#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i0x s TYR 2 N 0.00 -0.03 0.08 1.12 5.04 -0.29 -2.17 117.35 121.10 2i0x s TYR 2 Ca 0.00 0.22 0.05 0.00 -2.44 0.00 0.00 57.07 54.90 2i0x s TYR 2 Cb 0.00 -0.16 -0.03 0.00 0.35 0.00 0.00 41.96 42.12 2i0x s TYR 2 CO 0.00 -0.10 -0.13 0.96 -1.34 0.00 0.00 175.55 174.94 2i0x s ILE 3 N 0.94 1.11 -0.21 3.14 -0.00 -0.70 0.00 121.20 125.49 2i0x s ILE 3 Ca -0.08 -1.42 -0.01 0.00 -0.00 0.00 0.00 60.65 59.14 2i0x s ILE 3 Cb -0.11 -1.18 0.01 0.00 -0.00 0.00 0.00 42.46 41.19 2i0x s ILE 3 CO -0.03 -0.31 -0.13 0.68 -0.00 0.00 0.00 174.94 175.15 2i0x s VAL 4 N -1.59 2.60 -0.25 8.37 -7.23 -1.08 -1.93 120.40 119.28 2i0x s VAL 4 Ca 0.01 -0.83 -0.07 0.00 -1.81 0.00 0.00 61.98 59.27 2i0x s VAL 4 Cb -0.08 -2.18 -0.03 0.00 0.56 0.00 0.00 36.38 34.65 2i0x s VAL 4 CO 0.02 0.44 0.08 -0.69 -0.31 0.00 0.00 175.10 174.63 2i0x s VAL 5 N 1.35 4.35 -0.01 1.32 1.01 0.25 -1.87 120.40 126.81 2i0x s VAL 5 Ca 0.04 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 61.93 2i0x s VAL 5 Cb -0.14 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 2i0x s VAL 5 CO -0.08 0.33 -0.23 -0.69 0.00 0.00 0.00 175.10 174.43 2i0x s VAL 6 N 1.62 2.36 0.04 2.92 1.01 -0.06 -1.25 120.40 127.04 2i0x s VAL 6 Ca 0.06 -1.08 -0.09 0.00 0.00 0.00 0.00 61.98 60.88 2i0x s VAL 6 Cb -0.15 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.35 2i0x s VAL 6 CO 0.04 0.52 0.17 -0.72 0.00 0.00 0.00 175.10 175.12 2i0x s TYR 7 N -0.70 0.09 -0.40 5.22 -0.85 -0.80 -0.74 117.35 119.17 2i0x s TYR 7 Ca 0.11 -0.33 0.02 0.00 -0.52 0.00 0.00 57.07 56.36 2i0x s TYR 7 Cb -0.10 -0.05 0.12 0.00 0.38 0.00 0.00 41.96 42.30 2i0x s TYR 7 CO 0.00 -0.42 0.17 0.34 -1.52 0.00 0.00 175.55 174.13 2i0x s ASP 8 N -2.10 4.07 -0.08 -0.18 2.15 0.73 -4.80 116.67 116.45 2i0x s ASP 8 Ca -0.05 -2.36 0.04 0.00 0.43 0.00 0.00 52.55 50.61 2i0x s ASP 8 Cb -0.01 -1.20 0.00 0.00 -0.30 0.00 0.00 42.92 41.41 2i0x s ASP 8 CO -0.04 -0.32 -0.22 -0.69 -0.17 0.00 0.00 175.17 173.73 2i0x s VAL 9 N 0.66 1.85 0.52 1.11 1.01 -1.26 -1.56 120.40 122.74 2i0x s VAL 9 Ca 0.14 -0.91 -0.20 0.00 0.00 0.00 0.00 61.98 61.01 2i0x s VAL 9 Cb -0.22 -1.61 -0.08 0.00 0.00 0.00 0.00 36.38 34.47 2i0x s VAL 9 CO -0.08 0.52 0.79 0.61 0.00 0.00 0.00 175.10 176.94 2i0x n GLY 10 N 3.45 -0.79 3.39 4.51 0.00 -1.26 -4.54 105.19 109.95 2i0x n GLY 10 Ca -0.19 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 2i0x n GLY 10 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2i0x n VAL 11 N -1.30 0.00 -3.73 1.61 0.31 -1.26 -2.64 118.33 111.32 2i0x n VAL 11 Ca 0.12 -0.36 -0.23 0.00 -0.01 0.00 0.00 64.34 63.85 2i0x n VAL 11 Cb 0.44 -0.81 0.04 0.00 -0.91 0.00 0.00 33.84 32.60 2i0x n VAL 11 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2i0x n GLU 12 N -3.55 -5.30 0.00 5.55 4.71 -1.26 -4.39 120.64 116.40 2i0x n GLU 12 Ca 0.02 0.64 0.00 0.00 -0.01 0.00 0.00 57.16 57.81 2i0x n GLU 12 Cb 0.57 -5.32 0.00 0.00 -1.01 0.00 0.00 31.44 25.68 2i0x n GLU 12 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 2i0x n ARG 13 N -4.39 0.00 -0.02 3.49 0.63 -1.23 -4.97 116.66 110.16 2i0x n ARG 13 Ca -0.21 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.63 2i0x n ARG 13 Cb 0.64 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.47 2i0x n ARG 13 CO 0.00 0.00 0.00 -0.24 -2.51 0.00 0.00 177.63 174.88 2i0x h VAL 14 N 0.00 0.94 -1.19 5.15 3.04 -1.71 -3.10 116.25 119.38 2i0x h VAL 14 Ca 0.00 -1.52 0.36 0.00 -1.01 0.00 0.00 66.70 64.53 2i0x h VAL 14 Cb 0.00 1.70 -0.11 0.00 -2.01 0.00 0.00 31.29 30.87 2i0x h VAL 14 CO 0.00 0.29 0.77 -1.13 -1.01 0.00 0.00 177.57 176.49 2i0x h ASN 15 N -0.95 0.32 0.09 3.17 -1.24 -1.93 0.22 115.58 115.26 2i0x h ASN 15 Ca -0.01 0.11 -0.00 0.00 0.71 0.00 0.00 56.30 57.11 2i0x h ASN 15 Cb 0.54 0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.66 2i0x h ASN 15 CO 0.01 -0.06 -0.04 0.50 -1.29 0.00 0.00 177.43 176.55 2i0x h LYS 16 N 0.22 -0.11 0.00 6.67 1.63 -1.95 -1.54 116.57 121.49 2i0x h LYS 16 Ca 0.71 0.01 -0.08 0.00 -0.85 0.00 0.00 60.65 60.44 2i0x h LYS 16 Cb 2.09 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 33.73 2i0x h LYS 16 CO -0.35 0.13 -0.36 -0.39 -3.45 0.00 0.00 179.45 175.02 2i0x h VAL 17 N -0.34 1.10 -0.16 2.00 -1.51 -0.62 -2.59 116.25 114.13 2i0x h VAL 17 Ca -0.01 -1.31 -0.03 0.00 -1.23 0.00 0.00 66.70 64.12 2i0x h VAL 17 Cb 0.29 1.74 -0.01 0.00 -2.13 0.00 0.00 31.29 31.19 2i0x h VAL 17 CO 0.02 0.35 -0.00 0.50 -1.23 0.00 0.00 177.57 177.21 2i0x h LYS 18 N 0.00 0.27 -0.63 5.19 3.64 -0.65 -1.86 116.57 122.54 2i0x h LYS 18 Ca -0.00 -0.09 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2i0x h LYS 18 Cb 0.71 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.47 2i0x h LYS 18 CO 0.05 0.50 0.39 0.87 -2.27 0.00 0.00 179.45 178.99 2i0x h LYS 19 N 0.02 0.74 0.21 1.90 1.79 -1.12 -1.83 116.57 118.28 2i0x h LYS 19 Ca 0.04 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2i0x h LYS 19 Cb 0.38 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 30.84 2i0x h LYS 19 CO 0.01 0.49 -0.20 0.35 -1.08 0.00 0.00 179.45 179.02 2i0x h PHE 20 N 0.76 -0.52 0.00 -1.35 3.57 -1.28 -2.89 116.94 115.23 2i0x h PHE 20 Ca 0.26 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 2i0x h PHE 20 Cb 0.03 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 2i0x h PHE 20 CO -0.05 -0.30 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.42 2i0x h LEU 21 N -0.44 0.00 -0.98 0.59 3.38 -1.24 -2.53 115.31 114.10 2i0x h LEU 21 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2i0x h LEU 21 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2i0x h LEU 21 CO -0.04 0.24 0.00 0.54 0.09 0.00 0.00 178.44 179.27 2i0x n ARG 22 N -3.62 0.16 -0.25 1.13 1.74 -0.70 0.64 116.66 115.77 2i0x n ARG 22 Ca -0.01 0.52 0.07 0.00 -0.77 0.00 0.00 57.85 57.66 2i0x n ARG 22 Cb 0.37 -1.89 0.20 0.00 -1.02 0.00 0.00 32.46 30.12 2i0x n ARG 22 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2i0x n MET 23 N -2.20 2.89 0.00 5.56 2.81 -0.95 -4.58 117.12 120.65 2i0x n MET 23 Ca 0.01 -2.24 0.00 0.00 -1.81 0.00 0.00 57.70 53.65 2i0x n MET 23 Cb 0.13 -1.39 0.00 0.00 -0.71 0.00 0.00 33.22 31.26 2i0x n MET 23 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2i0x n HIS 24 N 0.66 0.00 -4.48 2.03 8.25 -0.16 -5.12 115.22 116.39 2i0x n HIS 24 Ca 0.15 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.36 2i0x n HIS 24 Cb 0.51 0.04 -0.08 0.00 1.12 0.00 0.00 29.99 31.58 2i0x n HIS 24 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2i0x s LEU 25 N -3.97 1.95 0.08 2.41 1.43 0.21 -4.89 118.68 115.89 2i0x s LEU 25 Ca 0.00 -1.70 -0.09 0.00 -1.03 0.00 0.00 54.13 51.30 2i0x s LEU 25 Cb 0.00 0.01 -0.06 0.00 0.03 0.00 0.00 46.19 46.18 2i0x s LEU 25 CO 0.00 -0.97 0.39 0.20 0.23 0.00 0.00 176.35 176.20 2i0x s ASN 26 N -3.58 6.62 -0.33 2.29 0.01 0.30 -4.38 114.94 115.88 2i0x s ASN 26 Ca 0.26 0.77 -0.19 0.00 -0.71 0.00 0.00 52.86 52.99 2i0x s ASN 26 Cb 0.02 -2.17 -0.01 0.00 0.41 0.00 0.00 41.25 39.51 2i0x s ASN 26 CO 0.17 0.17 0.54 0.86 -1.51 0.00 0.00 177.10 177.33 2i0x s TRP 27 N -1.40 3.19 -0.19 2.20 -0.00 -1.26 -0.56 118.94 120.92 2i0x s TRP 27 Ca 0.33 0.31 -0.18 0.00 -0.00 0.00 0.00 56.10 56.57 2i0x s TRP 27 Cb -0.14 -2.94 -0.14 0.00 -0.00 0.00 0.00 33.47 30.26 2i0x s TRP 27 CO 0.18 -0.51 0.06 0.28 -0.00 0.00 0.00 176.95 176.97 2i0x n VAL 28 N 5.41 1.50 -3.99 5.86 0.31 -0.17 -4.81 118.33 122.44 2i0x n VAL 28 Ca -0.04 0.03 -0.13 0.00 -0.01 0.00 0.00 64.34 64.19 2i0x n VAL 28 Cb 0.49 -2.14 -0.02 0.00 -0.91 0.00 0.00 33.84 31.26 2i0x n VAL 28 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2i0x n GLN 29 N -4.48 0.79 -1.75 5.55 10.64 -1.18 -3.82 117.38 123.13 2i0x n GLN 29 Ca -0.26 -2.65 -0.42 0.00 -1.83 0.00 0.00 57.00 51.84 2i0x n GLN 29 Cb 0.57 2.69 -0.03 0.00 -0.86 0.00 0.00 30.24 32.62 2i0x n GLN 29 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 2i0x s ASN 30 N -3.13 6.47 0.00 2.61 3.84 -1.26 -1.37 114.94 122.10 2i0x s ASN 30 Ca 0.26 2.67 0.00 0.00 0.21 0.00 0.00 52.86 56.00 2i0x s ASN 30 Cb -0.02 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.13 2i0x s ASN 30 CO 0.19 -0.99 0.00 -1.20 -2.79 0.00 0.00 177.10 172.30 2i0x n SER 31 N 6.19 -2.91 -3.92 -4.21 7.64 -1.26 -5.00 113.62 110.13 2i0x n SER 31 Ca 0.18 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.81 2i0x n SER 31 Cb 0.39 -0.69 -0.17 0.00 -1.01 0.00 0.00 64.21 62.74 2i0x n SER 31 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2i0x s VAL 32 N -2.11 0.91 0.07 0.44 1.01 -0.47 -1.90 120.40 118.35 2i0x s VAL 32 Ca 0.00 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 61.75 2i0x s VAL 32 Cb 0.00 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 2i0x s VAL 32 CO 0.00 0.33 -0.13 -0.36 0.00 0.00 0.00 175.10 174.94 2i0x s PHE 33 N 1.30 1.08 0.09 5.22 0.40 -0.38 -1.00 117.98 124.70 2i0x s PHE 33 Ca -0.03 -0.48 -0.14 0.00 -0.60 0.00 0.00 56.93 55.68 2i0x s PHE 33 Cb -0.14 -0.61 0.02 0.00 0.51 0.00 0.00 43.02 42.80 2i0x s PHE 33 CO -0.03 0.02 0.33 -1.83 0.70 0.00 0.00 175.22 174.42 2i0x s GLU 34 N -1.75 0.94 0.00 0.44 -1.05 0.28 0.86 118.70 118.43 2i0x s GLU 34 Ca -0.04 -0.67 0.00 0.00 -0.15 0.00 0.00 54.97 54.11 2i0x s GLU 34 Cb -0.10 0.41 0.00 0.00 -0.44 0.00 0.00 34.13 34.00 2i0x s GLU 34 CO 0.02 -0.34 0.00 0.41 0.95 0.00 0.00 175.26 176.30 2i0x n GLY 35 N 0.08 -0.17 3.87 -3.83 0.00 -0.81 -0.54 105.19 103.78 2i0x n GLY 35 Ca -0.17 -1.15 -0.32 0.00 0.00 0.00 0.00 46.02 44.38 2i0x n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2i0x s GLU 36 N -2.00 3.86 0.12 1.61 2.02 -1.26 -1.72 118.70 121.33 2i0x s GLU 36 Ca 0.00 0.37 -0.12 0.00 0.02 0.00 0.00 54.97 55.24 2i0x s GLU 36 Cb 0.00 -2.64 0.01 0.00 0.10 0.00 0.00 34.13 31.60 2i0x s GLU 36 CO 0.00 0.31 0.30 0.14 0.02 0.00 0.00 175.26 176.03 2i0x s VAL 37 N -1.81 0.10 0.17 2.63 -7.23 -0.92 -4.96 120.40 108.38 2i0x s VAL 37 Ca 0.48 -0.93 -0.02 0.00 -1.81 0.00 0.00 61.98 59.70 2i0x s VAL 37 Cb -0.11 -1.33 -0.05 0.00 0.56 0.00 0.00 36.38 35.45 2i0x s VAL 37 CO 0.20 -0.45 0.37 0.28 -0.31 0.00 0.00 175.10 175.19 2i0x s THR 38 N -3.85 5.21 0.18 5.32 -1.32 -1.26 -4.10 115.64 115.82 2i0x s THR 38 Ca 0.06 -0.26 0.14 0.00 -1.21 0.00 0.00 61.69 60.42 2i0x s THR 38 Cb 0.03 -3.69 0.14 0.00 -1.51 0.00 0.00 72.50 67.47 2i0x s THR 38 CO -0.10 -0.08 1.34 0.25 -2.21 0.00 0.00 174.62 173.82 2i0x h LEU 39 N 2.35 0.00 0.00 9.08 5.85 -1.99 0.35 115.31 130.95 2i0x h LEU 39 Ca -0.47 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.10 2i0x h LEU 39 Cb 1.18 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 2i0x h LEU 39 CO 0.70 0.00 -0.98 0.00 -0.34 0.00 0.00 178.44 177.83 2i0x h ALA 40 N 1.06 0.18 0.00 1.25 0.00 -2.00 -3.29 119.26 116.46 2i0x h ALA 40 Ca 0.00 -0.96 -0.02 0.00 0.00 0.00 0.00 54.91 53.93 2i0x h ALA 40 Cb 0.75 0.64 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 2i0x h ALA 40 CO 0.00 0.61 -0.10 1.49 0.00 0.00 0.00 179.25 181.25 2i0x h GLU 41 N -1.00 0.00 -0.62 0.00 4.81 -1.16 -0.86 114.58 115.75 2i0x h GLU 41 Ca -0.23 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.91 2i0x h GLU 41 Cb 1.04 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 2i0x h GLU 41 CO -0.14 0.10 0.03 0.35 -0.73 0.00 0.00 179.01 178.62 2i0x h PHE 42 N 0.00 1.16 -0.11 0.92 3.57 -0.62 0.01 116.94 121.87 2i0x h PHE 42 Ca -0.00 -0.19 -0.11 0.00 3.53 0.00 0.00 57.97 61.20 2i0x h PHE 42 Cb 0.19 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2i0x h PHE 42 CO 0.00 1.01 -0.41 0.93 -2.23 0.00 0.00 178.31 177.60 2i0x h GLU 43 N 0.98 0.25 -0.22 1.11 4.39 -1.27 -2.85 114.58 116.96 2i0x h GLU 43 Ca 0.18 -0.12 -0.11 0.00 0.34 0.00 0.00 59.36 59.65 2i0x h GLU 43 Cb 0.52 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2i0x h GLU 43 CO 0.03 0.63 -0.31 0.00 -1.16 0.00 0.00 179.01 178.20 2i0x h ARG 44 N 0.21 0.60 0.19 2.33 3.08 -0.74 0.18 114.38 120.22 2i0x h ARG 44 Ca 0.02 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2i0x h ARG 44 Cb 0.82 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2i0x h ARG 44 CO 0.06 0.95 -0.17 0.82 -1.07 0.00 0.00 179.97 180.57 2i0x h ILE 45 N 0.29 0.63 0.00 2.04 2.04 -0.93 -1.05 117.51 120.52 2i0x h ILE 45 Ca 0.02 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 2i0x h ILE 45 Cb 0.88 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2i0x h ILE 45 CO 0.07 0.00 -0.27 0.07 0.00 0.00 0.00 178.15 178.02 2i0x h LYS 46 N -0.38 0.00 0.75 2.37 2.10 -1.54 -0.59 116.57 119.27 2i0x h LYS 46 Ca -0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.61 2i0x h LYS 46 Cb 0.35 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.69 2i0x h LYS 46 CO -0.03 0.27 -0.36 0.93 -2.00 0.00 0.00 179.45 178.26 2i0x h GLU 47 N 0.00 -0.97 0.11 0.07 5.08 0.07 -0.21 114.58 118.74 2i0x h GLU 47 Ca -0.00 0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2i0x h GLU 47 Cb 0.63 0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2i0x h GLU 47 CO 0.04 -0.64 -0.05 0.78 -1.00 0.00 0.00 179.01 178.13 2i0x h GLY 48 N -1.12 -0.15 1.34 -3.84 0.00 -1.20 -1.15 103.07 96.95 2i0x h GLY 48 Ca -0.10 0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.30 2i0x h GLY 48 CO 0.17 -0.06 0.31 -2.00 0.00 0.00 0.00 176.54 174.96 2i0x h LEU 49 N -0.22 0.00 -0.93 3.11 5.85 -1.16 0.38 115.31 122.34 2i0x h LEU 49 Ca -0.02 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.59 2i0x h LEU 49 Cb 0.18 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 2i0x h LEU 49 CO 0.02 0.00 -0.52 0.50 -0.34 0.00 0.00 178.44 178.10 2i0x h LYS 50 N 0.00 0.03 0.00 1.25 3.64 0.29 -3.06 116.57 118.73 2i0x h LYS 50 Ca 0.03 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2i0x h LYS 50 Cb 0.66 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 2i0x h LYS 50 CO -0.00 0.55 -0.86 1.63 -2.27 0.00 0.00 179.45 178.50 2i0x n LYS 51 N -3.92 2.40 0.00 1.90 4.01 0.58 -4.36 118.16 118.77 2i0x n LYS 51 Ca -0.01 -0.04 0.15 0.00 -0.51 0.00 0.00 58.31 57.90 2i0x n LYS 51 Cb 0.54 -1.05 0.75 0.00 -0.51 0.00 0.00 35.03 34.76 2i0x n LYS 51 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 2i0x n ILE 52 N -1.48 0.00 -4.23 -0.18 2.08 0.10 -4.82 119.36 110.83 2i0x n ILE 52 Ca 0.00 -0.04 -0.17 0.00 0.56 0.00 0.00 62.75 63.10 2i0x n ILE 52 Cb 0.18 -0.28 -0.11 0.00 -0.75 0.00 0.00 39.64 38.69 2i0x n ILE 52 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 2i0x s ILE 53 N -2.30 1.25 -0.37 1.39 1.01 -1.16 -4.72 121.20 116.30 2i0x s ILE 53 Ca 0.36 -1.77 -0.09 0.00 0.00 0.00 0.00 60.65 59.15 2i0x s ILE 53 Cb 0.21 -1.56 0.04 0.00 0.01 0.00 0.00 42.46 41.16 2i0x s ILE 53 CO 0.42 -0.50 0.19 -0.62 0.00 0.00 0.00 174.94 174.43 2i0x s ASP 54 N -2.59 5.58 1.31 3.58 2.15 -1.26 -4.89 116.67 120.53 2i0x s ASP 54 Ca 0.10 -1.17 -0.17 0.00 0.43 0.00 0.00 52.55 51.75 2i0x s ASP 54 Cb -0.03 -1.96 0.26 0.00 -0.30 0.00 0.00 42.92 40.88 2i0x s ASP 54 CO 0.02 -0.40 0.58 -0.62 -0.17 0.00 0.00 175.17 174.58 2i0x n GLU 55 N 4.92 -3.82 0.00 4.34 4.71 -1.26 -1.41 120.64 128.11 2i0x n GLU 55 Ca -0.12 -0.98 0.00 0.00 -0.01 0.00 0.00 57.16 56.05 2i0x n GLU 55 Cb 0.45 -1.31 0.00 0.00 -1.01 0.00 0.00 31.44 29.57 2i0x n GLU 55 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2i0x n ASN 56 N -4.73 0.00 -0.00 1.62 3.02 -1.26 -4.20 115.26 109.71 2i0x n ASN 56 Ca 0.09 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.60 2i0x n ASN 56 Cb 0.41 -0.04 -0.01 0.00 -0.61 0.00 0.00 39.78 39.52 2i0x n ASN 56 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2i0x n SER 57 N 0.38 1.01 -4.88 6.41 2.88 -1.16 -5.08 113.62 113.18 2i0x n SER 57 Ca 0.00 0.15 -0.30 0.00 -1.33 0.00 0.00 58.87 57.39 2i0x n SER 57 Cb 0.00 -0.35 0.01 0.00 -0.75 0.00 0.00 64.21 63.12 2i0x n SER 57 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2i0x s ASP 58 N -5.85 6.19 -0.05 -3.46 1.01 -0.50 -4.95 116.67 109.07 2i0x s ASP 58 Ca -0.08 1.23 0.02 0.00 0.71 0.00 0.00 52.55 54.42 2i0x s ASP 58 Cb 0.02 -2.35 0.02 0.00 1.01 0.00 0.00 42.92 41.62 2i0x s ASP 58 CO 0.11 -0.80 -0.07 -0.55 0.21 0.00 0.00 175.17 174.07 2i0x s SER 59 N -4.17 1.14 -0.07 0.27 0.15 -0.60 -4.77 113.70 105.66 2i0x s SER 59 Ca 0.53 -0.17 -0.00 0.00 0.70 0.00 0.00 55.95 57.00 2i0x s SER 59 Cb -0.11 -0.52 0.02 0.00 -1.71 0.00 0.00 66.02 63.71 2i0x s SER 59 CO 0.51 -0.02 -0.03 -0.69 1.20 0.00 0.00 173.24 174.21 2i0x s VAL 60 N 0.75 0.55 -0.14 4.45 1.01 -1.26 -0.19 120.40 125.57 2i0x s VAL 60 Ca -0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.80 2i0x s VAL 60 Cb -0.14 -0.63 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 2i0x s VAL 60 CO 0.01 0.27 -0.07 -0.63 0.00 0.00 0.00 175.10 174.68 2i0x s ILE 61 N 1.50 3.65 -0.39 2.22 1.01 0.08 -5.00 121.20 124.26 2i0x s ILE 61 Ca -0.02 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.21 2i0x s ILE 61 Cb -0.13 -2.57 0.11 0.00 0.01 0.00 0.00 42.46 39.88 2i0x s ILE 61 CO -0.03 0.51 0.15 -0.63 0.00 0.00 0.00 174.94 174.94 2i0x s ILE 62 N 0.21 1.80 0.24 2.92 1.01 -1.26 -0.88 121.20 125.23 2i0x s ILE 62 Ca -0.04 -2.37 -0.30 0.00 0.00 0.00 0.00 60.65 57.95 2i0x s ILE 62 Cb -0.14 -2.30 -0.09 0.00 0.01 0.00 0.00 42.46 39.94 2i0x s ILE 62 CO 0.04 -0.73 1.23 -0.31 0.00 0.00 0.00 174.94 175.17 2i0x s TYR 63 N 0.70 3.34 -0.44 3.97 1.51 -0.78 -4.92 117.35 120.72 2i0x s TYR 63 Ca 0.13 1.42 -0.06 0.00 -1.01 0.00 0.00 57.07 57.55 2i0x s TYR 63 Cb -0.21 -3.50 0.11 0.00 -0.11 0.00 0.00 41.96 38.25 2i0x s TYR 63 CO -0.09 -1.38 0.28 0.15 -1.11 0.00 0.00 175.55 173.41 2i0x s LYS 64 N -0.77 2.28 0.36 -0.62 1.02 -1.26 -2.65 119.74 118.10 2i0x s LYS 64 Ca 0.51 -1.78 0.07 0.00 0.02 0.00 0.00 55.97 54.80 2i0x s LYS 64 Cb -0.35 -3.78 -0.02 0.00 -0.52 0.00 0.00 37.83 33.17 2i0x s LYS 64 CO 0.41 -1.14 0.39 -0.51 -0.92 0.00 0.00 175.35 173.59 2i0x s LEU 65 N 1.27 3.66 0.20 3.17 1.43 0.10 -4.97 118.68 123.54 2i0x s LEU 65 Ca 0.07 -0.46 0.21 0.00 -1.03 0.00 0.00 54.13 52.92 2i0x s LEU 65 Cb -0.25 -2.38 0.01 0.00 0.03 0.00 0.00 46.19 43.60 2i0x s LEU 65 CO -0.02 -0.49 1.07 0.03 0.23 0.00 0.00 176.35 177.17 2i0x h ARG 66 N 1.03 0.00 -2.77 1.70 2.47 -1.95 -0.74 114.38 114.12 2i0x h ARG 66 Ca -0.44 0.00 0.08 0.00 -1.26 0.00 0.00 59.98 58.37 2i0x h ARG 66 Cb 1.26 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 29.50 2i0x h ARG 66 CO 0.55 0.09 0.31 -1.54 0.56 0.00 0.00 179.97 179.95 2i0x s SER 67 N -5.61 -0.31 -0.25 7.04 1.04 -1.26 -4.30 113.70 110.05 2i0x s SER 67 Ca -0.00 -0.38 -0.32 0.00 0.48 0.00 0.00 55.95 55.73 2i0x s SER 67 Cb 0.09 0.61 -0.08 0.00 0.10 0.00 0.00 66.02 66.73 2i0x s SER 67 CO 0.78 -1.09 2.17 0.80 0.98 0.00 0.00 173.24 176.87 2i0x n MET 68 N -0.43 1.66 -1.95 4.02 1.56 -1.26 -4.89 117.12 115.83 2i0x n MET 68 Ca -0.08 0.48 -0.34 0.00 -0.27 0.00 0.00 57.70 57.50 2i0x n MET 68 Cb 0.61 -2.86 0.03 0.00 2.15 0.00 0.00 33.22 33.15 2i0x n MET 68 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 2i0x s PRO 69 N 5.99 3.02 0.67 2.12 0.04 -1.26 -5.02 135.00 140.56 2i0x s PRO 69 Ca 1.03 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 63.42 2i0x s PRO 69 Cb -0.59 -1.97 -0.00 0.00 0.04 0.00 0.00 34.50 31.98 2i0x s PRO 69 CO 0.43 -1.09 1.06 -2.14 0.04 0.00 0.00 177.00 175.30 2i0x s PRO 70 N -3.78 3.01 0.07 0.56 0.02 -1.26 -5.05 135.00 128.57 2i0x s PRO 70 Ca 0.69 1.05 -0.08 0.00 0.02 0.00 0.00 61.00 62.69 2i0x s PRO 70 Cb -0.22 -2.00 -0.01 0.00 0.02 0.00 0.00 34.50 32.30 2i0x s PRO 70 CO 0.36 -1.04 0.15 -0.98 -0.33 0.00 0.00 177.00 175.16 2i0x s ARG 71 N -4.71 0.75 -0.11 5.54 1.70 -1.26 -5.14 118.95 115.73 2i0x s ARG 71 Ca 0.60 -0.89 0.01 0.00 -0.47 0.00 0.00 55.73 54.98 2i0x s ARG 71 Cb -0.15 0.30 0.02 0.00 -0.57 0.00 0.00 34.95 34.55 2i0x s ARG 71 CO 0.49 -0.22 -0.14 -2.00 -1.08 0.00 0.00 175.30 172.35 2i0x s GLU 72 N -3.45 2.11 -0.05 3.89 2.56 -1.26 -5.12 118.70 117.38 2i0x s GLU 72 Ca 0.02 -0.51 0.06 0.00 0.00 0.00 0.00 54.97 54.53 2i0x s GLU 72 Cb 0.03 -1.85 -0.02 0.00 2.00 0.00 0.00 34.13 34.30 2i0x s GLU 72 CO -0.09 -0.11 -0.23 0.95 -0.56 0.00 0.00 175.26 175.23 2i0x s THR 73 N 1.12 2.28 0.27 -1.70 -4.23 -1.26 -5.12 115.64 107.01 2i0x s THR 73 Ca -0.04 -0.99 0.09 0.00 -1.18 0.00 0.00 61.69 59.57 2i0x s THR 73 Cb -0.14 -1.84 -0.04 0.00 1.34 0.00 0.00 72.50 71.81 2i0x s THR 73 CO -0.03 0.57 0.02 -0.76 -0.54 0.00 0.00 174.62 173.88 2i0x s LEU 74 N -0.32 3.23 0.00 4.79 1.43 -1.26 -5.01 118.68 121.54 2i0x s LEU 74 Ca 0.01 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.47 2i0x s LEU 74 Cb -0.13 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.35 2i0x s LEU 74 CO 0.02 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.19 2i0x n GLY 75 N -0.93 -1.29 3.57 -3.19 0.00 -1.26 -4.60 105.19 97.49 2i0x n GLY 75 Ca -0.06 -1.10 -0.44 0.00 0.00 0.00 0.00 46.02 44.41 2i0x n GLY 75 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2i0x n ILE 76 N -1.93 0.33 -1.69 -0.61 -5.35 -1.26 -4.85 119.36 103.99 2i0x n ILE 76 Ca 0.00 -0.42 -0.39 0.00 -0.27 0.00 0.00 62.75 61.67 2i0x n ILE 76 Cb 0.09 -2.39 -0.03 0.00 -1.74 0.00 0.00 39.64 35.57 2i0x n ILE 76 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2i0x s GLU 77 N 6.27 2.60 0.05 6.28 2.02 -1.26 -4.77 118.70 129.89 2i0x s GLU 77 Ca 1.02 1.47 0.02 0.00 0.02 0.00 0.00 54.97 57.51 2i0x s GLU 77 Cb -0.44 -4.45 0.13 0.00 0.10 0.00 0.00 34.13 29.47 2i0x s GLU 77 CO 0.38 -2.72 0.91 1.63 0.02 0.00 0.00 175.26 175.48 2i0x n LYS 78 N 8.90 0.02 -3.31 1.61 4.76 -1.26 -4.42 118.16 124.46 2i0x n LYS 78 Ca 0.31 0.37 0.03 0.00 -2.87 0.00 0.00 58.31 56.14 2i0x n LYS 78 Cb 0.51 -1.74 -0.04 0.00 -1.84 0.00 0.00 35.03 31.91 2i0x n LYS 78 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2i0x s ASN 79 N -2.79 -0.24 0.21 4.39 3.84 -1.25 -4.86 114.94 114.24 2i0x s ASN 79 Ca -0.00 0.34 -0.32 0.00 0.21 0.00 0.00 52.86 53.09 2i0x s ASN 79 Cb 0.01 1.26 -0.13 0.00 -0.55 0.00 0.00 41.25 41.84 2i0x s ASN 79 CO 0.02 -0.05 1.63 -2.65 -2.79 0.00 0.00 177.10 173.26 2i0x n PRO 80 N 4.52 2.52 -0.33 0.43 -0.02 -1.26 -4.88 135.00 135.98 2i0x n PRO 80 Ca -0.09 0.91 0.19 0.00 -2.02 0.00 0.00 63.50 62.49 2i0x n PRO 80 Cb 0.55 -2.70 0.43 0.00 -0.02 0.00 0.00 33.50 31.75 2i0x n PRO 80 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2i0x h ILE 81 N 3.59 0.58 -0.36 4.25 1.08 -1.99 -1.31 117.51 123.34 2i0x h ILE 81 Ca -0.44 -0.18 -0.11 0.00 -0.39 0.00 0.00 64.86 63.73 2i0x h ILE 81 Cb 1.23 -0.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.96 2i0x h ILE 81 CO 0.89 0.10 -0.19 -0.33 -0.69 0.00 0.00 178.15 177.92 2i0x h GLU 82 N 0.54 0.77 -0.31 2.37 3.07 -2.07 -3.23 114.58 115.72 2i0x h GLU 82 Ca 0.60 -0.34 0.09 0.00 -0.50 0.00 0.00 59.36 59.21 2i0x h GLU 82 Cb 1.26 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 29.14 2i0x h GLU 82 CO -0.37 0.96 0.34 1.49 -1.40 0.00 0.00 179.01 180.03 2i0x h GLU 83 N 0.56 0.00 0.00 2.33 4.81 -1.61 -3.56 114.58 117.11 2i0x h GLU 83 Ca 0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2i0x h GLU 83 Cb 0.74 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.12 2i0x h GLU 83 CO 0.06 0.00 0.00 0.44 -0.73 0.00 0.00 179.01 178.78