#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cey n ASP 3 N 0.00 1.03 -0.81 0.00 8.00 -1.26 -4.68 116.55 118.83 1cey n ASP 3 Ca 0.00 0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.62 1cey n ASP 3 Cb 0.00 -1.11 0.00 0.00 -0.02 0.00 0.00 41.12 39.99 1cey n ASP 3 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1cey n LYS 4 N 8.45 0.45 -2.03 -1.24 2.85 -1.26 -2.28 118.16 123.10 1cey n LYS 4 Ca 0.55 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.79 1cey n LYS 4 Cb 0.16 -1.26 0.05 0.00 -0.65 0.00 0.00 35.03 33.34 1cey n LYS 4 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1cey n GLU 5 N 0.58 1.46 -2.94 -1.58 1.02 -1.26 -3.15 120.64 114.77 1cey n GLU 5 Ca 0.00 -3.11 -0.40 0.00 -0.02 0.00 0.00 57.16 53.63 1cey n GLU 5 Cb 0.18 -1.21 -0.05 0.00 -0.02 0.00 0.00 31.44 30.34 1cey n GLU 5 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1cey s LEU 6 N -2.52 4.50 -0.04 -4.62 2.96 -0.96 -4.97 118.68 113.03 1cey s LEU 6 Ca 0.34 1.56 -0.26 0.00 -0.22 0.00 0.00 54.13 55.55 1cey s LEU 6 Cb 0.36 -3.30 -0.03 0.00 0.50 0.00 0.00 46.19 43.72 1cey s LEU 6 CO -0.07 0.06 0.81 -0.54 -1.32 0.00 0.00 176.35 175.29 1cey s LYS 7 N -0.37 4.48 0.23 1.98 1.02 -1.26 -4.70 119.74 121.12 1cey s LYS 7 Ca 0.39 1.10 0.09 0.00 0.02 0.00 0.00 55.97 57.57 1cey s LYS 7 Cb -0.22 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.60 1cey s LYS 7 CO 0.25 0.01 -0.04 -0.06 -0.92 0.00 0.00 175.35 174.59 1cey s PHE 8 N 0.90 2.67 -0.22 3.18 0.40 -1.01 -1.51 117.98 122.39 1cey s PHE 8 Ca 0.43 -0.22 -0.02 0.00 -0.60 0.00 0.00 56.93 56.53 1cey s PHE 8 Cb -0.19 -1.23 0.07 0.00 0.51 0.00 0.00 43.02 42.18 1cey s PHE 8 CO 0.22 0.58 0.03 -1.17 0.70 0.00 0.00 175.22 175.58 1cey s LEU 9 N -3.33 1.59 -0.43 -0.37 2.96 -0.85 -2.33 118.68 115.92 1cey s LEU 9 Ca 0.29 -1.02 -0.20 0.00 -0.22 0.00 0.00 54.13 52.98 1cey s LEU 9 Cb -0.07 -0.74 0.02 0.00 0.50 0.00 0.00 46.19 45.90 1cey s LEU 9 CO 0.18 -0.31 0.61 0.68 -1.32 0.00 0.00 176.35 176.19 1cey s VAL 10 N 1.74 4.87 -0.85 1.68 -7.23 -1.08 -1.70 120.40 117.83 1cey s VAL 10 Ca -0.00 0.04 -0.19 0.00 -1.81 0.00 0.00 61.98 60.02 1cey s VAL 10 Cb -0.17 -4.18 0.12 0.00 0.56 0.00 0.00 36.38 32.71 1cey s VAL 10 CO -0.11 -0.56 1.05 -0.69 -0.31 0.00 0.00 175.10 174.48 1cey s VAL 11 N 2.70 4.69 0.02 1.32 1.01 -0.95 -2.10 120.40 127.09 1cey s VAL 11 Ca 0.21 -1.33 -0.08 0.00 0.00 0.00 0.00 61.98 60.78 1cey s VAL 11 Cb -0.15 -4.73 -0.00 0.00 0.00 0.00 0.00 36.38 31.51 1cey s VAL 11 CO 0.18 -1.45 0.14 -0.62 0.00 0.00 0.00 175.10 173.35 1cey s ASP 12 N 3.59 0.05 -0.22 3.32 -1.08 -0.63 -3.98 116.67 117.72 1cey s ASP 12 Ca 0.28 -0.29 0.12 0.00 -0.52 0.00 0.00 52.55 52.15 1cey s ASP 12 Cb -0.09 0.23 -0.22 0.00 -1.46 0.00 0.00 42.92 41.38 1cey s ASP 12 CO -0.05 -0.43 -0.03 -0.90 0.52 0.00 0.00 175.17 174.28 1cey n ASP 13 N 1.18 0.70 -4.57 -0.34 5.68 -1.26 -4.30 116.55 113.65 1cey n ASP 13 Ca -0.21 -0.05 -0.51 0.00 -0.50 0.00 0.00 54.79 53.52 1cey n ASP 13 Cb 0.57 0.52 -0.05 0.00 -1.14 0.00 0.00 41.12 41.01 1cey n ASP 13 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 1cey n PHE 14 N -2.92 1.22 0.34 2.11 -0.00 -1.26 -4.79 117.46 112.16 1cey n PHE 14 Ca -0.37 0.73 -0.04 0.00 -0.00 0.00 0.00 57.45 57.76 1cey n PHE 14 Cb 1.10 -2.26 0.08 0.00 -0.00 0.00 0.00 39.48 38.40 1cey n PHE 14 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1cey n SER 15 N 2.15 2.96 0.00 -2.13 3.41 -1.26 -3.65 113.62 115.10 1cey n SER 15 Ca 0.17 -2.43 0.00 0.00 -0.26 0.00 0.00 58.87 56.35 1cey n SER 15 Cb 0.20 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 1cey n SER 15 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1cey n THR 16 N 0.06 0.00 -0.07 6.66 5.66 -1.26 -4.86 114.28 120.47 1cey n THR 16 Ca 0.15 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 61.04 1cey n THR 16 Cb 0.75 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.48 1cey n THR 16 CO 0.00 0.00 0.00 -0.03 -3.05 0.00 0.00 175.07 171.99 1cey h MET 17 N 0.00 0.36 -0.47 1.09 -1.53 -1.94 -2.46 114.93 109.97 1cey h MET 17 Ca 0.00 -0.11 0.12 0.00 -3.44 0.00 0.00 59.70 56.27 1cey h MET 17 Cb 0.00 -0.04 -0.02 0.00 -0.55 0.00 0.00 31.60 30.99 1cey h MET 17 CO 0.00 0.53 0.33 0.07 0.14 0.00 0.00 176.91 177.98 1cey h ARG 18 N 0.14 0.10 0.00 0.39 0.11 -1.90 0.13 114.38 113.35 1cey h ARG 18 Ca 0.06 -0.01 -0.05 0.00 0.10 0.00 0.00 59.98 60.09 1cey h ARG 18 Cb 0.36 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.41 1cey h ARG 18 CO 0.01 0.07 -0.23 0.00 0.10 0.00 0.00 179.97 179.91 1cey h ARG 19 N 0.11 0.00 -0.05 0.08 3.08 -1.77 -0.96 114.38 114.87 1cey h ARG 19 Ca 0.22 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.21 1cey h ARG 19 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1cey h ARG 19 CO -0.02 0.23 -0.20 0.82 -1.07 0.00 0.00 179.97 179.73 1cey h ILE 20 N 0.00 1.46 -0.01 2.04 2.04 -0.66 -3.25 117.51 119.12 1cey h ILE 20 Ca -0.00 -1.65 -0.21 0.00 1.00 0.00 0.00 64.86 64.00 1cey h ILE 20 Cb 0.68 2.40 -0.00 0.00 -0.74 0.00 0.00 36.82 39.16 1cey h ILE 20 CO 0.03 0.46 -0.87 -0.37 0.00 0.00 0.00 178.15 177.40 1cey h VAL 21 N -0.32 1.43 -0.57 1.67 -1.51 -1.49 -2.73 116.25 112.73 1cey h VAL 21 Ca -0.01 -2.45 0.11 0.00 -1.23 0.00 0.00 66.70 63.12 1cey h VAL 21 Cb 0.85 2.37 -0.11 0.00 -2.13 0.00 0.00 31.29 32.27 1cey h VAL 21 CO 0.04 0.72 -0.22 0.03 -1.23 0.00 0.00 177.57 176.92 1cey h ARG 22 N 0.19 -0.08 0.46 5.19 3.08 -1.24 0.57 114.38 122.55 1cey h ARG 22 Ca -0.06 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1cey h ARG 22 Cb 1.49 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.56 1cey h ARG 22 CO 0.14 -0.05 -0.22 -0.97 -1.07 0.00 0.00 179.97 177.80 1cey h ASN 23 N -0.08 -0.52 -0.98 7.04 -0.73 -1.60 -2.23 115.58 116.48 1cey h ASN 23 Ca 0.26 -0.05 0.27 0.00 1.87 0.00 0.00 56.30 58.65 1cey h ASN 23 Cb 0.49 0.13 -0.18 0.00 0.27 0.00 0.00 38.32 39.03 1cey h ASN 23 CO -0.63 -0.10 0.04 0.25 -0.37 0.00 0.00 177.43 176.63 1cey h LEU 24 N -1.09 -0.46 -0.24 0.34 6.46 -1.12 0.78 115.31 119.98 1cey h LEU 24 Ca -0.06 0.28 -0.15 0.00 -0.12 0.00 0.00 57.88 57.82 1cey h LEU 24 Cb 0.54 0.48 0.00 0.00 -0.73 0.00 0.00 40.66 40.95 1cey h LEU 24 CO 0.10 -0.35 -0.44 -0.07 -0.62 0.00 0.00 178.44 177.06 1cey h LEU 25 N 0.01 0.80 -1.78 2.25 3.38 -0.93 -2.89 115.31 116.16 1cey h LEU 25 Ca 0.60 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1cey h LEU 25 Cb 1.24 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1cey h LEU 25 CO -0.91 1.19 -0.08 0.50 0.09 0.00 0.00 178.44 179.23 1cey h LYS 26 N 0.45 0.05 -0.03 1.13 3.64 0.92 -0.60 116.57 122.13 1cey h LYS 26 Ca 0.01 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1cey h LYS 26 Cb 1.04 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1cey h LYS 26 CO 0.10 0.13 0.05 0.93 -2.27 0.00 0.00 179.45 178.38 1cey h GLU 27 N 0.05 0.00 0.11 1.90 4.39 0.18 -2.39 114.58 118.81 1cey h GLU 27 Ca 0.01 0.00 -0.36 0.00 0.34 0.00 0.00 59.36 59.35 1cey h GLU 27 Cb 0.17 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1cey h GLU 27 CO 0.01 0.00 -1.99 1.28 -1.16 0.00 0.00 179.01 177.15 1cey n LEU 28 N -3.53 2.62 0.00 1.33 4.77 -0.25 -4.98 117.00 116.96 1cey n LEU 28 Ca -0.02 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1cey n LEU 28 Cb 0.13 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 1cey n LEU 28 CO 0.24 0.83 0.00 0.61 -1.33 0.00 0.00 177.39 177.75 1cey n GLY 29 N 1.98 -0.79 3.77 -0.72 0.00 -0.90 -5.02 105.19 103.52 1cey n GLY 29 Ca -0.33 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 1cey n GLY 29 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1cey s PHE 30 N 0.00 3.67 -0.41 1.61 0.08 -1.14 -4.42 117.98 117.38 1cey s PHE 30 Ca 0.00 1.13 0.09 0.00 0.12 0.00 0.00 56.93 58.27 1cey s PHE 30 Cb 0.00 -2.55 0.30 0.00 -0.57 0.00 0.00 43.02 40.20 1cey s PHE 30 CO 0.00 0.38 0.75 0.27 -0.10 0.00 0.00 175.22 176.52 1cey n ASN 31 N 2.66 -0.35 -3.08 1.36 2.04 -1.26 -3.58 115.26 113.04 1cey n ASN 31 Ca -0.08 -3.07 0.04 0.00 -0.44 0.00 0.00 54.58 51.04 1cey n ASN 31 Cb 0.51 0.10 0.00 0.00 -2.53 0.00 0.00 39.78 37.86 1cey n ASN 31 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 1cey s ASN 32 N -1.77 -0.61 0.33 0.53 3.04 -1.26 -5.10 114.94 110.10 1cey s ASN 32 Ca 0.35 -0.01 -0.03 0.00 0.04 0.00 0.00 52.86 53.20 1cey s ASN 32 Cb 0.27 1.24 0.00 0.00 -1.54 0.00 0.00 41.25 41.22 1cey s ASN 32 CO -0.10 -0.10 0.46 0.68 -3.04 0.00 0.00 177.10 174.99 1cey s VAL 33 N 2.71 0.00 0.00 -5.21 -7.23 -1.26 -2.40 120.40 107.00 1cey s VAL 33 Ca 0.23 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 58.79 1cey s VAL 33 Cb -0.02 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.32 1cey s VAL 33 CO -0.21 0.00 0.00 -1.84 -0.31 0.00 0.00 175.10 172.74 1cey n GLU 34 N -0.54 0.67 -3.83 4.82 0.28 -0.99 -4.97 120.64 116.08 1cey n GLU 34 Ca 0.01 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.90 1cey n GLU 34 Cb 0.62 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 33.41 1cey n GLU 34 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1cey s GLU 35 N -1.08 0.72 0.00 3.44 2.12 -1.26 -2.63 118.70 120.02 1cey s GLU 35 Ca 0.00 -0.62 0.00 0.00 0.36 0.00 0.00 54.97 54.71 1cey s GLU 35 Cb 0.00 0.30 0.00 0.00 0.26 0.00 0.00 34.13 34.69 1cey s GLU 35 CO 0.00 -0.22 0.00 0.00 -0.54 0.00 0.00 175.26 174.50 1cey n ALA 36 N 0.63 0.00 -0.17 6.30 0.00 -0.89 -4.95 120.51 121.43 1cey n ALA 36 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1cey n ALA 36 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1cey n ALA 36 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1cey n GLU 37 N 0.00 0.98 -3.56 0.00 1.02 -1.26 -1.61 120.64 116.21 1cey n GLU 37 Ca 0.00 -0.02 0.01 0.00 -0.02 0.00 0.00 57.16 57.13 1cey n GLU 37 Cb 0.00 -0.19 0.01 0.00 -0.02 0.00 0.00 31.44 31.24 1cey n GLU 37 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1cey n ASP 38 N -0.14 -1.11 0.10 1.62 5.68 -1.26 -4.66 116.55 116.78 1cey n ASP 38 Ca 0.00 -1.36 -0.13 0.00 -0.50 0.00 0.00 54.79 52.79 1cey n ASP 38 Cb 0.04 1.75 -0.08 0.00 -1.14 0.00 0.00 41.12 41.69 1cey n ASP 38 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1cey h GLY 39 N 1.62 -0.25 0.16 6.12 0.00 -1.88 0.13 103.07 108.97 1cey h GLY 39 Ca -0.19 0.09 0.22 0.00 0.00 0.00 0.00 47.33 47.46 1cey h GLY 39 CO 0.27 -0.09 0.63 -0.24 0.00 0.00 0.00 176.54 177.11 1cey h VAL 40 N -0.44 0.63 0.03 4.60 3.04 -1.93 1.00 116.25 123.18 1cey h VAL 40 Ca -0.02 -0.14 -0.00 0.00 -1.01 0.00 0.00 66.70 65.53 1cey h VAL 40 Cb 0.34 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 29.82 1cey h VAL 40 CO 0.04 0.07 -0.02 -0.78 -1.01 0.00 0.00 177.57 175.88 1cey h ASP 41 N 0.40 -0.04 0.57 3.17 1.82 -1.75 -2.01 116.42 118.58 1cey h ASP 41 Ca 0.51 -0.39 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 1cey h ASP 41 Cb 1.29 0.01 0.00 0.00 0.68 0.00 0.00 39.33 41.31 1cey h ASP 41 CO -0.21 0.37 0.00 0.00 -1.61 0.00 0.00 179.24 177.79 1cey h ALA 42 N 0.49 1.00 0.00 -0.78 0.00 0.20 -1.09 119.26 119.07 1cey h ALA 42 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1cey h ALA 42 Cb 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1cey h ALA 42 CO 0.01 0.00 -0.66 1.25 0.00 0.00 0.00 179.25 179.85 1cey h LEU 43 N 0.00 0.00 0.04 0.00 6.46 0.14 -0.86 115.31 121.09 1cey h LEU 43 Ca 0.00 0.00 -0.32 0.00 -0.12 0.00 0.00 57.88 57.44 1cey h LEU 43 Cb 0.29 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.18 1cey h LEU 43 CO 0.00 0.66 -1.83 0.59 -0.62 0.00 0.00 178.44 177.24 1cey n ASN 44 N -3.41 1.27 -0.07 1.25 3.02 -0.52 -3.75 115.26 113.04 1cey n ASN 44 Ca 0.00 0.33 -0.07 0.00 -0.03 0.00 0.00 54.58 54.82 1cey n ASN 44 Cb 0.74 -0.30 -0.03 0.00 -0.61 0.00 0.00 39.78 39.59 1cey n ASN 44 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1cey n LYS 45 N -3.18 0.47 0.22 3.52 4.01 -0.54 -4.04 118.16 118.62 1cey n LYS 45 Ca -0.23 0.54 0.17 0.00 -0.51 0.00 0.00 58.31 58.28 1cey n LYS 45 Cb 1.05 -1.71 0.73 0.00 -0.51 0.00 0.00 35.03 34.59 1cey n LYS 45 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1cey h LEU 46 N -1.00 0.00 -1.99 -0.35 6.46 -1.36 0.25 115.31 117.33 1cey h LEU 46 Ca -0.05 0.00 0.22 0.00 -0.12 0.00 0.00 57.88 57.94 1cey h LEU 46 Cb 0.61 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.51 1cey h LEU 46 CO -0.03 0.00 0.58 -0.61 -0.62 0.00 0.00 178.44 177.76 1cey h GLN 47 N 0.00 0.00 -0.52 1.25 5.75 -1.65 -1.81 115.11 118.13 1cey h GLN 47 Ca 0.09 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.66 1cey h GLN 47 Cb 0.99 0.00 -0.09 0.00 1.07 0.00 0.00 27.48 29.45 1cey h GLN 47 CO -0.00 0.00 -0.54 0.00 -2.65 0.00 0.00 178.83 175.64 1cey h ALA 48 N 1.57 -0.67 0.00 3.38 0.00 -0.72 -3.48 119.26 119.35 1cey h ALA 48 Ca 0.36 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1cey h ALA 48 Cb 1.51 1.13 0.00 0.00 0.00 0.00 0.00 17.79 20.43 1cey h ALA 48 CO -0.00 -1.00 0.00 0.41 0.00 0.00 0.00 179.25 178.66 1cey n GLY 49 N -1.37 1.65 0.00 0.00 0.00 -0.68 -5.06 105.19 99.74 1cey n GLY 49 Ca -0.02 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1cey n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cey n GLY 50 N 1.74 0.85 3.57 -0.02 0.00 -1.26 -5.06 105.19 105.01 1cey n GLY 50 Ca 0.00 -0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 1cey n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1cey s TYR 51 N 0.00 1.46 -2.00 1.61 2.02 -1.26 -4.37 117.35 114.81 1cey s TYR 51 Ca 0.00 1.51 0.01 0.00 -0.37 0.00 0.00 57.07 58.21 1cey s TYR 51 Cb 0.00 -3.64 0.04 0.00 -0.40 0.00 0.00 41.96 37.96 1cey s TYR 51 CO 0.00 -1.27 0.53 0.41 -1.57 0.00 0.00 175.55 173.66 1cey n GLY 52 N 6.43 -0.50 3.48 0.71 0.00 -0.79 -4.67 105.19 109.85 1cey n GLY 52 Ca 0.43 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.29 1cey n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1cey s PHE 53 N -2.00 -0.60 -0.06 1.61 5.36 -0.57 -4.11 117.98 117.60 1cey s PHE 53 Ca 0.01 0.85 -0.08 0.00 -0.96 0.00 0.00 56.93 56.75 1cey s PHE 53 Cb 0.00 0.44 0.02 0.00 -0.34 0.00 0.00 43.02 43.14 1cey s PHE 53 CO 0.01 -0.67 0.21 0.08 -1.46 0.00 0.00 175.22 173.38 1cey s VAL 54 N -1.97 0.02 -0.29 3.12 1.01 -0.85 -2.00 120.40 119.44 1cey s VAL 54 Ca -0.07 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1cey s VAL 54 Cb -0.00 -0.36 0.08 0.00 0.00 0.00 0.00 36.38 36.10 1cey s VAL 54 CO 0.03 -0.10 0.03 -0.63 0.00 0.00 0.00 175.10 174.42 1cey s ILE 55 N -0.32 1.49 0.12 2.22 1.01 -0.69 -1.29 121.20 123.74 1cey s ILE 55 Ca -0.04 -1.56 0.08 0.00 0.00 0.00 0.00 60.65 59.13 1cey s ILE 55 Cb -0.03 -1.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.43 1cey s ILE 55 CO 0.01 -0.42 -0.14 -0.94 0.00 0.00 0.00 174.94 173.45 1cey s SER 56 N 1.35 4.14 0.00 3.58 1.04 -1.23 -2.24 113.70 120.34 1cey s SER 56 Ca 0.04 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.97 1cey s SER 56 Cb -0.18 -0.68 0.00 0.00 0.10 0.00 0.00 66.02 65.25 1cey s SER 56 CO -0.13 0.17 0.02 -0.90 0.98 0.00 0.00 173.24 173.38 1cey n ASP 57 N 0.66 0.00 -3.75 7.02 5.68 -1.26 -0.35 116.55 124.56 1cey n ASP 57 Ca -0.14 0.02 -0.04 0.00 -0.50 0.00 0.00 54.79 54.13 1cey n ASP 57 Cb 0.53 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.49 1cey n ASP 57 CO 0.00 0.00 0.00 0.86 -1.33 0.00 0.00 177.20 176.73 1cey s TRP 58 N -0.04 -0.16 0.00 2.11 -0.11 -1.26 -3.95 118.94 115.54 1cey s TRP 58 Ca 0.00 -0.15 -0.02 0.00 1.22 0.00 0.00 56.10 57.14 1cey s TRP 58 Cb 0.00 0.64 -0.10 0.00 -1.50 0.00 0.00 33.47 32.51 1cey s TRP 58 CO 0.00 -0.86 2.25 0.27 -4.62 0.00 0.00 176.95 173.99 1cey n ASN 59 N -0.45 4.33 -0.04 5.86 2.04 -1.26 -4.32 115.26 121.41 1cey n ASN 59 Ca -0.06 -2.22 -0.14 0.00 -0.44 0.00 0.00 54.58 51.73 1cey n ASN 59 Cb 0.61 -1.03 -0.08 0.00 -2.53 0.00 0.00 39.78 36.75 1cey n ASN 59 CO 0.00 0.00 0.00 0.24 -0.44 0.00 0.00 177.26 177.06 1cey h MET 60 N 2.42 0.29 0.04 -3.83 2.86 -2.00 -3.32 114.93 111.40 1cey h MET 60 Ca 0.07 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1cey h MET 60 Cb 1.00 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1cey h MET 60 CO 0.12 0.77 -0.02 -1.35 1.06 0.00 0.00 176.91 177.49 1cey h PRO 61 N -0.15 -0.06 -2.13 -0.22 0.11 -1.94 -3.47 132.00 124.14 1cey h PRO 61 Ca 0.01 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.14 1cey h PRO 61 Cb 0.75 0.01 -0.18 0.00 0.11 0.00 0.00 31.00 31.70 1cey h PRO 61 CO 0.04 0.22 0.36 0.54 -0.21 0.00 0.00 178.00 178.95 1cey s ASN 62 N -5.41 -0.50 -0.13 -2.05 2.20 -1.25 -5.11 114.94 102.70 1cey s ASN 62 Ca -0.15 0.33 -0.40 0.00 -0.94 0.00 0.00 52.86 51.71 1cey s ASN 62 Cb 0.03 0.45 -0.17 0.00 -2.00 0.00 0.00 41.25 39.56 1cey s ASN 62 CO 0.65 -0.61 1.49 0.23 -2.94 0.00 0.00 177.10 175.92 1cey n MET 63 N 0.35 0.87 0.00 3.55 2.81 -1.26 -4.37 117.12 119.06 1cey n MET 63 Ca -0.14 0.31 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 1cey n MET 63 Cb 0.60 -1.94 0.00 0.00 -0.71 0.00 0.00 33.22 31.17 1cey n MET 63 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1cey n ASP 64 N 3.62 0.00 -0.29 7.83 8.00 -1.26 -4.85 116.55 129.60 1cey n ASP 64 Ca 0.23 0.00 0.29 0.00 0.71 0.00 0.00 54.79 56.02 1cey n ASP 64 Cb 0.12 0.00 0.53 0.00 -0.02 0.00 0.00 41.12 41.76 1cey n ASP 64 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cey n GLY 65 N 0.00 -0.70 0.16 0.44 0.00 -1.26 0.16 105.19 103.99 1cey n GLY 65 Ca 0.00 0.74 -0.10 0.00 0.00 0.00 0.00 46.02 46.66 1cey n GLY 65 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1cey h LEU 66 N 0.00 -0.24 -0.00 0.99 7.12 -1.93 -2.83 115.31 118.41 1cey h LEU 66 Ca 0.77 -0.27 0.00 0.00 0.13 0.00 0.00 57.88 58.51 1cey h LEU 66 Cb 2.04 0.06 0.00 0.00 -0.53 0.00 0.00 40.66 42.23 1cey h LEU 66 CO -0.71 0.28 0.00 -0.62 -0.13 0.00 0.00 178.44 177.26 1cey n GLU 67 N -4.97 0.00 0.13 1.25 4.71 0.10 -0.85 120.64 121.01 1cey n GLU 67 Ca -0.07 0.41 -0.06 0.00 -0.01 0.00 0.00 57.16 57.42 1cey n GLU 67 Cb 0.25 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.15 1cey n GLU 67 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1cey h LEU 68 N 0.00 -0.35 -0.26 -4.62 6.46 0.18 -1.61 115.31 115.11 1cey h LEU 68 Ca 0.00 0.01 -0.19 0.00 -0.12 0.00 0.00 57.88 57.57 1cey h LEU 68 Cb 0.09 0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 40.09 1cey h LEU 68 CO 0.00 0.10 -0.89 0.17 -0.62 0.00 0.00 178.44 177.20 1cey h LEU 69 N -1.11 0.17 -0.14 2.25 8.10 -1.29 -2.20 115.31 121.09 1cey h LEU 69 Ca -0.04 -0.14 -0.03 0.00 0.11 0.00 0.00 57.88 57.78 1cey h LEU 69 Cb 0.32 -0.05 -0.00 0.00 -0.44 0.00 0.00 40.66 40.48 1cey h LEU 69 CO 0.07 0.97 -0.03 0.50 -4.11 0.00 0.00 178.44 175.84 1cey h LYS 70 N 0.06 0.26 -0.62 0.17 3.64 -1.13 -1.73 116.57 117.23 1cey h LYS 70 Ca -0.04 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.19 1cey h LYS 70 Cb 1.53 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.31 1cey h LYS 70 CO 0.13 0.55 0.16 1.15 -2.27 0.00 0.00 179.45 179.16 1cey h THR 71 N -0.04 1.25 0.00 1.00 2.02 -1.34 0.83 112.91 116.63 1cey h THR 71 Ca 0.03 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 66.30 1cey h THR 71 Cb 0.45 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1cey h THR 71 CO 0.01 0.34 -0.01 0.40 0.37 0.00 0.00 175.52 176.63 1cey h ILE 72 N 0.90 0.70 0.00 3.11 2.04 -1.28 -1.18 117.51 121.79 1cey h ILE 72 Ca 0.19 -0.06 -0.16 0.00 1.00 0.00 0.00 64.86 65.84 1cey h ILE 72 Cb 0.35 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 1cey h ILE 72 CO 0.00 0.01 -1.32 -0.09 0.00 0.00 0.00 178.15 176.75 1cey h ARG 73 N 0.00 0.00 0.00 2.37 2.43 -0.35 -3.33 114.38 115.50 1cey h ARG 73 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1cey h ARG 73 Cb 0.03 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1cey h ARG 73 CO 0.00 0.29 -0.05 0.00 -1.51 0.00 0.00 179.97 178.70 1cey h ALA 74 N 1.45 1.74 -1.15 2.80 0.00 0.41 -3.36 119.26 121.15 1cey h ALA 74 Ca -0.14 -0.05 -0.55 0.00 0.00 0.00 0.00 54.91 54.17 1cey h ALA 74 Cb 1.55 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 19.24 1cey h ALA 74 CO 0.05 0.06 1.30 0.16 0.00 0.00 0.00 179.25 180.81 1cey s ASP 75 N -6.73 6.20 0.61 0.00 1.47 -1.17 -4.81 116.67 112.25 1cey s ASP 75 Ca -0.05 -1.02 0.32 0.00 1.18 0.00 0.00 52.55 52.98 1cey s ASP 75 Cb 0.16 -2.56 1.85 0.00 -0.34 0.00 0.00 42.92 42.03 1cey s ASP 75 CO 0.64 -1.77 2.19 1.23 0.68 0.00 0.00 175.17 178.13 1cey h GLY 76 N 13.60 0.00 2.00 2.12 0.00 -1.90 2.28 103.07 121.17 1cey h GLY 76 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1cey h GLY 76 CO 1.36 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.90 1cey n ALA 77 N -2.25 2.28 -2.03 3.60 0.00 -1.26 -3.89 120.51 116.96 1cey n ALA 77 Ca -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 53.44 53.34 1cey n ALA 77 Cb 0.20 -1.46 -0.00 0.00 0.00 0.00 0.00 19.45 18.20 1cey n ALA 77 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1cey n MET 78 N -1.58 0.00 -1.24 0.00 2.81 0.11 -4.98 117.12 112.23 1cey n MET 78 Ca 0.07 -0.64 -0.37 0.00 -1.81 0.00 0.00 57.70 54.94 1cey n MET 78 Cb 0.34 -0.22 -0.03 0.00 -0.71 0.00 0.00 33.22 32.60 1cey n MET 78 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1cey n SER 79 N 0.03 4.68 0.00 7.83 3.41 0.73 -3.52 113.62 126.78 1cey n SER 79 Ca -0.01 -2.62 0.00 0.00 -0.26 0.00 0.00 58.87 55.98 1cey n SER 79 Cb 0.64 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 1cey n SER 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cey n ALA 80 N 5.56 0.44 -1.36 7.33 0.00 -1.26 -4.94 120.51 126.28 1cey n ALA 80 Ca 0.55 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 53.46 1cey n ALA 80 Cb 0.30 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.64 1cey n ALA 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1cey n LEU 81 N -0.44 1.10 -4.65 0.00 7.94 -1.23 -4.78 117.00 114.95 1cey n LEU 81 Ca 0.00 0.45 -0.42 0.00 -1.11 0.00 0.00 56.01 54.93 1cey n LEU 81 Cb 0.00 -1.03 -0.03 0.00 0.53 0.00 0.00 43.42 42.89 1cey n LEU 81 CO 0.00 -0.79 1.65 -2.84 -1.11 0.00 0.00 177.39 174.30 1cey s PRO 82 N 6.76 3.90 -0.37 1.96 0.02 -1.26 -4.88 135.00 141.13 1cey s PRO 82 Ca 1.19 2.45 -0.05 0.00 0.02 0.00 0.00 61.00 64.61 1cey s PRO 82 Cb -1.22 -4.20 0.07 0.00 0.02 0.00 0.00 34.50 29.17 1cey s PRO 82 CO 0.56 -1.23 0.16 0.08 -0.33 0.00 0.00 177.00 176.24 1cey s VAL 83 N 5.36 3.62 -0.54 3.83 1.01 -1.26 -2.01 120.40 130.40 1cey s VAL 83 Ca 0.90 -1.51 -0.22 0.00 0.00 0.00 0.00 61.98 61.16 1cey s VAL 83 Cb -0.40 -3.22 0.05 0.00 0.00 0.00 0.00 36.38 32.82 1cey s VAL 83 CO 0.39 -0.40 0.81 -0.22 0.00 0.00 0.00 175.10 175.68 1cey s LEU 84 N 1.31 4.51 -0.27 3.92 2.96 -0.41 -1.97 118.68 128.73 1cey s LEU 84 Ca 0.02 -0.65 -0.28 0.00 -0.22 0.00 0.00 54.13 52.99 1cey s LEU 84 Cb -0.21 -2.63 0.01 0.00 0.50 0.00 0.00 46.19 43.86 1cey s LEU 84 CO -0.00 -1.10 1.03 -0.32 -1.32 0.00 0.00 176.35 174.63 1cey s MET 85 N 3.38 4.17 0.09 1.98 1.75 -1.03 -3.49 119.30 126.15 1cey s MET 85 Ca 0.23 1.18 0.03 0.00 -1.25 0.00 0.00 55.69 55.88 1cey s MET 85 Cb -0.16 -3.68 -0.04 0.00 2.84 0.00 0.00 34.83 33.79 1cey s MET 85 CO 0.15 -0.73 0.12 0.54 -0.65 0.00 0.00 175.02 174.46 1cey s VAL 86 N 3.34 4.74 0.19 10.11 0.11 0.52 -2.74 120.40 136.67 1cey s VAL 86 Ca 0.43 -0.72 -0.11 0.00 -2.93 0.00 0.00 61.98 58.64 1cey s VAL 86 Cb -0.14 -3.32 0.00 0.00 -1.53 0.00 0.00 36.38 31.39 1cey s VAL 86 CO 0.10 0.09 0.37 0.28 -3.33 0.00 0.00 175.10 172.61 1cey s THR 87 N -1.48 0.04 0.00 5.04 -1.32 -0.68 -3.98 115.64 113.27 1cey s THR 87 Ca 0.31 -1.26 0.00 0.00 -1.21 0.00 0.00 61.69 59.53 1cey s THR 87 Cb -0.12 -1.85 0.00 0.00 -1.51 0.00 0.00 72.50 69.02 1cey s THR 87 CO 0.24 -0.20 0.00 0.00 -2.21 0.00 0.00 174.62 172.45 1cey n ALA 88 N -0.27 0.00 -1.57 11.08 0.00 -1.26 -1.36 120.51 127.12 1cey n ALA 88 Ca -0.07 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.23 1cey n ALA 88 Cb 0.63 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.96 1cey n ALA 88 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1cey n GLU 89 N 0.00 0.14 -1.17 0.00 4.71 -1.26 -4.60 120.64 118.46 1cey n GLU 89 Ca 0.00 -1.60 -0.43 0.00 -0.01 0.00 0.00 57.16 55.12 1cey n GLU 89 Cb 0.00 -3.90 -0.06 0.00 -1.01 0.00 0.00 31.44 26.47 1cey n GLU 89 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1cey n ALA 90 N 19.83 3.18 -1.00 0.62 0.00 -1.26 -4.78 120.51 137.09 1cey n ALA 90 Ca 0.41 -3.29 0.00 0.00 0.00 0.00 0.00 53.44 50.57 1cey n ALA 90 Cb 0.47 -3.64 0.00 0.00 0.00 0.00 0.00 19.45 16.28 1cey n ALA 90 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1cey n LYS 91 N 7.09 0.00 0.00 0.00 4.01 -1.26 -4.96 118.16 123.04 1cey n LYS 91 Ca 0.49 0.13 0.00 0.00 -0.51 0.00 0.00 58.31 58.42 1cey n LYS 91 Cb 0.41 -0.73 0.00 0.00 -0.51 0.00 0.00 35.03 34.20 1cey n LYS 91 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 1cey n LYS 92 N -0.36 0.00 -0.16 1.97 2.85 -1.26 -4.94 118.16 116.26 1cey n LYS 92 Ca 0.00 0.00 0.13 0.00 -1.05 0.00 0.00 58.31 57.39 1cey n LYS 92 Cb 0.00 0.00 0.47 0.00 -0.65 0.00 0.00 35.03 34.85 1cey n LYS 92 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1cey h GLU 93 N 0.00 0.48 0.00 -1.58 5.08 -2.00 0.43 114.58 116.99 1cey h GLU 93 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1cey h GLU 93 Cb 0.00 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1cey h GLU 93 CO 0.00 0.32 0.00 0.09 -1.00 0.00 0.00 179.01 178.42 1cey n ASN 94 N -4.49 0.26 -0.02 1.42 3.02 -1.26 -3.15 115.26 111.04 1cey n ASN 94 Ca 0.13 0.53 -0.01 0.00 -0.03 0.00 0.00 54.58 55.20 1cey n ASN 94 Cb 0.45 -0.60 -0.00 0.00 -0.61 0.00 0.00 39.78 39.02 1cey n ASN 94 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1cey h ILE 95 N 0.00 0.00 -0.18 2.41 1.08 -0.52 -3.32 117.51 116.98 1cey h ILE 95 Ca 0.00 -0.29 0.05 0.00 -0.39 0.00 0.00 64.86 64.23 1cey h ILE 95 Cb 0.55 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.29 1cey h ILE 95 CO 0.00 0.00 0.64 0.40 -0.69 0.00 0.00 178.15 178.50 1cey h ILE 96 N -0.29 0.06 0.49 -0.67 5.03 -1.60 -0.43 117.51 120.10 1cey h ILE 96 Ca 0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.72 1cey h ILE 96 Cb 0.07 0.40 -0.00 0.00 -3.03 0.00 0.00 36.82 34.26 1cey h ILE 96 CO 0.00 0.00 -0.33 0.00 -0.68 0.00 0.00 178.15 177.14 1cey h ALA 97 N 0.90 -1.12 -0.06 1.87 0.00 -1.64 1.62 119.26 120.84 1cey h ALA 97 Ca 0.09 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1cey h ALA 97 Cb 1.36 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 19.55 1cey h ALA 97 CO -0.00 -1.10 -0.49 0.00 0.00 0.00 0.00 179.25 177.66 1cey h ALA 98 N -1.39 -0.80 -0.17 0.00 0.00 -1.18 0.54 119.26 116.25 1cey h ALA 98 Ca -0.06 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.84 1cey h ALA 98 Cb 0.62 0.89 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1cey h ALA 98 CO 0.05 -1.04 0.21 0.00 0.00 0.00 0.00 179.25 178.47 1cey h ALA 99 N -0.20 1.72 -0.87 0.00 0.00 -1.39 0.42 119.26 118.94 1cey h ALA 99 Ca 0.04 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.18 1cey h ALA 99 Cb 0.69 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1cey h ALA 99 CO -0.38 -0.30 0.61 0.37 0.00 0.00 0.00 179.25 179.55 1cey h GLN 100 N 0.00 0.14 0.00 0.00 4.15 0.78 2.68 115.11 122.85 1cey h GLN 100 Ca 0.08 -0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.39 1cey h GLN 100 Cb 0.51 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.15 1cey h GLN 100 CO -0.00 0.09 -1.29 0.00 -1.93 0.00 0.00 178.83 175.70 1cey n ALA 101 N -2.64 2.19 -2.29 3.38 0.00 0.14 -5.02 120.51 116.28 1cey n ALA 101 Ca 0.18 -0.43 -0.03 0.00 0.00 0.00 0.00 53.44 53.17 1cey n ALA 101 Cb 0.85 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1cey n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cey n GLY 102 N 1.31 -0.94 0.00 0.00 0.00 0.90 -4.93 105.19 101.53 1cey n GLY 102 Ca -0.06 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1cey n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cey n ALA 103 N -0.82 0.00 -0.11 4.61 0.00 -1.26 -4.96 120.51 117.98 1cey n ALA 103 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.25 1cey n ALA 103 Cb 0.36 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.69 1cey n ALA 103 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1cey n SER 104 N 0.00 1.89 0.00 0.00 3.41 -0.83 -4.77 113.62 113.32 1cey n SER 104 Ca 0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 1cey n SER 104 Cb 0.00 -0.93 0.00 0.00 -0.26 0.00 0.00 64.21 63.02 1cey n SER 104 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1cey n GLY 105 N 1.44 -0.76 2.94 5.00 0.00 -1.26 -4.99 105.19 107.55 1cey n GLY 105 Ca -0.36 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 44.47 1cey n GLY 105 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1cey s TYR 106 N -3.00 0.39 0.06 1.61 5.04 -1.26 -2.47 117.35 117.72 1cey s TYR 106 Ca 0.00 -0.07 0.03 0.00 -2.44 0.00 0.00 57.07 54.59 1cey s TYR 106 Cb 0.00 -0.27 -0.03 0.00 0.35 0.00 0.00 41.96 42.02 1cey s TYR 106 CO 0.00 -0.02 -0.10 0.54 -1.34 0.00 0.00 175.55 174.63 1cey s VAL 107 N -0.02 0.78 0.41 3.14 0.11 -1.11 -5.01 120.40 118.70 1cey s VAL 107 Ca 0.01 -1.22 -0.02 0.00 -2.93 0.00 0.00 61.98 57.81 1cey s VAL 107 Cb -0.03 -0.86 -0.03 0.00 -1.53 0.00 0.00 36.38 33.94 1cey s VAL 107 CO -0.00 -0.35 0.67 -0.69 -3.33 0.00 0.00 175.10 171.39 1cey s VAL 108 N -1.48 4.98 0.14 2.04 1.01 -1.26 -1.68 120.40 124.15 1cey s VAL 108 Ca -0.05 -0.15 0.06 0.00 0.00 0.00 0.00 61.98 61.84 1cey s VAL 108 Cb -0.09 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1cey s VAL 108 CO 0.01 -0.69 -0.14 -1.59 0.00 0.00 0.00 175.10 172.69 1cey s LYS 109 N -4.53 1.08 -0.08 2.72 -2.85 -0.47 -3.47 119.74 112.15 1cey s LYS 109 Ca 0.44 -1.32 -0.30 0.00 -1.00 0.00 0.00 55.97 53.79 1cey s LYS 109 Cb -0.10 -0.92 -0.03 0.00 -2.06 0.00 0.00 37.83 34.72 1cey s LYS 109 CO 0.40 0.17 1.25 -1.25 0.10 0.00 0.00 175.35 176.02 1cey s PRO 110 N -2.94 4.31 0.54 1.78 0.05 -1.26 -4.64 135.00 132.84 1cey s PRO 110 Ca 0.12 1.71 -0.03 0.00 0.05 0.00 0.00 61.00 62.86 1cey s PRO 110 Cb -0.03 -3.62 0.01 0.00 0.05 0.00 0.00 34.50 30.91 1cey s PRO 110 CO 0.03 -0.54 0.80 -0.59 0.05 0.00 0.00 177.00 176.76 1cey s PHE 111 N 2.60 3.16 0.37 0.56 -0.12 -1.23 -5.09 117.98 118.23 1cey s PHE 111 Ca 0.57 0.37 0.07 0.00 -0.05 0.00 0.00 56.93 57.89 1cey s PHE 111 Cb -0.25 -2.61 -0.00 0.00 -0.63 0.00 0.00 43.02 39.53 1cey s PHE 111 CO 0.21 -0.70 0.51 -0.08 -0.05 0.00 0.00 175.22 175.11 1cey s THR 112 N -2.81 3.66 0.27 -4.49 -1.32 -1.26 -4.87 115.64 104.81 1cey s THR 112 Ca 0.53 -0.98 -0.03 0.00 -1.21 0.00 0.00 61.69 59.99 1cey s THR 112 Cb -0.10 -3.25 0.18 0.00 -1.51 0.00 0.00 72.50 67.81 1cey s THR 112 CO 0.41 -0.10 1.84 0.00 -2.21 0.00 0.00 174.62 174.57 1cey h ALA 113 N 0.78 1.22 0.00 11.08 0.00 -1.99 0.54 119.26 130.89 1cey h ALA 113 Ca -0.44 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.27 1cey h ALA 113 Cb 1.27 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1cey h ALA 113 CO 0.50 0.57 -0.15 0.00 0.00 0.00 0.00 179.25 180.17 1cey h ALA 114 N 1.33 1.21 0.00 0.00 0.00 -1.97 0.24 119.26 120.07 1cey h ALA 114 Ca 0.22 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1cey h ALA 114 Cb 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1cey h ALA 114 CO -0.02 0.19 -0.00 1.15 0.00 0.00 0.00 179.25 180.57 1cey h THR 115 N 0.00 0.00 -1.14 0.00 2.02 -1.34 -1.09 112.91 111.36 1cey h THR 115 Ca -0.00 -0.01 0.33 0.00 0.77 0.00 0.00 66.41 67.49 1cey h THR 115 Cb 0.45 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.76 1cey h THR 115 CO 0.02 0.00 0.74 0.25 0.37 0.00 0.00 175.52 176.90 1cey h LEU 116 N -0.01 0.36 0.49 2.58 5.85 -1.10 -1.79 115.31 121.68 1cey h LEU 116 Ca -0.00 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1cey h LEU 116 Cb 0.00 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1cey h LEU 116 CO 0.00 -0.01 -0.23 -0.08 -0.34 0.00 0.00 178.44 177.78 1cey h GLU 117 N 0.27 -0.63 -1.40 1.25 4.22 -0.58 0.13 114.58 117.84 1cey h GLU 117 Ca 0.67 0.04 0.41 0.00 0.08 0.00 0.00 59.36 60.56 1cey h GLU 117 Cb 1.89 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 31.23 1cey h GLU 117 CO -0.33 -0.42 1.02 1.05 -2.18 0.00 0.00 179.01 178.15 1cey h GLU 118 N -0.86 0.00 0.06 1.92 4.11 -0.36 1.03 114.58 120.47 1cey h GLU 118 Ca -0.07 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.08 1cey h GLU 118 Cb 0.50 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1cey h GLU 118 CO 0.11 0.00 -1.48 0.87 0.07 0.00 0.00 179.01 178.58 1cey h LYS 119 N 0.00 0.12 0.13 1.06 1.57 -1.27 -3.22 116.57 114.96 1cey h LYS 119 Ca 0.66 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 59.24 1cey h LYS 119 Cb 2.69 0.07 0.00 0.00 0.08 0.00 0.00 32.23 35.08 1cey h LYS 119 CO -0.01 0.91 -0.06 1.25 -0.57 0.00 0.00 179.45 180.97 1cey h LEU 120 N 0.03 -0.15 0.30 2.94 5.85 0.39 -1.90 115.31 122.77 1cey h LEU 120 Ca -0.21 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.24 1cey h LEU 120 Cb 1.96 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 43.00 1cey h LEU 120 CO 0.13 0.20 -0.47 -1.13 -0.34 0.00 0.00 178.44 176.83 1cey h ASN 121 N -0.52 -1.34 -0.58 1.25 -0.00 -1.14 0.92 115.58 114.18 1cey h ASN 121 Ca -0.02 0.12 0.17 0.00 -0.00 0.00 0.00 56.30 56.57 1cey h ASN 121 Cb 0.41 0.47 -0.02 0.00 -0.00 0.00 0.00 38.32 39.17 1cey h ASN 121 CO 0.03 -0.56 0.49 0.50 -0.00 0.00 0.00 177.43 177.89 1cey h LYS 122 N -0.81 0.00 0.04 6.67 1.63 -1.61 -0.78 116.57 121.71 1cey h LYS 122 Ca -0.03 0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.59 1cey h LYS 122 Cb 0.74 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.39 1cey h LYS 122 CO -0.15 0.00 -0.73 0.82 -3.45 0.00 0.00 179.45 175.95 1cey h ILE 123 N 0.00 1.43 0.00 2.00 2.04 -0.21 -3.10 117.51 119.67 1cey h ILE 123 Ca 0.27 -2.22 0.00 0.00 1.00 0.00 0.00 64.86 63.91 1cey h ILE 123 Cb 1.25 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 40.05 1cey h ILE 123 CO -0.00 0.65 0.00 0.49 0.00 0.00 0.00 178.15 179.28 1cey n PHE 124 N -4.14 0.00 0.22 1.37 3.72 0.14 -1.62 117.46 117.15 1cey n PHE 124 Ca -0.11 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.38 1cey n PHE 124 Cb 0.74 -0.29 0.48 0.00 -0.94 0.00 0.00 39.48 39.46 1cey n PHE 124 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1cey h GLU 125 N 0.00 0.00 0.00 -1.08 4.57 -1.39 1.28 114.58 117.97 1cey h GLU 125 Ca 0.00 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.02 1cey h GLU 125 Cb 0.10 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.66 1cey h GLU 125 CO 0.00 0.24 -1.76 1.63 -1.18 0.00 0.00 179.01 177.94 1cey n LYS 126 N -3.48 0.65 0.02 1.92 5.02 -0.64 -4.07 118.16 117.58 1cey n LYS 126 Ca -0.00 0.05 0.11 0.00 -2.02 0.00 0.00 58.31 56.45 1cey n LYS 126 Cb 0.41 -1.67 0.01 0.00 -0.02 0.00 0.00 35.03 33.77 1cey n LYS 126 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1cey n LEU 127 N -2.67 0.62 -3.13 -0.35 7.99 -1.03 -5.03 117.00 113.40 1cey n LEU 127 Ca -0.13 -0.07 -0.10 0.00 -0.01 0.00 0.00 56.01 55.70 1cey n LEU 127 Cb 0.82 -0.09 0.01 0.00 -0.11 0.00 0.00 43.42 44.05 1cey n LEU 127 CO 0.43 0.07 -0.39 0.61 -1.51 0.00 0.00 177.39 176.60 1cey n GLY 128 N 1.38 -0.99 0.62 -0.72 0.00 0.44 -5.05 105.19 100.87 1cey n GLY 128 Ca 0.02 0.49 0.13 0.00 0.00 0.00 0.00 46.02 46.67 1cey n GLY 128 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19