#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dip s SER 2 N 0.00 -0.35 0.28 1.61 1.04 -1.26 -5.19 113.70 109.84 2dip s SER 2 Ca 0.00 -0.31 -0.08 0.00 0.48 0.00 0.00 55.95 56.04 2dip s SER 2 Cb 0.00 0.58 -0.00 0.00 0.10 0.00 0.00 66.02 66.69 2dip s SER 2 CO 0.00 -1.01 0.45 -0.94 0.98 0.00 0.00 173.24 172.72 2dip s SER 3 N -2.83 0.30 0.01 7.02 1.04 -1.26 -5.19 113.70 112.79 2dip s SER 3 Ca 0.06 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.30 2dip s SER 3 Cb -0.01 0.60 -0.00 0.00 0.10 0.00 0.00 66.02 66.72 2dip s SER 3 CO -0.07 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 173.57 2dip n GLY 4 N -0.44 4.11 3.55 7.32 0.00 -1.26 -5.18 105.19 113.29 2dip n GLY 4 Ca -0.01 -1.97 -0.07 0.00 0.00 0.00 0.00 46.02 43.97 2dip n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dip s SER 5 N -1.05 -0.31 0.57 1.61 0.15 -1.26 -5.18 113.70 108.23 2dip s SER 5 Ca 0.00 -0.06 0.02 0.00 0.70 0.00 0.00 55.95 56.61 2dip s SER 5 Cb 0.00 0.37 0.05 0.00 -1.71 0.00 0.00 66.02 64.73 2dip s SER 5 CO 0.00 -0.61 0.80 -0.44 1.20 0.00 0.00 173.24 174.18 2dip s SER 6 N -2.53 5.16 -0.12 5.45 0.01 -1.26 -5.07 113.70 115.34 2dip s SER 6 Ca 0.07 -0.10 -0.10 0.00 1.31 0.00 0.00 55.95 57.13 2dip s SER 6 Cb -0.01 -0.72 -0.03 0.00 0.21 0.00 0.00 66.02 65.47 2dip s SER 6 CO -0.07 -1.23 -0.19 0.61 0.41 0.00 0.00 173.24 172.78 2dip n GLY 7 N -2.38 -0.72 3.56 3.44 0.00 -1.26 -4.94 105.19 102.89 2dip n GLY 7 Ca 0.09 -0.18 -0.54 0.00 0.00 0.00 0.00 46.02 45.40 2dip n GLY 7 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2dip n LEU 8 N -3.99 1.11 -3.82 0.99 -0.00 -1.26 -4.94 117.00 105.09 2dip n LEU 8 Ca -0.07 1.13 -0.05 0.00 -0.00 0.00 0.00 56.01 57.01 2dip n LEU 8 Cb 0.28 -1.11 -0.00 0.00 -0.00 0.00 0.00 43.42 42.58 2dip n LEU 8 CO 0.11 -1.35 0.62 -1.61 -0.00 0.00 0.00 177.39 175.16 2dip s GLU 9 N 0.25 1.59 0.15 1.47 0.41 -1.26 -5.18 118.70 116.13 2dip s GLU 9 Ca 0.85 -0.93 0.09 0.00 -0.41 0.00 0.00 54.97 54.57 2dip s GLU 9 Cb -1.04 0.51 -0.04 0.00 -1.78 0.00 0.00 34.13 31.78 2dip s GLU 9 CO 0.50 -0.73 -0.17 -1.83 -0.49 0.00 0.00 175.26 172.54 2dip s GLU 10 N -3.16 1.81 0.43 1.61 -1.05 -1.26 -5.09 118.70 112.00 2dip s GLU 10 Ca 0.14 -1.28 -0.15 0.00 -0.15 0.00 0.00 54.97 53.53 2dip s GLU 10 Cb -0.04 -2.07 -0.12 0.00 -0.44 0.00 0.00 34.13 31.46 2dip s GLU 10 CO 0.06 0.45 -0.12 1.97 0.95 0.00 0.00 175.26 178.57 2dip n PHE 11 N 0.45 -2.47 -3.66 4.83 -1.74 -1.26 -4.99 117.46 108.63 2dip n PHE 11 Ca -0.13 0.37 -0.14 0.00 -0.56 0.00 0.00 57.45 56.98 2dip n PHE 11 Cb 0.54 -1.40 -0.08 0.00 1.52 0.00 0.00 39.48 40.06 2dip n PHE 11 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 2dip s LYS 12 N -0.86 0.75 0.65 3.97 0.00 -1.26 -5.18 119.74 117.81 2dip s LYS 12 Ca 0.47 0.64 0.02 0.00 0.00 0.00 0.00 55.97 57.10 2dip s LYS 12 Cb -0.41 0.36 0.10 0.00 0.00 0.00 0.00 37.83 37.88 2dip s LYS 12 CO 0.55 -0.13 0.90 -0.80 0.00 0.00 0.00 175.35 175.88 2dip s ASN 13 N -0.08 4.69 0.33 0.03 0.01 -1.26 -5.13 114.94 113.53 2dip s ASN 13 Ca -0.03 -0.43 -0.07 0.00 -0.71 0.00 0.00 52.86 51.62 2dip s ASN 13 Cb -0.04 -0.08 0.01 0.00 0.41 0.00 0.00 41.25 41.56 2dip s ASN 13 CO 0.03 -1.61 0.54 -0.94 -1.51 0.00 0.00 177.10 173.60 2dip s SER 14 N -4.67 0.55 1.28 -1.22 1.04 -1.26 -5.17 113.70 104.26 2dip s SER 14 Ca 0.64 -1.32 -0.18 0.00 0.48 0.00 0.00 55.95 55.57 2dip s SER 14 Cb -0.06 0.69 0.30 0.00 0.10 0.00 0.00 66.02 67.05 2dip s SER 14 CO 0.42 -1.35 0.80 -0.24 0.98 0.00 0.00 173.24 173.86 2dip n SER 15 N -1.22 -2.85 -4.29 7.02 2.88 -1.26 -5.06 113.62 108.84 2dip n SER 15 Ca -0.01 -0.45 -0.22 0.00 -1.33 0.00 0.00 58.87 56.85 2dip n SER 15 Cb 0.61 -1.10 -0.09 0.00 -0.75 0.00 0.00 64.21 62.88 2dip n SER 15 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2dip s LYS 16 N -4.45 1.73 0.17 -1.46 -2.85 -1.26 -5.17 119.74 106.45 2dip s LYS 16 Ca 0.65 -2.00 0.08 0.00 -1.00 0.00 0.00 55.97 53.69 2dip s LYS 16 Cb -0.18 -0.67 -0.04 0.00 -2.06 0.00 0.00 37.83 34.88 2dip s LYS 16 CO 0.61 -0.33 -0.05 -1.17 0.10 0.00 0.00 175.35 174.51 2dip s LEU 17 N -3.51 3.14 0.10 2.77 2.96 -1.26 -5.14 118.68 117.74 2dip s LEU 17 Ca 0.31 -0.47 -0.04 0.00 -0.22 0.00 0.00 54.13 53.71 2dip s LEU 17 Cb 0.06 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 2dip s LEU 17 CO 0.15 0.10 0.10 0.68 -1.32 0.00 0.00 176.35 176.06 2dip s VAL 18 N -1.68 0.14 0.94 1.68 -7.23 -1.26 -5.16 120.40 107.83 2dip s VAL 18 Ca 0.26 -1.61 -0.11 0.00 -1.81 0.00 0.00 61.98 58.70 2dip s VAL 18 Cb -0.09 -1.67 0.15 0.00 0.56 0.00 0.00 36.38 35.33 2dip s VAL 18 CO 0.17 -0.65 1.09 0.00 -0.31 0.00 0.00 175.10 175.40 2dip s ALA 19 N -3.95 1.24 0.19 1.32 0.00 -1.26 -5.06 121.76 114.24 2dip s ALA 19 Ca 0.13 0.09 0.08 0.00 0.00 0.00 0.00 51.96 52.26 2dip s ALA 19 Cb 0.06 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 2dip s ALA 19 CO -0.05 -2.65 -0.15 0.00 0.00 0.00 0.00 175.76 172.91 2dip s ALA 20 N -2.79 1.97 0.90 0.00 0.00 -1.26 -5.14 121.76 115.43 2dip s ALA 20 Ca 0.65 -1.59 -0.11 0.00 0.00 0.00 0.00 51.96 50.90 2dip s ALA 20 Cb -0.20 -0.11 0.13 0.00 0.00 0.00 0.00 23.12 22.94 2dip s ALA 20 CO 0.58 0.10 1.09 0.00 0.00 0.00 0.00 175.76 177.54 2dip s ALA 21 N -2.71 1.52 0.33 0.00 0.00 -1.26 -5.07 121.76 114.58 2dip s ALA 21 Ca 0.20 -0.03 0.08 0.00 0.00 0.00 0.00 51.96 52.21 2dip s ALA 21 Cb -0.02 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 2dip s ALA 21 CO 0.06 -2.38 0.11 -1.21 0.00 0.00 0.00 175.76 172.35 2dip s GLU 22 N -4.91 2.33 -0.07 0.00 0.41 -1.26 -5.14 118.70 110.06 2dip s GLU 22 Ca 0.64 -1.55 0.03 0.00 -0.41 0.00 0.00 54.97 53.68 2dip s GLU 22 Cb -0.18 -2.14 -0.02 0.00 -1.78 0.00 0.00 34.13 30.01 2dip s GLU 22 CO 0.57 0.15 -0.18 0.21 -0.49 0.00 0.00 175.26 175.52 2dip s LYS 23 N -3.81 2.77 0.18 1.61 2.36 -1.26 -5.12 119.74 116.47 2dip s LYS 23 Ca 0.36 -0.76 -0.13 0.00 -2.55 0.00 0.00 55.97 52.89 2dip s LYS 23 Cb -0.03 -2.38 0.01 0.00 -1.05 0.00 0.00 37.83 34.39 2dip s LYS 23 CO 0.22 0.43 0.40 -1.21 1.55 0.00 0.00 175.35 176.74 2dip s GLU 24 N -0.23 1.27 0.21 4.03 0.41 -1.26 -5.13 118.70 118.00 2dip s GLU 24 Ca -0.00 -1.03 -0.19 0.00 -0.41 0.00 0.00 54.97 53.34 2dip s GLU 24 Cb -0.13 0.45 -0.13 0.00 -1.78 0.00 0.00 34.13 32.54 2dip s GLU 24 CO 0.03 -0.51 0.27 -2.13 -0.49 0.00 0.00 175.26 172.43 2dip n ARG 25 N -0.28 0.00 -0.02 1.61 0.63 -1.26 -4.91 116.66 112.44 2dip n ARG 25 Ca -0.08 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.82 2dip n ARG 25 Cb 0.63 -0.76 -0.02 0.00 0.45 0.00 0.00 32.46 32.76 2dip n ARG 25 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2dip n LEU 26 N 1.62 2.71 -4.70 6.15 4.32 -1.26 -5.09 117.00 120.76 2dip n LEU 26 Ca 0.12 -0.02 -0.31 0.00 -0.02 0.00 0.00 56.01 55.78 2dip n LEU 26 Cb 0.23 -0.09 -0.08 0.00 -1.62 0.00 0.00 43.42 41.86 2dip n LEU 26 CO 0.42 0.51 -0.25 1.51 -1.22 0.00 0.00 177.39 178.36 2dip s ASP 27 N -4.21 3.83 0.03 -1.43 1.47 -1.26 -5.06 116.67 110.03 2dip s ASP 27 Ca -0.04 -1.62 -0.18 0.00 1.18 0.00 0.00 52.55 51.89 2dip s ASP 27 Cb 0.01 0.41 -0.23 0.00 -0.34 0.00 0.00 42.92 42.77 2dip s ASP 27 CO 0.08 -0.82 1.13 0.11 0.68 0.00 0.00 175.17 176.35 2dip h LYS 28 N 1.49 0.51 -5.15 2.11 1.79 -2.04 -3.40 116.57 111.88 2dip h LYS 28 Ca -0.42 -0.54 -0.04 0.00 -2.18 0.00 0.00 60.65 57.47 2dip h LYS 28 Cb 1.30 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 32.09 2dip h LYS 28 CO 0.72 1.17 0.14 -1.58 -1.08 0.00 0.00 179.45 178.81 2dip s HIS 29 N -3.27 1.27 -0.18 -1.35 2.46 -1.26 -4.56 115.29 108.40 2dip s HIS 29 Ca -0.12 2.17 -0.07 0.00 0.47 0.00 0.00 55.06 57.51 2dip s HIS 29 Cb 0.05 -3.38 -0.22 0.00 -0.13 0.00 0.00 32.58 28.90 2dip s HIS 29 CO 0.85 -0.76 0.14 1.28 -2.47 0.00 0.00 174.74 173.79 2dip n LEU 30 N 19.28 2.59 0.00 8.88 4.77 -1.26 -4.43 117.00 146.83 2dip n LEU 30 Ca 0.42 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 2dip n LEU 30 Cb 0.47 -1.03 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 2dip n LEU 30 CO 0.60 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 178.06 2dip n GLY 31 N 1.95 1.39 2.93 -0.72 0.00 -1.26 -4.40 105.19 105.09 2dip n GLY 31 Ca -0.37 0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 2dip n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dip s ILE 32 N 0.00 -0.00 0.88 -0.61 1.01 -1.26 -5.13 121.20 116.09 2dip s ILE 32 Ca 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.55 2dip s ILE 32 Cb 0.00 -0.10 0.12 0.00 0.01 0.00 0.00 42.46 42.49 2dip s ILE 32 CO 0.00 0.00 1.09 -2.16 0.00 0.00 0.00 174.94 173.88 2dip s PRO 33 N 0.09 1.39 0.45 2.79 0.04 -1.26 -4.74 135.00 133.75 2dip s PRO 33 Ca -0.00 0.86 -0.22 0.00 0.04 0.00 0.00 61.00 61.68 2dip s PRO 33 Cb -0.01 -1.82 -0.09 0.00 0.04 0.00 0.00 34.50 32.62 2dip s PRO 33 CO -0.00 -2.16 1.04 0.00 0.04 0.00 0.00 177.00 175.92 2dip n ASN 35 N -0.56 0.70 0.00 0.00 2.85 0.33 -3.11 115.26 115.46 2dip n ASN 35 Ca 0.07 -0.52 0.00 0.00 -0.11 0.00 0.00 54.58 54.03 2dip n ASN 35 Cb 0.51 0.62 0.00 0.00 1.24 0.00 0.00 39.78 42.15 2dip n ASN 35 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2dip n ASN 36 N -1.58 0.00 0.17 1.20 5.15 -1.26 -4.71 115.26 114.23 2dip n ASN 36 Ca 0.04 0.00 0.05 0.00 -0.60 0.00 0.00 54.58 54.07 2dip n ASN 36 Cb 0.35 -0.35 0.16 0.00 -0.53 0.00 0.00 39.78 39.41 2dip n ASN 36 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dip n LYS 38 N -3.30 -4.12 -2.85 0.00 4.76 -1.18 -4.98 118.16 106.48 2dip n LYS 38 Ca 0.01 0.45 -0.42 0.00 -2.87 0.00 0.00 58.31 55.49 2dip n LYS 38 Cb 0.64 -4.33 -0.04 0.00 -1.84 0.00 0.00 35.03 29.46 2dip n LYS 38 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2dip s GLN 39 N -5.43 4.24 -0.11 1.97 0.74 -1.26 -4.74 119.66 115.07 2dip s GLN 39 Ca 0.23 1.04 -0.05 0.00 0.05 0.00 0.00 55.36 56.62 2dip s GLN 39 Cb -0.10 -3.62 0.05 0.00 1.10 0.00 0.00 33.01 30.45 2dip s GLN 39 CO 0.40 -0.46 0.25 0.12 -0.55 0.00 0.00 175.29 175.05 2dip s PHE 40 N 2.62 -0.36 0.93 1.67 5.36 -1.26 -3.21 117.98 123.73 2dip s PHE 40 Ca 0.38 0.84 -0.12 0.00 -0.96 0.00 0.00 56.93 57.07 2dip s PHE 40 Cb -0.16 0.03 0.15 0.00 -0.34 0.00 0.00 43.02 42.70 2dip s PHE 40 CO 0.09 -0.27 1.09 -1.25 -1.46 0.00 0.00 175.22 173.43 2dip s PRO 41 N 1.56 1.00 -0.52 10.12 0.04 -1.26 -5.06 135.00 140.88 2dip s PRO 41 Ca -0.07 0.73 -0.21 0.00 0.04 0.00 0.00 61.00 61.49 2dip s PRO 41 Cb -0.11 -1.79 0.05 0.00 0.04 0.00 0.00 34.50 32.70 2dip s PRO 41 CO -0.09 -2.40 0.72 0.42 0.04 0.00 0.00 177.00 175.70 2dip s ILE 42 N -2.94 4.73 0.03 0.56 1.01 -1.24 -4.94 121.20 118.41 2dip s ILE 42 Ca 0.64 -0.22 -0.29 0.00 0.00 0.00 0.00 60.65 60.78 2dip s ILE 42 Cb -0.18 -4.36 -0.17 0.00 0.01 0.00 0.00 42.46 37.75 2dip s ILE 42 CO 0.57 -0.88 1.35 -0.33 0.00 0.00 0.00 174.94 175.65 2dip h GLU 43 N 9.08 -0.77 -7.04 2.79 4.39 -1.91 -3.45 114.58 117.67 2dip h GLU 43 Ca -0.27 0.05 -0.38 0.00 0.34 0.00 0.00 59.36 59.10 2dip h GLU 43 Cb 1.09 0.18 0.22 0.00 -0.10 0.00 0.00 28.75 30.13 2dip h GLU 43 CO 1.00 -0.46 -0.12 0.20 -1.16 0.00 0.00 179.01 178.47 2dip s GLY 44 N -2.37 1.41 1.14 -3.84 0.00 -1.26 -4.98 107.32 97.42 2dip s GLY 44 Ca -0.16 -0.88 -0.16 0.00 0.00 0.00 0.00 44.72 43.53 2dip s GLY 44 CO 0.54 0.15 0.53 0.28 0.00 0.00 0.00 173.10 174.60 2dip n LYS 45 N -5.67 -3.08 -4.08 2.90 4.76 -1.26 -4.62 118.16 107.10 2dip n LYS 45 Ca 0.14 -0.91 -0.32 0.00 -2.87 0.00 0.00 58.31 54.34 2dip n LYS 45 Cb 0.60 -1.60 -0.15 0.00 -1.84 0.00 0.00 35.03 32.04 2dip n LYS 45 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dip s TYR 47 N 1.16 2.60 -0.07 0.00 1.51 -1.00 -2.93 117.35 118.62 2dip s TYR 47 Ca -0.05 -0.23 -0.08 0.00 -1.01 0.00 0.00 57.07 55.70 2dip s TYR 47 Cb -0.18 -1.41 0.02 0.00 -0.11 0.00 0.00 41.96 40.28 2dip s TYR 47 CO -0.07 0.35 0.22 -1.59 -1.11 0.00 0.00 175.55 173.35 2dip s LYS 48 N -1.89 0.31 -0.06 -0.62 -2.85 -1.13 0.28 119.74 113.77 2dip s LYS 48 Ca 0.17 0.20 -0.30 0.00 -1.00 0.00 0.00 55.97 55.05 2dip s LYS 48 Cb -0.11 0.14 -0.02 0.00 -2.06 0.00 0.00 37.83 35.78 2dip s LYS 48 CO 0.09 -0.05 1.05 0.00 0.10 0.00 0.00 175.35 176.54 2dip n THR 50 N 4.36 0.22 -0.02 0.00 -2.24 -0.00 -3.73 114.28 112.88 2dip n THR 50 Ca 0.08 -0.31 -0.01 0.00 -2.27 0.00 0.00 64.05 61.55 2dip n THR 50 Cb 0.49 0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 68.92 2dip n THR 50 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dip n GLU 51 N 0.18 2.20 -1.49 -0.78 1.02 -1.26 -5.01 120.64 115.50 2dip n GLU 51 Ca 0.14 -0.02 -0.09 0.00 -0.02 0.00 0.00 57.16 57.18 2dip n GLU 51 Cb 0.27 -1.11 0.04 0.00 -0.02 0.00 0.00 31.44 30.62 2dip n GLU 51 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dip s ILE 53 N -0.86 2.89 -1.53 0.00 -1.09 -1.26 -4.67 121.20 114.69 2dip s ILE 53 Ca 0.25 -0.78 -0.19 0.00 -2.23 0.00 0.00 60.65 57.70 2dip s ILE 53 Cb -0.02 -2.13 0.19 0.00 -1.58 0.00 0.00 42.46 38.93 2dip s ILE 53 CO 0.16 0.58 0.48 -1.84 -1.23 0.00 0.00 174.94 173.10 2dip n GLU 54 N 2.52 -0.85 -3.72 2.79 0.28 -1.26 -4.86 120.64 115.53 2dip n GLU 54 Ca -0.17 0.11 -0.37 0.00 -0.16 0.00 0.00 57.16 56.57 2dip n GLU 54 Cb 0.52 -4.01 -0.12 0.00 1.43 0.00 0.00 31.44 29.26 2dip n GLU 54 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 2dip s TYR 55 N -2.85 3.12 -0.03 -1.84 6.14 -1.26 -4.97 117.35 115.65 2dip s TYR 55 Ca 0.68 -0.35 -0.01 0.00 0.64 0.00 0.00 57.07 58.04 2dip s TYR 55 Cb -0.40 -2.27 0.03 0.00 0.42 0.00 0.00 41.96 39.74 2dip s TYR 55 CO 0.83 -0.33 0.05 -1.01 0.64 0.00 0.00 175.55 175.73 2dip s HIS 56 N 1.64 -0.01 0.47 4.97 3.76 -1.26 -1.51 115.29 123.35 2dip s HIS 56 Ca 0.06 0.18 0.03 0.00 -0.15 0.00 0.00 55.06 55.19 2dip s HIS 56 Cb -0.15 -0.18 0.03 0.00 1.11 0.00 0.00 32.58 33.39 2dip s HIS 56 CO 0.05 -0.09 0.26 1.28 -0.85 0.00 0.00 174.74 175.39 2dip n LEU 57 N 4.04 0.00 -4.28 0.89 4.77 0.14 0.12 117.00 122.68 2dip n LEU 57 Ca -0.26 -2.60 -0.26 0.00 -0.03 0.00 0.00 56.01 52.86 2dip n LEU 57 Cb 0.52 0.06 -0.14 0.00 -2.33 0.00 0.00 43.42 41.53 2dip n LEU 57 CO 0.22 -0.51 -0.53 0.00 -1.33 0.00 0.00 177.39 175.24 2dip n GLN 59 N 1.75 -0.04 0.41 0.00 -0.06 -1.20 0.44 117.38 118.68 2dip n GLN 59 Ca -0.17 0.97 -0.17 0.00 -2.00 0.00 0.00 57.00 55.63 2dip n GLN 59 Cb 0.53 -1.71 -0.08 0.00 -4.06 0.00 0.00 30.24 24.92 2dip n GLN 59 CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 2dip h GLU 60 N 0.00 -1.03 -0.97 3.69 4.81 -1.94 -1.89 114.58 117.24 2dip h GLU 60 Ca 0.56 0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.93 2dip h GLU 60 Cb 1.45 0.24 -0.06 0.00 0.63 0.00 0.00 28.75 31.00 2dip h GLU 60 CO -0.55 -0.69 0.63 0.00 -0.73 0.00 0.00 179.01 177.67 2dip h PHE 62 N 1.13 0.89 -0.89 0.00 3.57 -0.72 -0.82 116.94 120.09 2dip h PHE 62 Ca 0.42 0.02 0.12 0.00 3.53 0.00 0.00 57.97 62.06 2dip h PHE 62 Cb 0.18 -0.29 -0.07 0.00 2.79 0.00 0.00 35.95 38.56 2dip h PHE 62 CO -0.00 0.41 0.57 0.22 -2.23 0.00 0.00 178.31 177.28 2dip h ASP 63 N 0.82 0.72 0.28 0.41 3.58 -0.40 0.34 116.42 122.17 2dip h ASP 63 Ca 0.40 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.88 2dip h ASP 63 Cb 0.44 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.37 2dip h ASP 63 CO -0.16 0.39 0.00 -1.20 -2.88 0.00 0.00 179.24 175.39 2dip n SER 64 N -4.55 0.14 -3.06 2.28 7.64 -0.31 -4.83 113.62 110.93 2dip n SER 64 Ca 0.16 0.55 -0.20 0.00 1.01 0.00 0.00 58.87 60.39 2dip n SER 64 Cb 0.39 -0.57 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 2dip n SER 64 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2dip n TYR 65 N -1.67 -1.73 0.00 1.43 4.02 0.12 -4.90 117.16 114.42 2dip n TYR 65 Ca 0.01 0.37 0.00 0.00 -0.01 0.00 0.00 57.90 58.27 2dip n TYR 65 Cb 0.10 -3.26 0.00 0.00 -0.02 0.00 0.00 39.34 36.16 2dip n TYR 65 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dip n HIS 67 N -1.23 0.53 0.01 0.00 -0.00 -1.26 -3.60 115.22 109.67 2dip n HIS 67 Ca 0.00 0.18 0.19 0.00 -0.00 0.00 0.00 57.72 58.09 2dip n HIS 67 Cb 0.00 -0.79 0.38 0.00 -0.00 0.00 0.00 29.99 29.58 2dip n HIS 67 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2dip h LEU 68 N 0.00 0.00 -0.87 0.27 6.46 -1.89 0.61 115.31 119.88 2dip h LEU 68 Ca 0.00 0.00 0.23 0.00 -0.12 0.00 0.00 57.88 57.99 2dip h LEU 68 Cb 0.49 0.00 -0.14 0.00 -0.73 0.00 0.00 40.66 40.28 2dip h LEU 68 CO 0.00 0.00 0.22 0.28 -0.62 0.00 0.00 178.44 178.32 2dip h SER 69 N 0.00 -0.02 -4.09 1.25 0.02 -1.79 -3.41 113.55 105.50 2dip h SER 69 Ca 0.29 0.20 -0.49 0.00 -0.84 0.00 0.00 61.79 60.94 2dip h SER 69 Cb 2.31 0.27 0.06 0.00 0.14 0.00 0.00 62.40 65.18 2dip h SER 69 CO -0.00 -0.16 0.31 -1.00 -1.14 0.00 0.00 176.83 174.84 2dip s HIS 70 N -5.95 3.45 -0.38 3.45 3.76 0.20 -4.98 115.29 114.85 2dip s HIS 70 Ca -0.12 0.99 -0.28 0.00 -0.15 0.00 0.00 55.06 55.50 2dip s HIS 70 Cb 0.26 -2.75 -0.02 0.00 1.11 0.00 0.00 32.58 31.19 2dip s HIS 70 CO 0.77 -0.78 1.76 0.99 -0.85 0.00 0.00 174.74 176.63 2dip s THR 71 N -3.11 3.51 0.21 1.30 2.01 -1.26 -4.95 115.64 113.35 2dip s THR 71 Ca 0.54 0.50 0.06 0.00 0.31 0.00 0.00 61.69 63.10 2dip s THR 71 Cb -0.11 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 2dip s THR 71 CO 0.50 -0.52 0.15 -0.36 -0.69 0.00 0.00 174.62 173.70 2dip s PHE 72 N 7.02 3.08 -0.05 4.92 0.40 -1.26 -0.82 117.98 131.28 2dip s PHE 72 Ca 0.76 -0.08 0.01 0.00 -0.60 0.00 0.00 56.93 57.02 2dip s PHE 72 Cb -0.20 -1.43 0.02 0.00 0.51 0.00 0.00 43.02 41.92 2dip s PHE 72 CO 0.32 0.53 -0.04 0.95 0.70 0.00 0.00 175.22 177.67 2dip s THR 73 N -1.97 0.50 -0.09 0.64 -4.23 -0.89 -3.76 115.64 105.85 2dip s THR 73 Ca 0.32 -0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 60.71 2dip s THR 73 Cb -0.09 -0.54 -0.03 0.00 1.34 0.00 0.00 72.50 73.18 2dip s THR 73 CO 0.24 0.22 0.01 0.72 -0.54 0.00 0.00 174.62 175.27 2dip s PHE 74 N 0.99 3.20 0.53 3.99 -0.12 -0.95 -2.83 117.98 122.79 2dip s PHE 74 Ca -0.10 0.22 0.08 0.00 -0.05 0.00 0.00 56.93 57.08 2dip s PHE 74 Cb -0.14 -1.80 0.05 0.00 -0.63 0.00 0.00 43.02 40.50 2dip s PHE 74 CO -0.00 0.49 0.60 -0.98 -0.05 0.00 0.00 175.22 175.28 2dip s ARG 75 N -0.91 2.38 0.41 1.99 1.70 -1.15 0.45 118.95 123.82 2dip s ARG 75 Ca 0.13 -1.69 0.08 0.00 -0.47 0.00 0.00 55.73 53.78 2dip s ARG 75 Cb -0.11 -2.47 -0.04 0.00 -0.57 0.00 0.00 34.95 31.76 2dip s ARG 75 CO 0.03 -0.63 0.26 -1.21 -1.08 0.00 0.00 175.30 172.66 2dip s GLU 76 N -4.45 2.37 1.01 3.89 2.02 -1.09 -4.63 118.70 117.83 2dip s GLU 76 Ca 0.51 -1.68 -0.18 0.00 0.02 0.00 0.00 54.97 53.64 2dip s GLU 76 Cb -0.05 -2.17 -0.05 0.00 0.10 0.00 0.00 34.13 31.96 2dip s GLU 76 CO 0.32 -0.12 -0.45 0.36 0.02 0.00 0.00 175.26 175.38 2dip n LYS 77 N -1.36 -0.43 -0.91 1.61 2.85 -1.26 -4.59 118.16 114.06 2dip n LYS 77 Ca 0.01 -0.11 -0.31 0.00 -1.05 0.00 0.00 58.31 56.84 2dip n LYS 77 Cb 0.63 -1.39 0.03 0.00 -0.65 0.00 0.00 35.03 33.65 2dip n LYS 77 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2dip n ARG 78 N 0.33 0.00 -3.51 -1.58 3.00 -1.26 -2.99 116.66 110.65 2dip n ARG 78 Ca 0.01 0.00 -0.20 0.00 -0.00 0.00 0.00 57.85 57.66 2dip n ARG 78 Cb 0.61 -0.85 0.08 0.00 0.00 0.00 0.00 32.46 32.30 2dip n ARG 78 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2dip n ASN 79 N 2.71 -3.99 -2.20 6.15 5.15 -1.26 -4.99 115.26 116.83 2dip n ASN 79 Ca 0.01 -0.59 -0.09 0.00 -0.60 0.00 0.00 54.58 53.31 2dip n ASN 79 Cb 0.45 -5.06 -0.02 0.00 -0.53 0.00 0.00 39.78 34.62 2dip n ASN 79 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dip n GLN 80 N -4.53 0.43 -4.19 1.20 1.13 -1.16 -5.11 117.38 105.15 2dip n GLN 80 Ca -0.15 -1.68 -0.24 0.00 -1.94 0.00 0.00 57.00 52.98 2dip n GLN 80 Cb 0.62 1.62 -0.06 0.00 0.11 0.00 0.00 30.24 32.53 2dip n GLN 80 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2dip n LYS 81 N -0.35 0.70 -1.61 -1.09 4.76 -1.26 -4.87 118.16 114.44 2dip n LYS 81 Ca 0.00 -3.11 -0.29 0.00 -2.87 0.00 0.00 58.31 52.05 2dip n LYS 81 Cb 0.35 1.44 0.14 0.00 -1.84 0.00 0.00 35.03 35.12 2dip n LYS 81 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2dip s TRP 82 N -2.82 2.44 -0.08 2.13 0.52 -1.26 -2.65 118.94 117.21 2dip s TRP 82 Ca 0.13 0.78 -0.04 0.00 0.02 0.00 0.00 56.10 57.00 2dip s TRP 82 Cb 0.01 -3.46 0.04 0.00 -1.15 0.00 0.00 33.47 28.91 2dip s TRP 82 CO 0.09 -2.35 0.18 1.03 0.02 0.00 0.00 176.95 175.93 2dip s ARG 83 N -5.38 0.13 -0.19 4.98 0.52 0.17 -4.89 118.95 114.29 2dip s ARG 83 Ca 0.64 0.44 -0.29 0.00 -0.52 0.00 0.00 55.73 56.00 2dip s ARG 83 Cb -0.13 -0.16 -0.02 0.00 0.52 0.00 0.00 34.95 35.16 2dip s ARG 83 CO 0.53 -0.17 1.39 -1.54 0.02 0.00 0.00 175.30 175.52 2dip s SER 84 N 1.28 6.74 0.80 0.23 1.04 -1.26 -2.23 113.70 120.30 2dip s SER 84 Ca -0.08 1.65 -0.12 0.00 0.48 0.00 0.00 55.95 57.88 2dip s SER 84 Cb -0.11 -2.54 0.07 0.00 0.10 0.00 0.00 66.02 63.54 2dip s SER 84 CO -0.07 -0.95 1.10 -0.76 0.98 0.00 0.00 173.24 173.55 2dip s LEU 85 N 4.08 2.55 0.41 2.42 1.43 -1.25 -5.00 118.68 123.33 2dip s LEU 85 Ca 0.61 1.25 -0.07 0.00 -1.03 0.00 0.00 54.13 54.89 2dip s LEU 85 Cb -0.23 -3.84 -0.05 0.00 0.03 0.00 0.00 46.19 42.10 2dip s LEU 85 CO 0.21 -2.00 0.73 -1.61 0.23 0.00 0.00 176.35 173.92 2dip s GLU 86 N -5.19 3.64 -0.91 1.70 0.41 -1.26 -5.00 118.70 112.10 2dip s GLU 86 Ca 0.61 0.24 -0.23 0.00 -0.41 0.00 0.00 54.97 55.18 2dip s GLU 86 Cb -0.14 -2.44 0.06 0.00 -1.78 0.00 0.00 34.13 29.83 2dip s GLU 86 CO 0.54 -0.05 1.31 0.21 -0.49 0.00 0.00 175.26 176.77 2dip s LYS 87 N -4.18 3.46 -0.25 1.61 2.20 -1.26 -4.98 119.74 116.34 2dip s LYS 87 Ca 0.48 -1.02 -0.07 0.00 -0.36 0.00 0.00 55.97 55.00 2dip s LYS 87 Cb -0.10 -4.91 -0.03 0.00 -1.51 0.00 0.00 37.83 31.28 2dip s LYS 87 CO 0.37 -2.08 0.06 1.03 -0.36 0.00 0.00 175.35 174.37 2dip s ARG 88 N 4.63 3.65 0.24 4.03 0.52 -1.26 -5.07 118.95 125.69 2dip s ARG 88 Ca 0.39 -0.48 -0.31 0.00 -0.52 0.00 0.00 55.73 54.80 2dip s ARG 88 Cb -0.04 -3.30 -0.12 0.00 0.52 0.00 0.00 34.95 32.00 2dip s ARG 88 CO -0.02 -0.18 1.62 0.00 0.02 0.00 0.00 175.30 176.73 2dip n ALA 89 N 4.89 2.32 -0.74 2.13 0.00 -1.26 -4.96 120.51 122.89 2dip n ALA 89 Ca -0.16 0.40 -0.30 0.00 0.00 0.00 0.00 53.44 53.38 2dip n ALA 89 Cb 0.51 -2.45 0.25 0.00 0.00 0.00 0.00 19.45 17.77 2dip n ALA 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2dip s ASP 90 N 0.78 0.35 -0.24 0.00 1.01 -1.26 -5.06 116.67 112.24 2dip s ASP 90 Ca 0.71 0.92 -0.02 0.00 0.71 0.00 0.00 52.55 54.87 2dip s ASP 90 Cb -0.54 -1.36 0.13 0.00 1.01 0.00 0.00 42.92 42.16 2dip s ASP 90 CO 0.41 -4.51 0.35 -0.70 0.21 0.00 0.00 175.17 170.93 2dip s GLU 91 N -5.07 0.33 0.03 8.23 2.12 -1.26 -5.15 118.70 117.93 2dip s GLU 91 Ca 0.69 0.40 0.01 0.00 0.36 0.00 0.00 54.97 56.44 2dip s GLU 91 Cb -0.15 -0.60 -0.02 0.00 0.26 0.00 0.00 34.13 33.63 2dip s GLU 91 CO 0.58 -0.70 -0.06 0.08 -0.54 0.00 0.00 175.26 174.62 2dip s VAL 92 N 2.50 0.39 -0.48 3.70 1.01 -1.26 -5.04 120.40 121.23 2dip s VAL 92 Ca 0.11 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 61.12 2dip s VAL 92 Cb -0.15 -0.46 0.12 0.00 0.00 0.00 0.00 36.38 35.89 2dip s VAL 92 CO -0.17 -0.34 0.35 -0.55 0.00 0.00 0.00 175.10 174.38 2dip s SER 93 N -1.31 5.68 0.14 3.32 0.15 -1.26 -4.98 113.70 115.43 2dip s SER 93 Ca -0.10 -1.97 0.00 0.00 0.70 0.00 0.00 55.95 54.59 2dip s SER 93 Cb -0.09 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 2dip s SER 93 CO -0.00 -0.67 0.00 0.61 1.20 0.00 0.00 173.24 174.38 2dip n GLY 94 N 4.83 -3.02 3.69 9.45 0.00 -1.26 -4.98 105.19 113.90 2dip n GLY 94 Ca -0.07 -1.24 -0.29 0.00 0.00 0.00 0.00 46.02 44.43 2dip n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dip s PRO 95 N -4.09 0.65 -0.12 1.61 0.04 -1.26 -5.03 135.00 126.80 2dip s PRO 95 Ca 0.00 0.60 -0.06 0.00 0.04 0.00 0.00 61.00 61.58 2dip s PRO 95 Cb 0.00 -1.76 -0.05 0.00 0.04 0.00 0.00 34.50 32.73 2dip s PRO 95 CO 0.00 -2.60 -0.16 0.43 0.04 0.00 0.00 177.00 174.71 2dip n SER 96 N -4.10 0.88 -4.45 6.66 7.64 -1.26 -5.03 113.62 113.97 2dip n SER 96 Ca 0.06 0.15 -0.49 0.00 1.01 0.00 0.00 58.87 59.60 2dip n SER 96 Cb 0.57 -0.37 -0.04 0.00 -1.01 0.00 0.00 64.21 63.36 2dip n SER 96 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dip n SER 97 N -3.56 -0.61 0.00 6.43 2.88 -1.26 -5.31 113.62 112.18 2dip n SER 97 Ca -0.24 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 2dip n SER 97 Cb 0.67 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.13 2dip n SER 97 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42