#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1weo n SER 2 N 0.00 -2.19 -3.93 1.61 3.41 -1.26 -4.90 113.62 106.37 1weo n SER 2 Ca 0.00 -1.10 -0.29 0.00 -0.26 0.00 0.00 58.87 57.21 1weo n SER 2 Cb 0.00 -2.35 0.27 0.00 -0.26 0.00 0.00 64.21 61.87 1weo n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1weo s SER 3 N -3.49 -0.00 0.00 4.04 0.15 -1.26 -5.07 113.70 108.07 1weo s SER 3 Ca 0.63 1.08 0.00 0.00 0.70 0.00 0.00 55.95 58.36 1weo s SER 3 Cb -0.35 -1.61 0.00 0.00 -1.71 0.00 0.00 66.02 62.35 1weo s SER 3 CO 0.96 -4.74 0.00 0.61 1.20 0.00 0.00 173.24 171.27 1weo n GLY 4 N 0.83 5.41 3.53 9.45 0.00 -1.26 -5.19 105.19 117.96 1weo n GLY 4 Ca 0.08 -1.24 -0.14 0.00 0.00 0.00 0.00 46.02 44.72 1weo n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1weo s SER 5 N 1.00 0.75 0.01 1.61 1.04 -1.26 -5.18 113.70 111.67 1weo s SER 5 Ca 0.00 -1.42 0.02 0.00 0.48 0.00 0.00 55.95 55.03 1weo s SER 5 Cb 0.00 0.68 -0.01 0.00 0.10 0.00 0.00 66.02 66.79 1weo s SER 5 CO 0.00 -1.33 -0.05 -0.55 0.98 0.00 0.00 173.24 172.29 1weo s SER 6 N -3.21 0.63 -0.51 7.02 0.15 -1.26 -5.12 113.70 111.41 1weo s SER 6 Ca 0.28 -0.18 -0.18 0.00 0.70 0.00 0.00 55.95 56.57 1weo s SER 6 Cb -0.01 -0.04 0.07 0.00 -1.71 0.00 0.00 66.02 64.33 1weo s SER 6 CO 0.19 0.01 0.55 -0.83 1.20 0.00 0.00 173.24 174.36 1weo s GLY 7 N -0.42 1.88 -0.02 9.45 0.00 -1.26 -5.04 107.32 111.92 1weo s GLY 7 Ca -0.01 -1.99 -0.30 0.00 0.00 0.00 0.00 44.72 42.42 1weo s GLY 7 CO -0.00 1.34 1.46 2.56 0.00 0.00 0.00 173.10 178.46 1weo s PRO 8 N 2.25 4.25 0.45 2.90 0.04 -1.26 -5.01 135.00 138.61 1weo s PRO 8 Ca 0.10 2.02 -0.13 0.00 0.04 0.00 0.00 61.00 63.03 1weo s PRO 8 Cb -0.22 -3.66 -0.07 0.00 0.04 0.00 0.00 34.50 30.59 1weo s PRO 8 CO 0.09 -0.65 0.85 0.15 0.04 0.00 0.00 177.00 177.48 1weo s LYS 9 N 2.80 3.84 -0.70 4.56 3.01 -1.26 -4.98 119.74 127.01 1weo s LYS 9 Ca 0.66 0.65 -0.26 0.00 -1.01 0.00 0.00 55.97 56.01 1weo s LYS 9 Cb -0.32 -2.29 -0.03 0.00 -1.01 0.00 0.00 37.83 34.18 1weo s LYS 9 CO 0.27 -0.13 1.89 -1.25 0.51 0.00 0.00 175.35 176.64 1weo s PRO 10 N -3.94 2.60 0.39 -1.68 0.04 -1.26 -4.96 135.00 126.21 1weo s PRO 10 Ca 0.54 0.33 0.08 0.00 0.04 0.00 0.00 61.00 61.98 1weo s PRO 10 Cb -0.10 -4.60 -0.07 0.00 0.04 0.00 0.00 34.50 29.77 1weo s PRO 10 CO 0.31 -2.94 0.04 -1.17 0.04 0.00 0.00 177.00 173.29 1weo s LEU 11 N 9.39 2.94 0.14 -3.56 2.96 -1.26 -5.02 118.68 124.27 1weo s LEU 11 Ca 0.68 -1.23 -0.11 0.00 -0.22 0.00 0.00 54.13 53.25 1weo s LEU 11 Cb -0.11 -1.11 0.14 0.00 0.50 0.00 0.00 46.19 45.61 1weo s LEU 11 CO 0.14 -0.42 0.97 0.29 -1.32 0.00 0.00 176.35 176.01 1weo n LYS 12 N -1.02 -0.15 -0.40 1.98 4.01 -1.26 -4.39 118.16 116.93 1weo n LYS 12 Ca -0.04 0.96 -0.14 0.00 -0.51 0.00 0.00 58.31 58.58 1weo n LYS 12 Cb 0.65 -1.42 0.13 0.00 -0.51 0.00 0.00 35.03 33.88 1weo n LYS 12 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1weo n ASN 13 N -4.91 -2.84 -3.61 4.39 2.85 -1.26 -4.07 115.26 105.82 1weo n ASN 13 Ca 0.06 -0.39 -0.22 0.00 -0.11 0.00 0.00 54.58 53.92 1weo n ASN 13 Cb 0.25 -0.65 0.07 0.00 1.24 0.00 0.00 39.78 40.69 1weo n ASN 13 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1weo n LEU 14 N 0.00 -3.44 -0.27 1.20 7.99 -1.26 -4.89 117.00 116.33 1weo n LEU 14 Ca 0.06 -0.65 -0.00 0.00 -0.01 0.00 0.00 56.01 55.41 1weo n LEU 14 Cb 0.27 -2.93 0.12 0.00 -0.11 0.00 0.00 43.42 40.77 1weo n LEU 14 CO 0.18 0.49 1.14 0.44 -1.51 0.00 0.00 177.39 178.12 1weo h ASP 15 N -2.20 0.68 0.00 -1.43 3.32 -1.88 -3.47 116.42 111.44 1weo h ASP 15 Ca -0.59 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.49 1weo h ASP 15 Cb 1.36 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1weo h ASP 15 CO 0.56 0.43 0.00 0.61 -1.72 0.00 0.00 179.24 179.12 1weo n GLY 16 N -1.31 3.27 0.43 2.75 0.00 -1.26 -4.98 105.19 104.09 1weo n GLY 16 Ca 0.11 -0.45 0.36 0.00 0.00 0.00 0.00 46.02 46.03 1weo n GLY 16 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1weo n GLN 17 N 0.00 -0.03 -1.66 1.61 1.13 -1.26 -4.37 117.38 112.80 1weo n GLN 17 Ca 0.00 1.04 -0.53 0.00 -1.94 0.00 0.00 57.00 55.57 1weo n GLN 17 Cb 0.00 -2.10 -0.06 0.00 0.11 0.00 0.00 30.24 28.19 1weo n GLN 17 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1weo n PHE 18 N -4.28 2.11 -1.41 1.08 3.01 -1.26 -3.68 117.46 113.03 1weo n PHE 18 Ca 0.35 0.27 -0.38 0.00 1.01 0.00 0.00 57.45 58.70 1weo n PHE 18 Cb 1.39 -2.56 0.03 0.00 -0.01 0.00 0.00 39.48 38.33 1weo n PHE 18 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1weo n GLU 20 N 0.19 0.56 -0.06 0.00 -0.58 -0.91 -3.19 120.64 116.65 1weo n GLU 20 Ca 0.11 0.12 -0.11 0.00 -0.42 0.00 0.00 57.16 56.86 1weo n GLU 20 Cb 0.48 -1.44 -0.08 0.00 -0.57 0.00 0.00 31.44 29.83 1weo n GLU 20 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1weo h ILE 21 N 0.00 0.00 0.01 -3.67 2.04 -1.93 -3.33 117.51 110.63 1weo h ILE 21 Ca -0.49 0.00 -0.42 0.00 1.00 0.00 0.00 64.86 64.95 1weo h ILE 21 Cb 1.77 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.78 1weo h ILE 21 CO -0.07 0.00 -2.45 0.00 0.00 0.00 0.00 178.15 175.62 1weo n GLY 23 N 1.78 3.73 2.62 0.00 0.00 -1.19 -5.09 105.19 107.03 1weo n GLY 23 Ca -0.49 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.24 1weo n GLY 23 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1weo n ASP 24 N 0.00 -3.93 -4.64 1.61 9.92 -1.26 -3.70 116.55 114.55 1weo n ASP 24 Ca 0.00 0.37 -0.43 0.00 -0.53 0.00 0.00 54.79 54.20 1weo n ASP 24 Cb 0.00 -0.67 -0.02 0.00 -0.64 0.00 0.00 41.12 39.78 1weo n ASP 24 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1weo s GLN 25 N -1.20 4.08 -0.59 -1.24 0.74 -1.26 -0.84 119.66 119.35 1weo s GLN 25 Ca 0.41 1.06 -0.27 0.00 0.05 0.00 0.00 55.36 56.61 1weo s GLN 25 Cb -0.30 -3.72 -0.10 0.00 1.10 0.00 0.00 33.01 29.99 1weo s GLN 25 CO 0.61 -0.84 2.47 -0.89 -0.55 0.00 0.00 175.29 176.09 1weo n ILE 26 N 5.76 -0.07 0.00 -2.34 5.41 -1.24 -4.84 119.36 122.04 1weo n ILE 26 Ca 0.11 -0.66 0.00 0.00 1.00 0.00 0.00 62.75 63.21 1weo n ILE 26 Cb 0.47 -2.37 0.00 0.00 -0.71 0.00 0.00 39.64 37.03 1weo n ILE 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1weo n GLY 27 N 6.11 -2.92 3.80 7.39 0.00 -1.26 -4.81 105.19 113.50 1weo n GLY 27 Ca 0.43 -0.97 -0.25 0.00 0.00 0.00 0.00 46.02 45.22 1weo n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1weo s LEU 28 N 0.00 3.81 0.95 0.99 1.43 -1.26 -4.02 118.68 120.58 1weo s LEU 28 Ca 0.00 -0.15 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 1weo s LEU 28 Cb 0.00 -2.40 0.16 0.00 0.03 0.00 0.00 46.19 43.98 1weo s LEU 28 CO 0.00 0.05 1.09 0.42 0.23 0.00 0.00 176.35 178.14 1weo s THR 29 N -1.81 2.43 0.38 5.49 -4.23 0.11 -4.79 115.64 113.21 1weo s THR 29 Ca 0.31 0.14 0.22 0.00 -1.18 0.00 0.00 61.69 61.19 1weo s THR 29 Cb -0.10 -2.47 0.38 0.00 1.34 0.00 0.00 72.50 71.65 1weo s THR 29 CO 0.24 -0.18 1.59 0.58 -0.54 0.00 0.00 174.62 176.31 1weo h VAL 30 N -1.82 0.05 0.00 2.29 2.07 -2.00 0.21 116.25 117.06 1weo h VAL 30 Ca -0.51 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1weo h VAL 30 Cb 1.29 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1weo h VAL 30 CO 0.52 0.01 -0.08 -0.33 0.02 0.00 0.00 177.57 177.71 1weo h GLU 31 N 0.05 0.00 0.00 1.57 5.08 -2.03 -3.49 114.58 115.76 1weo h GLU 31 Ca 0.84 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.20 1weo h GLU 31 Cb 2.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.52 1weo h GLU 31 CO -0.69 0.70 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 1weo n GLY 32 N 1.65 0.33 3.76 -3.84 0.00 0.06 -5.15 105.19 102.00 1weo n GLY 32 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1weo n GLY 32 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1weo s ASP 33 N 0.00 5.03 0.10 1.61 1.01 -1.26 -4.19 116.67 118.97 1weo s ASP 33 Ca 0.00 2.20 -0.34 0.00 0.71 0.00 0.00 52.55 55.12 1weo s ASP 33 Cb 0.00 -2.58 -0.14 0.00 1.01 0.00 0.00 42.92 41.22 1weo s ASP 33 CO 0.00 -1.69 1.61 -0.11 0.21 0.00 0.00 175.17 175.19 1weo n LEU 34 N -2.09 2.99 -4.56 1.23 -0.00 -1.26 0.03 117.00 113.35 1weo n LEU 34 Ca 0.12 1.07 -0.33 0.00 -0.00 0.00 0.00 56.01 56.87 1weo n LEU 34 Cb 0.51 -1.39 -0.04 0.00 -0.00 0.00 0.00 43.42 42.50 1weo n LEU 34 CO 0.46 -0.33 1.46 0.12 -0.00 0.00 0.00 177.39 179.10 1weo s PHE 35 N 1.51 2.13 -0.89 1.96 5.36 -1.26 -4.75 117.98 122.04 1weo s PHE 35 Ca 0.82 -0.02 -0.23 0.00 -0.96 0.00 0.00 56.93 56.54 1weo s PHE 35 Cb -0.72 -4.30 0.07 0.00 -0.34 0.00 0.00 43.02 37.73 1weo s PHE 35 CO 0.42 -1.74 1.27 0.08 -1.46 0.00 0.00 175.22 173.79 1weo s VAL 36 N 8.18 4.13 0.19 3.12 1.01 -1.26 -4.83 120.40 130.94 1weo s VAL 36 Ca 0.61 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.81 1weo s VAL 36 Cb -0.03 -4.91 0.11 0.00 0.00 0.00 0.00 36.38 31.55 1weo s VAL 36 CO -0.01 -1.75 1.82 0.00 0.00 0.00 0.00 175.10 175.16 1weo h ALA 37 N 9.58 0.83 -3.80 5.51 0.00 -1.82 -3.43 119.26 126.13 1weo h ALA 37 Ca 0.02 -0.09 -0.47 0.00 0.00 0.00 0.00 54.91 54.37 1weo h ALA 37 Cb 1.03 -0.26 -0.25 0.00 0.00 0.00 0.00 17.79 18.31 1weo h ALA 37 CO 1.29 0.32 -0.80 0.00 0.00 0.00 0.00 179.25 180.06 1weo n ASN 39 N 1.87 3.33 -0.24 0.00 5.15 -1.26 -3.99 115.26 120.12 1weo n ASN 39 Ca -0.18 -0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.68 1weo n ASN 39 Cb 0.54 -0.02 -0.09 0.00 -0.53 0.00 0.00 39.78 39.68 1weo n ASN 39 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1weo h GLU 40 N -0.01 -0.21 0.00 1.20 4.57 -1.99 -3.24 114.58 114.91 1weo h GLU 40 Ca -0.02 0.01 -0.38 0.00 -1.18 0.00 0.00 59.36 57.80 1weo h GLU 40 Cb 1.03 0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 29.60 1weo h GLU 40 CO -0.00 -0.14 -2.42 0.00 -1.18 0.00 0.00 179.01 175.26 1weo n GLY 42 N 2.15 0.68 3.69 0.00 0.00 -1.22 -5.07 105.19 105.41 1weo n GLY 42 Ca -0.41 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 1weo n GLY 42 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1weo s PHE 43 N -1.74 3.50 -0.13 1.61 5.36 -1.26 -4.98 117.98 120.34 1weo s PHE 43 Ca 0.00 1.38 -0.29 0.00 -0.96 0.00 0.00 56.93 57.06 1weo s PHE 43 Cb 0.00 -3.03 -0.04 0.00 -0.34 0.00 0.00 43.02 39.61 1weo s PHE 43 CO 0.00 -0.15 1.54 -1.25 -1.46 0.00 0.00 175.22 173.90 1weo s PRO 44 N 1.74 4.09 -0.24 10.12 0.04 -1.26 -4.00 135.00 145.50 1weo s PRO 44 Ca 0.42 1.92 -0.03 0.00 0.04 0.00 0.00 61.00 63.34 1weo s PRO 44 Cb -0.18 -3.94 0.13 0.00 0.04 0.00 0.00 34.50 30.55 1weo s PRO 44 CO 0.16 -0.93 0.40 0.00 0.04 0.00 0.00 177.00 176.68 1weo s ALA 45 N 4.20 -1.19 1.11 8.56 0.00 -1.26 -2.15 121.76 131.03 1weo s ALA 45 Ca 0.68 1.11 -0.14 0.00 0.00 0.00 0.00 51.96 53.61 1weo s ALA 45 Cb -0.28 -1.64 0.22 0.00 0.00 0.00 0.00 23.12 21.42 1weo s ALA 45 CO 0.26 -1.16 0.49 0.00 0.00 0.00 0.00 175.76 175.35 1weo h ARG 47 N 0.00 -0.13 -0.31 0.00 2.43 -1.97 -2.54 114.38 111.86 1weo h ARG 47 Ca -0.22 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 1weo h ARG 47 Cb 0.76 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1weo h ARG 47 CO 0.13 0.29 0.00 -0.35 -1.51 0.00 0.00 179.97 178.54 1weo n PRO 48 N -4.94 0.49 0.00 0.20 -0.04 -1.26 -2.48 135.00 126.98 1weo n PRO 48 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1weo n PRO 48 Cb 0.25 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 1weo n PRO 48 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1weo h TYR 50 N 0.00 1.00 0.90 0.00 5.03 -1.21 -2.99 116.97 119.70 1weo h TYR 50 Ca 0.00 -0.50 -0.04 0.00 2.58 0.00 0.00 58.73 60.77 1weo h TYR 50 Cb 0.87 -0.13 0.01 0.00 1.55 0.00 0.00 36.73 39.03 1weo h TYR 50 CO 0.00 1.33 -0.45 0.93 -1.32 0.00 0.00 178.16 178.66 1weo h GLU 51 N 0.39 -1.18 -0.48 1.82 5.08 -1.76 -3.08 114.58 115.37 1weo h GLU 51 Ca -0.09 0.08 0.10 0.00 -1.00 0.00 0.00 59.36 58.45 1weo h GLU 51 Cb 1.52 0.27 -0.10 0.00 0.50 0.00 0.00 28.75 30.95 1weo h GLU 51 CO 0.18 -0.79 -0.16 -0.92 -1.00 0.00 0.00 179.01 176.31 1weo h TYR 52 N -1.23 -0.38 -1.38 4.33 3.20 -1.82 0.14 116.97 119.84 1weo h TYR 52 Ca -0.12 0.05 0.46 0.00 3.14 0.00 0.00 58.73 62.25 1weo h TYR 52 Cb 0.95 0.24 -0.13 0.00 1.54 0.00 0.00 36.73 39.33 1weo h TYR 52 CO -0.02 -0.25 0.90 1.49 -1.64 0.00 0.00 178.16 178.63 1weo h GLU 53 N -0.05 0.05 0.06 1.82 4.57 -1.43 0.76 114.58 120.35 1weo h GLU 53 Ca 0.23 -0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 58.08 1weo h GLU 53 Cb 0.41 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 1weo h GLU 53 CO -0.53 0.03 -1.85 0.54 -1.18 0.00 0.00 179.01 176.02 1weo n ARG 54 N -4.67 0.70 0.03 1.92 1.74 0.29 -0.13 116.66 116.54 1weo n ARG 54 Ca 0.39 0.28 -0.02 0.00 -0.77 0.00 0.00 57.85 57.73 1weo n ARG 54 Cb 1.52 -1.75 -0.01 0.00 -1.02 0.00 0.00 32.46 31.19 1weo n ARG 54 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1weo h ARG 55 N 0.04 -0.09 0.00 5.56 2.43 0.25 -3.40 114.38 119.17 1weo h ARG 55 Ca -0.35 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 1weo h ARG 55 Cb 2.03 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.60 1weo h ARG 55 CO 0.09 -0.06 -0.50 0.39 -1.51 0.00 0.00 179.97 178.38 1weo n GLU 56 N -2.48 3.62 0.00 0.20 -0.58 -0.55 -4.89 120.64 115.97 1weo n GLU 56 Ca -0.01 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1weo n GLU 56 Cb 0.04 -0.76 0.00 0.00 -0.57 0.00 0.00 31.44 30.15 1weo n GLU 56 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1weo n GLY 57 N 1.69 -3.29 0.00 0.62 0.00 -0.75 -4.93 105.19 98.54 1weo n GLY 57 Ca 0.00 -0.90 0.08 0.00 0.00 0.00 0.00 46.02 45.20 1weo n GLY 57 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1weo n THR 58 N 0.00 0.00 -3.09 2.61 -2.24 -0.33 -4.85 114.28 106.38 1weo n THR 58 Ca 0.00 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.45 1weo n THR 58 Cb 0.00 0.70 0.04 0.00 -2.10 0.00 0.00 70.33 68.98 1weo n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1weo n GLN 59 N -1.62 -4.33 -3.65 -0.78 6.02 0.81 -4.98 117.38 108.85 1weo n GLN 59 Ca 0.01 0.45 -0.05 0.00 -0.01 0.00 0.00 57.00 57.40 1weo n GLN 59 Cb 0.32 -4.34 -0.06 0.00 1.02 0.00 0.00 30.24 27.18 1weo n GLN 59 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1weo s ASN 60 N -3.18 -0.99 -0.24 1.08 0.01 -1.26 -4.50 114.94 105.85 1weo s ASN 60 Ca 0.32 1.51 -0.42 0.00 -0.71 0.00 0.00 52.86 53.55 1weo s ASN 60 Cb -0.14 1.67 -0.18 0.00 0.41 0.00 0.00 41.25 43.00 1weo s ASN 60 CO 0.40 -0.23 1.48 0.00 -1.51 0.00 0.00 177.10 177.23 1weo n PRO 62 N 3.56 0.49 -0.04 0.00 -0.04 -1.26 0.24 135.00 137.95 1weo n PRO 62 Ca 0.25 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.65 1weo n PRO 62 Cb 0.06 -1.34 -0.03 0.00 -0.04 0.00 0.00 33.50 32.15 1weo n PRO 62 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1weo n GLN 63 N -0.84 0.17 -0.00 0.54 7.27 -1.26 -4.83 117.38 118.42 1weo n GLN 63 Ca 0.08 0.05 0.01 0.00 0.07 0.00 0.00 57.00 57.21 1weo n GLN 63 Cb 0.04 -1.01 -0.02 0.00 2.41 0.00 0.00 30.24 31.66 1weo n GLN 63 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1weo n LYS 65 N -1.69 -6.68 -3.44 0.00 4.01 0.67 -4.90 118.16 106.13 1weo n LYS 65 Ca -0.01 0.74 -0.28 0.00 -0.51 0.00 0.00 58.31 58.25 1weo n LYS 65 Cb 0.17 -5.68 -0.03 0.00 -0.51 0.00 0.00 35.03 28.98 1weo n LYS 65 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1weo s THR 66 N -3.37 5.09 0.12 -0.18 2.01 -1.26 -4.66 115.64 113.39 1weo s THR 66 Ca 0.44 -0.13 -0.35 0.00 0.31 0.00 0.00 61.69 61.95 1weo s THR 66 Cb -0.20 -3.75 -0.16 0.00 0.01 0.00 0.00 72.50 68.40 1weo s THR 66 CO 0.77 -0.31 1.36 -2.11 -0.69 0.00 0.00 174.62 173.64 1weo n ARG 67 N -0.96 1.36 -1.56 4.92 1.85 -1.26 -3.97 116.66 117.03 1weo n ARG 67 Ca -0.03 0.49 -0.15 0.00 -1.00 0.00 0.00 57.85 57.16 1weo n ARG 67 Cb 0.54 -2.13 0.09 0.00 -1.05 0.00 0.00 32.46 29.91 1weo n ARG 67 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1weo n TYR 68 N 2.50 -3.43 -3.80 2.89 4.01 -1.26 -5.01 117.16 113.05 1weo n TYR 68 Ca 0.17 -0.94 -0.13 0.00 -0.16 0.00 0.00 57.90 56.85 1weo n TYR 68 Cb 0.22 -0.51 -0.11 0.00 -0.31 0.00 0.00 39.34 38.63 1weo n TYR 68 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1weo s LYS 69 N -4.29 0.31 -0.27 -0.72 0.00 -1.26 -5.10 119.74 108.41 1weo s LYS 69 Ca 0.42 0.23 -0.28 0.00 0.00 0.00 0.00 55.97 56.33 1weo s LYS 69 Cb -0.02 0.15 -0.03 0.00 0.00 0.00 0.00 37.83 37.93 1weo s LYS 69 CO 0.28 -0.05 1.90 0.50 0.00 0.00 0.00 175.35 177.99 1weo s ARG 70 N -0.09 3.37 0.48 1.78 3.52 -1.26 -4.98 118.95 121.77 1weo s ARG 70 Ca -0.02 1.69 -0.05 0.00 -0.13 0.00 0.00 55.73 57.22 1weo s ARG 70 Cb -0.02 -4.22 0.10 0.00 -1.56 0.00 0.00 34.95 29.24 1weo s ARG 70 CO 0.01 -1.81 0.65 1.28 -0.81 0.00 0.00 175.30 174.61 1weo n LEU 71 N 10.32 0.00 -0.25 -0.88 4.77 -1.25 -4.98 117.00 124.73 1weo n LEU 71 Ca 0.24 -1.01 -0.05 0.00 -0.03 0.00 0.00 56.01 55.17 1weo n LEU 71 Cb 0.46 -0.46 0.11 0.00 -2.33 0.00 0.00 43.42 41.19 1weo n LEU 71 CO 0.67 -0.90 1.04 0.08 -1.33 0.00 0.00 177.39 176.96 1weo h ARG 72 N 0.00 1.09 0.00 3.23 -0.00 -2.04 -3.33 114.38 113.33 1weo h ARG 72 Ca -0.21 -0.19 -0.41 0.00 -0.00 0.00 0.00 59.98 59.16 1weo h ARG 72 Cb 0.68 -0.18 -0.06 0.00 -0.00 0.00 0.00 29.97 30.41 1weo h ARG 72 CO 0.19 0.89 -2.25 0.41 -0.00 0.00 0.00 179.97 179.21 1weo n GLY 73 N -0.91 -0.55 3.41 0.08 0.00 -1.26 -4.90 105.19 101.06 1weo n GLY 73 Ca 0.06 -0.08 -0.49 0.00 0.00 0.00 0.00 46.02 45.52 1weo n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1weo n SER 74 N -4.29 0.96 -4.77 1.61 7.64 -1.25 -4.87 113.62 108.64 1weo n SER 74 Ca -0.49 0.33 -0.35 0.00 1.01 0.00 0.00 58.87 59.37 1weo n SER 74 Cb 0.84 -1.03 0.01 0.00 -1.01 0.00 0.00 64.21 63.01 1weo n SER 74 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1weo s PRO 75 N 7.40 3.29 0.50 1.43 0.04 -1.26 -3.96 135.00 142.43 1weo s PRO 75 Ca 1.22 1.58 -0.22 0.00 0.04 0.00 0.00 61.00 63.62 1weo s PRO 75 Cb -1.17 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 31.29 1weo s PRO 75 CO 0.53 -0.90 1.08 -2.13 0.04 0.00 0.00 177.00 175.62 1weo n ARG 76 N -1.44 1.34 -3.35 4.56 0.63 -1.26 -4.84 116.66 112.30 1weo n ARG 76 Ca 0.11 0.49 -0.14 0.00 -0.92 0.00 0.00 57.85 57.40 1weo n ARG 76 Cb 0.51 -2.21 -0.04 0.00 0.45 0.00 0.00 32.46 31.17 1weo n ARG 76 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 1weo n VAL 77 N -0.92 0.00 -0.61 5.15 0.24 -1.26 -5.00 118.33 115.93 1weo n VAL 77 Ca 0.10 -1.38 -0.03 0.00 -2.04 0.00 0.00 64.34 60.99 1weo n VAL 77 Cb 0.43 0.56 -0.02 0.00 -1.47 0.00 0.00 33.84 33.34 1weo n VAL 77 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1weo n GLU 78 N -0.48 1.21 0.00 7.34 -0.58 -1.26 -3.42 120.64 123.45 1weo n GLU 78 Ca -0.01 -0.29 0.00 0.00 -0.42 0.00 0.00 57.16 56.44 1weo n GLU 78 Cb 0.35 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 30.04 1weo n GLU 78 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1weo n GLY 79 N 1.50 0.00 0.27 0.62 0.00 -1.26 -4.86 105.19 101.46 1weo n GLY 79 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1weo n GLY 79 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1weo h ASP 80 N 0.00 0.88 -3.12 1.61 3.32 -1.98 -3.44 116.42 113.69 1weo h ASP 80 Ca 0.00 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1weo h ASP 80 Cb 0.14 -0.23 -0.21 0.00 0.22 0.00 0.00 39.33 39.24 1weo h ASP 80 CO 0.00 0.91 0.00 -0.70 -1.72 0.00 0.00 179.24 177.74 1weo s GLU 81 N -5.20 0.70 0.65 3.56 2.56 -1.26 -5.11 118.70 114.59 1weo s GLU 81 Ca -0.12 1.17 -0.11 0.00 0.00 0.00 0.00 54.97 55.91 1weo s GLU 81 Cb 0.12 0.15 -0.02 0.00 2.00 0.00 0.00 34.13 36.39 1weo s GLU 81 CO 0.82 -0.15 1.05 0.34 -0.56 0.00 0.00 175.26 176.76 1weo s ASP 82 N 1.49 5.92 0.31 -1.70 -1.08 -1.26 -4.84 116.67 115.51 1weo s ASP 82 Ca -0.09 1.39 0.03 0.00 -0.52 0.00 0.00 52.55 53.36 1weo s ASP 82 Cb -0.05 -2.35 -0.04 0.00 -1.46 0.00 0.00 42.92 39.02 1weo s ASP 82 CO -0.17 -1.07 0.16 -1.83 0.52 0.00 0.00 175.17 172.78 1weo s GLU 83 N -5.20 1.61 -0.53 4.34 -1.05 -1.26 -5.12 118.70 111.49 1weo s GLU 83 Ca 0.56 -1.92 -0.11 0.00 -0.15 0.00 0.00 54.97 53.35 1weo s GLU 83 Cb -0.11 -0.09 0.13 0.00 -0.44 0.00 0.00 34.13 33.62 1weo s GLU 83 CO 0.54 -0.46 0.43 -1.83 0.95 0.00 0.00 175.26 174.88 1weo s GLU 84 N -3.80 2.71 0.26 -4.83 -1.05 -1.26 -5.04 118.70 105.69 1weo s GLU 84 Ca 0.36 -1.85 0.02 0.00 -0.15 0.00 0.00 54.97 53.34 1weo s GLU 84 Cb 0.05 -4.06 -0.04 0.00 -0.44 0.00 0.00 34.13 29.64 1weo s GLU 84 CO 0.18 -1.24 0.13 0.16 0.95 0.00 0.00 175.26 175.44 1weo s ASP 85 N 2.76 1.07 -0.09 0.83 1.47 -1.26 -5.09 116.67 116.37 1weo s ASP 85 Ca 0.07 -1.46 -0.02 0.00 1.18 0.00 0.00 52.55 52.32 1weo s ASP 85 Cb -0.26 0.31 -0.05 0.00 -0.34 0.00 0.00 42.92 42.59 1weo s ASP 85 CO -0.01 -0.83 -0.10 -0.38 0.68 0.00 0.00 175.17 174.54 1weo n ILE 86 N -0.46 0.51 -1.55 2.11 5.41 -1.26 -5.03 119.36 119.08 1weo n ILE 86 Ca 0.01 -0.16 -0.42 0.00 1.00 0.00 0.00 62.75 63.18 1weo n ILE 86 Cb 0.66 -1.23 0.01 0.00 -0.71 0.00 0.00 39.64 38.36 1weo n ILE 86 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1weo n ASP 87 N -3.10 0.54 -3.58 4.38 2.03 -1.26 -5.00 116.55 110.57 1weo n ASP 87 Ca -0.17 1.01 -0.13 0.00 0.52 0.00 0.00 54.79 56.02 1weo n ASP 87 Cb 0.65 -1.26 -0.06 0.00 -0.72 0.00 0.00 41.12 39.72 1weo n ASP 87 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1weo s SER 88 N -0.80 -0.53 -0.44 1.67 1.04 -1.26 -5.10 113.70 108.28 1weo s SER 88 Ca 0.63 0.74 0.05 0.00 0.48 0.00 0.00 55.95 57.85 1weo s SER 88 Cb -0.60 0.66 0.30 0.00 0.10 0.00 0.00 66.02 66.48 1weo s SER 88 CO 0.57 -0.37 1.11 0.61 0.98 0.00 0.00 173.24 176.14 1weo n GLY 89 N 1.37 -0.09 3.56 7.32 0.00 -1.26 -5.09 105.19 111.00 1weo n GLY 89 Ca -0.14 0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 1weo n GLY 89 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1weo s PRO 90 N 0.34 2.56 -0.20 1.61 0.04 -1.26 -4.86 135.00 133.23 1weo s PRO 90 Ca 0.25 -0.22 -0.29 0.00 0.04 0.00 0.00 61.00 60.78 1weo s PRO 90 Cb 0.27 -5.01 0.14 0.00 0.04 0.00 0.00 34.50 29.93 1weo s PRO 90 CO -0.13 -3.32 1.06 0.45 0.04 0.00 0.00 177.00 175.10 1weo s SER 91 N 8.03 -0.34 0.03 6.66 0.15 -1.26 -5.09 113.70 121.88 1weo s SER 91 Ca 0.70 0.44 -0.02 0.00 0.70 0.00 0.00 55.95 57.77 1weo s SER 91 Cb -0.07 0.37 -0.01 0.00 -1.71 0.00 0.00 66.02 64.60 1weo s SER 91 CO 0.01 -0.26 -0.04 -1.20 1.20 0.00 0.00 173.24 172.95 1weo n SER 92 N 1.03 0.91 0.00 5.45 7.64 -1.26 -5.31 113.62 122.08 1weo n SER 92 Ca -0.10 0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1weo n SER 92 Cb 0.58 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1weo n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64