#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e2u s LEU 27 N 0.00 1.97 0.24 1.53 0.20 -1.26 -5.00 118.68 116.37 3e2u s LEU 27 Ca 0.00 -0.41 -0.21 0.00 0.69 0.00 0.00 54.13 54.20 3e2u s LEU 27 Cb 0.00 -1.11 0.06 0.00 -0.43 0.00 0.00 46.19 44.71 3e2u s LEU 27 CO 0.00 0.19 0.92 -0.13 -0.29 0.00 0.00 176.35 177.04 3e2u s ARG 28 N -0.06 1.60 0.22 1.98 0.52 -1.26 -5.06 118.95 116.89 3e2u s ARG 28 Ca -0.03 -0.98 -0.32 0.00 -0.52 0.00 0.00 55.73 53.87 3e2u s ARG 28 Cb -0.12 0.47 -0.12 0.00 0.52 0.00 0.00 34.95 35.70 3e2u s ARG 28 CO 0.03 -0.74 1.66 0.28 0.02 0.00 0.00 175.30 176.54 3e2u n VAL 29 N -0.57 0.25 0.00 3.52 0.31 -1.26 -1.41 118.33 119.17 3e2u n VAL 29 Ca -0.05 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3e2u n VAL 29 Cb 0.60 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 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 3.42 2.65 3.53 2.92 0.00 -0.20 -5.03 105.19 112.48 3e2u n GLY 30 Ca 0.14 -0.18 -0.45 0.00 0.00 0.00 0.00 46.02 45.54 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 0.16 0.37 -4.74 1.61 7.64 -0.50 -4.57 113.62 113.58 3e2u n SER 31 Ca 0.00 1.11 -0.39 0.00 1.01 0.00 0.00 58.87 60.60 3e2u n SER 31 Cb 0.00 -1.19 -0.05 0.00 -1.01 0.00 0.00 64.21 61.96 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 -1.47 4.35 0.10 1.43 1.81 -1.26 -0.83 118.95 123.07 3e2u s ARG 32 Ca 0.61 0.72 0.02 0.00 -1.72 0.00 0.00 55.73 55.36 3e2u s ARG 32 Cb -0.72 -3.38 -0.04 0.00 -0.45 0.00 0.00 34.95 30.36 3e2u s ARG 32 CO 0.59 0.26 -0.07 0.14 -0.68 0.00 0.00 175.30 175.54 3e2u s VAL 33 N 0.18 0.72 -0.05 3.52 -7.23 -0.64 -1.75 120.40 115.15 3e2u s VAL 33 Ca 0.32 -1.88 0.06 0.00 -1.81 0.00 0.00 61.98 58.67 3e2u s VAL 33 Cb -0.18 -1.61 -0.01 0.00 0.56 0.00 0.00 36.38 35.14 3e2u s VAL 33 CO 0.16 -0.82 -0.25 -0.70 -0.31 0.00 0.00 175.10 173.18 3e2u s GLU 34 N -3.65 2.46 -0.36 4.82 2.12 0.43 -0.97 118.70 123.55 3e2u s GLU 34 Ca 0.11 -0.90 -0.29 0.00 0.36 0.00 0.00 54.97 54.25 3e2u s GLU 34 Cb 0.04 -2.15 -0.00 0.00 0.26 0.00 0.00 34.13 32.28 3e2u s GLU 34 CO -0.04 0.43 1.49 0.08 -0.54 0.00 0.00 175.26 176.69 3e2u s VAL 35 N -0.28 3.83 0.26 3.70 1.01 0.39 -1.09 120.40 128.21 3e2u s VAL 35 Ca 0.00 0.86 -0.30 0.00 0.00 0.00 0.00 61.98 62.55 3e2u s VAL 35 Cb -0.13 -4.04 -0.14 0.00 0.00 0.00 0.00 36.38 32.08 3e2u s VAL 35 CO 0.02 -0.61 1.25 -0.38 0.00 0.00 0.00 175.10 175.38 3e2u n ILE 36 N 6.97 1.43 0.00 2.22 5.41 -0.91 -1.35 119.36 133.12 3e2u n ILE 36 Ca 0.18 -0.36 0.00 0.00 1.00 0.00 0.00 62.75 63.57 3e2u n ILE 36 Cb 0.47 -1.28 0.00 0.00 -0.71 0.00 0.00 39.64 38.12 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 1.60 1.80 0.24 7.39 0.00 -1.26 -4.59 105.19 110.36 3e2u n GLY 37 Ca 0.10 -0.14 0.10 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 -0.44 1.61 1.57 -1.92 -3.46 116.57 113.93 3e2u h LYS 38 Ca 0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.59 3e2u h LYS 38 Cb 0.00 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.23 3e2u h LYS 38 CO 0.00 0.20 -0.17 0.41 -0.57 0.00 0.00 179.45 179.32 3e2u n GLY 39 N -0.23 1.03 3.68 3.86 0.00 -0.46 -4.97 105.19 108.10 3e2u n GLY 39 Ca -0.01 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.12 3.21 0.01 1.61 3.76 -1.25 -4.85 115.29 115.66 3e2u s HIS 40 Ca 0.00 1.27 -0.04 0.00 -0.15 0.00 0.00 55.06 56.13 3e2u s HIS 40 Cb 0.00 -3.38 -0.04 0.00 1.11 0.00 0.00 32.58 30.26 3e2u s HIS 40 CO 0.00 -1.13 0.23 1.03 -0.85 0.00 0.00 174.74 174.02 3e2u s ARG 41 N 2.37 3.51 0.21 1.40 0.52 -1.26 -0.47 118.95 125.23 3e2u s ARG 41 Ca 0.54 -0.20 -0.05 0.00 -0.52 0.00 0.00 55.73 55.50 3e2u s ARG 41 Cb -0.23 -3.08 0.02 0.00 0.52 0.00 0.00 34.95 32.18 3e2u s ARG 41 CO 0.20 0.65 0.36 0.41 0.02 0.00 0.00 175.30 176.94 3e2u n GLY 42 N 0.98 2.01 3.21 -3.53 0.00 -0.14 -1.04 105.19 106.67 3e2u n GLY 42 Ca -0.11 -1.34 -0.32 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.58 2.10 -0.58 2.61 2.01 0.07 -1.62 115.64 117.65 3e2u s THR 43 Ca 0.13 -1.00 -0.27 0.00 0.31 0.00 0.00 61.69 60.87 3e2u s THR 43 Cb -0.02 -1.81 -0.01 0.00 0.01 0.00 0.00 72.50 70.67 3e2u s THR 43 CO 0.10 0.56 1.72 -0.69 -0.69 0.00 0.00 174.62 175.61 3e2u s VAL 44 N 0.46 3.48 -0.49 3.82 1.01 -0.01 0.11 120.40 128.78 3e2u s VAL 44 Ca -0.16 0.35 0.23 0.00 0.00 0.00 0.00 61.98 62.40 3e2u s VAL 44 Cb -0.17 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 3e2u s VAL 44 CO 0.06 -0.97 1.13 0.00 0.00 0.00 0.00 175.10 175.32 3e2u n ALA 45 N 11.55 2.94 -3.50 5.51 0.00 0.29 -1.04 120.51 136.27 3e2u n ALA 45 Ca 0.18 -0.30 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 3e2u n ALA 45 Cb 0.51 -1.08 -0.09 0.00 0.00 0.00 0.00 19.45 18.79 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 -3.24 -0.64 -0.16 0.00 6.14 -0.72 -4.91 117.35 113.81 3e2u s TYR 46 Ca 0.03 1.49 -0.05 0.00 0.64 0.00 0.00 57.07 59.18 3e2u s TYR 46 Cb 0.13 0.26 0.06 0.00 0.42 0.00 0.00 41.96 42.83 3e2u s TYR 46 CO 0.77 -0.32 0.12 0.08 0.64 0.00 0.00 175.55 176.84 3e2u s VAL 47 N 0.62 -0.15 -3.69 3.14 1.01 -1.26 0.15 120.40 120.22 3e2u s VAL 47 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 61.86 3e2u s VAL 47 Cb -0.05 -0.55 0.00 0.00 0.00 0.00 0.00 36.38 35.78 3e2u s VAL 47 CO -0.04 -0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.46 3e2u n GLY 48 N 5.29 -0.51 3.88 4.51 0.00 -1.09 -5.03 105.19 112.24 3e2u n GLY 48 Ca -0.06 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 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 3.25 0.31 4.61 0.00 -1.26 -1.72 121.76 125.95 3e2u s ALA 49 Ca 0.00 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 51.80 3e2u s ALA 49 Cb 0.00 -2.85 -0.02 0.00 0.00 0.00 0.00 23.12 20.25 3e2u s ALA 49 CO 0.00 -0.40 0.23 0.25 0.00 0.00 0.00 175.76 175.84 3e2u n THR 50 N -2.18 0.00 -0.03 0.00 -2.24 -1.26 -4.94 114.28 103.63 3e2u n THR 50 Ca 0.04 -2.19 0.04 0.00 -2.27 0.00 0.00 64.05 59.66 3e2u n THR 50 Cb 0.54 1.03 -0.16 0.00 -2.10 0.00 0.00 70.33 69.65 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 0.05 0.18 3.22 4.77 -1.26 -4.38 117.00 119.58 3e2u n LEU 51 Ca 0.04 0.02 0.06 0.00 -0.03 0.00 0.00 56.01 56.11 3e2u n LEU 51 Cb 0.55 0.16 0.25 0.00 -2.33 0.00 0.00 43.42 42.05 3e2u n LEU 51 CO 0.28 0.16 0.65 2.19 -1.33 0.00 0.00 177.39 179.34 3e2u h PHE 52 N 0.00 0.00 -1.46 -1.77 -5.15 -1.98 -3.46 116.94 103.12 3e2u h PHE 52 Ca -0.18 0.00 0.11 0.00 -0.20 0.00 0.00 57.97 57.70 3e2u h PHE 52 Cb 1.41 0.00 -0.25 0.00 0.22 0.00 0.00 35.95 37.33 3e2u h PHE 52 CO 0.00 0.35 0.62 0.00 -2.00 0.00 0.00 178.31 177.28 3e2u s ALA 53 N -3.35 -1.98 1.16 12.09 0.00 -1.26 -5.17 121.76 123.24 3e2u s ALA 53 Ca 0.02 1.68 -0.15 0.00 0.00 0.00 0.00 51.96 53.51 3e2u s ALA 53 Cb 0.09 -0.98 0.27 0.00 0.00 0.00 0.00 23.12 22.50 3e2u s ALA 53 CO 0.69 -0.28 1.05 0.95 0.00 0.00 0.00 175.76 178.17 3e2u s THR 54 N -0.90 1.82 0.00 0.00 -4.23 -1.26 -4.29 115.64 106.78 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 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.52 3e2u s THR 54 CO -0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 3e2u n GLY 55 N -0.15 -1.49 3.72 3.99 0.00 -1.26 -4.88 105.19 105.12 3e2u n GLY 55 Ca 0.07 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.72 4.57 0.13 1.61 2.20 -1.26 -4.36 119.74 120.91 3e2u s LYS 56 Ca 0.00 1.56 0.10 0.00 -0.36 0.00 0.00 55.97 57.27 3e2u s LYS 56 Cb 0.00 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 3e2u s LYS 56 CO 0.00 -0.02 -0.21 -1.58 -0.36 0.00 0.00 175.35 173.18 3e2u s TRP 57 N 0.57 2.44 -0.23 4.03 0.52 -0.70 -4.61 118.94 120.96 3e2u s TRP 57 Ca 0.52 -0.31 -0.02 0.00 0.02 0.00 0.00 56.10 56.31 3e2u s TRP 57 Cb -0.25 -1.29 0.01 0.00 -1.15 0.00 0.00 33.47 30.80 3e2u s TRP 57 CO 0.30 0.39 -0.08 0.08 0.02 0.00 0.00 176.95 177.66 3e2u s VAL 58 N -1.20 2.90 -0.27 4.03 1.01 0.60 -2.67 120.40 124.79 3e2u s VAL 58 Ca 0.17 -0.83 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 3e2u s VAL 58 Cb -0.10 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 3e2u s VAL 58 CO 0.09 0.33 0.78 -0.83 0.00 0.00 0.00 175.10 175.47 3e2u s GLY 59 N 1.37 1.75 -0.07 4.51 0.00 0.12 -1.60 107.32 113.40 3e2u s GLY 59 Ca 0.03 -0.30 0.03 0.00 0.00 0.00 0.00 44.72 44.48 3e2u s GLY 59 CO -0.06 1.72 -0.17 0.14 0.00 0.00 0.00 173.10 174.73 3e2u s VAL 60 N 2.82 2.77 -0.55 1.40 1.01 0.36 0.11 120.40 128.32 3e2u s VAL 60 Ca 0.32 -0.81 -0.18 0.00 0.00 0.00 0.00 61.98 61.31 3e2u s VAL 60 Cb -0.15 -2.09 0.09 0.00 0.00 0.00 0.00 36.38 34.24 3e2u s VAL 60 CO 0.09 0.57 0.63 -0.63 0.00 0.00 0.00 175.10 175.76 3e2u s ILE 61 N -0.32 4.93 0.39 2.22 1.01 0.12 -1.51 121.20 128.04 3e2u s ILE 61 Ca 0.02 -0.96 -0.26 0.00 0.00 0.00 0.00 60.65 59.45 3e2u s ILE 61 Cb -0.13 -4.39 -0.09 0.00 0.01 0.00 0.00 42.46 37.87 3e2u s ILE 61 CO 0.02 -0.96 1.20 -0.76 0.00 0.00 0.00 174.94 174.44 3e2u s LEU 62 N 2.41 4.22 0.37 2.97 1.43 0.15 -0.75 118.68 129.48 3e2u s LEU 62 Ca 0.10 2.42 0.11 0.00 -1.03 0.00 0.00 54.13 55.74 3e2u s LEU 62 Cb -0.24 -3.96 0.74 0.00 0.03 0.00 0.00 46.19 42.76 3e2u s LEU 62 CO 0.07 -0.68 1.85 0.44 0.23 0.00 0.00 176.35 178.26 3e2u h ASP 63 N 2.73 0.09 -2.18 2.29 3.32 -1.40 -3.44 116.42 117.83 3e2u h ASP 63 Ca -0.49 -0.03 -0.56 0.00 0.02 0.00 0.00 57.03 55.98 3e2u h ASP 63 Cb 1.24 -0.02 -0.10 0.00 0.22 0.00 0.00 39.33 40.67 3e2u h ASP 63 CO 0.63 0.38 -0.65 -1.61 -1.72 0.00 0.00 179.24 176.28 3e2u s GLU 64 N -4.37 2.25 -1.04 3.56 2.02 -1.26 -5.01 118.70 114.85 3e2u s GLU 64 Ca -0.04 -1.46 -0.07 0.00 0.02 0.00 0.00 54.97 53.42 3e2u s GLU 64 Cb 0.15 -2.13 -0.08 0.00 0.10 0.00 0.00 34.13 32.17 3e2u s GLU 64 CO 0.73 0.34 2.48 0.00 0.02 0.00 0.00 175.26 178.83 3e2u n ALA 65 N -0.89 5.70 -1.14 5.21 0.00 -1.26 -4.35 120.51 123.78 3e2u n ALA 65 Ca -0.06 -2.42 0.04 0.00 0.00 0.00 0.00 53.44 51.00 3e2u n ALA 65 Cb 0.59 -3.04 0.23 0.00 0.00 0.00 0.00 19.45 17.24 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 3.80 2.49 -1.35 0.00 4.76 -1.07 -4.85 118.16 121.94 3e2u n LYS 66 Ca 0.54 -2.93 0.00 0.00 -2.87 0.00 0.00 58.31 53.05 3e2u n LYS 66 Cb 0.23 -1.82 0.00 0.00 -1.84 0.00 0.00 35.03 31.60 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 -0.76 4.84 0.06 0.72 0.00 0.22 -5.02 105.19 105.25 3e2u n GLY 67 Ca 0.25 -2.15 0.01 0.00 0.00 0.00 0.00 46.02 44.13 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 -0.09 2.99 -0.17 1.61 5.02 0.17 -4.69 118.16 123.01 3e2u n LYS 68 Ca 0.00 -0.32 0.00 0.00 -2.02 0.00 0.00 58.31 55.97 3e2u n LYS 68 Cb 0.00 -0.83 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 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 -0.49 0.00 -1.30 4.39 0.23 -0.04 -4.85 115.26 113.21 3e2u n ASN 69 Ca 0.01 -0.17 0.04 0.00 -0.53 0.00 0.00 54.58 53.94 3e2u n ASN 69 Cb 0.06 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 37.82 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 -0.16 1.13 0.00 0.53 5.68 -1.26 -1.39 116.55 121.08 3e2u n ASP 70 Ca 0.00 -2.38 0.00 0.00 -0.50 0.00 0.00 54.79 51.91 3e2u n ASP 70 Cb 0.00 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 39.64 3e2u n ASP 70 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3e2u n GLY 71 N 0.17 0.80 3.12 6.12 0.00 -1.26 -2.49 105.19 111.65 3e2u n GLY 71 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.58 2.36 -0.19 2.61 2.01 -1.26 0.43 115.64 119.02 3e2u s THR 72 Ca 0.00 -1.27 -0.01 0.00 0.31 0.00 0.00 61.69 60.72 3e2u s THR 72 Cb 0.00 -2.23 0.00 0.00 0.01 0.00 0.00 72.50 70.29 3e2u s THR 72 CO 0.00 0.19 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.29 3e2u s VAL 73 N 1.22 2.65 -1.34 3.82 1.01 -1.04 -4.78 120.40 121.94 3e2u s VAL 73 Ca -0.02 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 3e2u s VAL 73 Cb -0.17 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.06 3e2u s VAL 73 CO -0.07 0.50 0.23 0.00 0.00 0.00 0.00 175.10 175.76 3e2u n GLN 74 N 4.52 -2.56 0.00 2.72 6.02 -1.26 -2.83 117.38 123.98 3e2u n GLN 74 Ca -0.20 0.77 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 3e2u n GLN 74 Cb 0.51 -5.23 0.00 0.00 1.02 0.00 0.00 30.24 26.54 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 -1.19 3.24 3.66 1.08 0.00 -1.26 -5.01 105.19 105.71 3e2u n GLY 75 Ca -0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.52 4.13 -0.09 1.61 6.06 -1.13 -5.06 118.95 123.96 3e2u s ARG 76 Ca 0.00 0.07 -0.26 0.00 -2.50 0.00 0.00 55.73 53.04 3e2u s ARG 76 Cb 0.00 -3.55 -0.03 0.00 0.06 0.00 0.00 34.95 31.43 3e2u s ARG 76 CO 0.00 -0.04 0.82 0.21 -2.50 0.00 0.00 175.30 173.79 3e2u s LYS 77 N 1.32 4.42 -0.06 5.12 2.20 -1.26 -2.48 119.74 129.00 3e2u s LYS 77 Ca 0.16 1.07 0.07 0.00 -0.36 0.00 0.00 55.97 56.91 3e2u s LYS 77 Cb -0.15 -3.50 -0.10 0.00 -1.51 0.00 0.00 37.83 32.57 3e2u s LYS 77 CO 0.07 -0.12 0.07 0.66 -0.36 0.00 0.00 175.35 175.67 3e2u n TYR 78 N 4.37 0.00 -3.30 4.03 4.02 0.17 -4.99 117.16 121.46 3e2u n TYR 78 Ca 0.03 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.89 3e2u n TYR 78 Cb 0.50 -0.32 0.01 0.00 -0.02 0.00 0.00 39.34 39.51 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 -2.15 -1.40 -4.19 -0.72 1.16 -0.61 -4.86 117.46 104.69 3e2u n PHE 79 Ca -0.09 -0.61 -0.23 0.00 -1.87 0.00 0.00 57.45 54.65 3e2u n PHE 79 Cb 0.60 0.30 -0.17 0.00 -1.61 0.00 0.00 39.48 38.61 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 -2.67 0.75 0.00 1.97 2.01 -1.26 -3.99 115.64 112.46 3e2u s THR 80 Ca 0.06 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 61.84 3e2u s THR 80 Cb -0.02 -0.76 0.00 0.00 0.01 0.00 0.00 72.50 71.73 3e2u s THR 80 CO 0.04 0.29 0.00 0.00 -0.69 0.00 0.00 174.62 174.25 3e2u s ASP 82 N -0.22 6.86 0.11 0.00 1.01 -1.26 -4.74 116.67 118.42 3e2u s ASP 82 Ca 0.00 1.62 -0.31 0.00 0.71 0.00 0.00 52.55 54.57 3e2u s ASP 82 Cb 0.00 -2.52 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 3e2u s ASP 82 CO 0.00 -0.39 1.68 -0.70 0.21 0.00 0.00 175.17 175.97 3e2u s GLU 83 N -3.35 4.18 0.00 8.23 2.56 -1.26 -2.09 118.70 126.97 3e2u s GLU 83 Ca 0.61 2.41 0.00 0.00 0.00 0.00 0.00 54.97 57.99 3e2u s GLU 83 Cb -0.09 -3.47 0.00 0.00 2.00 0.00 0.00 34.13 32.56 3e2u s GLU 83 CO 0.17 -0.73 0.00 0.41 -0.56 0.00 0.00 175.26 174.55 3e2u n GLY 84 N 4.00 1.93 0.01 -1.50 0.00 -0.53 -4.91 105.19 104.18 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 -1.35 0.00 -2.94 1.61 8.25 -0.89 0.70 115.22 120.60 3e2u n HIS 85 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 3e2u n HIS 85 Cb 0.00 -0.31 -0.06 0.00 1.12 0.00 0.00 29.99 30.74 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 -3.86 2.92 -0.11 -1.41 0.00 -0.48 0.30 107.32 104.68 3e2u s GLY 86 Ca -0.03 0.40 -0.20 0.00 0.00 0.00 0.00 44.72 44.90 3e2u s GLY 86 CO 0.83 0.90 0.49 -1.50 0.00 0.00 0.00 173.10 173.83 3e2u s ILE 87 N -1.22 0.02 -0.16 0.90 2.07 -0.57 0.47 121.20 122.70 3e2u s ILE 87 Ca 0.38 -0.14 -0.02 0.00 -1.41 0.00 0.00 60.65 59.46 3e2u s ILE 87 Cb -0.23 -0.75 -0.02 0.00 0.13 0.00 0.00 42.46 41.60 3e2u s ILE 87 CO 0.27 -0.08 -0.07 -0.36 -1.91 0.00 0.00 174.94 172.79 3e2u s PHE 88 N -0.52 2.94 0.06 3.50 0.08 -1.26 -0.49 117.98 122.29 3e2u s PHE 88 Ca -0.06 -0.52 0.01 0.00 0.12 0.00 0.00 56.93 56.47 3e2u s PHE 88 Cb -0.03 -1.94 -0.03 0.00 -0.57 0.00 0.00 43.02 40.44 3e2u s PHE 88 CO 0.04 -0.18 -0.06 0.14 -0.10 0.00 0.00 175.22 175.06 3e2u s VAL 89 N 0.54 0.48 0.72 -0.44 -7.23 -0.63 -4.93 120.40 108.90 3e2u s VAL 89 Ca -0.05 -1.57 -0.13 0.00 -1.81 0.00 0.00 61.98 58.42 3e2u s VAL 89 Cb -0.15 -1.21 0.03 0.00 0.56 0.00 0.00 36.38 35.61 3e2u s VAL 89 CO 0.03 -0.73 1.12 -0.13 -0.31 0.00 0.00 175.10 175.07 3e2u s ARG 90 N -3.01 2.45 0.34 4.82 1.81 -1.26 -0.29 118.95 123.81 3e2u s ARG 90 Ca 0.02 1.37 0.25 0.00 -1.72 0.00 0.00 55.73 55.65 3e2u s ARG 90 Cb 0.00 -1.91 1.19 0.00 -0.45 0.00 0.00 34.95 33.78 3e2u s ARG 90 CO -0.04 -1.52 1.77 -0.56 -0.68 0.00 0.00 175.30 174.27 3e2u h GLN 91 N -0.48 0.00 0.00 3.54 3.07 -1.93 -2.17 115.11 117.15 3e2u h GLN 91 Ca -0.46 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.23 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 0.52 0.00 -0.25 0.66 0.09 0.00 0.00 178.83 179.85 3e2u h SER 92 N 0.00 0.00 1.24 0.06 4.64 -1.98 -3.21 113.55 114.31 3e2u h SER 92 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 3e2u h SER 92 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 3e2u h SER 92 CO 0.00 0.25 -0.41 1.56 -0.87 0.00 0.00 176.83 177.36 3e2u h GLN 93 N 0.00 0.00 -5.81 4.77 1.08 -1.76 -3.47 115.11 109.93 3e2u h GLN 93 Ca -0.00 0.00 -0.61 0.00 -1.45 0.00 0.00 58.65 56.58 3e2u h GLN 93 Cb 0.91 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 28.21 3e2u h GLN 93 CO 0.03 0.41 -0.65 0.96 -0.95 0.00 0.00 178.83 178.63 3e2u s ILE 94 N -3.25 2.11 0.07 2.54 -4.36 -1.21 -2.15 121.20 114.94 3e2u s ILE 94 Ca 0.02 -2.13 -0.05 0.00 -0.26 0.00 0.00 60.65 58.23 3e2u s ILE 94 Cb 0.09 -2.76 -0.02 0.00 1.25 0.00 0.00 42.46 41.02 3e2u s ILE 94 CO 0.71 -0.14 0.10 0.00 0.24 0.00 0.00 174.94 175.85 3e2u s GLN 95 N -3.66 0.74 0.05 0.37 -2.07 -0.25 -4.86 119.66 109.98 3e2u s GLN 95 Ca 0.33 -1.05 -0.31 0.00 -1.82 0.00 0.00 55.36 52.52 3e2u s GLN 95 Cb 0.05 0.28 -0.08 0.00 -1.09 0.00 0.00 33.01 32.18 3e2u s GLN 95 CO 0.17 -0.20 1.66 0.54 -1.32 0.00 0.00 175.29 176.14 3e2u s VAL 96 N -3.81 3.11 -2.00 3.63 0.11 -1.26 -0.42 120.40 119.75 3e2u s VAL 96 Ca 0.05 0.51 0.22 0.00 -2.93 0.00 0.00 61.98 59.83 3e2u s VAL 96 Cb 0.06 -3.33 0.62 0.00 -1.53 0.00 0.00 36.38 32.20 3e2u s VAL 96 CO -0.10 -0.01 1.68 2.22 -3.33 0.00 0.00 175.10 175.56