#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 1.25 -0.05 1.61 1.04 -1.26 -5.14 113.70 111.15 1weo s SER 2 Ca 0.00 -0.19 -0.09 0.00 0.48 0.00 0.00 55.95 56.14 1weo s SER 2 Cb 0.00 -0.49 0.02 0.00 0.10 0.00 0.00 66.02 65.65 1weo s SER 2 CO 0.00 0.02 0.23 -0.94 0.98 0.00 0.00 173.24 173.53 1weo s SER 3 N 0.54 -0.17 -0.46 7.02 1.04 -1.26 -5.12 113.70 115.30 1weo s SER 3 Ca -0.09 0.22 0.06 0.00 0.48 0.00 0.00 55.95 56.63 1weo s SER 3 Cb -0.12 0.38 0.18 0.00 0.10 0.00 0.00 66.02 66.56 1weo s SER 3 CO 0.01 -0.24 0.60 -0.83 0.98 0.00 0.00 173.24 173.76 1weo s GLY 4 N -0.57 -0.68 0.16 7.32 0.00 -1.26 -5.09 107.32 107.20 1weo s GLY 4 Ca -0.07 -0.72 -0.10 0.00 0.00 0.00 0.00 44.72 43.83 1weo s GLY 4 CO 0.01 3.28 0.31 -0.56 0.00 0.00 0.00 173.10 176.14 1weo s SER 5 N 1.00 -0.00 -0.28 1.64 0.01 -1.26 -5.10 113.70 109.70 1weo s SER 5 Ca 0.26 -0.76 -0.28 0.00 1.31 0.00 0.00 55.95 56.48 1weo s SER 5 Cb -0.02 0.44 -0.04 0.00 0.21 0.00 0.00 66.02 66.61 1weo s SER 5 CO -0.08 -0.89 2.10 -0.94 0.41 0.00 0.00 173.24 173.84 1weo s SER 6 N -2.93 5.50 -0.00 2.44 1.04 -1.26 -4.76 113.70 113.73 1weo s SER 6 Ca 0.14 1.60 -0.02 0.00 0.48 0.00 0.00 55.95 58.15 1weo s SER 6 Cb 0.03 -2.51 0.01 0.00 0.10 0.00 0.00 66.02 63.64 1weo s SER 6 CO -0.02 -1.97 0.08 0.61 0.98 0.00 0.00 173.24 172.92 1weo n GLY 7 N 5.68 0.54 0.00 7.32 0.00 -1.26 -4.98 105.19 112.49 1weo n GLY 7 Ca 0.28 -0.84 0.05 0.00 0.00 0.00 0.00 46.02 45.51 1weo n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1weo n PRO 8 N -0.06 0.49 -1.51 1.61 -0.04 -1.26 -4.87 135.00 129.36 1weo n PRO 8 Ca 0.00 0.00 -0.47 0.00 -0.04 0.00 0.00 63.50 62.99 1weo n PRO 8 Cb 0.04 -1.29 -0.03 0.00 -0.04 0.00 0.00 33.50 32.18 1weo n PRO 8 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1weo n LYS 9 N -0.79 0.71 -1.21 0.54 4.76 -1.26 -4.93 118.16 115.98 1weo n LYS 9 Ca 0.07 0.25 -0.30 0.00 -2.87 0.00 0.00 58.31 55.46 1weo n LYS 9 Cb 0.03 -1.50 0.13 0.00 -1.84 0.00 0.00 35.03 31.86 1weo n LYS 9 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1weo s PRO 10 N -1.09 1.41 -0.00 1.97 0.04 -1.26 -4.91 135.00 131.15 1weo s PRO 10 Ca 0.64 0.87 -0.35 0.00 0.04 0.00 0.00 61.00 62.20 1weo s PRO 10 Cb -0.84 -1.82 -0.14 0.00 0.04 0.00 0.00 34.50 31.74 1weo s PRO 10 CO 0.57 -2.15 1.68 -0.11 0.04 0.00 0.00 177.00 177.03 1weo n LEU 11 N -3.83 2.91 -0.07 -3.56 -0.00 -1.26 -4.88 117.00 106.32 1weo n LEU 11 Ca 0.07 1.05 -0.14 0.00 -0.00 0.00 0.00 56.01 56.99 1weo n LEU 11 Cb 0.55 -1.33 -0.05 0.00 -0.00 0.00 0.00 43.42 42.59 1weo n LEU 11 CO 0.55 -0.34 -0.85 0.29 -0.00 0.00 0.00 177.39 177.04 1weo n LYS 12 N 4.72 0.34 -1.39 1.96 4.76 -1.26 -5.00 118.16 122.30 1weo n LYS 12 Ca 0.21 0.14 -0.54 0.00 -2.87 0.00 0.00 58.31 55.25 1weo n LYS 12 Cb 0.25 -1.07 -0.08 0.00 -1.84 0.00 0.00 35.03 32.29 1weo n LYS 12 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1weo n ASN 13 N -3.84 0.93 -2.11 4.39 4.13 -1.26 -4.84 115.26 112.66 1weo n ASN 13 Ca -0.25 0.95 -0.24 0.00 1.68 0.00 0.00 54.58 56.72 1weo n ASN 13 Cb 0.59 -0.70 0.02 0.00 -1.54 0.00 0.00 39.78 38.15 1weo n ASN 13 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1weo n LEU 14 N 3.11 4.84 0.10 3.41 4.77 -1.26 -4.86 117.00 127.11 1weo n LEU 14 Ca 0.24 -4.79 -0.15 0.00 -0.03 0.00 0.00 56.01 51.28 1weo n LEU 14 Cb -0.04 -0.34 -0.08 0.00 -2.33 0.00 0.00 43.42 40.62 1weo n LEU 14 CO 0.71 2.11 0.57 0.44 -1.33 0.00 0.00 177.39 179.89 1weo h ASP 15 N 2.25 -1.34 0.00 -1.43 5.19 -2.01 -3.47 116.42 115.60 1weo h ASP 15 Ca 0.35 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.91 1weo h ASP 15 Cb 1.44 0.51 0.00 0.00 0.18 0.00 0.00 39.33 41.46 1weo h ASP 15 CO 0.76 -0.50 0.00 0.61 -3.12 0.00 0.00 179.24 176.99 1weo n GLY 16 N -1.47 3.82 0.57 2.75 0.00 -1.26 -4.96 105.19 104.64 1weo n GLY 16 Ca -0.07 -0.77 0.43 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.00 -1.80 1.61 6.02 -1.26 -4.31 117.38 117.63 1weo n GLN 17 Ca 0.00 0.91 -0.42 0.00 -0.01 0.00 0.00 57.00 57.47 1weo n GLN 17 Cb 0.00 -2.06 -0.03 0.00 1.02 0.00 0.00 30.24 29.17 1weo n GLN 17 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1weo s PHE 18 N -4.56 2.43 0.74 1.08 0.40 -1.26 -3.24 117.98 113.56 1weo s PHE 18 Ca -0.04 0.20 -0.16 0.00 -0.60 0.00 0.00 56.93 56.33 1weo s PHE 18 Cb 0.22 -4.08 -0.02 0.00 0.51 0.00 0.00 43.02 39.65 1weo s PHE 18 CO 0.73 -4.34 0.67 0.00 0.70 0.00 0.00 175.22 172.97 1weo n GLU 20 N -1.20 0.52 -0.01 0.00 -0.58 0.31 -3.42 120.64 116.26 1weo n GLU 20 Ca 0.11 0.11 -0.09 0.00 -0.42 0.00 0.00 57.16 56.87 1weo n GLU 20 Cb 0.50 -1.40 -0.06 0.00 -0.57 0.00 0.00 31.44 29.91 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 -3.35 117.51 110.60 1weo h ILE 21 Ca -0.45 0.00 -0.42 0.00 1.00 0.00 0.00 64.86 64.99 1weo h ILE 21 Cb 1.70 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.72 1weo h ILE 21 CO -0.07 0.00 -2.39 0.00 0.00 0.00 0.00 178.15 175.69 1weo n GLY 23 N 1.61 3.87 2.57 0.00 0.00 -1.22 -5.08 105.19 106.93 1weo n GLY 23 Ca -0.49 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.13 -4.61 1.61 8.00 -1.26 -3.59 116.55 114.57 1weo n ASP 24 Ca 0.00 0.65 -0.43 0.00 0.71 0.00 0.00 54.79 55.72 1weo n ASP 24 Cb 0.00 -0.69 -0.02 0.00 -0.02 0.00 0.00 41.12 40.39 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 -0.78 3.71 -0.37 -1.24 0.74 -1.26 -1.04 119.66 119.42 1weo s GLN 25 Ca 0.46 1.02 -0.36 0.00 0.05 0.00 0.00 55.36 56.53 1weo s GLN 25 Cb -0.52 -3.96 -0.12 0.00 1.10 0.00 0.00 33.01 29.51 1weo s GLN 25 CO 0.48 -1.39 2.19 -0.89 -0.55 0.00 0.00 175.29 175.13 1weo n ILE 26 N 6.74 0.16 0.00 -2.34 5.41 -1.20 -4.86 119.36 123.28 1weo n ILE 26 Ca 0.15 -0.23 0.00 0.00 1.00 0.00 0.00 62.75 63.67 1weo n ILE 26 Cb 0.48 -1.52 0.00 0.00 -0.71 0.00 0.00 39.64 37.89 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 6.66 -1.48 3.73 7.39 0.00 -1.26 -4.85 105.19 115.37 1weo n GLY 27 Ca 0.43 -1.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 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 3.29 0.78 0.99 1.43 -1.26 -3.83 118.68 120.08 1weo s LEU 28 Ca 0.00 -0.73 -0.12 0.00 -1.03 0.00 0.00 54.13 52.25 1weo s LEU 28 Cb 0.00 -1.78 0.06 0.00 0.03 0.00 0.00 46.19 44.50 1weo s LEU 28 CO 0.00 -0.27 1.12 0.42 0.23 0.00 0.00 176.35 177.85 1weo s THR 29 N -2.40 2.88 0.38 5.49 -4.23 0.79 -4.77 115.64 113.77 1weo s THR 29 Ca 0.37 0.28 0.19 0.00 -1.18 0.00 0.00 61.69 61.36 1weo s THR 29 Cb -0.03 -3.18 0.39 0.00 1.34 0.00 0.00 72.50 71.01 1weo s THR 29 CO 0.23 -0.37 1.69 0.58 -0.54 0.00 0.00 174.62 176.20 1weo h VAL 30 N -0.96 0.34 0.00 2.29 2.07 -2.01 -1.21 116.25 116.77 1weo h VAL 30 Ca -0.46 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 1weo h VAL 30 Cb 1.28 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1weo h VAL 30 CO 0.63 0.06 -0.01 -0.33 0.02 0.00 0.00 177.57 177.94 1weo h GLU 31 N 0.30 0.00 0.00 1.57 5.08 -2.04 -3.49 114.58 116.01 1weo h GLU 31 Ca 0.71 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.07 1weo h GLU 31 Cb 1.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.07 1weo h GLU 31 CO -0.46 0.79 0.00 0.41 -1.00 0.00 0.00 179.01 178.76 1weo n GLY 32 N 1.64 0.52 3.44 -3.84 0.00 -0.46 -5.15 105.19 101.34 1weo n GLY 32 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.82 -4.70 1.61 9.92 -1.26 -4.22 116.55 116.07 1weo n ASP 33 Ca 0.00 -0.14 -0.42 0.00 -0.53 0.00 0.00 54.79 53.70 1weo n ASP 33 Cb 0.00 -1.21 -0.03 0.00 -0.64 0.00 0.00 41.12 39.24 1weo n ASP 33 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1weo s LEU 34 N -6.09 4.34 -0.84 0.64 1.98 -1.26 -0.15 118.68 117.30 1weo s LEU 34 Ca 0.66 2.02 -0.25 0.00 -2.89 0.00 0.00 54.13 53.67 1weo s LEU 34 Cb -0.23 -3.57 0.04 0.00 0.66 0.00 0.00 46.19 43.09 1weo s LEU 34 CO 0.65 -0.55 1.32 0.12 -1.89 0.00 0.00 176.35 176.00 1weo s PHE 35 N 1.54 2.42 -0.62 5.38 5.36 -1.25 -4.78 117.98 126.03 1weo s PHE 35 Ca 0.59 -0.41 -0.05 0.00 -0.96 0.00 0.00 56.93 56.10 1weo s PHE 35 Cb -0.29 -4.62 0.16 0.00 -0.34 0.00 0.00 43.02 37.92 1weo s PHE 35 CO 0.27 -1.98 0.46 0.54 -1.46 0.00 0.00 175.22 173.04 1weo s VAL 36 N 5.26 3.99 0.00 3.12 0.11 -1.26 -4.83 120.40 126.79 1weo s VAL 36 Ca 0.38 -2.70 0.00 0.00 -2.93 0.00 0.00 61.98 56.73 1weo s VAL 36 Cb -0.06 -3.59 0.00 0.00 -1.53 0.00 0.00 36.38 31.21 1weo s VAL 36 CO 0.05 -0.87 0.99 0.00 -3.33 0.00 0.00 175.10 171.93 1weo n ALA 37 N 3.78 -0.03 -2.77 1.54 0.00 -1.25 -4.46 120.51 117.32 1weo n ALA 37 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.15 1weo n ALA 37 Cb 0.40 0.47 -0.08 0.00 0.00 0.00 0.00 19.45 20.24 1weo n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1weo n ASN 39 N 2.02 3.77 -0.07 0.00 5.15 -1.26 -3.76 115.26 121.11 1weo n ASN 39 Ca -0.19 -0.02 -0.13 0.00 -0.60 0.00 0.00 54.58 53.65 1weo n ASN 39 Cb 0.54 0.09 -0.09 0.00 -0.53 0.00 0.00 39.78 39.79 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 0.00 -0.40 0.13 1.20 4.22 -1.97 -3.15 114.58 114.60 1weo h GLU 40 Ca -0.10 0.03 -0.35 0.00 0.08 0.00 0.00 59.36 59.02 1weo h GLU 40 Cb 1.17 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1weo h GLU 40 CO -0.01 -0.27 -1.88 0.00 -2.18 0.00 0.00 179.01 174.67 1weo n GLY 42 N 1.91 1.53 3.62 0.00 0.00 -1.19 -5.06 105.19 105.99 1weo n GLY 42 Ca -0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 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 2.89 -0.53 1.61 5.36 -1.25 -4.97 117.98 119.09 1weo s PHE 43 Ca 0.00 0.90 -0.27 0.00 -0.96 0.00 0.00 56.93 56.59 1weo s PHE 43 Cb 0.00 -4.12 -0.02 0.00 -0.34 0.00 0.00 43.02 38.54 1weo s PHE 43 CO 0.00 -1.19 1.82 -1.25 -1.46 0.00 0.00 175.22 173.13 1weo s PRO 44 N 4.19 2.85 -0.15 10.12 0.04 -1.26 -3.63 135.00 147.16 1weo s PRO 44 Ca 0.49 0.82 -0.01 0.00 0.04 0.00 0.00 61.00 62.34 1weo s PRO 44 Cb -0.10 -4.32 0.04 0.00 0.04 0.00 0.00 34.50 30.16 1weo s PRO 44 CO 0.25 -2.46 -0.03 0.00 0.04 0.00 0.00 177.00 174.80 1weo s ALA 45 N 8.35 1.28 1.31 8.56 0.00 -1.26 -0.53 121.76 139.47 1weo s ALA 45 Ca 0.70 -0.67 -0.18 0.00 0.00 0.00 0.00 51.96 51.80 1weo s ALA 45 Cb -0.15 -1.05 0.28 0.00 0.00 0.00 0.00 23.12 22.21 1weo s ALA 45 CO 0.24 -0.75 0.64 0.00 0.00 0.00 0.00 175.76 175.90 1weo h ARG 47 N 0.00 -0.11 -0.14 0.00 2.43 -1.98 -1.88 114.38 112.70 1weo h ARG 47 Ca -0.29 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1weo h ARG 47 Cb 0.99 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 1weo h ARG 47 CO 0.18 0.27 0.00 -0.35 -1.51 0.00 0.00 179.97 178.56 1weo n PRO 48 N -4.96 0.49 0.00 0.20 -0.04 -1.26 -2.10 135.00 127.33 1weo n PRO 48 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1weo n PRO 48 Cb 0.23 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 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 0.00 -0.85 0.00 5.03 -1.12 -3.25 116.97 116.79 1weo h TYR 50 Ca 0.00 0.00 0.16 0.00 2.58 0.00 0.00 58.73 61.47 1weo h TYR 50 Cb 0.91 0.00 -0.16 0.00 1.55 0.00 0.00 36.73 39.04 1weo h TYR 50 CO 0.00 0.28 -0.26 0.93 -1.32 0.00 0.00 178.16 177.80 1weo h GLU 51 N -1.00 -0.02 -0.71 1.82 3.07 -1.67 0.42 114.58 116.48 1weo h GLU 51 Ca -0.01 0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.96 1weo h GLU 51 Cb 0.30 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 28.14 1weo h GLU 51 CO -0.00 -0.01 0.34 -0.92 -1.40 0.00 0.00 179.01 177.01 1weo h TYR 52 N -0.02 0.61 -1.03 4.33 3.20 -1.77 -0.93 116.97 121.36 1weo h TYR 52 Ca 0.38 0.03 0.32 0.00 3.14 0.00 0.00 58.73 62.60 1weo h TYR 52 Cb 0.62 -0.16 -0.14 0.00 1.54 0.00 0.00 36.73 38.58 1weo h TYR 52 CO -0.70 0.20 0.60 1.49 -1.64 0.00 0.00 178.16 178.11 1weo h GLU 53 N 0.57 0.32 0.00 1.82 4.57 -0.19 0.90 114.58 122.57 1weo h GLU 53 Ca 0.36 -0.02 -0.20 0.00 -1.18 0.00 0.00 59.36 58.32 1weo h GLU 53 Cb 0.41 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.90 1weo h GLU 53 CO -0.29 0.21 -0.97 0.00 -1.18 0.00 0.00 179.01 176.78 1weo h ARG 54 N 0.33 0.00 0.07 1.92 3.08 -1.11 -0.81 114.38 117.86 1weo h ARG 54 Ca 0.73 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.77 1weo h ARG 54 Cb 1.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.76 1weo h ARG 54 CO -0.56 0.87 -0.04 -0.09 -1.07 0.00 0.00 179.97 179.08 1weo h ARG 55 N 0.00 -0.09 0.00 0.04 1.12 0.13 -3.42 114.38 112.15 1weo h ARG 55 Ca -0.03 0.01 -0.27 0.00 -1.11 0.00 0.00 59.98 58.57 1weo h ARG 55 Cb 1.72 0.02 -0.05 0.00 -0.01 0.00 0.00 29.97 31.65 1weo h ARG 55 CO 0.11 -0.06 -2.03 0.39 -3.11 0.00 0.00 179.97 175.27 1weo n GLU 56 N -2.50 1.48 0.00 0.20 1.02 0.27 -5.00 120.64 116.11 1weo n GLU 56 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1weo n GLU 56 Cb 0.04 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1weo n GLU 56 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1weo n GLY 57 N 2.12 -2.84 0.60 0.62 0.00 -0.40 -4.93 105.19 100.36 1weo n GLY 57 Ca -0.25 -0.96 0.06 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.96 1.45 -2.17 2.61 -2.24 -0.86 -4.76 114.28 107.35 1weo n THR 58 Ca 0.00 -1.35 -0.19 0.00 -2.27 0.00 0.00 64.05 60.23 1weo n THR 58 Cb 0.00 0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 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 -0.06 -1.69 -4.52 -0.78 6.02 -0.67 -4.96 117.38 110.72 1weo n GLN 59 Ca 0.13 0.99 -0.24 0.00 -0.01 0.00 0.00 57.00 57.88 1weo n GLN 59 Cb 0.56 -5.57 -0.17 0.00 1.02 0.00 0.00 30.24 26.09 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 -2.21 1.63 0.14 1.08 0.01 -1.26 -3.26 114.94 111.07 1weo s ASN 60 Ca 0.00 -0.27 -0.32 0.00 -0.71 0.00 0.00 52.86 51.56 1weo s ASN 60 Cb 0.00 -0.76 -0.12 0.00 0.41 0.00 0.00 41.25 40.78 1weo s ASN 60 CO 0.00 0.02 1.77 0.00 -1.51 0.00 0.00 177.10 177.38 1weo n PRO 62 N 4.93 0.49 -0.02 0.00 -0.04 -1.26 0.26 135.00 139.35 1weo n PRO 62 Ca 0.18 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.60 1weo n PRO 62 Cb 0.35 -1.24 -0.02 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.74 0.11 0.00 0.54 7.27 -1.26 -4.84 117.38 118.46 1weo n GLN 63 Ca 0.06 0.03 0.00 0.00 0.07 0.00 0.00 57.00 57.16 1weo n GLN 63 Cb 0.03 -1.01 0.00 0.00 2.41 0.00 0.00 30.24 31.67 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 -1.24 -5.73 -3.70 0.00 4.76 0.72 -4.87 118.16 108.10 1weo n LYS 65 Ca 0.00 0.72 -0.24 0.00 -2.87 0.00 0.00 58.31 55.91 1weo n LYS 65 Cb 0.00 -5.49 -0.02 0.00 -1.84 0.00 0.00 35.03 27.68 1weo n LYS 65 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1weo s THR 66 N -3.52 5.20 0.05 -0.18 2.01 -1.26 -4.61 115.64 113.32 1weo s THR 66 Ca 0.05 -0.61 -0.33 0.00 0.31 0.00 0.00 61.69 61.12 1weo s THR 66 Cb -0.03 -3.81 -0.12 0.00 0.01 0.00 0.00 72.50 68.56 1weo s THR 66 CO 0.78 -0.34 1.82 -2.11 -0.69 0.00 0.00 174.62 174.08 1weo n ARG 67 N -1.23 2.46 -1.22 4.92 1.85 -1.26 -3.74 116.66 118.44 1weo n ARG 67 Ca -0.06 0.90 -0.30 0.00 -1.00 0.00 0.00 57.85 57.38 1weo n ARG 67 Cb 0.56 -2.76 0.23 0.00 -1.05 0.00 0.00 32.46 29.44 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 3.04 0.75 -0.03 2.89 1.51 -1.20 -5.03 117.35 119.27 1weo s TYR 68 Ca 0.86 0.49 -0.03 0.00 -1.01 0.00 0.00 57.07 57.38 1weo s TYR 68 Cb -0.59 -3.54 0.01 0.00 -0.11 0.00 0.00 41.96 37.73 1weo s TYR 68 CO 0.43 -3.64 0.09 -1.59 -1.11 0.00 0.00 175.55 169.74 1weo s LYS 69 N -5.46 0.12 0.04 -0.62 0.00 -1.26 -5.12 119.74 107.44 1weo s LYS 69 Ca 0.71 0.12 -0.30 0.00 0.00 0.00 0.00 55.97 56.49 1weo s LYS 69 Cb -0.09 0.06 -0.09 0.00 0.00 0.00 0.00 37.83 37.71 1weo s LYS 69 CO 0.56 -0.01 1.91 0.50 0.00 0.00 0.00 175.35 178.30 1weo s ARG 70 N 0.01 4.15 0.53 1.78 3.52 -1.26 -4.98 118.95 122.69 1weo s ARG 70 Ca -0.00 2.56 0.07 0.00 -0.13 0.00 0.00 55.73 58.23 1weo s ARG 70 Cb -0.01 -4.06 0.07 0.00 -1.56 0.00 0.00 34.95 29.39 1weo s ARG 70 CO 0.00 -0.93 0.60 1.28 -0.81 0.00 0.00 175.30 175.45 1weo n LEU 71 N 7.23 0.00 -0.04 -0.88 4.77 -1.25 -5.04 117.00 121.79 1weo n LEU 71 Ca 0.19 -2.45 -0.11 0.00 -0.03 0.00 0.00 56.01 53.61 1weo n LEU 71 Cb 0.41 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.19 1weo n LEU 71 CO 0.67 -0.64 0.84 0.08 -1.33 0.00 0.00 177.39 177.01 1weo h ARG 72 N 0.00 0.25 0.00 3.23 0.11 -2.02 -3.36 114.38 112.59 1weo h ARG 72 Ca -0.28 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 59.76 1weo h ARG 72 Cb 1.17 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.21 1weo h ARG 72 CO 0.42 0.33 -0.07 0.78 0.10 0.00 0.00 179.97 181.52 1weo h GLY 73 N 0.11 0.00 -7.11 0.08 0.00 -2.01 -3.44 103.07 90.70 1weo h GLY 73 Ca 0.05 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.79 1weo h GLY 73 CO -0.00 0.00 1.55 -1.14 0.00 0.00 0.00 176.54 176.94 1weo n SER 74 N -4.43 1.42 -4.69 0.19 3.41 -1.26 -4.90 113.62 103.36 1weo n SER 74 Ca -0.01 0.21 -0.29 0.00 -0.26 0.00 0.00 58.87 58.52 1weo n SER 74 Cb 0.04 -1.17 0.16 0.00 -0.26 0.00 0.00 64.21 62.98 1weo n SER 74 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1weo s PRO 75 N 7.39 0.73 0.65 4.33 0.04 -1.26 -3.81 135.00 143.07 1weo s PRO 75 Ca 1.17 0.63 -0.17 0.00 0.04 0.00 0.00 61.00 62.67 1weo s PRO 75 Cb -0.94 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 31.82 1weo s PRO 75 CO 0.47 -2.56 1.07 -2.13 0.04 0.00 0.00 177.00 173.89 1weo n ARG 76 N -4.07 0.83 -4.16 4.56 0.00 -1.26 -4.97 116.66 107.59 1weo n ARG 76 Ca 0.06 0.34 -0.14 0.00 -0.00 0.00 0.00 57.85 58.10 1weo n ARG 76 Cb 0.56 -2.30 -0.07 0.00 0.00 0.00 0.00 32.46 30.66 1weo n ARG 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1weo s VAL 77 N -1.57 0.00 -0.25 5.15 -7.23 -1.26 -5.05 120.40 110.19 1weo s VAL 77 Ca 0.78 -1.80 -0.36 0.00 -1.81 0.00 0.00 61.98 58.79 1weo s VAL 77 Cb -0.38 -2.49 -0.16 0.00 0.56 0.00 0.00 36.38 33.91 1weo s VAL 77 CO 0.46 0.00 1.13 -0.62 -0.31 0.00 0.00 175.10 175.75 1weo n GLU 78 N -0.45 0.00 0.00 4.82 -0.58 -1.26 -2.71 120.64 120.46 1weo n GLU 78 Ca 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 1weo n GLU 78 Cb 0.63 -1.20 0.00 0.00 -0.57 0.00 0.00 31.44 30.30 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 2.47 3.64 3.41 0.62 0.00 -1.26 -5.12 105.19 108.96 1weo n GLY 79 Ca 0.22 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 1weo n GLY 79 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1weo n ASP 80 N 0.00 -1.85 -3.68 1.61 2.03 -1.10 -5.04 116.55 108.53 1weo n ASP 80 Ca 0.00 0.15 -0.10 0.00 0.52 0.00 0.00 54.79 55.37 1weo n ASP 80 Cb 0.00 -1.17 -0.10 0.00 -0.72 0.00 0.00 41.12 39.13 1weo n ASP 80 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1weo s GLU 81 N -3.77 0.34 0.79 -0.67 2.02 -1.26 -5.07 118.70 111.08 1weo s GLU 81 Ca 0.59 0.90 -0.17 0.00 0.02 0.00 0.00 54.97 56.32 1weo s GLU 81 Cb -0.19 0.15 -0.12 0.00 0.10 0.00 0.00 34.13 34.07 1weo s GLU 81 CO 0.66 -0.21 -0.25 -0.25 0.02 0.00 0.00 175.26 175.23 1weo n ASP 82 N 4.88 -4.09 -2.41 -0.19 8.00 -1.26 -4.85 116.55 116.62 1weo n ASP 82 Ca -0.15 0.42 -0.35 0.00 0.71 0.00 0.00 54.79 55.42 1weo n ASP 82 Cb 0.52 -0.91 0.07 0.00 -0.02 0.00 0.00 41.12 40.78 1weo n ASP 82 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1weo n GLU 83 N 1.27 2.76 -2.77 -1.24 0.28 -1.26 -4.63 120.64 115.04 1weo n GLU 83 Ca 0.04 -3.39 -0.25 0.00 -0.16 0.00 0.00 57.16 53.40 1weo n GLU 83 Cb 0.52 -2.29 -0.02 0.00 1.43 0.00 0.00 31.44 31.08 1weo n GLU 83 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1weo n GLU 84 N -0.84 3.04 -3.56 3.44 -0.00 -1.26 -4.99 120.64 116.47 1weo n GLU 84 Ca 0.60 -4.55 -0.16 0.00 -0.00 0.00 0.00 57.16 53.06 1weo n GLU 84 Cb 0.61 -2.15 -0.13 0.00 -0.00 0.00 0.00 31.44 29.76 1weo n GLU 84 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.13 177.29 1weo s ASP 85 N -3.41 0.91 0.04 -1.84 -4.77 -1.26 -5.03 116.67 101.31 1weo s ASP 85 Ca 0.47 0.13 -0.01 0.00 -3.30 0.00 0.00 52.55 49.84 1weo s ASP 85 Cb 0.34 0.52 -0.00 0.00 -1.09 0.00 0.00 42.92 42.68 1weo s ASP 85 CO -0.14 -0.29 -0.02 -0.38 0.70 0.00 0.00 175.17 175.04 1weo n ILE 86 N 5.33 0.67 -2.98 2.11 5.41 -1.26 -5.04 119.36 123.61 1weo n ILE 86 Ca -0.05 0.20 -0.40 0.00 1.00 0.00 0.00 62.75 63.49 1weo n ILE 86 Cb 0.50 -1.57 -0.05 0.00 -0.71 0.00 0.00 39.64 37.80 1weo n ILE 86 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1weo s ASP 87 N -5.56 7.28 0.52 4.38 1.11 -1.26 -5.03 116.67 118.11 1weo s ASP 87 Ca -0.01 1.52 -0.22 0.00 0.18 0.00 0.00 52.55 54.01 1weo s ASP 87 Cb 0.00 -2.48 -0.05 0.00 1.07 0.00 0.00 42.92 41.46 1weo s ASP 87 CO 0.02 0.08 1.34 -0.55 1.18 0.00 0.00 175.17 177.24 1weo s SER 88 N -0.43 5.45 0.00 0.27 0.15 -1.26 -4.90 113.70 112.98 1weo s SER 88 Ca 0.38 2.72 0.00 0.00 0.70 0.00 0.00 55.95 59.74 1weo s SER 88 Cb -0.21 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.46 1weo s SER 88 CO 0.24 -1.44 0.00 0.61 1.20 0.00 0.00 173.24 173.85 1weo n GLY 89 N 0.67 -0.40 3.67 9.45 0.00 -1.26 -5.17 105.19 112.15 1weo n GLY 89 Ca 0.09 0.19 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 0.19 -0.01 1.61 0.04 -1.26 -5.08 135.00 130.49 1weo s PRO 90 Ca 0.00 0.44 0.01 0.00 0.04 0.00 0.00 61.00 61.49 1weo s PRO 90 Cb 0.00 -1.72 -0.00 0.00 0.04 0.00 0.00 34.50 32.82 1weo s PRO 90 CO 0.00 -2.88 -0.05 -1.54 0.04 0.00 0.00 177.00 172.58 1weo s SER 91 N -3.49 0.60 -0.56 6.66 1.04 -1.26 -5.11 113.70 111.57 1weo s SER 91 Ca 0.66 -0.09 -0.19 0.00 0.48 0.00 0.00 55.95 56.81 1weo s SER 91 Cb -0.18 -0.09 0.09 0.00 0.10 0.00 0.00 66.02 65.94 1weo s SER 91 CO 0.58 0.05 0.66 -0.44 0.98 0.00 0.00 173.24 175.06 1weo s SER 92 N -0.00 6.19 0.00 7.02 0.01 -1.26 -5.37 113.70 120.28 1weo s SER 92 Ca 0.01 -1.33 0.00 0.00 1.31 0.00 0.00 55.95 55.94 1weo s SER 92 Cb -0.03 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.91 1weo s SER 92 CO -0.00 -1.03 0.38 0.61 0.41 0.00 0.00 173.24 173.61