#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1weo s SER 2 N 0.00 -0.10 0.39 1.61 0.01 -1.26 -5.19 113.70 109.15 1weo s SER 2 Ca 0.00 -0.75 0.04 0.00 1.31 0.00 0.00 55.95 56.54 1weo s SER 2 Cb 0.00 0.67 -0.04 0.00 0.21 0.00 0.00 66.02 66.86 1weo s SER 2 CO 0.00 -1.29 0.07 -0.55 0.41 0.00 0.00 173.24 171.88 1weo s SER 3 N -3.07 2.86 0.07 2.44 0.15 -1.26 -5.17 113.70 109.73 1weo s SER 3 Ca 0.15 -1.52 -0.05 0.00 0.70 0.00 0.00 55.95 55.23 1weo s SER 3 Cb -0.04 0.18 0.02 0.00 -1.71 0.00 0.00 66.02 64.47 1weo s SER 3 CO 0.07 -0.74 0.25 0.61 1.20 0.00 0.00 173.24 174.63 1weo n GLY 4 N -0.86 1.37 2.89 9.45 0.00 -1.26 -5.17 105.19 111.60 1weo n GLY 4 Ca -0.06 -1.02 -0.16 0.00 0.00 0.00 0.00 46.02 44.78 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 -1.62 0.44 -0.63 1.61 1.04 -1.26 -5.09 113.70 108.19 1weo s SER 5 Ca 0.05 -0.05 -0.27 0.00 0.48 0.00 0.00 55.95 56.16 1weo s SER 5 Cb -0.01 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 65.96 1weo s SER 5 CO 0.02 -0.01 1.79 -0.44 0.98 0.00 0.00 173.24 175.58 1weo s SER 6 N 0.36 5.37 0.89 7.02 0.01 -1.26 -4.98 113.70 121.12 1weo s SER 6 Ca -0.03 0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.45 1weo s SER 6 Cb -0.06 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.63 1weo s SER 6 CO -0.01 -2.32 0.00 0.61 0.41 0.00 0.00 173.24 171.93 1weo n GLY 7 N 5.68 -2.46 3.66 3.44 0.00 -1.26 -4.92 105.19 109.33 1weo n GLY 7 Ca 0.19 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 1weo n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1weo s PRO 8 N -2.68 4.20 0.24 1.61 0.04 -1.26 -5.01 135.00 132.14 1weo s PRO 8 Ca 0.00 2.01 -0.09 0.00 0.04 0.00 0.00 61.00 62.96 1weo s PRO 8 Cb 0.00 -3.91 -0.07 0.00 0.04 0.00 0.00 34.50 30.56 1weo s PRO 8 CO 0.00 -0.80 0.55 0.15 0.04 0.00 0.00 177.00 176.94 1weo s LYS 9 N 3.86 3.76 0.11 4.56 3.01 -1.26 -5.05 119.74 128.73 1weo s LYS 9 Ca 0.67 0.22 -0.31 0.00 -1.01 0.00 0.00 55.97 55.54 1weo s LYS 9 Cb -0.29 -2.64 -0.08 0.00 -1.01 0.00 0.00 37.83 33.81 1weo s LYS 9 CO 0.24 0.29 1.36 -1.25 0.51 0.00 0.00 175.35 176.50 1weo s PRO 10 N -2.99 4.34 0.41 -1.68 0.04 -1.26 -4.96 135.00 128.89 1weo s PRO 10 Ca 0.47 2.03 -0.23 0.00 0.04 0.00 0.00 61.00 63.31 1weo s PRO 10 Cb -0.11 -3.26 -0.12 0.00 0.04 0.00 0.00 34.50 31.05 1weo s PRO 10 CO 0.23 -0.40 0.68 -0.11 0.04 0.00 0.00 177.00 177.44 1weo n LEU 11 N 3.87 0.63 -4.60 -3.56 7.94 -1.26 -4.89 117.00 115.14 1weo n LEU 11 Ca 0.11 0.96 -0.42 0.00 -1.11 0.00 0.00 56.01 55.54 1weo n LEU 11 Cb 0.43 -1.17 -0.04 0.00 0.53 0.00 0.00 43.42 43.16 1weo n LEU 11 CO 0.58 -2.49 0.66 -0.54 -1.11 0.00 0.00 177.39 174.49 1weo s LYS 12 N -1.66 3.83 -0.12 1.96 3.01 -1.26 -5.04 119.74 120.46 1weo s LYS 12 Ca 0.63 0.48 -0.10 0.00 -1.01 0.00 0.00 55.97 55.97 1weo s LYS 12 Cb -0.61 -3.79 -0.05 0.00 -1.01 0.00 0.00 37.83 32.37 1weo s LYS 12 CO 0.58 -0.86 0.21 1.21 0.51 0.00 0.00 175.35 176.99 1weo s ASN 13 N 1.81 6.43 -1.53 2.83 2.47 -1.26 -4.33 114.94 121.37 1weo s ASN 13 Ca 0.34 0.51 -0.14 0.00 0.42 0.00 0.00 52.86 54.00 1weo s ASN 13 Cb -0.13 -2.12 0.09 0.00 -1.45 0.00 0.00 41.25 37.64 1weo s ASN 13 CO 0.17 0.30 0.90 0.18 -3.72 0.00 0.00 177.10 174.93 1weo n LEU 14 N 2.51 -2.34 0.04 3.21 4.77 -1.26 -4.88 117.00 119.05 1weo n LEU 14 Ca -0.17 -0.74 -0.13 0.00 -0.03 0.00 0.00 56.01 54.94 1weo n LEU 14 Cb 0.53 -2.47 -0.09 0.00 -2.33 0.00 0.00 43.42 39.06 1weo n LEU 14 CO 0.35 0.41 0.66 -0.78 -1.33 0.00 0.00 177.39 176.70 1weo h ASP 15 N -1.87 -0.08 0.00 -1.43 1.82 -2.01 -3.48 116.42 109.37 1weo h ASP 15 Ca -0.56 -0.31 0.00 0.00 -0.39 0.00 0.00 57.03 55.77 1weo h ASP 15 Cb 1.37 0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.40 1weo h ASP 15 CO 0.67 0.27 0.00 0.61 -1.61 0.00 0.00 179.24 179.18 1weo n GLY 16 N -0.18 4.29 0.62 -0.78 0.00 -1.26 -4.96 105.19 102.92 1weo n GLY 16 Ca -0.08 -0.89 0.48 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.01 -1.64 1.61 1.13 -1.26 -4.35 117.38 112.86 1weo n GLN 17 Ca 0.00 1.13 -0.46 0.00 -1.94 0.00 0.00 57.00 55.73 1weo n GLN 17 Cb 0.00 -2.46 -0.04 0.00 0.11 0.00 0.00 30.24 27.84 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 -4.17 2.23 -1.25 1.08 3.01 -1.26 -3.58 117.46 113.52 1weo n PHE 18 Ca 0.43 -0.09 -0.38 0.00 1.01 0.00 0.00 57.45 58.42 1weo n PHE 18 Cb 1.85 -2.70 0.03 0.00 -0.01 0.00 0.00 39.48 38.65 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 0.93 0.53 -0.20 0.00 -0.58 -1.13 -3.25 120.64 116.93 1weo n GLU 20 Ca 0.08 0.15 -0.10 0.00 -0.42 0.00 0.00 57.16 56.86 1weo n GLU 20 Cb 0.49 -1.40 -0.08 0.00 -0.57 0.00 0.00 31.44 29.88 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 -0.23 0.00 0.00 -3.67 2.04 -1.93 -3.32 117.51 110.40 1weo h ILE 21 Ca -0.51 0.00 -0.41 0.00 1.00 0.00 0.00 64.86 64.94 1weo h ILE 21 Cb 1.68 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.70 1weo h ILE 21 CO -0.15 0.00 -2.42 0.00 0.00 0.00 0.00 178.15 175.57 1weo n GLY 23 N 1.73 3.92 2.61 0.00 0.00 -1.20 -5.09 105.19 107.15 1weo n GLY 23 Ca -0.48 -0.96 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 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 -3.06 -4.65 1.61 8.00 -1.26 -3.65 116.55 113.54 1weo n ASP 24 Ca 0.00 0.51 -0.43 0.00 0.71 0.00 0.00 54.79 55.58 1weo n ASP 24 Cb 0.00 -0.68 -0.02 0.00 -0.02 0.00 0.00 41.12 40.40 1weo n ASP 24 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1weo s GLN 25 N -0.86 4.11 -0.28 -1.24 0.74 -1.26 -1.05 119.66 119.82 1weo s GLN 25 Ca 0.45 1.32 -0.32 0.00 0.05 0.00 0.00 55.36 56.86 1weo s GLN 25 Cb -0.39 -3.76 -0.08 0.00 1.10 0.00 0.00 33.01 29.88 1weo s GLN 25 CO 0.54 -0.86 2.20 -0.89 -0.55 0.00 0.00 175.29 175.73 1weo n ILE 26 N 5.73 0.27 0.00 -2.34 5.41 -1.23 -4.85 119.36 122.34 1weo n ILE 26 Ca 0.13 -0.35 0.00 0.00 1.00 0.00 0.00 62.75 63.53 1weo n ILE 26 Cb 0.46 -2.08 0.00 0.00 -0.71 0.00 0.00 39.64 37.32 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 6.15 -2.73 3.91 7.39 0.00 -1.26 -4.76 105.19 113.88 1weo n GLY 27 Ca 0.36 -1.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.08 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 3.33 0.00 0.99 1.43 -1.26 -3.66 118.68 119.52 1weo s LEU 28 Ca 0.00 -0.76 -0.01 0.00 -1.03 0.00 0.00 54.13 52.32 1weo s LEU 28 Cb 0.00 -2.01 0.08 0.00 0.03 0.00 0.00 46.19 44.29 1weo s LEU 28 CO 0.00 -0.77 0.53 0.35 0.23 0.00 0.00 176.35 176.70 1weo n THR 29 N -1.66 0.00 -0.07 5.49 -2.24 0.23 -4.73 114.28 111.31 1weo n THR 29 Ca 0.04 -0.76 0.04 0.00 -2.27 0.00 0.00 64.05 61.11 1weo n THR 29 Cb 0.62 -1.22 0.39 0.00 -2.10 0.00 0.00 70.33 68.02 1weo n THR 29 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1weo h VAL 30 N -0.62 1.09 0.11 2.28 3.04 -1.88 -2.52 116.25 117.76 1weo h VAL 30 Ca -0.18 -0.22 -0.31 0.00 -1.01 0.00 0.00 66.70 64.98 1weo h VAL 30 Cb 0.62 0.39 -0.01 0.00 -2.01 0.00 0.00 31.29 30.28 1weo h VAL 30 CO 0.18 0.12 -1.57 1.05 -1.01 0.00 0.00 177.57 176.34 1weo h GLU 31 N 0.65 0.24 0.00 4.17 4.11 -1.97 -3.48 114.58 118.29 1weo h GLU 31 Ca 0.20 -0.41 0.00 0.00 0.07 0.00 0.00 59.36 59.22 1weo h GLU 31 Cb 0.02 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1weo h GLU 31 CO -0.05 1.09 0.00 0.41 0.07 0.00 0.00 179.01 180.53 1weo n GLY 32 N 1.68 1.99 3.50 1.06 0.00 -0.95 -5.13 105.19 107.34 1weo n GLY 32 Ca -0.17 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1weo n GLY 32 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1weo n ASP 33 N 0.00 -1.18 -4.76 1.61 8.00 -1.26 -3.97 116.55 114.98 1weo n ASP 33 Ca 0.00 0.21 -0.41 0.00 0.71 0.00 0.00 54.79 55.30 1weo n ASP 33 Cb 0.00 -1.28 -0.01 0.00 -0.02 0.00 0.00 41.12 39.81 1weo n ASP 33 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1weo s LEU 34 N -4.28 4.34 -0.89 0.64 1.98 -1.26 -0.60 118.68 118.61 1weo s LEU 34 Ca 0.63 2.98 -0.25 0.00 -2.89 0.00 0.00 54.13 54.60 1weo s LEU 34 Cb -0.21 -3.65 0.02 0.00 0.66 0.00 0.00 46.19 43.01 1weo s LEU 34 CO 0.63 -0.87 1.52 0.12 -1.89 0.00 0.00 176.35 175.87 1weo s PHE 35 N -0.57 2.26 -1.25 5.38 5.36 -1.24 -4.73 117.98 123.19 1weo s PHE 35 Ca 0.58 -0.23 -0.15 0.00 -0.96 0.00 0.00 56.93 56.16 1weo s PHE 35 Cb -0.47 -4.52 0.14 0.00 -0.34 0.00 0.00 43.02 37.83 1weo s PHE 35 CO 0.55 -1.98 1.57 0.28 -1.46 0.00 0.00 175.22 174.18 1weo n VAL 36 N 6.94 4.14 -0.17 3.12 0.31 -1.26 -4.78 118.33 126.63 1weo n VAL 36 Ca 0.25 -4.48 -0.12 0.00 -0.01 0.00 0.00 64.34 59.98 1weo n VAL 36 Cb 0.50 -2.43 -0.08 0.00 -0.91 0.00 0.00 33.84 30.92 1weo n VAL 36 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1weo h ALA 37 N 7.18 -0.67 -3.80 3.52 0.00 -1.82 -3.40 119.26 120.27 1weo h ALA 37 Ca 0.37 0.03 -0.68 0.00 0.00 0.00 0.00 54.91 54.63 1weo h ALA 37 Cb 0.85 1.10 -0.24 0.00 0.00 0.00 0.00 17.79 19.51 1weo h ALA 37 CO 1.35 -1.00 -0.76 0.00 0.00 0.00 0.00 179.25 178.84 1weo n ASN 39 N 2.65 3.12 -0.26 0.00 2.85 -1.26 -3.67 115.26 118.69 1weo n ASN 39 Ca -0.17 -0.03 -0.12 0.00 -0.11 0.00 0.00 54.58 54.14 1weo n ASN 39 Cb 0.52 -0.14 -0.10 0.00 1.24 0.00 0.00 39.78 41.30 1weo n ASN 39 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1weo h GLU 40 N -0.03 -0.20 0.00 1.20 4.39 -1.98 -3.19 114.58 114.78 1weo h GLU 40 Ca -0.19 0.01 -0.36 0.00 0.34 0.00 0.00 59.36 59.16 1weo h GLU 40 Cb 1.29 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 29.91 1weo h GLU 40 CO -0.04 -0.13 -2.37 0.00 -1.16 0.00 0.00 179.01 175.31 1weo n GLY 42 N 1.99 1.71 3.66 0.00 0.00 -1.21 -5.05 105.19 106.29 1weo n GLY 42 Ca -0.36 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.00 2.15 0.01 1.61 5.36 -1.25 -4.91 117.98 118.94 1weo s PHE 43 Ca 0.00 0.35 -0.30 0.00 -0.96 0.00 0.00 56.93 56.02 1weo s PHE 43 Cb 0.00 -3.84 -0.06 0.00 -0.34 0.00 0.00 43.02 38.79 1weo s PHE 43 CO 0.00 -3.43 1.44 -1.25 -1.46 0.00 0.00 175.22 170.52 1weo s PRO 44 N 3.93 4.27 -0.20 10.12 0.04 -1.26 -3.32 135.00 148.58 1weo s PRO 44 Ca 0.70 2.02 -0.05 0.00 0.04 0.00 0.00 61.00 63.70 1weo s PRO 44 Cb -0.31 -3.58 0.10 0.00 0.04 0.00 0.00 34.50 30.75 1weo s PRO 44 CO 0.27 -0.60 0.38 0.00 0.04 0.00 0.00 177.00 177.09 1weo s ALA 45 N 2.44 -1.05 1.27 8.56 0.00 -1.26 -2.86 121.76 128.87 1weo s ALA 45 Ca 0.65 1.25 -0.19 0.00 0.00 0.00 0.00 51.96 53.67 1weo s ALA 45 Cb -0.33 -1.38 0.31 0.00 0.00 0.00 0.00 23.12 21.73 1weo s ALA 45 CO 0.27 -0.89 1.02 0.00 0.00 0.00 0.00 175.76 176.16 1weo h ARG 47 N -2.89 -0.41 -0.48 0.00 3.08 -1.96 -1.39 114.38 110.33 1weo h ARG 47 Ca -0.48 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1weo h ARG 47 Cb 1.32 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.47 1weo h ARG 47 CO 0.37 -0.21 0.00 -0.35 -1.07 0.00 0.00 179.97 178.71 1weo n PRO 48 N -5.23 0.49 0.00 0.04 -0.04 -1.26 -1.69 135.00 127.31 1weo n PRO 48 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1weo n PRO 48 Cb 0.22 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1weo n PRO 48 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1weo n TYR 50 N -1.57 0.90 -0.12 0.00 4.19 -0.56 -3.28 117.16 116.72 1weo n TYR 50 Ca 0.00 0.39 -0.05 0.00 3.31 0.00 0.00 57.90 61.55 1weo n TYR 50 Cb 0.24 -1.09 0.01 0.00 0.49 0.00 0.00 39.34 38.99 1weo n TYR 50 CO 0.00 0.00 0.00 0.93 0.91 0.00 0.00 176.86 178.70 1weo h GLU 51 N -0.99 -0.06 -0.02 2.98 5.08 -1.56 -2.18 114.58 117.83 1weo h GLU 51 Ca -0.39 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.97 1weo h GLU 51 Cb 1.35 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 1weo h GLU 51 CO -0.24 -0.04 0.01 -0.92 -1.00 0.00 0.00 179.01 176.82 1weo h TYR 52 N -0.06 0.02 -1.34 4.33 3.20 -1.77 -1.60 116.97 119.76 1weo h TYR 52 Ca 0.19 -0.00 0.40 0.00 3.14 0.00 0.00 58.73 62.46 1weo h TYR 52 Cb 0.36 -0.01 -0.09 0.00 1.54 0.00 0.00 36.73 38.53 1weo h TYR 52 CO -0.39 0.20 0.91 1.49 -1.64 0.00 0.00 178.16 178.73 1weo h GLU 53 N -0.16 0.11 0.00 1.82 4.57 -1.40 1.10 114.58 120.62 1weo h GLU 53 Ca 0.01 -0.01 -0.23 0.00 -1.18 0.00 0.00 59.36 57.95 1weo h GLU 53 Cb 0.19 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.71 1weo h GLU 53 CO -0.00 0.07 -1.38 0.00 -1.18 0.00 0.00 179.01 176.53 1weo h ARG 54 N 0.11 0.00 0.15 1.92 3.08 -1.06 -1.16 114.38 117.43 1weo h ARG 54 Ca 0.73 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.77 1weo h ARG 54 Cb 2.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.52 1weo h ARG 54 CO -0.22 0.54 -0.07 -0.09 -1.07 0.00 0.00 179.97 179.06 1weo h ARG 55 N 0.00 -0.19 0.00 0.04 1.12 0.22 -3.41 114.38 112.15 1weo h ARG 55 Ca -0.17 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.71 1weo h ARG 55 Cb 1.79 0.04 0.00 0.00 -0.01 0.00 0.00 29.97 31.80 1weo h ARG 55 CO 0.08 -0.13 -0.17 0.39 -3.11 0.00 0.00 179.97 177.03 1weo n GLU 56 N -2.71 5.88 0.00 0.20 -0.58 -0.55 -4.80 120.64 118.08 1weo n GLU 56 Ca -0.03 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 1weo n GLU 56 Cb 0.08 -0.62 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 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 1.16 -2.45 0.05 0.62 0.00 -0.71 -4.94 105.19 98.92 1weo n GLY 57 Ca 0.00 -1.14 0.11 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.19 0.24 -2.82 2.61 -2.24 -0.82 -4.84 114.28 106.21 1weo n THR 58 Ca 0.00 -0.49 -0.08 0.00 -2.27 0.00 0.00 64.05 61.21 1weo n THR 58 Cb 0.00 -0.09 0.03 0.00 -2.10 0.00 0.00 70.33 68.17 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 -2.38 -2.84 -3.71 -0.78 6.02 -0.52 -5.00 117.38 108.17 1weo n GLN 59 Ca -0.02 0.31 -0.10 0.00 -0.01 0.00 0.00 57.00 57.18 1weo n GLN 59 Cb 0.55 -3.75 -0.05 0.00 1.02 0.00 0.00 30.24 28.01 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 -3.20 -0.13 -0.16 1.08 0.01 -1.26 -4.03 114.94 107.24 1weo s ASN 60 Ca 0.17 -0.43 -0.23 0.00 -0.71 0.00 0.00 52.86 51.66 1weo s ASN 60 Cb -0.08 0.44 -0.02 0.00 0.41 0.00 0.00 41.25 42.00 1weo s ASN 60 CO 0.27 -0.83 0.72 0.00 -1.51 0.00 0.00 177.10 175.74 1weo n PRO 62 N 4.85 0.49 -0.04 0.00 -0.04 -1.26 0.23 135.00 139.23 1weo n PRO 62 Ca 0.01 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.40 1weo n PRO 62 Cb 0.50 -1.31 -0.03 0.00 -0.04 0.00 0.00 33.50 32.61 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 -0.81 0.19 -0.00 0.54 7.27 -1.26 -4.84 117.38 118.46 1weo n GLN 63 Ca 0.07 0.06 0.01 0.00 0.07 0.00 0.00 57.00 57.22 1weo n GLN 63 Cb 0.03 -0.97 -0.02 0.00 2.41 0.00 0.00 30.24 31.69 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 -1.67 -4.14 -4.05 0.00 4.01 0.62 -4.90 118.16 108.03 1weo n LYS 65 Ca -0.01 0.73 -0.22 0.00 -0.51 0.00 0.00 58.31 58.30 1weo n LYS 65 Cb 0.15 -5.41 -0.03 0.00 -0.51 0.00 0.00 35.03 29.23 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 -3.48 4.71 0.04 -0.18 2.01 -1.26 -4.70 115.64 112.78 1weo s THR 66 Ca 0.19 -1.25 -0.31 0.00 0.31 0.00 0.00 61.69 60.64 1weo s THR 66 Cb -0.04 -3.56 -0.10 0.00 0.01 0.00 0.00 72.50 68.81 1weo s THR 66 CO 0.78 -0.34 1.95 -2.11 -0.69 0.00 0.00 174.62 174.21 1weo n ARG 67 N -1.27 2.80 -1.54 4.92 1.85 -1.26 -3.93 116.66 118.22 1weo n ARG 67 Ca -0.08 1.02 -0.30 0.00 -1.00 0.00 0.00 57.85 57.49 1weo n ARG 67 Cb 0.58 -2.96 0.07 0.00 -1.05 0.00 0.00 32.46 29.10 1weo n ARG 67 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1weo s TYR 68 N 4.19 2.93 0.14 2.89 1.51 -1.26 -5.06 117.35 122.69 1weo s TYR 68 Ca 0.88 1.28 -0.00 0.00 -1.01 0.00 0.00 57.07 58.22 1weo s TYR 68 Cb -0.47 -3.02 -0.04 0.00 -0.11 0.00 0.00 41.96 38.32 1weo s TYR 68 CO 0.42 -1.56 0.04 -1.59 -1.11 0.00 0.00 175.55 171.75 1weo s LYS 69 N -5.10 0.96 -0.36 -0.62 0.00 -1.26 -5.11 119.74 108.26 1weo s LYS 69 Ca 0.60 -1.45 -0.29 0.00 0.00 0.00 0.00 55.97 54.83 1weo s LYS 69 Cb -0.14 0.10 -0.01 0.00 0.00 0.00 0.00 37.83 37.78 1weo s LYS 69 CO 0.55 -0.22 1.60 0.50 0.00 0.00 0.00 175.35 177.78 1weo s ARG 70 N -4.00 3.49 0.32 1.78 3.52 -1.26 -4.99 118.95 117.80 1weo s ARG 70 Ca 0.23 1.22 -0.02 0.00 -0.13 0.00 0.00 55.73 57.03 1weo s ARG 70 Cb 0.07 -4.10 0.07 0.00 -1.56 0.00 0.00 34.95 29.43 1weo s ARG 70 CO 0.02 -1.67 0.43 1.28 -0.81 0.00 0.00 175.30 174.55 1weo n LEU 71 N 9.42 0.00 -0.34 -0.88 4.77 -1.21 -4.96 117.00 123.80 1weo n LEU 71 Ca 0.20 -0.73 0.07 0.00 -0.03 0.00 0.00 56.01 55.52 1weo n LEU 71 Cb 0.47 -0.30 0.26 0.00 -2.33 0.00 0.00 43.42 41.52 1weo n LEU 71 CO 0.69 -0.75 1.24 0.03 -1.33 0.00 0.00 177.39 177.27 1weo h ARG 72 N 0.00 0.94 0.00 3.23 2.47 -1.99 -3.37 114.38 115.66 1weo h ARG 72 Ca -0.14 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.52 1weo h ARG 72 Cb 0.47 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.58 1weo h ARG 72 CO 0.13 0.62 0.00 0.41 0.56 0.00 0.00 179.97 181.69 1weo n GLY 73 N -1.37 -0.46 2.47 0.04 0.00 -1.26 -4.84 105.19 99.77 1weo n GLY 73 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1weo n GLY 73 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1weo n SER 74 N -2.07 0.12 -2.89 1.61 3.41 -1.26 -4.86 113.62 107.68 1weo n SER 74 Ca 0.00 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1weo n SER 74 Cb 0.00 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1weo n SER 74 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1weo n PRO 75 N 5.85 -0.26 -2.12 4.33 -0.04 -1.26 -3.31 135.00 138.20 1weo n PRO 75 Ca 0.47 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.54 1weo n PRO 75 Cb 0.03 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.48 1weo n PRO 75 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1weo s ARG 76 N -1.86 3.91 0.19 0.54 3.52 -1.26 -4.89 118.95 119.10 1weo s ARG 76 Ca 0.00 2.04 0.03 0.00 -0.13 0.00 0.00 55.73 57.67 1weo s ARG 76 Cb 0.00 -2.66 -0.01 0.00 -1.56 0.00 0.00 34.95 30.72 1weo s ARG 76 CO 0.00 -0.51 0.09 1.33 -0.81 0.00 0.00 175.30 175.41 1weo n VAL 77 N -0.03 0.00 -0.57 7.11 0.24 -1.26 -5.02 118.33 118.79 1weo n VAL 77 Ca 0.05 -1.19 -0.03 0.00 -2.04 0.00 0.00 64.34 61.13 1weo n VAL 77 Cb 0.45 0.48 -0.00 0.00 -1.47 0.00 0.00 33.84 33.30 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 -0.41 1.15 -0.97 7.34 -0.58 -1.26 -3.71 120.64 122.19 1weo n GLU 78 Ca -0.01 -0.24 0.04 0.00 -0.42 0.00 0.00 57.16 56.53 1weo n GLU 78 Cb 0.30 -1.12 0.06 0.00 -0.57 0.00 0.00 31.44 30.11 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 1.40 2.06 2.78 0.62 0.00 -1.26 -5.04 105.19 105.75 1weo n GLY 79 Ca 0.06 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 1weo n GLY 79 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1weo s ASP 80 N -2.11 0.88 0.04 1.61 -1.08 -1.24 -5.10 116.67 109.68 1weo s ASP 80 Ca 0.27 -0.02 0.02 0.00 -0.52 0.00 0.00 52.55 52.30 1weo s ASP 80 Cb 0.29 -0.27 -0.02 0.00 -1.46 0.00 0.00 42.92 41.46 1weo s ASP 80 CO -0.09 -0.15 -0.08 -0.70 0.52 0.00 0.00 175.17 174.66 1weo s GLU 81 N 1.48 0.54 0.37 4.34 2.56 -1.26 -5.04 118.70 121.69 1weo s GLU 81 Ca -0.03 -0.77 0.03 0.00 0.00 0.00 0.00 54.97 54.20 1weo s GLU 81 Cb -0.13 -0.32 -0.04 0.00 2.00 0.00 0.00 34.13 35.64 1weo s GLU 81 CO -0.03 0.06 0.10 -0.51 -0.56 0.00 0.00 175.26 174.32 1weo s ASP 82 N -1.60 2.54 -0.91 -1.70 1.01 -1.26 -5.08 116.67 109.67 1weo s ASP 82 Ca -0.09 -1.55 -0.23 0.00 0.71 0.00 0.00 52.55 51.39 1weo s ASP 82 Cb -0.10 0.28 0.07 0.00 1.01 0.00 0.00 42.92 44.18 1weo s ASP 82 CO 0.00 -0.80 1.29 -0.70 0.21 0.00 0.00 175.17 175.17 1weo s GLU 83 N -3.80 3.47 -0.17 8.23 2.12 -1.26 -4.95 118.70 122.34 1weo s GLU 83 Ca 0.29 -1.08 -0.02 0.00 0.36 0.00 0.00 54.97 54.52 1weo s GLU 83 Cb 0.05 -4.92 0.05 0.00 0.26 0.00 0.00 34.13 29.57 1weo s GLU 83 CO 0.15 -2.06 0.01 -1.21 -0.54 0.00 0.00 175.26 171.61 1weo s GLU 84 N 4.49 0.79 -0.94 4.30 0.41 -1.26 -5.07 118.70 121.42 1weo s GLU 84 Ca 0.38 -0.34 -0.06 0.00 -0.41 0.00 0.00 54.97 54.54 1weo s GLU 84 Cb -0.04 -1.87 0.24 0.00 -1.78 0.00 0.00 34.13 30.67 1weo s GLU 84 CO -0.03 -0.54 0.86 -0.51 -0.49 0.00 0.00 175.26 174.55 1weo s ASP 85 N 1.83 6.50 -0.33 -0.19 1.01 -1.26 -5.00 116.67 119.23 1weo s ASP 85 Ca 0.00 -3.46 0.01 0.00 0.71 0.00 0.00 52.55 49.81 1weo s ASP 85 Cb -0.16 -2.05 0.08 0.00 1.01 0.00 0.00 42.92 41.80 1weo s ASP 85 CO -0.07 -0.29 0.04 -0.63 0.21 0.00 0.00 175.17 174.42 1weo s ILE 86 N -1.00 2.65 -0.02 0.77 1.09 -1.26 -4.99 121.20 118.45 1weo s ILE 86 Ca 0.26 -1.89 -0.05 0.00 -1.10 0.00 0.00 60.65 57.87 1weo s ILE 86 Cb -0.10 -2.73 -0.24 0.00 -1.06 0.00 0.00 42.46 38.33 1weo s ILE 86 CO -0.09 -0.37 3.47 -0.67 -0.10 0.00 0.00 174.94 177.17 1weo n ASP 87 N 4.46 5.30 -3.57 3.58 2.03 -1.26 -4.78 116.55 122.30 1weo n ASP 87 Ca -0.06 -2.50 -0.17 0.00 0.52 0.00 0.00 54.79 52.58 1weo n ASP 87 Cb 0.42 -1.39 -0.07 0.00 -0.72 0.00 0.00 41.12 39.37 1weo n ASP 87 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1weo s SER 88 N 1.93 -0.55 0.00 1.67 0.01 -1.26 -5.11 113.70 110.40 1weo s SER 88 Ca 0.62 0.56 0.00 0.00 1.31 0.00 0.00 55.95 58.43 1weo s SER 88 Cb 0.30 0.49 0.00 0.00 0.21 0.00 0.00 66.02 67.02 1weo s SER 88 CO -0.01 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.67 1weo n GLY 89 N 0.96 -1.98 0.00 3.44 0.00 -1.26 -5.00 105.19 101.34 1weo n GLY 89 Ca -0.20 0.97 0.07 0.00 0.00 0.00 0.00 46.02 46.87 1weo n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1weo n PRO 90 N 0.00 0.26 0.01 1.61 -0.04 -1.26 -3.28 135.00 132.30 1weo n PRO 90 Ca 0.00 0.12 -0.12 0.00 -0.04 0.00 0.00 63.50 63.46 1weo n PRO 90 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 1weo n PRO 90 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1weo h SER 91 N 0.00 0.04 -6.63 3.54 4.64 -2.07 -3.45 113.55 109.62 1weo h SER 91 Ca 0.00 -0.14 -0.53 0.00 -0.47 0.00 0.00 61.79 60.64 1weo h SER 91 Cb 0.11 -0.01 -0.30 0.00 -0.31 0.00 0.00 62.40 61.90 1weo h SER 91 CO 0.00 0.17 -0.79 -0.24 -0.87 0.00 0.00 176.83 175.10 1weo n SER 92 N -5.00 -1.00 0.00 4.97 2.88 -1.21 -5.35 113.62 108.92 1weo n SER 92 Ca -0.07 -1.07 0.00 0.00 -1.33 0.00 0.00 58.87 56.40 1weo n SER 92 Cb 0.10 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.20 1weo n SER 92 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42