#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 6.14 0.00 2.45 2.96 -1.26 -4.95 118.68 124.02 3e2u s LEU 27 Ca 0.00 -3.25 0.07 0.00 -0.22 0.00 0.00 54.13 50.73 3e2u s LEU 27 Cb 0.00 -2.25 0.08 0.00 0.50 0.00 0.00 46.19 44.51 3e2u s LEU 27 CO 0.00 -0.46 0.62 0.54 -1.32 0.00 0.00 176.35 175.74 3e2u n ARG 28 N 3.63 0.65 -2.42 1.98 3.00 -1.26 -5.03 116.66 117.22 3e2u n ARG 28 Ca 0.24 -2.36 -0.41 0.00 -0.01 0.00 0.00 57.85 55.32 3e2u n ARG 28 Cb 0.42 -0.21 -0.04 0.00 0.00 0.00 0.00 32.46 32.63 3e2u n ARG 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3e2u s VAL 29 N -1.78 3.45 0.00 1.55 0.11 -1.26 -2.92 120.40 119.54 3e2u s VAL 29 Ca 0.47 1.38 0.00 0.00 -2.93 0.00 0.00 61.98 60.90 3e2u s VAL 29 Cb -0.04 -3.88 0.00 0.00 -1.53 0.00 0.00 36.38 30.93 3e2u s VAL 29 CO 0.30 0.30 0.00 0.61 -3.33 0.00 0.00 175.10 172.98 3e2u n GLY 30 N 1.42 2.61 3.50 6.54 0.00 -0.19 -5.03 105.19 114.05 3e2u n GLY 30 Ca 0.00 -0.21 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 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 0.18 0.00 -4.73 1.61 7.64 -1.15 -4.58 113.62 112.61 3e2u n SER 31 Ca 0.00 1.06 -0.39 0.00 1.01 0.00 0.00 58.87 60.55 3e2u n SER 31 Cb 0.00 -1.16 -0.05 0.00 -1.01 0.00 0.00 64.21 61.99 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 -1.49 4.41 0.17 1.43 1.81 -1.26 -1.07 118.95 122.95 3e2u s ARG 32 Ca 0.62 0.80 0.03 0.00 -1.72 0.00 0.00 55.73 55.46 3e2u s ARG 32 Cb -0.70 -3.43 -0.05 0.00 -0.45 0.00 0.00 34.95 30.33 3e2u s ARG 32 CO 0.58 0.13 -0.03 0.14 -0.68 0.00 0.00 175.30 175.45 3e2u s VAL 33 N 0.59 0.90 -0.04 3.52 -7.23 -0.70 -2.38 120.40 115.05 3e2u s VAL 33 Ca 0.35 -2.01 0.06 0.00 -1.81 0.00 0.00 61.98 58.56 3e2u s VAL 33 Cb -0.18 -2.07 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 3e2u s VAL 33 CO 0.17 -0.54 -0.21 -0.70 -0.31 0.00 0.00 175.10 173.51 3e2u s GLU 34 N -3.85 2.10 -0.41 4.82 2.12 0.89 -0.97 118.70 123.38 3e2u s GLU 34 Ca 0.22 -0.77 -0.29 0.00 0.36 0.00 0.00 54.97 54.49 3e2u s GLU 34 Cb 0.05 -1.84 0.02 0.00 0.26 0.00 0.00 34.13 32.63 3e2u s GLU 34 CO 0.04 0.35 1.11 0.08 -0.54 0.00 0.00 175.26 176.30 3e2u s VAL 35 N -0.17 4.32 0.33 3.70 1.01 0.54 -1.82 120.40 128.31 3e2u s VAL 35 Ca -0.01 1.43 -0.28 0.00 0.00 0.00 0.00 61.98 63.12 3e2u s VAL 35 Cb -0.12 -4.53 -0.12 0.00 0.00 0.00 0.00 36.38 31.61 3e2u s VAL 35 CO 0.02 -0.80 1.31 -0.38 0.00 0.00 0.00 175.10 175.25 3e2u n ILE 36 N 6.46 1.84 0.00 2.22 5.41 -0.92 -1.26 119.36 133.11 3e2u n ILE 36 Ca 0.12 -0.46 0.00 0.00 1.00 0.00 0.00 62.75 63.41 3e2u n ILE 36 Cb 0.48 -1.56 0.00 0.00 -0.71 0.00 0.00 39.64 37.85 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 0.99 1.88 0.22 7.39 0.00 -1.26 -4.59 105.19 109.82 3e2u n GLY 37 Ca 0.06 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.38 1.61 1.57 -1.92 -3.46 116.57 114.00 3e2u h LYS 38 Ca 0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 3e2u h LYS 38 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 3e2u h LYS 38 CO 0.00 0.24 -0.15 0.41 -0.57 0.00 0.00 179.45 179.38 3e2u n GLY 39 N -0.12 0.95 3.68 3.86 0.00 -0.39 -4.97 105.19 108.21 3e2u n GLY 39 Ca -0.01 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.16 3.40 -0.01 1.61 3.76 -1.25 -4.84 115.29 115.80 3e2u s HIS 40 Ca 0.00 1.47 -0.07 0.00 -0.15 0.00 0.00 55.06 56.31 3e2u s HIS 40 Cb 0.00 -3.26 -0.05 0.00 1.11 0.00 0.00 32.58 30.38 3e2u s HIS 40 CO 0.00 -0.56 0.26 1.03 -0.85 0.00 0.00 174.74 174.62 3e2u s ARG 41 N 2.20 3.59 0.29 1.40 0.52 -1.26 -0.34 118.95 125.35 3e2u s ARG 41 Ca 0.50 -0.04 -0.04 0.00 -0.52 0.00 0.00 55.73 55.63 3e2u s ARG 41 Cb -0.20 -3.11 0.01 0.00 0.52 0.00 0.00 34.95 32.18 3e2u s ARG 41 CO 0.18 0.67 0.44 0.41 0.02 0.00 0.00 175.30 177.02 3e2u n GLY 42 N 1.30 2.08 3.25 -3.53 0.00 -0.15 -0.96 105.19 107.17 3e2u n GLY 42 Ca -0.13 -1.50 -0.32 0.00 0.00 0.00 0.00 46.02 44.07 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 -2.65 2.28 -0.58 2.61 2.01 0.12 -1.72 115.64 117.72 3e2u s THR 43 Ca 0.21 -0.93 -0.27 0.00 0.31 0.00 0.00 61.69 61.01 3e2u s THR 43 Cb -0.01 -1.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.58 3e2u s THR 43 CO 0.15 0.55 1.80 -0.69 -0.69 0.00 0.00 174.62 175.75 3e2u s VAL 44 N 0.42 3.41 -0.65 3.82 1.01 -0.24 0.43 120.40 128.61 3e2u s VAL 44 Ca -0.15 0.28 0.24 0.00 0.00 0.00 0.00 61.98 62.34 3e2u s VAL 44 Cb -0.17 -3.97 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 3e2u s VAL 44 CO 0.07 -0.90 1.23 0.00 0.00 0.00 0.00 175.10 175.49 3e2u n ALA 45 N 12.14 3.11 -3.56 5.51 0.00 0.28 -1.03 120.51 136.97 3e2u n ALA 45 Ca 0.20 -0.31 -0.11 0.00 0.00 0.00 0.00 53.44 53.22 3e2u n ALA 45 Cb 0.51 -1.10 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 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 -3.17 -0.69 -0.13 0.00 6.14 -0.66 -4.91 117.35 113.94 3e2u s TYR 46 Ca 0.06 1.52 -0.04 0.00 0.64 0.00 0.00 57.07 59.25 3e2u s TYR 46 Cb 0.14 0.31 0.05 0.00 0.42 0.00 0.00 41.96 42.88 3e2u s TYR 46 CO 0.75 -0.35 0.07 0.08 0.64 0.00 0.00 175.55 176.73 3e2u s VAL 47 N 0.94 0.00 -3.77 3.14 1.01 -1.26 0.36 120.40 120.82 3e2u s VAL 47 Ca -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.91 3e2u s VAL 47 Cb -0.06 -0.50 0.00 0.00 0.00 0.00 0.00 36.38 35.82 3e2u s VAL 47 CO -0.08 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.52 3e2u n GLY 48 N 5.25 -0.66 3.86 4.51 0.00 -1.04 -5.02 105.19 112.09 3e2u n GLY 48 Ca -0.06 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 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 3.13 0.29 4.61 0.00 -1.26 -1.49 121.76 126.04 3e2u s ALA 49 Ca 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 51.96 51.97 3e2u s ALA 49 Cb 0.00 -3.03 -0.02 0.00 0.00 0.00 0.00 23.12 20.07 3e2u s ALA 49 CO 0.00 -0.48 0.21 0.25 0.00 0.00 0.00 175.76 175.74 3e2u n THR 50 N -2.25 0.00 0.07 0.00 -2.24 -1.26 -4.93 114.28 103.67 3e2u n THR 50 Ca 0.05 -2.00 0.09 0.00 -2.27 0.00 0.00 64.05 59.93 3e2u n THR 50 Cb 0.54 0.94 -0.14 0.00 -2.10 0.00 0.00 70.33 69.58 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 0.08 0.21 3.22 4.77 -1.26 -4.35 117.00 119.67 3e2u n LEU 51 Ca 0.04 -0.04 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 3e2u n LEU 51 Cb 0.50 0.00 0.29 0.00 -2.33 0.00 0.00 43.42 41.88 3e2u n LEU 51 CO 0.26 0.02 0.75 2.19 -1.33 0.00 0.00 177.39 179.28 3e2u h PHE 52 N 0.00 0.00 -1.42 -1.77 -5.15 -1.98 -3.46 116.94 103.17 3e2u h PHE 52 Ca 0.00 0.00 0.12 0.00 -0.20 0.00 0.00 57.97 57.89 3e2u h PHE 52 Cb 0.80 0.00 -0.25 0.00 0.22 0.00 0.00 35.95 36.72 3e2u h PHE 52 CO 0.00 0.18 0.66 0.00 -2.00 0.00 0.00 178.31 177.15 3e2u s ALA 53 N -3.33 -1.99 1.20 12.09 0.00 -1.26 -5.17 121.76 123.29 3e2u s ALA 53 Ca 0.04 1.69 -0.15 0.00 0.00 0.00 0.00 51.96 53.53 3e2u s ALA 53 Cb 0.08 -1.01 0.29 0.00 0.00 0.00 0.00 23.12 22.47 3e2u s ALA 53 CO 0.66 -0.28 1.02 0.95 0.00 0.00 0.00 175.76 178.12 3e2u s THR 54 N -0.95 1.81 0.00 0.00 -4.23 -1.26 -4.26 115.64 106.74 3e2u s THR 54 Ca 0.02 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.53 3e2u s THR 54 Cb -0.01 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.64 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 0.40 -1.29 3.71 3.99 0.00 -1.26 -4.88 105.19 105.86 3e2u n GLY 55 Ca 0.06 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.52 4.52 0.09 1.61 2.20 -1.26 -4.33 119.74 121.04 3e2u s LYS 56 Ca 0.00 1.51 0.08 0.00 -0.36 0.00 0.00 55.97 57.20 3e2u s LYS 56 Cb 0.00 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.84 3e2u s LYS 56 CO 0.00 -0.12 -0.18 -1.58 -0.36 0.00 0.00 175.35 173.10 3e2u s TRP 57 N 1.10 2.54 -0.22 4.03 0.52 -0.55 -4.60 118.94 121.76 3e2u s TRP 57 Ca 0.54 -0.26 -0.01 0.00 0.02 0.00 0.00 56.10 56.38 3e2u s TRP 57 Cb -0.23 -1.39 0.02 0.00 -1.15 0.00 0.00 33.47 30.72 3e2u s TRP 57 CO 0.28 0.34 -0.11 0.08 0.02 0.00 0.00 176.95 177.56 3e2u s VAL 58 N -1.07 2.69 -0.32 4.03 1.01 0.46 -2.51 120.40 124.70 3e2u s VAL 58 Ca 0.17 -0.87 -0.22 0.00 0.00 0.00 0.00 61.98 61.06 3e2u s VAL 58 Cb -0.11 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 34.02 3e2u s VAL 58 CO 0.08 0.37 0.73 -0.83 0.00 0.00 0.00 175.10 175.45 3e2u s GLY 59 N 1.35 1.72 -0.08 4.51 0.00 0.16 -1.39 107.32 113.59 3e2u s GLY 59 Ca 0.03 -0.58 0.02 0.00 0.00 0.00 0.00 44.72 44.19 3e2u s GLY 59 CO -0.07 1.64 -0.12 0.14 0.00 0.00 0.00 173.10 174.69 3e2u s VAL 60 N 2.86 3.22 -0.54 1.40 1.01 0.25 0.10 120.40 128.71 3e2u s VAL 60 Ca 0.29 -0.64 -0.17 0.00 0.00 0.00 0.00 61.98 61.46 3e2u s VAL 60 Cb -0.14 -2.30 0.10 0.00 0.00 0.00 0.00 36.38 34.03 3e2u s VAL 60 CO 0.13 0.57 0.57 -0.63 0.00 0.00 0.00 175.10 175.74 3e2u s ILE 61 N -0.44 5.03 0.38 2.22 1.01 0.17 -1.72 121.20 127.86 3e2u s ILE 61 Ca 0.05 -1.09 -0.26 0.00 0.00 0.00 0.00 60.65 59.36 3e2u s ILE 61 Cb -0.12 -4.34 -0.09 0.00 0.01 0.00 0.00 42.46 37.92 3e2u s ILE 61 CO 0.02 -0.89 1.17 -0.76 0.00 0.00 0.00 174.94 174.48 3e2u s LEU 62 N 2.13 4.24 0.35 2.97 1.43 0.16 -0.70 118.68 129.26 3e2u s LEU 62 Ca 0.08 2.35 0.02 0.00 -1.03 0.00 0.00 54.13 55.55 3e2u s LEU 62 Cb -0.25 -3.97 0.63 0.00 0.03 0.00 0.00 46.19 42.63 3e2u s LEU 62 CO 0.06 -0.61 2.00 0.44 0.23 0.00 0.00 176.35 178.47 3e2u h ASP 63 N 2.79 0.72 -2.08 2.29 3.32 -1.36 -3.44 116.42 118.66 3e2u h ASP 63 Ca -0.49 -0.03 -0.58 0.00 0.02 0.00 0.00 57.03 55.96 3e2u h ASP 63 Cb 1.23 -0.18 -0.11 0.00 0.22 0.00 0.00 39.33 40.49 3e2u h ASP 63 CO 0.63 0.54 -0.66 -1.61 -1.72 0.00 0.00 179.24 176.42 3e2u s GLU 64 N -5.69 2.06 -0.68 3.56 2.02 -1.26 -5.01 118.70 113.71 3e2u s GLU 64 Ca -0.10 -1.64 -0.06 0.00 0.02 0.00 0.00 54.97 53.19 3e2u s GLU 64 Cb 0.17 -1.97 -0.10 0.00 0.10 0.00 0.00 34.13 32.33 3e2u s GLU 64 CO 0.77 0.25 2.38 0.00 0.02 0.00 0.00 175.26 178.68 3e2u n ALA 65 N -0.86 5.01 -0.97 5.21 0.00 -1.26 -4.35 120.51 123.29 3e2u n ALA 65 Ca -0.05 -1.90 0.08 0.00 0.00 0.00 0.00 53.44 51.57 3e2u n ALA 65 Cb 0.61 -2.79 0.31 0.00 0.00 0.00 0.00 19.45 17.58 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 3.56 3.62 -0.83 0.00 4.01 -1.09 -4.84 118.16 122.61 3e2u n LYS 66 Ca 0.43 -2.96 0.00 0.00 -0.51 0.00 0.00 58.31 55.27 3e2u n LYS 66 Cb 0.31 -2.00 0.00 0.00 -0.51 0.00 0.00 35.03 32.84 3e2u n LYS 66 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3e2u n GLY 67 N -0.11 5.76 0.01 0.72 0.00 0.21 -5.02 105.19 106.76 3e2u n GLY 67 Ca 0.24 -2.11 0.01 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 -0.05 4.96 0.00 1.61 5.02 0.21 -4.71 118.16 125.20 3e2u n LYS 68 Ca 0.00 -0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 3e2u n LYS 68 Cb 0.00 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 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 -0.78 0.00 -0.32 4.39 0.23 0.11 -4.84 115.26 114.05 3e2u n ASN 69 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.06 3e2u n ASN 69 Cb 0.02 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 37.73 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 0.00 0.15 0.00 0.53 5.75 -1.26 -1.36 116.55 120.36 3e2u n ASP 70 Ca 0.00 -1.75 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 3e2u n ASP 70 Cb 0.00 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 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 -0.08 3.05 3.53 6.12 0.00 -1.26 -2.57 105.19 113.99 3e2u n GLY 71 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.82 4.96 -0.10 2.61 2.01 -1.26 -0.68 115.64 120.37 3e2u s THR 72 Ca 0.00 0.14 0.01 0.00 0.31 0.00 0.00 61.69 62.15 3e2u s THR 72 Cb 0.00 -4.06 0.02 0.00 0.01 0.00 0.00 72.50 68.47 3e2u s THR 72 CO 0.00 -0.38 -0.11 -0.69 -0.69 0.00 0.00 174.62 172.74 3e2u s VAL 73 N 2.49 1.24 -1.85 3.82 1.01 -0.43 -4.65 120.40 122.04 3e2u s VAL 73 Ca 0.19 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.70 3e2u s VAL 73 Cb -0.15 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.05 3e2u s VAL 73 CO 0.15 0.39 0.00 0.00 0.00 0.00 0.00 175.10 175.65 3e2u n GLN 74 N 4.44 -1.36 0.00 2.72 6.02 -1.26 -2.66 117.38 125.29 3e2u n GLN 74 Ca -0.17 1.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.89 3e2u n GLN 74 Cb 0.51 -5.44 0.00 0.00 1.02 0.00 0.00 30.24 26.33 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 -0.80 2.59 3.62 1.08 0.00 -1.26 -5.03 105.19 105.39 3e2u n GLY 75 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.92 4.04 -0.08 1.61 6.06 -1.09 -5.06 118.95 123.51 3e2u s ARG 76 Ca 0.00 -0.05 -0.27 0.00 -2.50 0.00 0.00 55.73 52.91 3e2u s ARG 76 Cb 0.00 -3.62 -0.03 0.00 0.06 0.00 0.00 34.95 31.36 3e2u s ARG 76 CO 0.00 -0.17 0.86 0.21 -2.50 0.00 0.00 175.30 173.70 3e2u s LYS 77 N 1.74 4.44 -0.08 5.12 2.20 -1.26 -1.31 119.74 130.59 3e2u s LYS 77 Ca 0.13 1.15 0.08 0.00 -0.36 0.00 0.00 55.97 56.97 3e2u s LYS 77 Cb -0.15 -3.49 -0.11 0.00 -1.51 0.00 0.00 37.83 32.56 3e2u s LYS 77 CO 0.09 -0.11 0.05 0.66 -0.36 0.00 0.00 175.35 175.67 3e2u n TYR 78 N 4.33 0.00 -3.57 4.03 4.02 0.14 -4.96 117.16 121.15 3e2u n TYR 78 Ca 0.04 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.90 3e2u n TYR 78 Cb 0.50 -0.42 0.01 0.00 -0.02 0.00 0.00 39.34 39.41 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 -2.29 -1.34 -4.27 -0.72 1.16 -1.20 -4.86 117.46 103.93 3e2u n PHE 79 Ca -0.13 -0.84 -0.23 0.00 -1.87 0.00 0.00 57.45 54.38 3e2u n PHE 79 Cb 0.74 0.42 -0.17 0.00 -1.61 0.00 0.00 39.48 38.86 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 -2.39 0.81 0.00 1.97 2.01 -1.26 -3.99 115.64 112.80 3e2u s THR 80 Ca 0.11 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 61.84 3e2u s THR 80 Cb -0.02 -0.80 0.00 0.00 0.01 0.00 0.00 72.50 71.69 3e2u s THR 80 CO 0.05 0.29 0.00 0.00 -0.69 0.00 0.00 174.62 174.27 3e2u s ASP 82 N -0.26 6.82 0.15 0.00 1.01 -1.26 -4.77 116.67 118.36 3e2u s ASP 82 Ca 0.00 1.45 -0.31 0.00 0.71 0.00 0.00 52.55 54.40 3e2u s ASP 82 Cb 0.00 -2.44 -0.10 0.00 1.01 0.00 0.00 42.92 41.38 3e2u s ASP 82 CO 0.00 -0.30 1.71 -0.70 0.21 0.00 0.00 175.17 176.09 3e2u s GLU 83 N -3.16 4.16 0.00 8.23 -6.30 -1.26 -1.87 118.70 118.50 3e2u s GLU 83 Ca 0.57 2.50 0.00 0.00 -2.50 0.00 0.00 54.97 55.55 3e2u s GLU 83 Cb -0.10 -3.33 0.00 0.00 0.00 0.00 0.00 34.13 30.70 3e2u s GLU 83 CO 0.17 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 175.12 3e2u n GLY 84 N 4.01 1.96 0.02 -1.50 0.00 -0.47 -4.91 105.19 104.30 3e2u n GLY 84 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.51 0.08 -3.03 1.61 8.25 -0.78 0.65 115.22 120.48 3e2u n HIS 85 Ca 0.00 0.02 -0.39 0.00 -0.26 0.00 0.00 57.72 57.09 3e2u n HIS 85 Cb 0.00 -0.45 -0.06 0.00 1.12 0.00 0.00 29.99 30.60 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 -4.23 2.86 -0.05 -1.41 0.00 -0.67 0.40 107.32 104.23 3e2u s GLY 86 Ca -0.04 0.29 -0.21 0.00 0.00 0.00 0.00 44.72 44.76 3e2u s GLY 86 CO 0.89 0.82 0.46 -1.50 0.00 0.00 0.00 173.10 173.77 3e2u s ILE 87 N -1.02 0.03 -0.18 0.90 2.07 -0.70 0.65 121.20 122.95 3e2u s ILE 87 Ca 0.35 -0.25 -0.02 0.00 -1.41 0.00 0.00 60.65 59.32 3e2u s ILE 87 Cb -0.22 -0.76 -0.01 0.00 0.13 0.00 0.00 42.46 41.60 3e2u s ILE 87 CO 0.25 -0.14 -0.09 -0.36 -1.91 0.00 0.00 174.94 172.69 3e2u s PHE 88 N -1.08 2.89 0.13 3.50 0.08 -1.26 -0.58 117.98 121.66 3e2u s PHE 88 Ca -0.11 -0.86 0.04 0.00 0.12 0.00 0.00 56.93 56.12 3e2u s PHE 88 Cb -0.03 -1.98 -0.04 0.00 -0.57 0.00 0.00 43.02 40.39 3e2u s PHE 88 CO 0.06 -0.42 -0.10 0.14 -0.10 0.00 0.00 175.22 174.80 3e2u s VAL 89 N 0.98 1.06 0.63 -0.44 -7.23 -0.48 -4.93 120.40 109.99 3e2u s VAL 89 Ca -0.01 -1.97 -0.17 0.00 -1.81 0.00 0.00 61.98 58.02 3e2u s VAL 89 Cb -0.15 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.04 3e2u s VAL 89 CO -0.01 -0.73 1.15 -0.13 -0.31 0.00 0.00 175.10 175.07 3e2u s ARG 90 N -3.59 2.87 0.43 4.82 1.81 -1.26 -0.40 118.95 123.63 3e2u s ARG 90 Ca 0.14 1.57 0.30 0.00 -1.72 0.00 0.00 55.73 56.02 3e2u s ARG 90 Cb 0.02 -1.94 1.47 0.00 -0.45 0.00 0.00 34.95 34.05 3e2u s ARG 90 CO -0.00 -1.23 1.90 -0.56 -0.68 0.00 0.00 175.30 174.73 3e2u h GLN 91 N 0.43 0.00 0.00 3.54 3.07 -1.93 -1.83 115.11 118.39 3e2u h GLN 91 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.26 3e2u h GLN 91 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.83 3e2u h GLN 91 CO 0.54 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.12 3e2u h SER 92 N 0.00 0.00 1.32 0.06 4.64 -1.98 -3.13 113.55 114.46 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 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3e2u h SER 92 CO 0.00 0.00 -0.00 1.56 -0.87 0.00 0.00 176.83 177.52 3e2u h GLN 93 N 0.00 0.00 -4.79 4.77 1.08 -1.70 -3.47 115.11 111.00 3e2u h GLN 93 Ca 0.00 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 56.90 3e2u h GLN 93 Cb 0.78 0.00 -0.15 0.00 -0.05 0.00 0.00 27.48 28.07 3e2u h GLN 93 CO 0.00 0.00 -0.64 0.96 -0.95 0.00 0.00 178.83 178.20 3e2u s ILE 94 N -3.53 0.55 0.02 2.54 -5.25 -1.18 -2.16 121.20 112.18 3e2u s ILE 94 Ca 0.03 -1.98 -0.02 0.00 -0.99 0.00 0.00 60.65 57.68 3e2u s ILE 94 Cb 0.08 -2.33 -0.01 0.00 2.95 0.00 0.00 42.46 43.14 3e2u s ILE 94 CO 0.58 -0.26 0.02 0.00 -1.79 0.00 0.00 174.94 173.48 3e2u s GLN 95 N -3.98 0.37 0.35 0.37 -2.07 -0.76 -4.92 119.66 109.02 3e2u s GLN 95 Ca 0.30 -0.57 -0.22 0.00 -1.82 0.00 0.00 55.36 53.05 3e2u s GLN 95 Cb 0.07 0.14 -0.10 0.00 -1.09 0.00 0.00 33.01 32.03 3e2u s GLN 95 CO 0.08 -0.07 0.90 0.08 -1.32 0.00 0.00 175.29 174.96 3e2u s VAL 96 N -1.50 4.36 0.35 3.63 1.01 -1.26 -0.08 120.40 126.90 3e2u s VAL 96 Ca -0.15 1.56 -0.06 0.00 0.00 0.00 0.00 61.98 63.33 3e2u s VAL 96 Cb -0.09 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.51 3e2u s VAL 96 CO -0.01 -0.06 0.56 2.22 0.00 0.00 0.00 175.10 177.81 3e2u n PHE 97 N 0.03 -1.70 -3.83 5.22 -1.74 -1.00 -4.86 117.46 109.59 3e2u n PHE 97 Ca 0.04 -2.08 -0.13 0.00 -0.56 0.00 0.00 57.45 54.71 3e2u n PHE 97 Cb 0.52 0.64 -0.15 0.00 1.52 0.00 0.00 39.48 42.01 3e2u n PHE 97 CO 0.00 0.00 0.00 -2.00 -0.56 0.00 0.00 176.76 174.20 3e2u s GLU 98 N -2.54 -0.01 0.00 3.97 2.56 -1.26 -4.75 118.70 116.68 3e2u s GLU 98 Ca 0.23 0.08 0.19 0.00 0.00 0.00 0.00 54.97 55.47 3e2u s GLU 98 Cb -0.02 -0.09 1.12 0.00 2.00 0.00 0.00 34.13 37.14 3e2u s GLU 98 CO 0.17 -0.07 1.52 -3.47 -0.56 0.00 0.00 175.26 172.85