#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 -0.02 0.32 1.61 1.04 -1.26 -5.18 113.70 110.21 2dip s SER 2 Ca 0.00 -0.36 0.06 0.00 0.48 0.00 0.00 55.95 56.13 2dip s SER 2 Cb 0.00 0.34 -0.06 0.00 0.10 0.00 0.00 66.02 66.39 2dip s SER 2 CO 0.00 -0.63 -0.00 -0.94 0.98 0.00 0.00 173.24 172.65 2dip s SER 3 N -2.28 2.80 0.26 7.02 1.04 -1.26 -5.17 113.70 116.12 2dip s SER 3 Ca -0.03 -1.29 0.02 0.00 0.48 0.00 0.00 55.95 55.14 2dip s SER 3 Cb 0.00 -0.18 -0.04 0.00 0.10 0.00 0.00 66.02 65.91 2dip s SER 3 CO -0.06 -0.46 0.18 -0.83 0.98 0.00 0.00 173.24 173.05 2dip s GLY 4 N -3.51 1.84 0.09 7.32 0.00 -1.26 -5.17 107.32 106.62 2dip s GLY 4 Ca 0.33 -1.83 -0.26 0.00 0.00 0.00 0.00 44.72 42.97 2dip s GLY 4 CO 0.14 -1.46 1.15 -0.45 0.00 0.00 0.00 173.10 172.48 2dip s SER 5 N -3.27 -0.02 0.16 1.64 0.15 -1.26 -5.19 113.70 105.91 2dip s SER 5 Ca 0.39 -0.42 -0.24 0.00 0.70 0.00 0.00 55.95 56.38 2dip s SER 5 Cb 0.05 0.33 0.07 0.00 -1.71 0.00 0.00 66.02 64.76 2dip s SER 5 CO 0.18 -0.65 0.99 -0.94 1.20 0.00 0.00 173.24 174.02 2dip s SER 6 N -3.45 -0.11 0.00 5.45 1.04 -1.26 -5.17 113.70 110.20 2dip s SER 6 Ca 0.23 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2dip s SER 6 Cb -0.01 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.60 2dip s SER 6 CO 0.02 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.91 2dip n GLY 7 N -0.54 1.39 3.61 7.32 0.00 -1.26 -5.19 105.19 110.52 2dip n GLY 7 Ca -0.05 0.49 -0.28 0.00 0.00 0.00 0.00 46.02 46.18 2dip n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dip s LEU 8 N 0.00 2.73 0.12 0.99 2.01 -1.26 -5.16 118.68 118.11 2dip s LEU 8 Ca 0.00 -1.40 0.10 0.00 0.01 0.00 0.00 54.13 52.84 2dip s LEU 8 Cb 0.00 -0.81 -0.04 0.00 0.01 0.00 0.00 46.19 45.35 2dip s LEU 8 CO 0.00 -0.51 -0.23 -0.70 1.01 0.00 0.00 176.35 175.91 2dip s GLU 9 N -3.75 1.59 0.36 1.70 2.56 -1.26 -5.15 118.70 114.75 2dip s GLU 9 Ca 0.32 -1.26 0.08 0.00 0.00 0.00 0.00 54.97 54.11 2dip s GLU 9 Cb 0.09 -1.99 -0.04 0.00 2.00 0.00 0.00 34.13 34.19 2dip s GLU 9 CO 0.16 0.47 0.19 -1.21 -0.56 0.00 0.00 175.26 174.31 2dip s GLU 10 N -2.02 2.39 0.48 4.30 2.02 -1.26 -5.15 118.70 119.46 2dip s GLU 10 Ca 0.15 -1.59 0.02 0.00 0.02 0.00 0.00 54.97 53.58 2dip s GLU 10 Cb -0.10 -2.18 -0.01 0.00 0.10 0.00 0.00 34.13 31.93 2dip s GLU 10 CO 0.07 0.03 0.06 -0.59 0.02 0.00 0.00 175.26 174.85 2dip s PHE 11 N -2.46 1.79 -0.12 1.61 -0.71 -1.26 -5.17 117.98 111.67 2dip s PHE 11 Ca 0.40 -1.12 -0.30 0.00 -1.04 0.00 0.00 56.93 54.87 2dip s PHE 11 Cb -0.02 -1.42 0.11 0.00 -1.21 0.00 0.00 43.02 40.48 2dip s PHE 11 CO 0.24 -0.01 0.91 0.21 -1.34 0.00 0.00 175.22 175.23 2dip s LYS 12 N -3.81 0.73 0.24 1.99 2.47 -1.26 -5.19 119.74 114.92 2dip s LYS 12 Ca 0.10 0.12 -0.17 0.00 -1.56 0.00 0.00 55.97 54.46 2dip s LYS 12 Cb 0.01 0.34 0.01 0.00 -1.46 0.00 0.00 37.83 36.74 2dip s LYS 12 CO 0.07 -0.24 0.57 0.54 0.16 0.00 0.00 175.35 176.44 2dip s ASN 13 N -1.29 -0.19 0.20 1.43 2.20 -1.26 -5.19 114.94 110.84 2dip s ASN 13 Ca -0.03 -0.69 -0.22 0.00 -0.94 0.00 0.00 52.86 50.98 2dip s ASN 13 Cb -0.00 0.63 0.07 0.00 -2.00 0.00 0.00 41.25 39.95 2dip s ASN 13 CO 0.02 -1.18 1.01 -0.94 -2.94 0.00 0.00 177.10 173.07 2dip s SER 14 N -2.94 -0.02 0.33 3.54 1.04 -1.26 -5.19 113.70 109.19 2dip s SER 14 Ca 0.15 -0.69 -0.18 0.00 0.48 0.00 0.00 55.95 55.71 2dip s SER 14 Cb -0.02 0.53 0.04 0.00 0.10 0.00 0.00 66.02 66.67 2dip s SER 14 CO 0.05 -1.05 0.78 -0.94 0.98 0.00 0.00 173.24 173.07 2dip s SER 15 N -3.32 -0.10 0.09 7.02 1.04 -1.26 -5.18 113.70 111.99 2dip s SER 15 Ca 0.20 -0.89 0.07 0.00 0.48 0.00 0.00 55.95 55.81 2dip s SER 15 Cb -0.03 0.77 -0.04 0.00 0.10 0.00 0.00 66.02 66.83 2dip s SER 15 CO 0.05 -1.50 -0.10 -0.75 0.98 0.00 0.00 173.24 171.92 2dip s LYS 16 N -2.94 2.17 -0.23 4.02 2.20 -1.26 -5.11 119.74 118.58 2dip s LYS 16 Ca 0.14 -0.99 -0.03 0.00 -0.36 0.00 0.00 55.97 54.74 2dip s LYS 16 Cb -0.05 -2.32 0.07 0.00 -1.51 0.00 0.00 37.83 34.02 2dip s LYS 16 CO 0.09 0.52 0.06 -1.17 -0.36 0.00 0.00 175.35 174.49 2dip s LEU 17 N -2.05 1.31 -0.06 5.43 0.20 -1.26 -5.11 118.68 117.14 2dip s LEU 17 Ca 0.20 -1.03 -0.02 0.00 0.69 0.00 0.00 54.13 53.97 2dip s LEU 17 Cb -0.11 -0.62 0.04 0.00 -0.43 0.00 0.00 46.19 45.07 2dip s LEU 17 CO 0.12 -0.34 0.11 -0.69 -0.29 0.00 0.00 176.35 175.26 2dip s VAL 18 N 1.84 -0.11 0.40 1.68 1.01 -1.26 -5.13 120.40 118.83 2dip s VAL 18 Ca 0.02 0.27 -0.22 0.00 0.00 0.00 0.00 61.98 62.05 2dip s VAL 18 Cb -0.17 -0.21 -0.15 0.00 0.00 0.00 0.00 36.38 35.85 2dip s VAL 18 CO -0.14 0.11 0.18 0.00 0.00 0.00 0.00 175.10 175.25 2dip n ALA 19 N 4.63 -2.73 -3.47 5.51 0.00 -1.26 -4.99 120.51 118.20 2dip n ALA 19 Ca -0.18 0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.23 2dip n ALA 19 Cb 0.51 -1.53 -0.05 0.00 0.00 0.00 0.00 19.45 18.37 2dip n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dip s ALA 20 N -1.62 -1.67 -1.25 0.00 0.00 -1.26 -4.96 121.76 111.00 2dip s ALA 20 Ca 0.60 1.06 -0.06 0.00 0.00 0.00 0.00 51.96 53.56 2dip s ALA 20 Cb -0.64 0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.71 2dip s ALA 20 CO 0.62 -0.46 1.08 0.00 0.00 0.00 0.00 175.76 176.99 2dip n ALA 21 N 0.60 -1.41 -3.34 0.00 0.00 -1.26 -4.96 120.51 110.14 2dip n ALA 21 Ca -0.19 0.27 -0.45 0.00 0.00 0.00 0.00 53.44 53.07 2dip n ALA 21 Cb 0.59 -4.50 -0.05 0.00 0.00 0.00 0.00 19.45 15.49 2dip n ALA 21 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2dip s GLU 22 N -6.00 2.98 -1.57 0.00 2.56 -1.26 -4.63 118.70 110.78 2dip s GLU 22 Ca 0.41 -1.78 -0.03 0.00 0.00 0.00 0.00 54.97 53.57 2dip s GLU 22 Cb -0.18 -4.27 0.03 0.00 2.00 0.00 0.00 34.13 31.71 2dip s GLU 22 CO 0.69 -1.31 0.12 1.17 -0.56 0.00 0.00 175.26 175.37 2dip n LYS 23 N 5.11 -1.21 -4.02 4.30 3.00 -1.26 -4.92 118.16 119.15 2dip n LYS 23 Ca -0.11 0.13 -0.26 0.00 -0.00 0.00 0.00 58.31 58.07 2dip n LYS 23 Cb 0.41 -3.83 -0.17 0.00 0.00 0.00 0.00 35.03 31.44 2dip n LYS 23 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 2dip s GLU 24 N -7.28 1.54 0.25 1.64 2.02 -1.26 -5.14 118.70 110.48 2dip s GLU 24 Ca 0.10 -0.28 0.00 0.00 0.02 0.00 0.00 54.97 54.82 2dip s GLU 24 Cb -0.06 -1.54 -0.00 0.00 0.10 0.00 0.00 34.13 32.63 2dip s GLU 24 CO 0.99 -0.22 0.01 2.89 0.02 0.00 0.00 175.26 178.96 2dip n ARG 25 N 4.74 1.27 -3.91 1.61 -4.01 -1.26 -4.72 116.66 110.37 2dip n ARG 25 Ca -0.14 -1.89 -0.29 0.00 -1.04 0.00 0.00 57.85 54.49 2dip n ARG 25 Cb 0.50 0.58 -0.04 0.00 -3.04 0.00 0.00 32.46 30.47 2dip n ARG 25 CO 0.00 0.00 0.00 -1.17 -3.04 0.00 0.00 177.63 173.42 2dip s LEU 26 N 0.00 4.34 -0.56 2.89 2.96 -1.26 -4.98 118.68 122.07 2dip s LEU 26 Ca 0.02 0.24 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 2dip s LEU 26 Cb 0.00 -2.96 0.28 0.00 0.50 0.00 0.00 46.19 44.01 2dip s LEU 26 CO 0.01 0.11 2.20 0.47 -1.32 0.00 0.00 176.35 177.82 2dip n ASP 27 N -0.13 7.06 0.04 3.68 8.00 -1.26 -4.33 116.55 129.61 2dip n ASP 27 Ca -0.06 -3.47 -0.00 0.00 0.71 0.00 0.00 54.79 51.97 2dip n ASP 27 Cb 0.52 -1.08 -0.00 0.00 -0.02 0.00 0.00 41.12 40.55 2dip n ASP 27 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2dip n LYS 28 N -0.09 0.01 -3.49 -1.24 4.01 -1.26 -4.97 118.16 111.13 2dip n LYS 28 Ca 0.49 0.00 -0.27 0.00 -0.51 0.00 0.00 58.31 58.02 2dip n LYS 28 Cb 0.53 -0.52 -0.10 0.00 -0.51 0.00 0.00 35.03 34.43 2dip n LYS 28 CO 0.00 0.00 0.00 -2.39 -1.11 0.00 0.00 177.40 173.90 2dip n HIS 29 N -3.41 0.17 -0.18 2.13 1.44 -1.26 -4.96 115.22 109.14 2dip n HIS 29 Ca -0.00 -3.57 -0.09 0.00 -2.01 0.00 0.00 57.72 52.04 2dip n HIS 29 Cb 0.12 -0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.23 2dip n HIS 29 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2dip h LEU 30 N 5.41 0.85 0.00 2.39 3.38 -1.94 -3.41 115.31 121.99 2dip h LEU 30 Ca 0.23 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2dip h LEU 30 Cb 0.87 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2dip h LEU 30 CO 0.47 0.91 0.00 0.61 0.09 0.00 0.00 178.44 180.52 2dip n GLY 31 N -0.48 0.98 3.03 0.83 0.00 -1.26 -4.43 105.19 103.86 2dip n GLY 31 Ca 0.01 0.20 -0.13 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.02 0.73 -0.61 1.01 -1.26 -5.14 121.20 115.91 2dip s ILE 32 Ca 0.00 0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.60 2dip s ILE 32 Cb 0.00 -0.27 0.04 0.00 0.01 0.00 0.00 42.46 42.23 2dip s ILE 32 CO 0.00 0.03 1.10 -2.16 0.00 0.00 0.00 174.94 173.91 2dip s PRO 33 N 0.57 2.45 0.65 2.79 0.04 -1.26 -4.75 135.00 135.48 2dip s PRO 33 Ca -0.04 1.25 -0.17 0.00 0.04 0.00 0.00 61.00 62.09 2dip s PRO 33 Cb -0.05 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.56 2dip s PRO 33 CO -0.03 -1.50 1.16 0.00 0.04 0.00 0.00 177.00 176.67 2dip n ASN 35 N -2.14 0.40 0.00 0.00 4.13 0.29 -3.26 115.26 114.67 2dip n ASN 35 Ca 0.12 0.16 0.00 0.00 1.68 0.00 0.00 54.58 56.54 2dip n ASN 35 Cb 0.51 1.18 0.00 0.00 -1.54 0.00 0.00 39.78 39.93 2dip n ASN 35 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2dip n ASN 36 N -2.51 0.00 0.17 6.41 5.15 -1.26 -4.61 115.26 118.61 2dip n ASN 36 Ca -0.05 0.12 0.04 0.00 -0.60 0.00 0.00 54.58 54.08 2dip n ASN 36 Cb 0.63 -0.30 0.25 0.00 -0.53 0.00 0.00 39.78 39.83 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 -3.53 -4.40 -2.81 0.00 4.76 -1.20 -4.98 118.16 105.99 2dip n LYS 38 Ca -0.00 0.48 -0.42 0.00 -2.87 0.00 0.00 58.31 55.50 2dip n LYS 38 Cb 0.57 -4.44 -0.03 0.00 -1.84 0.00 0.00 35.03 29.29 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 -5.52 4.32 -0.11 1.97 0.74 -1.26 -4.72 119.66 115.08 2dip s GLN 39 Ca 0.26 1.15 -0.05 0.00 0.05 0.00 0.00 55.36 56.77 2dip s GLN 39 Cb -0.11 -3.58 0.05 0.00 1.10 0.00 0.00 33.01 30.47 2dip s GLN 39 CO 0.42 -0.36 0.26 0.12 -0.55 0.00 0.00 175.29 175.17 2dip s PHE 40 N 2.25 -0.37 0.99 1.67 5.36 -1.26 -3.08 117.98 123.55 2dip s PHE 40 Ca 0.41 0.86 -0.12 0.00 -0.96 0.00 0.00 56.93 57.12 2dip s PHE 40 Cb -0.17 0.03 0.18 0.00 -0.34 0.00 0.00 43.02 42.73 2dip s PHE 40 CO 0.13 -0.27 1.09 -1.25 -1.46 0.00 0.00 175.22 173.46 2dip s PRO 41 N 1.61 0.48 -1.10 10.12 0.04 -1.26 -4.78 135.00 140.11 2dip s PRO 41 Ca -0.06 0.54 -0.12 0.00 0.04 0.00 0.00 61.00 61.40 2dip s PRO 41 Cb -0.11 -1.74 0.22 0.00 0.04 0.00 0.00 34.50 32.91 2dip s PRO 41 CO -0.09 -2.70 1.20 0.42 0.04 0.00 0.00 177.00 175.88 2dip s ILE 42 N -2.96 5.47 0.23 0.56 1.01 -1.24 -4.89 121.20 119.38 2dip s ILE 42 Ca 0.65 -2.86 -0.16 0.00 0.00 0.00 0.00 60.65 58.29 2dip s ILE 42 Cb -0.18 -4.73 0.27 0.00 0.01 0.00 0.00 42.46 37.83 2dip s ILE 42 CO 0.58 -1.37 1.56 -0.33 0.00 0.00 0.00 174.94 175.38 2dip h GLU 43 N 7.16 -0.03 0.00 2.79 4.39 -1.92 -3.41 114.58 123.56 2dip h GLU 43 Ca 0.22 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.75 2dip h GLU 43 Cb 0.90 0.01 0.09 0.00 -0.10 0.00 0.00 28.75 29.65 2dip h GLU 43 CO 1.09 -0.02 0.03 0.41 -1.16 0.00 0.00 179.01 179.35 2dip n GLY 44 N -1.50 -2.84 3.34 -3.84 0.00 -1.26 -5.01 105.19 94.08 2dip n GLY 44 Ca 0.10 -1.43 -0.30 0.00 0.00 0.00 0.00 46.02 44.40 2dip n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dip s LYS 45 N -4.10 -2.41 -0.13 1.61 -0.14 -1.26 -4.72 119.74 108.59 2dip s LYS 45 Ca 0.32 0.43 0.03 0.00 -1.36 0.00 0.00 55.97 55.39 2dip s LYS 45 Cb -0.04 -1.41 0.01 0.00 -1.68 0.00 0.00 37.83 34.71 2dip s LYS 45 CO 0.25 -4.61 -0.22 0.00 -0.76 0.00 0.00 175.35 170.01 2dip s TYR 47 N 0.65 2.45 -0.03 0.00 1.51 0.52 -2.83 117.35 119.62 2dip s TYR 47 Ca -0.11 -0.30 -0.03 0.00 -1.01 0.00 0.00 57.07 55.62 2dip s TYR 47 Cb -0.16 -1.21 0.01 0.00 -0.11 0.00 0.00 41.96 40.48 2dip s TYR 47 CO 0.02 0.49 0.08 0.21 -1.11 0.00 0.00 175.55 175.24 2dip s LYS 48 N -2.68 0.10 -0.23 -0.62 2.20 -0.58 -0.61 119.74 117.31 2dip s LYS 48 Ca 0.22 0.10 -0.21 0.00 -0.36 0.00 0.00 55.97 55.72 2dip s LYS 48 Cb -0.08 0.05 -0.02 0.00 -1.51 0.00 0.00 37.83 36.27 2dip s LYS 48 CO 0.12 -0.01 0.66 0.00 -0.36 0.00 0.00 175.35 175.76 2dip n THR 50 N 5.02 0.26 0.00 0.00 -2.24 -0.24 -3.49 114.28 113.59 2dip n THR 50 Ca 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2dip n THR 50 Cb 0.49 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 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 0.01 2.78 -1.81 -0.78 1.02 -1.26 -4.97 120.64 115.63 2dip n GLU 51 Ca 0.06 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.10 2dip n GLU 51 Cb 0.17 -0.99 0.04 0.00 -0.02 0.00 0.00 31.44 30.63 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 -0.97 3.37 -1.76 0.00 -1.09 -1.26 -4.64 121.20 114.85 2dip s ILE 53 Ca 0.30 -0.55 -0.16 0.00 -2.23 0.00 0.00 60.65 58.02 2dip s ILE 53 Cb -0.02 -2.43 0.15 0.00 -1.58 0.00 0.00 42.46 38.58 2dip s ILE 53 CO 0.20 0.52 0.43 -1.84 -1.23 0.00 0.00 174.94 173.02 2dip n GLU 54 N 3.40 -1.07 -4.19 2.79 0.28 -1.26 -4.90 120.64 115.69 2dip n GLU 54 Ca -0.18 0.15 -0.35 0.00 -0.16 0.00 0.00 57.16 56.63 2dip n GLU 54 Cb 0.53 -4.40 -0.10 0.00 1.43 0.00 0.00 31.44 28.90 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 -3.62 3.21 -0.06 -1.84 6.14 -1.26 -4.99 117.35 114.93 2dip s TYR 55 Ca 0.55 0.08 -0.10 0.00 0.64 0.00 0.00 57.07 58.23 2dip s TYR 55 Cb -0.32 -1.95 0.02 0.00 0.42 0.00 0.00 41.96 40.13 2dip s TYR 55 CO 1.01 0.27 0.25 -1.01 0.64 0.00 0.00 175.55 176.71 2dip s HIS 56 N -0.15 -0.20 0.35 4.97 3.76 -1.26 -1.84 115.29 120.91 2dip s HIS 56 Ca 0.06 0.43 0.06 0.00 -0.15 0.00 0.00 55.06 55.46 2dip s HIS 56 Cb -0.12 0.07 -0.07 0.00 1.11 0.00 0.00 32.58 33.57 2dip s HIS 56 CO 0.02 -0.24 0.01 -0.51 -0.85 0.00 0.00 174.74 173.17 2dip s LEU 57 N -0.55 2.52 0.05 0.89 1.43 0.22 0.11 118.68 123.34 2dip s LEU 57 Ca -0.06 -1.33 0.06 0.00 -1.03 0.00 0.00 54.13 51.77 2dip s LEU 57 Cb -0.04 -0.66 -0.03 0.00 0.03 0.00 0.00 46.19 45.49 2dip s LEU 57 CO 0.02 -0.47 -0.12 0.00 0.23 0.00 0.00 176.35 176.00 2dip n GLN 59 N 1.30 -0.04 0.17 0.00 -0.06 -1.17 -0.24 117.38 117.34 2dip n GLN 59 Ca -0.15 0.99 -0.07 0.00 -2.00 0.00 0.00 57.00 55.77 2dip n GLN 59 Cb 0.52 -1.85 -0.03 0.00 -4.06 0.00 0.00 30.24 24.82 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 -0.41 -0.98 3.69 4.57 -1.94 -2.26 114.58 117.26 2dip h GLU 60 Ca 0.65 0.03 0.24 0.00 -1.18 0.00 0.00 59.36 59.09 2dip h GLU 60 Cb 1.89 0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 30.50 2dip h GLU 60 CO -0.47 -0.27 0.64 0.00 -1.18 0.00 0.00 179.01 177.73 2dip h PHE 62 N 0.37 0.01 -0.08 0.00 3.57 -0.99 -1.80 116.94 118.02 2dip h PHE 62 Ca 0.52 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 62.05 2dip h PHE 62 Cb 1.38 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.11 2dip h PHE 62 CO -0.00 0.16 0.09 0.22 -2.23 0.00 0.00 178.31 176.55 2dip h ASP 63 N 0.01 0.00 1.50 0.41 3.58 0.63 0.13 116.42 122.68 2dip h ASP 63 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2dip h ASP 63 Cb 0.28 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2dip h ASP 63 CO 0.02 0.00 -0.38 -1.28 -2.88 0.00 0.00 179.24 174.72 2dip h SER 64 N 0.00 0.00 -6.03 2.28 0.87 -1.40 -3.48 113.55 105.80 2dip h SER 64 Ca 0.04 -0.02 -0.45 0.00 -1.23 0.00 0.00 61.79 60.13 2dip h SER 64 Cb 0.22 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2dip h SER 64 CO -0.00 0.01 -0.72 -1.22 -0.53 0.00 0.00 176.83 174.37 2dip n TYR 65 N -2.77 -2.44 -0.02 2.24 4.02 0.47 -4.92 117.16 113.75 2dip n TYR 65 Ca 0.03 0.90 -0.01 0.00 -0.01 0.00 0.00 57.90 58.80 2dip n TYR 65 Cb 0.52 -4.27 -0.01 0.00 -0.02 0.00 0.00 39.34 35.57 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 -4.81 0.31 -0.55 0.00 -0.00 -1.26 -3.66 115.22 105.26 2dip n HIS 67 Ca -0.01 0.11 0.46 0.00 -0.00 0.00 0.00 57.72 58.27 2dip n HIS 67 Cb 0.03 -0.67 0.74 0.00 -0.00 0.00 0.00 29.99 30.09 2dip n HIS 67 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2dip h LEU 68 N 0.00 0.00 -1.40 0.27 -0.00 -1.94 0.21 115.31 112.45 2dip h LEU 68 Ca 0.00 0.00 0.42 0.00 -0.00 0.00 0.00 57.88 58.30 2dip h LEU 68 Cb 0.45 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 40.99 2dip h LEU 68 CO 0.00 0.00 0.83 0.28 -0.00 0.00 0.00 178.44 179.55 2dip h SER 69 N 0.00 0.26 -2.68 -0.43 0.02 -1.81 -3.39 113.55 105.51 2dip h SER 69 Ca 0.79 0.14 -0.51 0.00 -0.84 0.00 0.00 61.79 61.37 2dip h SER 69 Cb 3.38 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 66.03 2dip h SER 69 CO -0.01 -0.17 -0.34 -1.00 -1.14 0.00 0.00 176.83 174.17 2dip s HIS 70 N -5.31 3.48 -0.54 3.45 3.76 0.73 -5.02 115.29 115.83 2dip s HIS 70 Ca -0.08 0.25 -0.27 0.00 -0.15 0.00 0.00 55.06 54.82 2dip s HIS 70 Cb 0.30 -1.79 -0.03 0.00 1.11 0.00 0.00 32.58 32.17 2dip s HIS 70 CO 0.82 0.36 1.93 0.99 -0.85 0.00 0.00 174.74 177.99 2dip s THR 71 N -1.96 3.33 0.22 1.30 2.01 -1.26 -4.94 115.64 114.33 2dip s THR 71 Ca 0.37 0.23 0.04 0.00 0.31 0.00 0.00 61.69 62.64 2dip s THR 71 Cb -0.10 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 2dip s THR 71 CO 0.30 -0.69 0.35 -0.36 -0.69 0.00 0.00 174.62 173.53 2dip s PHE 72 N 9.13 3.47 -0.00 4.92 0.40 -1.26 -1.08 117.98 133.56 2dip s PHE 72 Ca 0.74 0.06 0.00 0.00 -0.60 0.00 0.00 56.93 57.13 2dip s PHE 72 Cb -0.15 -1.63 0.00 0.00 0.51 0.00 0.00 43.02 41.75 2dip s PHE 72 CO 0.24 0.44 -0.01 0.95 0.70 0.00 0.00 175.22 177.54 2dip s THR 73 N -1.92 0.09 0.16 0.64 -4.23 -0.31 -4.37 115.64 105.70 2dip s THR 73 Ca 0.35 -0.02 0.05 0.00 -1.18 0.00 0.00 61.69 60.89 2dip s THR 73 Cb -0.10 -0.10 -0.04 0.00 1.34 0.00 0.00 72.50 73.60 2dip s THR 73 CO 0.29 0.04 0.11 0.72 -0.54 0.00 0.00 174.62 175.24 2dip s PHE 74 N 0.12 3.10 0.58 3.99 -0.71 -1.13 -1.53 117.98 122.40 2dip s PHE 74 Ca -0.01 -0.03 0.09 0.00 -1.04 0.00 0.00 56.93 55.94 2dip s PHE 74 Cb -0.02 -1.50 0.08 0.00 -1.21 0.00 0.00 43.02 40.37 2dip s PHE 74 CO -0.00 0.52 0.75 -0.98 -1.34 0.00 0.00 175.22 174.16 2dip s ARG 75 N -3.02 2.27 0.26 1.99 1.04 -1.13 -1.88 118.95 118.48 2dip s ARG 75 Ca 0.30 -1.72 0.04 0.00 -1.04 0.00 0.00 55.73 53.31 2dip s ARG 75 Cb -0.10 -2.56 -0.05 0.00 -2.04 0.00 0.00 34.95 30.19 2dip s ARG 75 CO 0.22 -0.86 0.01 -1.21 -0.04 0.00 0.00 175.30 173.42 2dip s GLU 76 N -4.63 1.42 1.04 3.89 2.02 -1.26 -4.83 118.70 116.35 2dip s GLU 76 Ca 0.58 -1.74 -0.18 0.00 0.02 0.00 0.00 54.97 53.65 2dip s GLU 76 Cb -0.05 -0.71 0.01 0.00 0.10 0.00 0.00 34.13 33.47 2dip s GLU 76 CO 0.37 -0.11 -0.20 0.36 0.02 0.00 0.00 175.26 175.70 2dip n LYS 77 N -0.49 -0.77 -0.86 1.61 2.85 -1.26 -4.67 118.16 114.58 2dip n LYS 77 Ca -0.04 -0.20 -0.31 0.00 -1.05 0.00 0.00 58.31 56.70 2dip n LYS 77 Cb 0.64 -1.56 0.03 0.00 -0.65 0.00 0.00 35.03 33.50 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 -0.72 0.00 -3.75 -1.58 3.00 -1.26 -3.07 116.66 109.27 2dip n ARG 78 Ca 0.02 0.00 -0.25 0.00 -0.00 0.00 0.00 57.85 57.61 2dip n ARG 78 Cb 0.61 -0.86 0.02 0.00 0.00 0.00 0.00 32.46 32.23 2dip n ARG 78 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2dip n ASN 79 N 2.99 -2.42 -2.18 6.15 0.23 -1.26 -4.97 115.26 113.81 2dip n ASN 79 Ca -0.02 -0.93 -0.08 0.00 -0.53 0.00 0.00 54.58 53.02 2dip n ASN 79 Cb 0.48 -3.60 -0.00 0.00 -2.08 0.00 0.00 39.78 34.58 2dip n ASN 79 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dip n GLN 80 N -4.24 0.55 -3.90 -3.83 1.13 -1.18 -5.12 117.38 100.79 2dip n GLN 80 Ca -0.23 -1.58 -0.09 0.00 -1.94 0.00 0.00 57.00 53.15 2dip n GLN 80 Cb 0.65 1.69 -0.09 0.00 0.11 0.00 0.00 30.24 32.61 2dip n GLN 80 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 2dip s LYS 81 N -2.31 0.67 1.26 -1.09 0.00 -1.26 -4.90 119.74 112.11 2dip s LYS 81 Ca 0.14 -0.79 -0.16 0.00 0.00 0.00 0.00 55.97 55.17 2dip s LYS 81 Cb -0.02 0.27 0.31 0.00 0.00 0.00 0.00 37.83 38.39 2dip s LYS 81 CO 0.11 -0.18 0.92 0.91 0.00 0.00 0.00 175.35 177.10 2dip n TRP 82 N 0.54 -1.93 -3.59 1.78 7.02 -1.26 -4.28 117.44 115.73 2dip n TRP 82 Ca -0.18 -0.31 -0.04 0.00 -1.02 0.00 0.00 57.50 55.95 2dip n TRP 82 Cb 0.59 -1.60 -0.02 0.00 -2.42 0.00 0.00 31.31 27.87 2dip n TRP 82 CO 0.00 0.00 0.00 -0.98 -2.02 0.00 0.00 177.69 174.69 2dip s ARG 83 N -4.45 0.37 0.89 -0.99 1.70 -0.79 -4.98 118.95 110.70 2dip s ARG 83 Ca 0.68 -0.14 -0.11 0.00 -0.47 0.00 0.00 55.73 55.68 2dip s ARG 83 Cb -0.22 0.17 0.11 0.00 -0.57 0.00 0.00 34.95 34.43 2dip s ARG 83 CO 0.64 -0.16 1.02 0.45 -1.08 0.00 0.00 175.30 176.17 2dip n SER 84 N -0.14 0.06 -4.95 -2.89 2.88 -1.26 -2.83 113.62 104.49 2dip n SER 84 Ca -0.01 0.45 -0.22 0.00 -1.33 0.00 0.00 58.87 57.76 2dip n SER 84 Cb 0.59 -1.43 -0.02 0.00 -0.75 0.00 0.00 64.21 62.59 2dip n SER 84 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2dip s LEU 85 N -5.27 4.27 -0.06 2.46 1.43 -1.26 -4.80 118.68 115.45 2dip s LEU 85 Ca 0.67 0.06 -0.30 0.00 -1.03 0.00 0.00 54.13 53.53 2dip s LEU 85 Cb -0.25 -2.82 -0.06 0.00 0.03 0.00 0.00 46.19 43.10 2dip s LEU 85 CO 0.58 -0.04 1.72 -1.83 0.23 0.00 0.00 176.35 177.01 2dip s GLU 86 N -3.81 4.11 -0.36 1.70 -1.05 -1.26 -4.88 118.70 113.15 2dip s GLU 86 Ca 0.34 2.21 -0.31 0.00 -0.15 0.00 0.00 54.97 57.06 2dip s GLU 86 Cb -0.09 -4.03 -0.09 0.00 -0.44 0.00 0.00 34.13 29.48 2dip s GLU 86 CO 0.28 -0.94 2.27 1.63 0.95 0.00 0.00 175.26 179.45 2dip n LYS 87 N 7.29 1.34 -3.67 -4.83 5.02 -1.26 -4.90 118.16 117.14 2dip n LYS 87 Ca 0.18 0.31 -0.30 0.00 -2.02 0.00 0.00 58.31 56.49 2dip n LYS 87 Cb 0.43 -2.86 -0.14 0.00 -0.02 0.00 0.00 35.03 32.44 2dip n LYS 87 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2dip s ARG 88 N 6.76 0.87 -0.68 1.97 0.52 -1.26 -5.04 118.95 122.09 2dip s ARG 88 Ca 1.06 -1.44 0.05 0.00 -0.52 0.00 0.00 55.73 54.88 2dip s ARG 88 Cb -0.58 -1.97 0.17 0.00 0.52 0.00 0.00 34.95 33.10 2dip s ARG 88 CO 0.40 -1.09 0.49 0.00 0.02 0.00 0.00 175.30 175.12 2dip n ALA 89 N 4.25 3.38 -3.86 2.13 0.00 -1.26 -5.05 120.51 120.10 2dip n ALA 89 Ca 0.04 -4.41 -0.05 0.00 0.00 0.00 0.00 53.44 49.03 2dip n ALA 89 Cb 0.38 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.85 2dip n ALA 89 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2dip s ASP 90 N -1.36 -0.01 0.10 0.00 1.47 -1.26 -5.15 116.67 110.47 2dip s ASP 90 Ca 0.26 -0.78 -0.30 0.00 1.18 0.00 0.00 52.55 52.91 2dip s ASP 90 Cb -0.03 0.59 -0.05 0.00 -0.34 0.00 0.00 42.92 43.09 2dip s ASP 90 CO -0.17 -1.17 0.96 -1.83 0.68 0.00 0.00 175.17 173.64 2dip s GLU 91 N -2.29 4.68 -0.02 2.11 -1.05 -1.26 -5.05 118.70 115.82 2dip s GLU 91 Ca 0.20 1.45 0.04 0.00 -0.15 0.00 0.00 54.97 56.50 2dip s GLU 91 Cb -0.03 -3.39 -0.01 0.00 -0.44 0.00 0.00 34.13 30.27 2dip s GLU 91 CO 0.07 0.18 -0.14 0.54 0.95 0.00 0.00 175.26 176.86 2dip s VAL 92 N 0.12 1.15 -0.01 1.83 0.11 -1.26 -5.14 120.40 117.20 2dip s VAL 92 Ca 0.48 -0.59 0.05 0.00 -2.93 0.00 0.00 61.98 58.99 2dip s VAL 92 Cb -0.23 -0.98 -0.03 0.00 -1.53 0.00 0.00 36.38 33.61 2dip s VAL 92 CO 0.30 0.33 -0.16 -0.55 -3.33 0.00 0.00 175.10 171.69 2dip s SER 93 N -0.09 3.95 -0.31 3.54 0.15 -1.26 -5.08 113.70 114.59 2dip s SER 93 Ca 0.01 -0.29 -0.11 0.00 0.70 0.00 0.00 55.95 56.25 2dip s SER 93 Cb -0.08 -0.75 0.19 0.00 -1.71 0.00 0.00 66.02 63.66 2dip s SER 93 CO 0.01 0.30 1.08 -0.83 1.20 0.00 0.00 173.24 175.00 2dip s GLY 94 N -1.07 -1.40 1.05 9.45 0.00 -1.26 -5.17 107.32 108.92 2dip s GLY 94 Ca 0.13 1.57 -0.14 0.00 0.00 0.00 0.00 44.72 46.28 2dip s GLY 94 CO 0.03 4.31 1.10 2.56 0.00 0.00 0.00 173.10 181.09 2dip s PRO 95 N 2.22 0.01 0.16 2.90 0.04 -1.26 -5.09 135.00 133.98 2dip s PRO 95 Ca 0.18 0.38 -0.16 0.00 0.04 0.00 0.00 61.00 61.44 2dip s PRO 95 Cb 0.03 -1.70 0.03 0.00 0.04 0.00 0.00 34.50 32.89 2dip s PRO 95 CO -0.17 -2.98 0.44 0.45 0.04 0.00 0.00 177.00 174.78 2dip s SER 96 N -3.54 -0.21 0.13 6.66 0.15 -1.26 -5.18 113.70 110.45 2dip s SER 96 Ca 0.67 -0.46 -0.20 0.00 0.70 0.00 0.00 55.95 56.66 2dip s SER 96 Cb -0.17 0.51 0.05 0.00 -1.71 0.00 0.00 66.02 64.71 2dip s SER 96 CO 0.57 -0.94 0.50 -0.55 1.20 0.00 0.00 173.24 174.02 2dip s SER 97 N -2.85 -0.40 0.00 5.45 0.15 -1.26 -5.38 113.70 109.41 2dip s SER 97 Ca 0.07 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.60 2dip s SER 97 Cb 0.01 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 2dip s SER 97 CO -0.07 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.10