws s TYR 96 N -2.92 3.42 -0.25 9.60 5.04 -0.21 -1.78 117.35 130.26 1sws s TYR 96 Ca -0.01 0.49 -0.00 0.00 -2.44 0.00 0.00 57.07 55.10 1sws s TYR 96 Cb 0.01 -2.31 0.04 0.00 0.35 0.00 0.00 41.96 40.05 1sws s TYR 96 CO -0.06 0.21 -0.09 0.08 -1.34 0.00 0.00 175.55 174.35 1sws s VAL 97 N 0.59 2.60 0.79 3.14 1.01 0.90 -1.49 120.40 127.94 1sws s VAL 97 Ca 0.14 -1.20 -0.13 0.00 0.00 0.00 0.00 61.98 60.78 1sws s VAL 97 Cb -0.13 -2.36 0.18 0.00 0.00 0.00 0.00 36.38 34.08 1sws s VAL 97 CO 0.03 0.16 1.02 0.61 0.00 0.00 0.00 175.10 176.91 1sws n GLY 98 N 4.60 -1.60 0.00 4.51 0.00 -1.26 -0.80 105.19 110.63 1sws n GLY 98 Ca -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.19 1sws n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sws n GLY 99 N -1.99 -1.66 0.20 -0.02 0.00 -1.26 -4.53 105.19 95.93 1sws n GLY 99 Ca 0.13 -2.06 -0.06 0.00 0.00 0.00 0.00 46.02 44.03 1sws n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sws h ALA 100 N 0.00 0.60 -1.18 4.61 0.00 -2.04 -3.07 119.26 118.18 1sws h ALA 100 Ca 0.00 0.00 -0.79 0.00 0.00 0.00 0.00 54.91 54.12 1sws h ALA 100 Cb 0.00 -0.11 -0.27 0.00 0.00 0.00 0.00 17.79 17.40 1sws h ALA 100 CO 0.00 -0.06 1.01 0.39 0.00 0.00 0.00 179.25 180.59 1sws n GLU 101 N -4.85 4.42 -2.18 0.00 1.02 -1.26 -5.04 120.64 112.75 1sws n GLU 101 Ca 0.03 -4.25 -0.36 0.00 -0.02 0.00 0.00 57.16 52.55 1sws n GLU 101 Cb 0.09 -2.39 0.01 0.00 -0.02 0.00 0.00 31.44 29.12 1sws n GLU 101 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sws s ALA 102 N -4.23 2.78 0.01 0.62 0.00 -1.16 -4.94 121.76 114.84 1sws s ALA 102 Ca 0.44 0.93 -0.06 0.00 0.00 0.00 0.00 51.96 53.27 1sws s ALA 102 Cb 0.28 -3.40 -0.00 0.00 0.00 0.00 0.00 23.12 20.00 1sws s ALA 102 CO -0.24 -0.84 0.11 1.03 0.00 0.00 0.00 175.76 175.82 1sws s ARG 103 N -3.05 0.48 -0.21 0.00 3.00 0.02 -3.96 118.95 115.23 1sws s ARG 103 Ca 0.70 -0.49 0.01 0.00 0.00 0.00 0.00 55.73 55.95 1sws s ARG 103 Cb -0.28 0.19 0.03 0.00 0.00 0.00 0.00 34.95 34.89 1sws s ARG 103 CO 0.32 -0.11 -0.16 0.42 0.00 0.00 0.00 175.30 175.77 1sws s ILE 104 N -1.60 2.21 -0.25 1.52 1.01 0.11 -0.07 121.20 124.13 1sws s ILE 104 Ca -0.13 -1.13 -0.11 0.00 0.00 0.00 0.00 60.65 59.28 1sws s ILE 104 Cb -0.07 -2.06 -0.05 0.00 0.01 0.00 0.00 42.46 40.30 1sws s ILE 104 CO 0.00 0.35 0.20 0.20 0.00 0.00 0.00 174.94 175.68 1sws s ASN 105 N 1.25 6.12 0.14 3.58 0.01 -0.73 -0.02 114.94 125.28 1sws s ASN 105 Ca 0.01 0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.30 1sws s ASN 105 Cb -0.15 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.34 1sws s ASN 105 CO -0.10 0.01 -0.05 0.42 -1.51 0.00 0.00 177.10 175.88 1sws s THR 106 N 1.30 0.79 0.02 1.60 -4.23 -0.23 -1.73 115.64 113.17 1sws s THR 106 Ca 0.09 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.69 1sws s THR 106 Cb -0.14 -1.90 -0.02 0.00 1.34 0.00 0.00 72.50 71.78 1sws s THR 106 CO 0.07 -0.68 -0.23 -1.10 -0.54 0.00 0.00 174.62 172.14 1sws s GLN 107 N -3.85 1.67 0.17 3.99 -0.21 -0.43 -1.59 119.66 119.41 1sws s GLN 107 Ca 0.18 -0.91 0.05 0.00 0.02 0.00 0.00 55.36 54.69 1sws s GLN 107 Cb 0.05 -1.71 -0.05 0.00 1.00 0.00 0.00 33.01 32.30 1sws s GLN 107 CO -0.00 0.45 -0.08 1.67 -2.12 0.00 0.00 175.29 175.21 1sws s TRP 108 N -0.67 1.39 -0.08 0.91 1.48 -0.02 -1.17 118.94 120.77 1sws s TRP 108 Ca 0.09 -0.77 0.02 0.00 -1.06 0.00 0.00 56.10 54.38 1sws s TRP 108 Cb -0.09 -0.73 0.01 0.00 -1.16 0.00 0.00 33.47 31.51 1sws s TRP 108 CO 0.01 0.09 -0.15 -0.51 -4.06 0.00 0.00 176.95 172.32 1sws s LEU 109 N -3.22 1.73 -0.20 -4.66 1.43 -0.54 -1.53 118.68 111.69 1sws s LEU 109 Ca 0.20 -0.38 -0.00 0.00 -1.03 0.00 0.00 54.13 52.92 1sws s LEU 109 Cb 0.03 -1.00 0.02 0.00 0.03 0.00 0.00 46.19 45.26 1sws s LEU 109 CO 0.03 0.05 -0.15 -0.22 0.23 0.00 0.00 176.35 176.29 1sws s LEU 110 N 0.72 2.46 -0.09 1.79 2.96 -0.96 -0.50 118.68 125.05 1sws s LEU 110 Ca -0.13 -0.66 0.02 0.00 -0.22 0.00 0.00 54.13 53.14 1sws s LEU 110 Cb -0.16 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 44.96 1sws s LEU 110 CO 0.03 -0.03 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.00 1sws s THR 111 N 1.32 2.98 0.08 3.68 2.01 -0.26 -0.89 115.64 124.56 1sws s THR 111 Ca 0.04 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.36 1sws s THR 111 Cb -0.14 -2.20 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1sws s THR 111 CO -0.10 0.56 0.04 -0.44 -0.69 0.00 0.00 174.62 173.99 1sws s SER 112 N -0.16 5.28 0.25 3.53 0.01 -0.77 -0.86 113.70 120.98 1sws s SER 112 Ca -0.01 -0.09 -0.30 0.00 1.31 0.00 0.00 55.95 56.87 1sws s SER 112 Cb -0.13 -1.35 -0.09 0.00 0.21 0.00 0.00 66.02 64.65 1sws s SER 112 CO 0.03 0.18 1.30 -0.83 0.41 0.00 0.00 173.24 174.33 1sws s GLY 113 N -2.33 2.65 0.22 3.44 0.00 -0.56 -4.87 107.32 105.86 1sws s GLY 113 Ca 0.27 1.15 -0.12 0.00 0.00 0.00 0.00 44.72 46.03 1sws s GLY 113 CO 0.20 2.00 0.42 -0.51 0.00 0.00 0.00 173.10 175.21 1sws s THR 114 N -0.36 0.02 0.81 0.90 -4.23 -1.26 -5.02 115.64 106.50 1sws s THR 114 Ca 0.54 -1.34 -0.12 0.00 -1.18 0.00 0.00 61.69 59.59 1sws s THR 114 Cb -0.38 -2.04 0.08 0.00 1.34 0.00 0.00 72.50 71.51 1sws s THR 114 CO 0.43 -0.09 1.12 0.42 -0.54 0.00 0.00 174.62 175.96 1sws s THR 115 N -3.99 2.75 0.19 3.99 -4.23 -1.26 -4.87 115.64 108.22 1sws s THR 115 Ca 0.20 0.24 -0.12 0.00 -1.18 0.00 0.00 61.69 60.83 1sws s THR 115 Cb 0.01 -3.06 0.10 0.00 1.34 0.00 0.00 72.50 70.89 1sws s THR 115 CO 0.05 -0.32 1.85 -0.33 -0.54 0.00 0.00 174.62 175.33 1sws h GLU 116 N -1.12 0.78 -0.01 3.99 3.07 -2.02 -1.22 114.58 118.06 1sws h GLU 116 Ca -0.47 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.34 1sws h GLU 116 Cb 1.29 -0.18 -0.00 0.00 -0.84 0.00 0.00 28.75 29.02 1sws h GLU 116 CO 0.61 0.52 0.02 0.00 -1.40 0.00 0.00 179.01 178.76 1sws h ALA 117 N 1.24 1.25 -0.01 3.43 0.00 -2.07 -2.52 119.26 120.58 1sws h ALA 117 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1sws h ALA 117 Cb -0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1sws h ALA 117 CO -0.07 -0.02 0.00 0.09 0.00 0.00 0.00 179.25 179.25 1sws n ASN 118 N -3.41 2.24 0.25 0.00 3.02 -0.70 -4.65 115.26 112.02 1sws n ASN 118 Ca -0.03 -2.67 0.16 0.00 -0.03 0.00 0.00 54.58 52.01 1sws n ASN 118 Cb 0.10 -0.27 0.87 0.00 -0.61 0.00 0.00 39.78 39.87 1sws n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sws h ALA 119 N 0.04 1.67 0.00 5.41 0.00 -0.79 -2.58 119.26 123.01 1sws h ALA 119 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1sws h ALA 119 Cb 0.81 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1sws h ALA 119 CO 0.00 -0.14 -0.07 0.11 0.00 0.00 0.00 179.25 179.15 1sws h TRP 120 N 0.00 0.00 -0.47 0.00 5.08 -1.82 -1.55 115.95 117.19 1sws h TRP 120 Ca 0.04 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 59.92 1sws h TRP 120 Cb 0.24 0.00 -0.05 0.00 -3.00 0.00 0.00 29.16 26.35 1sws h TRP 120 CO 0.00 0.07 0.07 0.36 -1.28 0.00 0.00 178.44 177.66 1sws n LYS 121 N -3.24 3.36 0.00 0.12 2.85 -0.97 -4.66 118.16 115.61 1sws n LYS 121 Ca -0.00 -3.02 0.12 0.00 -1.05 0.00 0.00 58.31 54.36 1sws n LYS 121 Cb 0.29 -2.03 0.30 0.00 -0.65 0.00 0.00 35.03 32.94 1sws n LYS 121 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1sws n SER 122 N -0.30 0.51 -3.95 -5.58 3.41 -0.58 -4.88 113.62 102.24 1sws n SER 122 Ca 0.30 -0.25 -0.25 0.00 -0.26 0.00 0.00 58.87 58.40 1sws n SER 122 Cb 1.11 0.18 -0.17 0.00 -0.26 0.00 0.00 64.21 65.07 1sws n SER 122 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1sws s THR 123 N -2.95 1.02 0.25 6.66 2.01 -1.26 -1.85 115.64 119.52 1sws s THR 123 Ca 0.13 -0.35 -0.02 0.00 0.31 0.00 0.00 61.69 61.76 1sws s THR 123 Cb 0.18 -0.99 -0.05 0.00 0.01 0.00 0.00 72.50 71.65 1sws s THR 123 CO 0.67 0.35 0.47 -0.76 -0.69 0.00 0.00 174.62 174.66 1sws s LEU 124 N 1.19 4.14 0.07 4.42 1.43 -0.07 -4.95 118.68 124.91 1sws s LEU 124 Ca -0.05 0.54 0.06 0.00 -1.03 0.00 0.00 54.13 53.65 1sws s LEU 124 Cb -0.14 -3.34 -0.03 0.00 0.03 0.00 0.00 46.19 42.71 1sws s LEU 124 CO -0.02 -0.13 -0.15 0.54 0.23 0.00 0.00 176.35 176.82 1sws s VAL 125 N -1.99 1.21 0.16 -1.59 0.11 -1.26 -2.27 120.40 114.77 1sws s VAL 125 Ca 0.41 -1.33 -0.11 0.00 -2.93 0.00 0.00 61.98 58.02 1sws s VAL 125 Cb -0.11 -1.15 0.04 0.00 -1.53 0.00 0.00 36.38 33.63 1sws s VAL 125 CO 0.30 -0.18 0.55 0.61 -3.33 0.00 0.00 175.10 173.05 1sws n GLY 126 N 1.29 1.09 3.08 6.54 0.00 -0.58 -5.00 105.19 111.60 1sws n GLY 126 Ca -0.21 -1.09 -0.07 0.00 0.00 0.00 0.00 46.02 44.64 1sws n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1sws s HIS 127 N -4.22 0.46 -0.22 1.61 -3.43 -1.26 -0.84 115.29 107.39 1sws s HIS 127 Ca 0.12 -0.95 -0.17 0.00 -0.80 0.00 0.00 55.06 53.26 1sws s HIS 127 Cb -0.02 -0.34 0.06 0.00 -1.43 0.00 0.00 32.58 30.85 1sws s HIS 127 CO 0.05 -0.36 0.56 0.00 -2.00 0.00 0.00 174.74 172.98 1sws s ALA 128 N -3.52 -1.41 -0.13 -1.38 0.00 -0.62 -4.94 121.76 109.75 1sws s ALA 128 Ca 0.03 1.73 -0.02 0.00 0.00 0.00 0.00 51.96 53.70 1sws s ALA 128 Cb 0.05 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.13 1sws s ALA 128 CO -0.09 -0.29 -0.06 0.99 0.00 0.00 0.00 175.76 176.32 1sws s THR 129 N 0.76 3.75 -0.05 0.00 2.01 -1.26 -1.06 115.64 119.80 1sws s THR 129 Ca -0.04 -0.42 0.02 0.00 0.31 0.00 0.00 61.69 61.56 1sws s THR 129 Cb -0.05 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.82 1sws s THR 129 CO -0.06 0.52 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.95 1sws s PHE 130 N 0.08 2.87 0.06 4.92 0.08 0.97 -4.25 117.98 122.71 1sws s PHE 130 Ca -0.01 -0.03 0.09 0.00 0.12 0.00 0.00 56.93 57.09 1sws s PHE 130 Cb -0.14 -1.67 -0.03 0.00 -0.57 0.00 0.00 43.02 40.62 1sws s PHE 130 CO 0.03 0.31 -0.24 0.95 -0.10 0.00 0.00 175.22 176.17 1sws s THR 131 N -0.84 1.99 -2.33 0.64 -4.23 0.03 -0.71 115.64 110.19 1sws s THR 131 Ca 0.13 -1.38 0.29 0.00 -1.18 0.00 0.00 61.69 59.55 1sws s THR 131 Cb -0.11 -1.72 0.67 0.00 1.34 0.00 0.00 72.50 72.69 1sws s THR 131 CO 0.03 0.26 1.91 1.17 -0.54 0.00 0.00 174.62 177.45