#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e2u s ARG 28 N 0.00 1.56 0.18 1.96 3.00 -1.26 -5.05 118.95 119.34 3e2u s ARG 28 Ca 0.00 -1.84 -0.33 0.00 0.00 0.00 0.00 55.73 53.56 3e2u s ARG 28 Cb 0.00 -0.83 -0.15 0.00 0.00 0.00 0.00 34.95 33.97 3e2u s ARG 28 CO 0.00 -0.14 1.28 0.28 0.00 0.00 0.00 175.30 176.72 3e2u n VAL 29 N -0.60 0.76 0.00 3.52 0.31 -1.26 -0.97 118.33 120.08 3e2u n VAL 29 Ca -0.03 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 3e2u n VAL 29 Cb 0.66 -1.07 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 3e2u n VAL 29 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3e2u n GLY 30 N 2.20 2.66 3.46 2.92 0.00 -0.31 -5.03 105.19 111.10 3e2u n GLY 30 Ca 0.14 -0.34 -0.51 0.00 0.00 0.00 0.00 46.02 45.32 3e2u n GLY 30 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3e2u n SER 31 N 0.28 -0.40 -4.74 1.61 7.64 -0.14 -4.58 113.62 113.29 3e2u n SER 31 Ca 0.00 1.14 -0.39 0.00 1.01 0.00 0.00 58.87 60.63 3e2u n SER 31 Cb 0.00 -1.01 -0.05 0.00 -1.01 0.00 0.00 64.21 62.14 3e2u n SER 31 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3e2u s ARG 32 N -0.72 4.39 0.08 1.43 1.81 -1.26 -0.97 118.95 123.72 3e2u s ARG 32 Ca 0.71 0.84 0.01 0.00 -1.72 0.00 0.00 55.73 55.57 3e2u s ARG 32 Cb -0.98 -3.38 -0.04 0.00 -0.45 0.00 0.00 34.95 30.10 3e2u s ARG 32 CO 0.56 0.26 -0.06 0.14 -0.68 0.00 0.00 175.30 175.52 3e2u s VAL 33 N 0.13 0.58 -0.04 3.52 -7.23 -0.62 -3.26 120.40 113.49 3e2u s VAL 33 Ca 0.34 -1.84 0.07 0.00 -1.81 0.00 0.00 61.98 58.74 3e2u s VAL 33 Cb -0.18 -1.56 -0.02 0.00 0.56 0.00 0.00 36.38 35.18 3e2u s VAL 33 CO 0.18 -0.86 -0.25 -0.70 -0.31 0.00 0.00 175.10 173.16 3e2u s GLU 34 N -3.67 2.36 -0.36 4.82 2.12 0.66 -0.95 118.70 123.67 3e2u s GLU 34 Ca 0.09 -0.91 -0.29 0.00 0.36 0.00 0.00 54.97 54.22 3e2u s GLU 34 Cb 0.05 -2.12 0.01 0.00 0.26 0.00 0.00 34.13 32.33 3e2u s GLU 34 CO -0.05 0.46 1.25 0.08 -0.54 0.00 0.00 175.26 176.46 3e2u s VAL 35 N -0.37 4.17 0.22 3.70 1.01 0.51 -1.14 120.40 128.50 3e2u s VAL 35 Ca 0.03 1.28 -0.31 0.00 0.00 0.00 0.00 61.98 62.97 3e2u s VAL 35 Cb -0.12 -4.30 -0.14 0.00 0.00 0.00 0.00 36.38 31.81 3e2u s VAL 35 CO 0.02 -0.64 1.25 -0.38 0.00 0.00 0.00 175.10 175.34 3e2u n ILE 36 N 6.46 1.10 0.00 2.22 5.41 -0.88 -1.34 119.36 132.33 3e2u n ILE 36 Ca 0.14 -0.28 0.00 0.00 1.00 0.00 0.00 62.75 63.62 3e2u n ILE 36 Cb 0.47 -1.14 0.00 0.00 -0.71 0.00 0.00 39.64 38.26 3e2u n ILE 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3e2u n GLY 37 N 1.92 1.85 0.24 7.39 0.00 -1.26 -4.59 105.19 110.74 3e2u n GLY 37 Ca 0.13 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.08 3e2u n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3e2u h LYS 38 N 0.00 0.00 -0.26 1.61 1.79 -1.92 -3.46 116.57 114.33 3e2u h LYS 38 Ca 0.00 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.36 3e2u h LYS 38 Cb 0.00 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.61 3e2u h LYS 38 CO 0.00 0.17 -0.10 0.41 -1.08 0.00 0.00 179.45 178.85 3e2u n GLY 39 N 0.04 0.72 3.67 3.86 0.00 -0.45 -4.97 105.19 108.07 3e2u n GLY 39 Ca 0.00 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 3e2u n GLY 39 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3e2u s HIS 40 N -1.92 2.76 0.01 1.61 3.76 -1.25 -4.84 115.29 115.41 3e2u s HIS 40 Ca 0.00 0.86 -0.07 0.00 -0.15 0.00 0.00 55.06 55.70 3e2u s HIS 40 Cb 0.00 -3.60 -0.05 0.00 1.11 0.00 0.00 32.58 30.05 3e2u s HIS 40 CO 0.00 -2.17 0.27 1.03 -0.85 0.00 0.00 174.74 173.03 3e2u s ARG 41 N 3.12 3.59 0.24 1.40 0.52 -1.26 -0.36 118.95 126.20 3e2u s ARG 41 Ca 0.60 -0.06 -0.04 0.00 -0.52 0.00 0.00 55.73 55.71 3e2u s ARG 41 Cb -0.26 -3.08 0.02 0.00 0.52 0.00 0.00 34.95 32.14 3e2u s ARG 41 CO 0.21 0.65 0.39 0.41 0.02 0.00 0.00 175.30 176.98 3e2u n GLY 42 N 1.14 2.09 3.16 -3.53 0.00 -0.13 -0.94 105.19 106.98 3e2u n GLY 42 Ca -0.11 -1.42 -0.30 0.00 0.00 0.00 0.00 46.02 44.18 3e2u n GLY 42 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3e2u s THR 43 N -2.60 1.84 -0.55 2.61 2.01 -0.02 -1.58 115.64 117.35 3e2u s THR 43 Ca 0.17 -0.88 -0.27 0.00 0.31 0.00 0.00 61.69 61.02 3e2u s THR 43 Cb -0.01 -1.62 -0.00 0.00 0.01 0.00 0.00 72.50 70.87 3e2u s THR 43 CO 0.12 0.51 1.64 -0.69 -0.69 0.00 0.00 174.62 175.51 3e2u s VAL 44 N 0.57 3.57 -0.47 3.82 1.01 -0.14 0.34 120.40 129.10 3e2u s VAL 44 Ca -0.14 0.46 0.23 0.00 0.00 0.00 0.00 61.98 62.53 3e2u s VAL 44 Cb -0.17 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 3e2u s VAL 44 CO 0.05 -0.97 1.12 0.00 0.00 0.00 0.00 175.10 175.30 3e2u n ALA 45 N 10.85 2.91 -3.50 5.51 0.00 0.34 -1.16 120.51 135.46 3e2u n ALA 45 Ca 0.17 -0.29 -0.12 0.00 0.00 0.00 0.00 53.44 53.19 3e2u n ALA 45 Cb 0.50 -1.08 -0.09 0.00 0.00 0.00 0.00 19.45 18.78 3e2u n ALA 45 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3e2u s TYR 46 N -3.25 -0.65 -0.13 0.00 6.14 -0.68 -4.91 117.35 113.87 3e2u s TYR 46 Ca 0.03 1.50 -0.04 0.00 0.64 0.00 0.00 57.07 59.19 3e2u s TYR 46 Cb 0.12 0.26 0.05 0.00 0.42 0.00 0.00 41.96 42.82 3e2u s TYR 46 CO 0.77 -0.32 0.10 0.08 0.64 0.00 0.00 175.55 176.82 3e2u s VAL 47 N 0.62 -0.12 -3.87 3.14 1.01 -1.26 0.50 120.40 120.42 3e2u s VAL 47 Ca -0.03 0.04 0.00 0.00 0.00 0.00 0.00 61.98 61.99 3e2u s VAL 47 Cb -0.05 -0.44 0.00 0.00 0.00 0.00 0.00 36.38 35.89 3e2u s VAL 47 CO -0.04 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.55 3e2u n GLY 48 N 5.29 -0.54 3.87 4.51 0.00 -1.08 -5.03 105.19 112.22 3e2u n GLY 48 Ca -0.06 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 3e2u n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e2u s ALA 49 N -1.00 3.18 0.24 4.61 0.00 -1.26 -1.53 121.76 126.00 3e2u s ALA 49 Ca 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.90 3e2u s ALA 49 Cb 0.00 -2.95 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 3e2u s ALA 49 CO 0.00 -0.39 0.14 0.25 0.00 0.00 0.00 175.76 175.76 3e2u n THR 50 N -2.09 0.00 -0.02 0.00 -2.24 -1.26 -4.93 114.28 103.74 3e2u n THR 50 Ca 0.05 -1.58 0.09 0.00 -2.27 0.00 0.00 64.05 60.34 3e2u n THR 50 Cb 0.54 0.68 -0.17 0.00 -2.10 0.00 0.00 70.33 69.29 3e2u n THR 50 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3e2u n LEU 51 N 0.00 0.00 0.20 3.22 4.77 -1.26 -4.37 117.00 119.57 3e2u n LEU 51 Ca 0.01 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 3e2u n LEU 51 Cb 0.40 0.04 0.27 0.00 -2.33 0.00 0.00 43.42 41.80 3e2u n LEU 51 CO 0.21 0.04 0.84 2.19 -1.33 0.00 0.00 177.39 179.34 3e2u h PHE 52 N 0.00 0.00 -1.42 -1.77 -5.15 -1.98 -3.46 116.94 103.16 3e2u h PHE 52 Ca -0.05 0.00 0.13 0.00 -0.20 0.00 0.00 57.97 57.85 3e2u h PHE 52 Cb 1.11 0.00 -0.24 0.00 0.22 0.00 0.00 35.95 37.03 3e2u h PHE 52 CO 0.00 0.00 0.66 0.00 -2.00 0.00 0.00 178.31 176.97 3e2u s ALA 53 N -3.24 -1.99 1.13 12.09 0.00 -1.26 -5.17 121.76 123.32 3e2u s ALA 53 Ca 0.07 1.68 -0.17 0.00 0.00 0.00 0.00 51.96 53.54 3e2u s ALA 53 Cb 0.07 -0.96 0.25 0.00 0.00 0.00 0.00 23.12 22.48 3e2u s ALA 53 CO 0.64 -0.29 1.11 0.95 0.00 0.00 0.00 175.76 178.17 3e2u s THR 54 N -1.05 1.75 0.00 0.00 -4.23 -1.26 -4.26 115.64 106.59 3e2u s THR 54 Ca 0.01 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 3e2u s THR 54 Cb -0.01 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.32 3e2u s THR 54 CO -0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 3e2u n GLY 55 N -1.11 -1.37 3.71 3.99 0.00 -1.26 -4.89 105.19 104.26 3e2u n GLY 55 Ca 0.11 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 3e2u n GLY 55 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3e2u s LYS 56 N -1.57 4.53 0.10 1.61 2.20 -1.26 -4.32 119.74 121.03 3e2u s LYS 56 Ca 0.00 1.51 0.09 0.00 -0.36 0.00 0.00 55.97 57.21 3e2u s LYS 56 Cb 0.00 -3.43 -0.04 0.00 -1.51 0.00 0.00 37.83 32.85 3e2u s LYS 56 CO 0.00 -0.10 -0.19 -1.58 -0.36 0.00 0.00 175.35 173.13 3e2u s TRP 57 N 1.00 2.53 -0.24 4.03 0.52 -0.58 -4.61 118.94 121.58 3e2u s TRP 57 Ca 0.54 -0.27 -0.02 0.00 0.02 0.00 0.00 56.10 56.37 3e2u s TRP 57 Cb -0.23 -1.37 0.02 0.00 -1.15 0.00 0.00 33.47 30.74 3e2u s TRP 57 CO 0.28 0.35 -0.06 0.08 0.02 0.00 0.00 176.95 177.62 3e2u s VAL 58 N -1.08 2.97 -0.32 4.03 1.01 0.72 -2.63 120.40 125.10 3e2u s VAL 58 Ca 0.17 -0.91 -0.24 0.00 0.00 0.00 0.00 61.98 61.01 3e2u s VAL 58 Cb -0.11 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.81 3e2u s VAL 58 CO 0.09 0.25 0.80 -0.83 0.00 0.00 0.00 175.10 175.41 3e2u s GLY 59 N 1.36 1.69 -0.07 4.51 0.00 0.18 -1.65 107.32 113.34 3e2u s GLY 59 Ca 0.02 -0.45 0.03 0.00 0.00 0.00 0.00 44.72 44.32 3e2u s GLY 59 CO -0.04 1.78 -0.16 0.14 0.00 0.00 0.00 173.10 174.81 3e2u s VAL 60 N 3.01 2.90 -0.53 1.40 1.01 0.45 0.13 120.40 128.77 3e2u s VAL 60 Ca 0.33 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.37 3e2u s VAL 60 Cb -0.14 -2.15 0.09 0.00 0.00 0.00 0.00 36.38 34.18 3e2u s VAL 60 CO 0.13 0.57 0.56 -0.63 0.00 0.00 0.00 175.10 175.73 3e2u s ILE 61 N -0.32 5.03 0.44 2.22 1.01 0.15 -1.56 121.20 128.18 3e2u s ILE 61 Ca 0.02 -1.01 -0.23 0.00 0.00 0.00 0.00 60.65 59.43 3e2u s ILE 61 Cb -0.13 -4.32 -0.08 0.00 0.01 0.00 0.00 42.46 37.95 3e2u s ILE 61 CO 0.03 -0.85 1.11 -0.76 0.00 0.00 0.00 174.94 174.47 3e2u s LEU 62 N 2.15 4.03 0.36 2.97 1.43 0.13 -0.84 118.68 128.91 3e2u s LEU 62 Ca 0.08 2.18 0.09 0.00 -1.03 0.00 0.00 54.13 55.45 3e2u s LEU 62 Cb -0.24 -4.26 0.68 0.00 0.03 0.00 0.00 46.19 42.40 3e2u s LEU 62 CO 0.07 -0.77 1.85 0.44 0.23 0.00 0.00 176.35 178.17 3e2u h ASP 63 N 2.14 0.22 -2.27 2.29 3.32 -1.35 -3.44 116.42 117.32 3e2u h ASP 63 Ca -0.49 -0.06 -0.57 0.00 0.02 0.00 0.00 57.03 55.94 3e2u h ASP 63 Cb 1.23 -0.06 -0.10 0.00 0.22 0.00 0.00 39.33 40.63 3e2u h ASP 63 CO 0.61 0.46 -0.66 -1.61 -1.72 0.00 0.00 179.24 176.32 3e2u s GLU 64 N -4.52 2.26 -0.86 3.56 2.02 -1.26 -5.00 118.70 114.89 3e2u s GLU 64 Ca -0.05 -1.41 -0.06 0.00 0.02 0.00 0.00 54.97 53.46 3e2u s GLU 64 Cb 0.15 -2.15 -0.10 0.00 0.10 0.00 0.00 34.13 32.13 3e2u s GLU 64 CO 0.74 0.37 2.47 0.00 0.02 0.00 0.00 175.26 178.86 3e2u n ALA 65 N -0.80 5.44 -1.05 5.21 0.00 -1.26 -4.34 120.51 123.71 3e2u n ALA 65 Ca -0.07 -2.19 0.06 0.00 0.00 0.00 0.00 53.44 51.24 3e2u n ALA 65 Cb 0.59 -2.92 0.27 0.00 0.00 0.00 0.00 19.45 17.39 3e2u n ALA 65 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3e2u n LYS 66 N 3.66 3.02 -0.83 0.00 4.76 -1.09 -4.84 118.16 122.85 3e2u n LYS 66 Ca 0.49 -2.94 0.00 0.00 -2.87 0.00 0.00 58.31 53.00 3e2u n LYS 66 Cb 0.28 -1.91 0.00 0.00 -1.84 0.00 0.00 35.03 31.56 3e2u n LYS 66 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3e2u n GLY 67 N -0.47 5.54 0.00 0.72 0.00 0.20 -5.02 105.19 106.17 3e2u n GLY 67 Ca 0.25 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 44.16 3e2u n GLY 67 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3e2u n LYS 68 N -0.07 3.13 -0.30 1.61 5.02 0.17 -4.71 118.16 123.00 3e2u n LYS 68 Ca 0.00 -0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 3e2u n LYS 68 Cb 0.00 -0.73 0.00 0.00 -0.02 0.00 0.00 35.03 34.28 3e2u n LYS 68 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3e2u n ASN 69 N -0.51 0.00 -1.14 4.39 0.23 -0.05 -4.85 115.26 113.33 3e2u n ASN 69 Ca 0.00 -0.29 0.04 0.00 -0.53 0.00 0.00 54.58 53.80 3e2u n ASN 69 Cb 0.00 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 37.75 3e2u n ASN 69 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3e2u n ASP 70 N -0.30 0.98 0.00 0.53 5.75 -1.26 -1.40 116.55 120.84 3e2u n ASP 70 Ca 0.00 -2.31 0.00 0.00 -0.01 0.00 0.00 54.79 52.47 3e2u n ASP 70 Cb 0.00 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.77 3e2u n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3e2u n GLY 71 N 0.11 3.18 3.46 6.12 0.00 -1.26 -2.63 105.19 114.17 3e2u n GLY 71 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3e2u n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3e2u s THR 72 N -2.95 4.26 -0.06 2.61 2.01 -1.25 -0.49 115.64 119.77 3e2u s THR 72 Ca 0.00 -0.19 0.05 0.00 0.31 0.00 0.00 61.69 61.85 3e2u s THR 72 Cb 0.00 -2.97 -0.00 0.00 0.01 0.00 0.00 72.50 69.53 3e2u s THR 72 CO 0.00 0.37 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.40 3e2u s VAL 73 N 1.37 1.74 -1.67 3.82 1.01 -0.54 -4.74 120.40 121.40 3e2u s VAL 73 Ca 0.05 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 3e2u s VAL 73 Cb -0.15 -1.50 0.11 0.00 0.00 0.00 0.00 36.38 34.85 3e2u s VAL 73 CO 0.03 0.49 0.45 0.00 0.00 0.00 0.00 175.10 176.07 3e2u n GLN 74 N 3.25 -1.80 0.00 2.72 6.02 -1.26 -2.09 117.38 124.22 3e2u n GLN 74 Ca -0.19 0.23 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 3e2u n GLN 74 Cb 0.52 -4.46 0.00 0.00 1.02 0.00 0.00 30.24 27.33 3e2u n GLN 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3e2u n GLY 75 N -1.73 3.15 3.63 1.08 0.00 -1.26 -5.00 105.19 105.06 3e2u n GLY 75 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 3e2u n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3e2u s ARG 76 N -0.41 4.08 -0.06 1.61 6.06 -0.89 -5.06 118.95 124.27 3e2u s ARG 76 Ca 0.00 0.06 -0.25 0.00 -2.50 0.00 0.00 55.73 53.03 3e2u s ARG 76 Cb 0.00 -3.60 -0.03 0.00 0.06 0.00 0.00 34.95 31.38 3e2u s ARG 76 CO 0.00 -0.15 0.80 0.21 -2.50 0.00 0.00 175.30 173.65 3e2u s LYS 77 N 1.68 4.45 -0.06 5.12 2.20 -1.26 -1.47 119.74 130.40 3e2u s LYS 77 Ca 0.15 1.05 0.07 0.00 -0.36 0.00 0.00 55.97 56.88 3e2u s LYS 77 Cb -0.15 -3.47 -0.09 0.00 -1.51 0.00 0.00 37.83 32.61 3e2u s LYS 77 CO 0.09 -0.02 0.05 0.66 -0.36 0.00 0.00 175.35 175.76 3e2u n TYR 78 N 4.02 0.00 -3.38 4.03 4.02 0.35 -4.95 117.16 121.25 3e2u n TYR 78 Ca 0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.88 3e2u n TYR 78 Cb 0.51 -0.32 0.01 0.00 -0.02 0.00 0.00 39.34 39.52 3e2u n TYR 78 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 176.86 177.82 3e2u n PHE 79 N -2.17 -1.39 -4.14 -0.72 1.16 -0.83 -4.86 117.46 104.51 3e2u n PHE 79 Ca -0.10 -0.68 -0.24 0.00 -1.87 0.00 0.00 57.45 54.57 3e2u n PHE 79 Cb 0.63 0.34 -0.17 0.00 -1.61 0.00 0.00 39.48 38.67 3e2u n PHE 79 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 3e2u s THR 80 N -2.58 0.81 0.00 1.97 2.01 -1.26 -3.85 115.64 112.74 3e2u s THR 80 Ca 0.07 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 61.84 3e2u s THR 80 Cb -0.02 -0.82 0.00 0.00 0.01 0.00 0.00 72.50 71.67 3e2u s THR 80 CO 0.04 0.31 0.00 0.00 -0.69 0.00 0.00 174.62 174.28 3e2u s ASP 82 N -0.28 6.95 0.16 0.00 1.01 -1.26 -4.77 116.67 118.48 3e2u s ASP 82 Ca 0.00 1.57 -0.31 0.00 0.71 0.00 0.00 52.55 54.52 3e2u s ASP 82 Cb 0.00 -2.49 -0.11 0.00 1.01 0.00 0.00 42.92 41.33 3e2u s ASP 82 CO 0.00 -0.26 1.71 -1.83 0.21 0.00 0.00 175.17 175.00 3e2u s GLU 83 N -2.91 4.16 0.00 8.23 1.03 -1.26 -1.99 118.70 125.95 3e2u s GLU 83 Ca 0.57 2.52 0.00 0.00 0.03 0.00 0.00 54.97 58.09 3e2u s GLU 83 Cb -0.11 -3.29 0.00 0.00 -0.80 0.00 0.00 34.13 29.93 3e2u s GLU 83 CO 0.16 -0.74 0.00 0.41 -1.33 0.00 0.00 175.26 173.76 3e2u n GLY 84 N 4.00 2.30 0.04 -3.83 0.00 -0.49 -4.90 105.19 102.30 3e2u n GLY 84 Ca 0.16 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.28 3e2u n GLY 84 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3e2u n HIS 85 N -1.52 0.25 -2.90 1.61 8.25 -0.84 0.62 115.22 120.69 3e2u n HIS 85 Ca 0.00 0.07 -0.40 0.00 -0.26 0.00 0.00 57.72 57.14 3e2u n HIS 85 Cb 0.00 -0.65 -0.06 0.00 1.12 0.00 0.00 29.99 30.40 3e2u n HIS 85 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3e2u s GLY 86 N -4.54 2.99 -0.12 -1.41 0.00 -0.69 0.18 107.32 103.74 3e2u s GLY 86 Ca -0.06 0.45 -0.19 0.00 0.00 0.00 0.00 44.72 44.92 3e2u s GLY 86 CO 0.88 0.98 0.47 -1.50 0.00 0.00 0.00 173.10 173.93 3e2u s ILE 87 N -1.15 0.02 -0.15 0.90 2.07 -0.60 0.41 121.20 122.70 3e2u s ILE 87 Ca 0.38 -0.13 -0.03 0.00 -1.41 0.00 0.00 60.65 59.46 3e2u s ILE 87 Cb -0.24 -0.72 -0.02 0.00 0.13 0.00 0.00 42.46 41.61 3e2u s ILE 87 CO 0.28 -0.07 -0.06 -0.36 -1.91 0.00 0.00 174.94 172.82 3e2u s PHE 88 N -0.42 2.97 0.11 3.50 0.08 -1.26 -0.41 117.98 122.55 3e2u s PHE 88 Ca -0.06 -0.38 0.01 0.00 0.12 0.00 0.00 56.93 56.62 3e2u s PHE 88 Cb -0.03 -1.93 -0.04 0.00 -0.57 0.00 0.00 43.02 40.45 3e2u s PHE 88 CO 0.03 -0.08 -0.03 0.14 -0.10 0.00 0.00 175.22 175.18 3e2u s VAL 89 N 0.35 0.53 0.62 -0.44 -7.23 -0.66 -4.93 120.40 108.64 3e2u s VAL 89 Ca -0.06 -1.91 -0.16 0.00 -1.81 0.00 0.00 61.98 58.03 3e2u s VAL 89 Cb -0.15 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.00 3e2u s VAL 89 CO 0.04 -0.78 1.11 -0.13 -0.31 0.00 0.00 175.10 175.02 3e2u s ARG 90 N -3.89 3.04 0.49 4.82 1.81 -1.26 -0.20 118.95 123.76 3e2u s ARG 90 Ca 0.14 1.43 0.33 0.00 -1.72 0.00 0.00 55.73 55.91 3e2u s ARG 90 Cb 0.06 -1.98 1.68 0.00 -0.45 0.00 0.00 34.95 34.27 3e2u s ARG 90 CO -0.04 -1.07 2.01 -0.56 -0.68 0.00 0.00 175.30 174.96 3e2u h GLN 91 N 0.43 0.00 0.00 3.54 3.07 -1.92 -1.91 115.11 118.32 3e2u h GLN 91 Ca -0.48 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.20 3e2u h GLN 91 Cb 1.25 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.80 3e2u h GLN 91 CO 0.55 0.00 -0.31 0.66 0.09 0.00 0.00 178.83 179.82 3e2u h SER 92 N 0.00 0.00 1.83 0.06 4.64 -1.98 -3.19 113.55 114.91 3e2u h SER 92 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3e2u h SER 92 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3e2u h SER 92 CO 0.00 0.31 0.00 1.56 -0.87 0.00 0.00 176.83 177.83 3e2u h GLN 93 N 0.00 0.00 -6.03 4.77 1.08 -1.72 -3.46 115.11 109.75 3e2u h GLN 93 Ca -0.00 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.65 3e2u h GLN 93 Cb 0.88 0.00 -0.18 0.00 -0.05 0.00 0.00 27.48 28.13 3e2u h GLN 93 CO 0.04 0.00 -0.79 0.96 -0.95 0.00 0.00 178.83 178.09 3e2u s ILE 94 N -3.21 1.92 0.18 2.54 -4.36 -1.20 -2.08 121.20 114.98 3e2u s ILE 94 Ca 0.07 -1.96 0.04 0.00 -0.26 0.00 0.00 60.65 58.55 3e2u s ILE 94 Cb 0.07 -1.91 -0.05 0.00 1.25 0.00 0.00 42.46 41.82 3e2u s ILE 94 CO 0.64 -0.30 -0.07 0.00 0.24 0.00 0.00 174.94 175.45 3e2u s GLN 95 N -2.83 1.16 0.00 0.37 -2.07 -0.29 -4.90 119.66 111.10 3e2u s GLN 95 Ca 0.17 -1.53 0.00 0.00 -1.82 0.00 0.00 55.36 52.18 3e2u s GLN 95 Cb -0.06 -0.65 0.00 0.00 -1.09 0.00 0.00 33.01 31.21 3e2u s GLN 95 CO 0.07 0.03 0.00 1.55 -1.32 0.00 0.00 175.29 175.62 3e2u n VAL 96 N -0.28 0.00 -0.04 3.63 3.14 -1.26 -0.25 118.33 123.28 3e2u n VAL 96 Ca -0.08 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.30 3e2u n VAL 96 Cb 0.62 -1.17 0.00 0.00 -1.06 0.00 0.00 33.84 32.23 3e2u n VAL 96 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86