#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhi n SER 2 N 0.00 1.66 -4.56 1.61 7.64 -1.26 -4.70 113.62 114.00 2dhi n SER 2 Ca 0.00 0.46 -0.41 0.00 1.01 0.00 0.00 58.87 59.94 2dhi n SER 2 Cb 0.00 -0.78 -0.03 0.00 -1.01 0.00 0.00 64.21 62.39 2dhi n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dhi s SER 3 N -5.58 5.82 0.00 6.43 1.04 -1.26 -3.90 113.70 116.26 2dhi s SER 3 Ca -0.19 0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.52 2dhi s SER 3 Cb 0.03 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.61 2dhi s SER 3 CO 0.28 -1.96 0.00 0.61 0.98 0.00 0.00 173.24 173.15 2dhi n GLY 4 N 5.44 0.39 3.77 7.32 0.00 -1.26 -5.13 105.19 115.72 2dhi n GLY 4 Ca 0.15 0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 2dhi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhi s SER 5 N 0.00 6.84 -0.05 1.61 0.01 -1.25 -4.94 113.70 115.92 2dhi s SER 5 Ca 0.00 2.53 0.00 0.00 1.31 0.00 0.00 55.95 59.80 2dhi s SER 5 Cb 0.00 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.56 2dhi s SER 5 CO 0.00 -0.47 -0.04 -0.24 0.41 0.00 0.00 173.24 172.90 2dhi n SER 6 N 0.76 3.62 0.00 2.44 2.88 -1.26 -5.04 113.62 117.03 2dhi n SER 6 Ca 0.00 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2dhi n SER 6 Cb 0.43 -0.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 2dhi n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dhi n GLY 7 N 3.28 1.85 3.86 0.46 0.00 -1.26 -4.96 105.19 108.42 2dhi n GLY 7 Ca -0.08 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.66 2dhi n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dhi s PHE 8 N 0.00 3.63 0.00 1.61 0.08 -1.26 -3.53 117.98 118.51 2dhi s PHE 8 Ca 0.00 0.75 -0.24 0.00 0.12 0.00 0.00 56.93 57.56 2dhi s PHE 8 Cb 0.00 -2.12 -0.14 0.00 -0.57 0.00 0.00 43.02 40.19 2dhi s PHE 8 CO 0.00 0.62 1.04 0.28 -0.10 0.00 0.00 175.22 177.06 2dhi h VAL 9 N 3.34 0.18 -3.22 -0.44 2.07 -0.83 -3.46 116.25 113.88 2dhi h VAL 9 Ca -0.51 -0.44 -0.26 0.00 0.82 0.00 0.00 66.70 66.31 2dhi h VAL 9 Cb 1.21 0.26 -0.33 0.00 -1.52 0.00 0.00 31.29 30.91 2dhi h VAL 9 CO 0.63 0.03 -0.61 -0.75 0.02 0.00 0.00 177.57 176.90 2dhi s LYS 10 N -4.39 0.08 -0.12 1.57 2.20 -1.26 -5.01 119.74 112.80 2dhi s LYS 10 Ca -0.13 0.41 0.02 0.00 -0.36 0.00 0.00 55.97 55.91 2dhi s LYS 10 Cb 0.01 -0.20 -0.00 0.00 -1.51 0.00 0.00 37.83 36.13 2dhi s LYS 10 CO 0.42 -0.20 -0.18 -1.54 -0.36 0.00 0.00 175.35 173.49 2dhi s SER 11 N 1.42 3.54 0.21 1.43 1.04 -1.26 -3.31 113.70 116.76 2dhi s SER 11 Ca -0.07 -0.46 -0.23 0.00 0.48 0.00 0.00 55.95 55.68 2dhi s SER 11 Cb -0.12 -1.52 0.06 0.00 0.10 0.00 0.00 66.02 64.54 2dhi s SER 11 CO -0.06 0.14 0.91 -0.83 0.98 0.00 0.00 173.24 174.38 2dhi s GLY 12 N 0.48 -0.06 -0.11 7.32 0.00 -1.17 -5.04 107.32 108.74 2dhi s GLY 12 Ca -0.12 -0.16 -0.17 0.00 0.00 0.00 0.00 44.72 44.26 2dhi s GLY 12 CO 0.05 0.43 0.45 -0.98 0.00 0.00 0.00 173.10 173.05 2dhi s TRP 13 N -3.04 3.52 -0.02 1.90 0.52 -1.26 -2.09 118.94 118.48 2dhi s TRP 13 Ca 0.14 0.86 -0.04 0.00 0.02 0.00 0.00 56.10 57.09 2dhi s TRP 13 Cb -0.03 -2.51 0.00 0.00 -1.15 0.00 0.00 33.47 29.79 2dhi s TRP 13 CO 0.05 0.21 0.09 -0.51 0.02 0.00 0.00 176.95 176.81 2dhi s LEU 14 N 0.47 1.72 0.37 2.99 1.43 -0.44 -4.81 118.68 120.40 2dhi s LEU 14 Ca 0.25 -0.04 -0.24 0.00 -1.03 0.00 0.00 54.13 53.07 2dhi s LEU 14 Cb -0.15 0.39 -0.10 0.00 0.03 0.00 0.00 46.19 46.36 2dhi s LEU 14 CO 0.10 -0.17 0.97 -0.76 0.23 0.00 0.00 176.35 176.71 2dhi s LEU 15 N -0.61 4.18 -0.04 1.79 1.43 -0.51 -0.59 118.68 124.32 2dhi s LEU 15 Ca -0.07 1.83 -0.01 0.00 -1.03 0.00 0.00 54.13 54.85 2dhi s LEU 15 Cb -0.04 -4.21 0.03 0.00 0.03 0.00 0.00 46.19 42.00 2dhi s LEU 15 CO 0.00 -0.24 0.08 -0.60 0.23 0.00 0.00 176.35 175.82 2dhi s ARG 16 N -2.49 -0.00 -0.30 1.70 3.52 -0.17 -1.46 118.95 119.74 2dhi s ARG 16 Ca 0.55 0.30 -0.25 0.00 -0.13 0.00 0.00 55.73 56.20 2dhi s ARG 16 Cb -0.16 -0.27 0.00 0.00 -1.56 0.00 0.00 34.95 32.96 2dhi s ARG 16 CO 0.21 -0.20 0.85 -1.14 -0.81 0.00 0.00 175.30 174.21 2dhi s GLN 17 N 1.36 4.01 0.95 5.12 0.74 -0.08 -2.77 119.66 128.98 2dhi s GLN 17 Ca -0.06 0.72 -0.15 0.00 0.05 0.00 0.00 55.36 55.91 2dhi s GLN 17 Cb -0.12 -3.72 0.19 0.00 1.10 0.00 0.00 33.01 30.46 2dhi s GLN 17 CO -0.04 -0.70 1.31 -1.12 -0.55 0.00 0.00 175.29 174.18 2dhi s SER 18 N 1.59 3.22 -0.16 6.67 0.01 -1.24 -4.56 113.70 119.24 2dhi s SER 18 Ca 0.35 0.28 0.18 0.00 1.31 0.00 0.00 55.95 58.07 2dhi s SER 18 Cb -0.14 -0.36 -0.25 0.00 0.21 0.00 0.00 66.02 65.49 2dhi s SER 18 CO 0.12 -2.67 0.19 0.35 0.41 0.00 0.00 173.24 171.65 2dhi n THR 19 N -3.72 1.33 -0.07 1.44 -2.24 -1.26 -3.27 114.28 106.49 2dhi n THR 19 Ca 0.15 -0.82 -0.22 0.00 -2.27 0.00 0.00 64.05 60.88 2dhi n THR 19 Cb 0.60 -0.52 -0.12 0.00 -2.10 0.00 0.00 70.33 68.19 2dhi n THR 19 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2dhi n ILE 20 N -2.76 1.62 0.17 2.28 5.41 -1.26 -4.28 119.36 120.54 2dhi n ILE 20 Ca -0.28 -0.32 0.06 0.00 1.00 0.00 0.00 62.75 63.20 2dhi n ILE 20 Cb 1.10 -1.88 0.14 0.00 -0.71 0.00 0.00 39.64 38.30 2dhi n ILE 20 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2dhi h LEU 21 N -0.55 0.00 -1.93 1.39 3.38 -1.99 -3.47 115.31 112.13 2dhi h LEU 21 Ca -0.43 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 56.95 2dhi h LEU 21 Cb 1.64 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 42.20 2dhi h LEU 21 CO -0.12 0.34 -0.94 0.29 0.09 0.00 0.00 178.44 178.10 2dhi n LYS 22 N -3.23 -1.61 -3.74 1.13 5.02 -1.20 -4.93 118.16 109.61 2dhi n LYS 22 Ca 0.02 0.18 -0.13 0.00 -2.02 0.00 0.00 58.31 56.36 2dhi n LYS 22 Cb 0.63 -3.97 -0.08 0.00 -0.02 0.00 0.00 35.03 31.59 2dhi n LYS 22 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2dhi s ARG 23 N -7.15 0.73 -0.25 1.97 1.70 -1.26 -4.93 118.95 109.76 2dhi s ARG 23 Ca 0.10 -0.23 -0.29 0.00 -0.47 0.00 0.00 55.73 54.84 2dhi s ARG 23 Cb -0.06 0.32 -0.01 0.00 -0.57 0.00 0.00 34.95 34.64 2dhi s ARG 23 CO 0.97 -0.21 1.32 -1.58 -1.08 0.00 0.00 175.30 174.72 2dhi s TRP 24 N -1.59 2.69 -0.04 5.89 0.52 -1.26 -3.64 118.94 121.50 2dhi s TRP 24 Ca -0.12 0.88 0.05 0.00 0.02 0.00 0.00 56.10 56.93 2dhi s TRP 24 Cb -0.04 -3.78 -0.00 0.00 -1.15 0.00 0.00 33.47 28.50 2dhi s TRP 24 CO 0.03 -1.83 -0.18 -1.59 0.02 0.00 0.00 176.95 173.41 2dhi s LYS 25 N 3.99 1.77 0.13 4.98 -2.85 -1.11 -4.88 119.74 121.76 2dhi s LYS 25 Ca 0.57 -0.62 -0.31 0.00 -1.00 0.00 0.00 55.97 54.61 2dhi s LYS 25 Cb -0.19 -1.55 -0.08 0.00 -2.06 0.00 0.00 37.83 33.95 2dhi s LYS 25 CO 0.21 0.27 1.37 0.21 0.10 0.00 0.00 175.35 177.50 2dhi s LYS 26 N -0.03 4.34 0.17 1.78 2.47 -1.26 -1.00 119.74 126.20 2dhi s LYS 26 Ca -0.02 2.06 0.01 0.00 -1.56 0.00 0.00 55.97 56.46 2dhi s LYS 26 Cb -0.11 -3.24 -0.05 0.00 -1.46 0.00 0.00 37.83 32.97 2dhi s LYS 26 CO 0.02 -0.40 0.02 -0.80 0.16 0.00 0.00 175.35 174.35 2dhi s ASN 27 N 0.97 1.02 -0.30 1.43 -0.87 0.24 -4.95 114.94 112.48 2dhi s ASN 27 Ca 0.63 -1.20 -0.13 0.00 -1.57 0.00 0.00 52.86 50.59 2dhi s ASN 27 Cb -0.36 0.16 -0.03 0.00 -0.02 0.00 0.00 41.25 40.99 2dhi s ASN 27 CO 0.32 -0.62 0.29 0.86 -2.57 0.00 0.00 177.10 175.38 2dhi s TRP 28 N -3.75 3.22 0.11 2.20 -0.00 -1.02 -1.33 118.94 118.38 2dhi s TRP 28 Ca 0.25 0.10 0.04 0.00 -0.00 0.00 0.00 56.10 56.49 2dhi s TRP 28 Cb 0.06 -2.53 -0.04 0.00 -0.00 0.00 0.00 33.47 30.97 2dhi s TRP 28 CO 0.04 -0.29 0.09 -0.06 -0.00 0.00 0.00 176.95 176.74 2dhi s PHE 29 N 1.91 3.15 -0.27 5.86 0.40 -0.89 0.30 117.98 128.44 2dhi s PHE 29 Ca 0.10 0.03 -0.04 0.00 -0.60 0.00 0.00 56.93 56.43 2dhi s PHE 29 Cb -0.16 -1.57 0.15 0.00 0.51 0.00 0.00 43.02 41.95 2dhi s PHE 29 CO 0.11 0.52 0.51 -0.51 0.70 0.00 0.00 175.22 176.55 2dhi s ASP 30 N -2.65 -0.69 0.25 1.36 1.11 -0.78 -3.04 116.67 112.23 2dhi s ASP 30 Ca 0.29 0.78 -0.14 0.00 0.18 0.00 0.00 52.55 53.67 2dhi s ASP 30 Cb -0.11 1.75 -0.08 0.00 1.07 0.00 0.00 42.92 45.54 2dhi s ASP 30 CO 0.22 -0.26 0.64 -0.22 1.18 0.00 0.00 175.17 176.73 2dhi s LEU 31 N 2.73 4.17 0.07 1.23 2.96 -1.21 -1.48 118.68 127.15 2dhi s LEU 31 Ca 0.12 1.14 0.01 0.00 -0.22 0.00 0.00 54.13 55.18 2dhi s LEU 31 Cb -0.14 -3.77 -0.04 0.00 0.50 0.00 0.00 46.19 42.73 2dhi s LEU 31 CO -0.18 -0.09 0.17 0.26 -1.32 0.00 0.00 176.35 175.19 2dhi s TRP 32 N -1.80 3.42 0.33 5.38 0.52 0.22 -0.16 118.94 126.85 2dhi s TRP 32 Ca 0.48 0.20 0.08 0.00 0.02 0.00 0.00 56.10 56.88 2dhi s TRP 32 Cb -0.12 -1.72 0.79 0.00 -1.15 0.00 0.00 33.47 31.28 2dhi s TRP 32 CO 0.19 0.57 1.80 1.03 0.02 0.00 0.00 176.95 180.56 2dhi h SER 33 N 3.11 0.73 0.51 2.95 0.87 -1.86 0.33 113.55 120.19 2dhi h SER 33 Ca -0.46 0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.10 2dhi h SER 33 Cb 1.16 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 63.05 2dhi h SER 33 CO 0.73 0.28 -0.42 0.44 -0.53 0.00 0.00 176.83 177.34 2dhi h ASP 34 N 0.72 0.00 0.00 6.23 3.32 -1.94 -3.47 116.42 121.28 2dhi h ASP 34 Ca 0.55 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.60 2dhi h ASP 34 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2dhi h ASP 34 CO -0.32 0.42 0.00 0.61 -1.72 0.00 0.00 179.24 178.22 2dhi n GLY 35 N -0.18 1.15 3.66 2.75 0.00 0.12 -4.98 105.19 107.70 2dhi n GLY 35 Ca -0.01 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.56 2dhi n GLY 35 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dhi n HIS 36 N 0.00 1.98 -4.99 1.61 8.25 -1.26 -3.96 115.22 116.86 2dhi n HIS 36 Ca 0.00 0.51 -0.32 0.00 -0.26 0.00 0.00 57.72 57.65 2dhi n HIS 36 Cb 0.00 -2.41 -0.16 0.00 1.12 0.00 0.00 29.99 28.55 2dhi n HIS 36 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2dhi s LEU 37 N 0.02 2.42 -0.04 2.41 2.96 0.28 0.71 118.68 127.44 2dhi s LEU 37 Ca 0.66 -0.43 0.00 0.00 -0.22 0.00 0.00 54.13 54.13 2dhi s LEU 37 Cb -0.67 -1.52 0.03 0.00 0.50 0.00 0.00 46.19 44.53 2dhi s LEU 37 CO 0.53 0.17 0.00 -0.63 -1.32 0.00 0.00 176.35 175.10 2dhi s ILE 38 N 0.33 0.20 0.23 6.68 1.01 -0.55 -1.61 121.20 127.49 2dhi s ILE 38 Ca -0.14 0.10 0.10 0.00 0.00 0.00 0.00 60.65 60.71 2dhi s ILE 38 Cb -0.17 -0.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.95 2dhi s ILE 38 CO 0.07 0.16 -0.11 -0.72 0.00 0.00 0.00 174.94 174.35 2dhi s TYR 39 N 1.19 2.53 0.49 3.97 1.13 -1.21 -1.87 117.35 123.58 2dhi s TYR 39 Ca -0.07 -0.26 0.02 0.00 -1.41 0.00 0.00 57.07 55.34 2dhi s TYR 39 Cb -0.13 -1.16 -0.01 0.00 -1.10 0.00 0.00 41.96 39.55 2dhi s TYR 39 CO -0.02 0.60 0.04 0.71 -2.51 0.00 0.00 175.55 174.37 2dhi s TYR 40 N -2.10 1.81 0.06 -3.49 1.51 0.15 -1.91 117.35 113.37 2dhi s TYR 40 Ca 0.28 -1.07 -0.11 0.00 -1.01 0.00 0.00 57.07 55.16 2dhi s TYR 40 Cb -0.07 -1.48 -0.30 0.00 -0.11 0.00 0.00 41.96 40.01 2dhi s TYR 40 CO 0.16 0.07 1.10 0.22 -1.11 0.00 0.00 175.55 175.98 2dhi h ASP 41 N 1.44 0.70 -5.64 2.29 3.58 -1.51 -2.72 116.42 114.57 2dhi h ASP 41 Ca -0.41 -0.70 -0.34 0.00 0.42 0.00 0.00 57.03 56.00 2dhi h ASP 41 Cb 1.31 -0.22 -0.10 0.00 1.72 0.00 0.00 39.33 42.04 2dhi h ASP 41 CO 0.69 1.54 -0.29 1.51 -2.88 0.00 0.00 179.24 179.81 2dhi s ASP 42 N -7.37 1.15 0.26 2.28 1.47 -1.26 -4.53 116.67 108.66 2dhi s ASP 42 Ca -0.07 -1.57 0.22 0.00 1.18 0.00 0.00 52.55 52.31 2dhi s ASP 42 Cb 0.06 0.63 1.00 0.00 -0.34 0.00 0.00 42.92 44.27 2dhi s ASP 42 CO 0.92 -1.22 1.67 1.67 0.68 0.00 0.00 175.17 178.88 2dhi n GLN 43 N -0.58 0.16 0.25 2.11 0.00 -1.26 -2.02 117.38 116.04 2dhi n GLN 43 Ca 0.03 0.49 0.12 0.00 -0.00 0.00 0.00 57.00 57.64 2dhi n GLN 43 Cb 0.62 -1.88 0.63 0.00 0.00 0.00 0.00 30.24 29.61 2dhi n GLN 43 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 2dhi h THR 44 N 0.00 0.56 -3.05 1.69 1.35 -1.99 -3.46 112.91 108.01 2dhi h THR 44 Ca 0.00 -0.75 -0.36 0.00 -0.55 0.00 0.00 66.41 64.75 2dhi h THR 44 Cb 0.23 1.50 -0.03 0.00 -1.73 0.00 0.00 68.15 68.12 2dhi h THR 44 CO 0.00 0.16 -0.44 0.54 -0.25 0.00 0.00 175.52 175.53 2dhi n ARG 45 N -3.54 -1.83 -0.00 4.72 1.74 -0.86 -4.84 116.66 112.06 2dhi n ARG 45 Ca -0.01 0.88 -0.03 0.00 -0.77 0.00 0.00 57.85 57.92 2dhi n ARG 45 Cb 0.31 -5.49 -0.11 0.00 -1.02 0.00 0.00 32.46 26.15 2dhi n ARG 45 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2dhi n GLN 46 N -2.85 0.63 -4.06 5.56 1.13 -1.26 -4.79 117.38 111.74 2dhi n GLN 46 Ca -0.21 0.19 -0.32 0.00 -1.94 0.00 0.00 57.00 54.72 2dhi n GLN 46 Cb 0.65 -1.75 -0.15 0.00 0.11 0.00 0.00 30.24 29.10 2dhi n GLN 46 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2dhi s SER 47 N -5.75 4.32 0.04 1.08 0.15 -1.26 -5.09 113.70 107.19 2dhi s SER 47 Ca -0.05 -1.33 -0.30 0.00 0.70 0.00 0.00 55.95 54.97 2dhi s SER 47 Cb 0.08 -1.52 -0.05 0.00 -1.71 0.00 0.00 66.02 62.83 2dhi s SER 47 CO 0.82 -0.18 1.15 -0.63 1.20 0.00 0.00 173.24 175.60 2dhi s ILE 48 N 1.13 4.24 -0.15 6.45 -1.09 -1.26 -1.32 121.20 129.20 2dhi s ILE 48 Ca -0.08 1.60 -0.25 0.00 -2.23 0.00 0.00 60.65 59.69 2dhi s ILE 48 Cb -0.19 -4.03 -0.22 0.00 -1.58 0.00 0.00 42.46 36.44 2dhi s ILE 48 CO -0.06 0.11 0.60 -0.33 -1.23 0.00 0.00 174.94 174.03 2dhi h GLU 49 N 6.86 0.00 0.00 2.79 4.39 -1.65 -3.46 114.58 123.51 2dhi h GLU 49 Ca -0.41 0.00 0.26 0.00 0.34 0.00 0.00 59.36 59.55 2dhi h GLU 49 Cb 1.21 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.81 2dhi h GLU 49 CO 0.80 0.89 0.73 -3.47 -1.16 0.00 0.00 179.01 176.80 2dhi n ASP 50 N -4.60 -1.23 -3.77 1.42 2.03 -1.22 -5.06 116.55 104.12 2dhi n ASP 50 Ca -0.12 -1.41 -0.13 0.00 0.52 0.00 0.00 54.79 53.65 2dhi n ASP 50 Cb 0.46 1.94 -0.12 0.00 -0.72 0.00 0.00 41.12 42.69 2dhi n ASP 50 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2dhi s LYS 51 N -2.02 0.30 -0.00 -0.67 2.20 -1.26 -3.35 119.74 114.93 2dhi s LYS 51 Ca 0.25 0.43 -0.26 0.00 -0.36 0.00 0.00 55.97 56.02 2dhi s LYS 51 Cb -0.01 0.10 0.06 0.00 -1.51 0.00 0.00 37.83 36.47 2dhi s LYS 51 CO 0.01 -0.07 0.59 0.08 -0.36 0.00 0.00 175.35 175.60 2dhi s VAL 52 N 0.40 0.01 0.41 4.02 1.01 -0.63 -5.05 120.40 120.57 2dhi s VAL 52 Ca -0.02 -0.12 0.05 0.00 0.00 0.00 0.00 61.98 61.89 2dhi s VAL 52 Cb -0.04 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.40 2dhi s VAL 52 CO -0.02 -0.07 0.58 -2.28 0.00 0.00 0.00 175.10 173.32 2dhi s HIS 53 N -1.73 3.01 0.00 5.22 2.46 -1.26 -0.55 115.29 122.44 2dhi s HIS 53 Ca -0.09 -0.16 0.00 0.00 0.47 0.00 0.00 55.06 55.28 2dhi s HIS 53 Cb -0.01 -2.28 0.00 0.00 -0.13 0.00 0.00 32.58 30.17 2dhi s HIS 53 CO 0.05 -0.32 0.00 -1.33 -2.47 0.00 0.00 174.74 170.66 2dhi n MET 54 N -1.89 0.00 0.00 2.88 2.81 -1.25 -2.32 117.12 117.35 2dhi n MET 54 Ca 0.04 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.98 2dhi n MET 54 Cb 0.58 -0.40 0.33 0.00 -0.71 0.00 0.00 33.22 33.03 2dhi n MET 54 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2dhi n PRO 55 N -2.50 0.49 0.00 0.03 -0.04 -1.26 -0.42 135.00 131.30 2dhi n PRO 55 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2dhi n PRO 55 Cb 0.00 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 2dhi n PRO 55 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2dhi n VAL 56 N -0.86 0.00 -0.09 0.52 0.31 -1.26 -4.89 118.33 112.05 2dhi n VAL 56 Ca 0.08 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.18 2dhi n VAL 56 Cb 0.04 -1.21 -0.12 0.00 -0.91 0.00 0.00 33.84 31.64 2dhi n VAL 56 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2dhi n ASP 57 N -2.84 1.93 -4.78 4.52 9.92 -1.21 -4.81 116.55 119.28 2dhi n ASP 57 Ca 0.00 0.34 -0.37 0.00 -0.53 0.00 0.00 54.79 54.23 2dhi n ASP 57 Cb 0.46 -0.89 -0.05 0.00 -0.64 0.00 0.00 41.12 40.00 2dhi n ASP 57 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dhi n ILE 59 N 0.25 0.00 -3.97 0.00 -5.35 0.53 -4.38 119.36 106.43 2dhi n ILE 59 Ca 0.03 0.00 -0.08 0.00 -0.27 0.00 0.00 62.75 62.43 2dhi n ILE 59 Cb 0.49 -0.60 -0.09 0.00 -1.74 0.00 0.00 39.64 37.70 2dhi n ILE 59 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2dhi s ASN 60 N -2.22 0.29 -0.19 7.28 2.47 -1.20 -5.04 114.94 116.33 2dhi s ASN 60 Ca 0.00 -0.76 -0.01 0.00 0.42 0.00 0.00 52.86 52.51 2dhi s ASN 60 Cb 0.00 0.25 0.05 0.00 -1.45 0.00 0.00 41.25 40.10 2dhi s ASN 60 CO 0.00 -0.60 -0.01 -0.63 -3.72 0.00 0.00 177.10 172.14 2dhi s ILE 61 N -3.48 0.90 -0.27 -5.21 1.01 -1.26 -1.54 121.20 111.34 2dhi s ILE 61 Ca 0.03 -0.71 -0.19 0.00 0.00 0.00 0.00 60.65 59.77 2dhi s ILE 61 Cb 0.04 -1.26 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 2dhi s ILE 61 CO -0.09 -0.09 0.57 -0.13 0.00 0.00 0.00 174.94 175.21 2dhi s ARG 62 N 1.70 4.04 -0.02 2.79 0.52 -1.10 -4.90 118.95 121.98 2dhi s ARG 62 Ca -0.02 0.38 -0.00 0.00 -0.52 0.00 0.00 55.73 55.57 2dhi s ARG 62 Cb -0.17 -3.67 0.02 0.00 0.52 0.00 0.00 34.95 31.65 2dhi s ARG 62 CO -0.07 -0.42 0.03 0.95 0.02 0.00 0.00 175.30 175.81 2dhi s THR 63 N 2.43 -0.03 0.00 0.02 -4.23 -1.26 -0.72 115.64 111.85 2dhi s THR 63 Ca 0.23 0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.85 2dhi s THR 63 Cb -0.15 -0.06 0.00 0.00 1.34 0.00 0.00 72.50 73.62 2dhi s THR 63 CO 0.09 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.83 2dhi n GLY 64 N 3.63 1.76 1.64 3.99 0.00 -1.22 -3.75 105.19 111.24 2dhi n GLY 64 Ca -0.20 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 2dhi n GLY 64 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dhi n HIS 65 N 4.67 1.51 -0.03 1.61 -0.00 -1.26 -3.79 115.22 117.92 2dhi n HIS 65 Ca 0.00 -1.28 -0.00 0.00 -0.00 0.00 0.00 57.72 56.44 2dhi n HIS 65 Cb 0.00 -0.64 -0.09 0.00 -0.00 0.00 0.00 29.99 29.26 2dhi n HIS 65 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2dhi n GLU 66 N -0.22 1.37 -2.83 -0.41 1.02 -1.25 -4.91 120.64 113.42 2dhi n GLU 66 Ca 0.29 -0.05 -0.43 0.00 -0.02 0.00 0.00 57.16 56.95 2dhi n GLU 66 Cb 1.00 -1.28 -0.04 0.00 -0.02 0.00 0.00 31.44 31.10 2dhi n GLU 66 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dhi n ARG 68 N 7.42 4.32 -0.15 0.00 1.85 -1.26 -4.60 116.66 124.25 2dhi n ARG 68 Ca 0.02 -0.13 0.11 0.00 -1.00 0.00 0.00 57.85 56.86 2dhi n ARG 68 Cb 0.48 -0.60 0.18 0.00 -1.05 0.00 0.00 32.46 31.47 2dhi n ARG 68 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2dhi n ASP 69 N -0.65 3.25 -3.59 2.89 8.00 -1.26 -4.97 116.55 120.22 2dhi n ASP 69 Ca 0.00 -1.95 -0.22 0.00 0.71 0.00 0.00 54.79 53.33 2dhi n ASP 69 Cb 0.01 -0.19 -0.06 0.00 -0.02 0.00 0.00 41.12 40.86 2dhi n ASP 69 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2dhi n ILE 70 N 1.35 0.00 -3.68 0.53 -5.35 -1.26 -5.16 119.36 105.79 2dhi n ILE 70 Ca 0.17 -1.87 -0.15 0.00 -0.27 0.00 0.00 62.75 60.63 2dhi n ILE 70 Cb 0.57 0.58 -0.14 0.00 -1.74 0.00 0.00 39.64 38.91 2dhi n ILE 70 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dhi s GLN 71 N -3.29 0.10 0.47 6.28 -2.07 -1.26 -5.08 119.66 114.81 2dhi s GLN 71 Ca 0.11 0.60 -0.22 0.00 -1.82 0.00 0.00 55.36 54.03 2dhi s GLN 71 Cb 0.01 -0.16 -0.07 0.00 -1.09 0.00 0.00 33.01 31.69 2dhi s GLN 71 CO 0.08 -0.26 1.16 -1.25 -1.32 0.00 0.00 175.29 173.69 2dhi s PRO 72 N 2.07 3.70 0.16 9.60 0.04 -1.26 -4.99 135.00 144.33 2dhi s PRO 72 Ca -0.01 1.75 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 2dhi s PRO 72 Cb -0.12 -2.35 -0.08 0.00 0.04 0.00 0.00 34.50 31.99 2dhi s PRO 72 CO -0.07 -0.59 1.32 -1.25 0.04 0.00 0.00 177.00 176.45 2dhi s PRO 73 N -2.78 4.37 -0.40 0.56 0.04 -1.26 -4.89 135.00 130.64 2dhi s PRO 73 Ca 0.65 2.04 -0.42 0.00 0.04 0.00 0.00 61.00 63.31 2dhi s PRO 73 Cb -0.28 -3.22 -0.17 0.00 0.04 0.00 0.00 34.50 30.87 2dhi s PRO 73 CO 0.34 -0.31 1.88 -0.40 0.04 0.00 0.00 177.00 178.55 2dhi n ASP 74 N 3.12 1.64 0.00 6.66 5.68 -1.26 -0.79 116.55 131.60 2dhi n ASP 74 Ca 0.08 0.89 0.00 0.00 -0.50 0.00 0.00 54.79 55.26 2dhi n ASP 74 Cb 0.43 -1.03 0.00 0.00 -1.14 0.00 0.00 41.12 39.37 2dhi n ASP 74 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dhi n GLY 75 N 5.38 2.65 3.82 6.12 0.00 -1.26 -5.09 105.19 116.81 2dhi n GLY 75 Ca 0.37 -0.97 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 2dhi n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dhi s LYS 76 N 0.00 4.21 0.00 1.61 -0.14 0.03 -5.08 119.74 120.37 2dhi s LYS 76 Ca 0.00 0.78 0.00 0.00 -1.36 0.00 0.00 55.97 55.39 2dhi s LYS 76 Cb 0.00 -3.02 0.00 0.00 -1.68 0.00 0.00 37.83 33.13 2dhi s LYS 76 CO 0.00 0.50 0.00 -0.35 -0.76 0.00 0.00 175.35 174.74 2dhi n PRO 77 N 1.09 -0.42 -0.09 -1.68 -0.04 -1.26 -4.67 135.00 127.92 2dhi n PRO 77 Ca -0.05 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.30 2dhi n PRO 77 Cb 0.51 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.85 2dhi n PRO 77 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2dhi n ARG 78 N -1.06 1.04 0.00 0.54 0.63 -1.26 -4.33 116.66 112.22 2dhi n ARG 78 Ca 0.00 0.04 0.06 0.00 -0.92 0.00 0.00 57.85 57.03 2dhi n ARG 78 Cb 0.00 -1.41 0.28 0.00 0.45 0.00 0.00 32.46 31.77 2dhi n ARG 78 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2dhi n ASP 79 N -2.79 0.00 -1.36 6.15 8.00 -1.26 -1.43 116.55 123.86 2dhi n ASP 79 Ca -0.30 0.19 0.12 0.00 0.71 0.00 0.00 54.79 55.51 2dhi n ASP 79 Cb 0.97 -0.32 0.32 0.00 -0.02 0.00 0.00 41.12 42.07 2dhi n ASP 79 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dhi s LEU 81 N -1.00 4.22 -0.12 0.00 1.43 -0.51 -0.70 118.68 121.99 2dhi s LEU 81 Ca 0.49 0.75 0.02 0.00 -1.03 0.00 0.00 54.13 54.36 2dhi s LEU 81 Cb 0.26 -2.68 0.01 0.00 0.03 0.00 0.00 46.19 43.80 2dhi s LEU 81 CO 0.33 -0.06 -0.19 -0.22 0.23 0.00 0.00 176.35 176.44 2dhi s LEU 82 N 1.00 1.94 0.09 1.79 2.96 -0.19 -3.41 118.68 122.86 2dhi s LEU 82 Ca 0.25 -0.52 0.10 0.00 -0.22 0.00 0.00 54.13 53.74 2dhi s LEU 82 Cb -0.15 -1.28 -0.03 0.00 0.50 0.00 0.00 46.19 45.23 2dhi s LEU 82 CO 0.10 0.06 -0.25 -1.58 -1.32 0.00 0.00 176.35 173.36 2dhi s GLN 83 N 0.81 1.47 -0.43 1.98 0.74 0.10 0.52 119.66 124.85 2dhi s GLN 83 Ca -0.09 -1.19 0.02 0.00 0.05 0.00 0.00 55.36 54.15 2dhi s GLN 83 Cb -0.16 -1.78 0.13 0.00 1.10 0.00 0.00 33.01 32.30 2dhi s GLN 83 CO -0.00 0.44 0.21 0.42 -0.55 0.00 0.00 175.29 175.81 2dhi s ILE 84 N -0.96 1.68 -0.06 -2.34 -1.09 -0.64 -2.69 121.20 115.10 2dhi s ILE 84 Ca 0.11 -2.56 -0.30 0.00 -2.23 0.00 0.00 60.65 55.67 2dhi s ILE 84 Cb -0.10 -2.19 -0.04 0.00 -1.58 0.00 0.00 42.46 38.56 2dhi s ILE 84 CO 0.04 -0.82 1.28 -0.69 -1.23 0.00 0.00 174.94 173.52 2dhi s VAL 85 N 0.42 4.08 0.87 2.92 1.01 -0.59 -2.74 120.40 126.38 2dhi s VAL 85 Ca 0.16 1.41 -0.12 0.00 0.00 0.00 0.00 61.98 63.43 2dhi s VAL 85 Cb -0.23 -3.91 0.19 0.00 0.00 0.00 0.00 36.38 32.43 2dhi s VAL 85 CO -0.04 -0.02 1.19 0.00 0.00 0.00 0.00 175.10 176.23 2dhi h ARG 87 N 0.00 -0.73 0.23 0.00 3.08 -0.79 -3.37 114.38 112.79 2dhi h ARG 87 Ca -0.39 0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.70 2dhi h ARG 87 Cb 1.15 0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.37 2dhi h ARG 87 CO 0.31 -0.47 -0.14 0.22 -1.07 0.00 0.00 179.97 178.82 2dhi h ASP 88 N -1.18 -0.35 0.00 7.04 1.82 -1.96 -3.48 116.42 118.32 2dhi h ASP 88 Ca -0.08 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.58 2dhi h ASP 88 Cb 0.60 0.10 0.00 0.00 0.68 0.00 0.00 39.33 40.71 2dhi h ASP 88 CO 0.13 -0.21 0.00 0.61 -1.61 0.00 0.00 179.24 178.16 2dhi n GLY 89 N -1.18 0.04 2.86 -0.78 0.00 -1.26 -5.12 105.19 99.75 2dhi n GLY 89 Ca -0.04 -0.02 -0.52 0.00 0.00 0.00 0.00 46.02 45.44 2dhi n GLY 89 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dhi n LYS 90 N -0.50 0.00 -4.90 1.61 4.81 -1.26 -4.41 118.16 113.50 2dhi n LYS 90 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.11 2dhi n LYS 90 Cb 0.00 -1.15 -0.14 0.00 0.02 0.00 0.00 35.03 33.76 2dhi n LYS 90 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2dhi s THR 91 N 2.10 2.97 -0.22 3.15 2.01 -1.26 -1.76 115.64 122.62 2dhi s THR 91 Ca 0.80 -0.74 -0.06 0.00 0.31 0.00 0.00 61.69 61.99 2dhi s THR 91 Cb -1.14 -2.17 -0.02 0.00 0.01 0.00 0.00 72.50 69.18 2dhi s THR 91 CO 0.61 0.58 0.03 -0.63 -0.69 0.00 0.00 174.62 174.52 2dhi s ILE 92 N -0.49 4.05 -0.37 1.82 1.01 -1.11 -4.96 121.20 121.16 2dhi s ILE 92 Ca 0.06 -0.27 -0.15 0.00 0.00 0.00 0.00 60.65 60.30 2dhi s ILE 92 Cb -0.12 -2.86 -0.00 0.00 0.01 0.00 0.00 42.46 39.49 2dhi s ILE 92 CO 0.02 0.39 0.31 -0.44 0.00 0.00 0.00 174.94 175.22 2dhi s SER 93 N 1.31 6.12 0.33 3.58 0.01 -1.26 -1.62 113.70 122.18 2dhi s SER 93 Ca 0.04 -0.50 0.09 0.00 1.31 0.00 0.00 55.95 56.90 2dhi s SER 93 Cb -0.15 -2.17 -0.06 0.00 0.21 0.00 0.00 66.02 63.85 2dhi s SER 93 CO 0.02 -0.35 -0.10 -0.76 0.41 0.00 0.00 173.24 172.46 2dhi s LEU 94 N 1.85 2.69 -0.14 2.44 1.43 0.18 -0.90 118.68 126.24 2dhi s LEU 94 Ca 0.08 -1.19 -0.12 0.00 -1.03 0.00 0.00 54.13 51.88 2dhi s LEU 94 Cb -0.17 -0.96 0.04 0.00 0.03 0.00 0.00 46.19 45.12 2dhi s LEU 94 CO 0.11 -0.20 0.36 0.00 0.23 0.00 0.00 176.35 176.85 2dhi s ALA 96 N 0.38 3.62 0.32 0.00 0.00 0.12 -1.43 121.76 124.77 2dhi s ALA 96 Ca -0.02 -1.19 0.10 0.00 0.00 0.00 0.00 51.96 50.86 2dhi s ALA 96 Cb -0.04 -1.41 0.94 0.00 0.00 0.00 0.00 23.12 22.61 2dhi s ALA 96 CO -0.01 0.51 1.68 1.49 0.00 0.00 0.00 175.76 179.42 2dhi h GLU 97 N 2.39 0.35 -3.05 0.00 4.81 -1.88 -3.44 114.58 113.76 2dhi h GLU 97 Ca -0.48 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 58.75 2dhi h GLU 97 Cb 1.20 -0.08 -0.09 0.00 0.63 0.00 0.00 28.75 30.41 2dhi h GLU 97 CO 0.64 0.23 0.19 0.45 -0.73 0.00 0.00 179.01 179.79 2dhi s SER 98 N -5.02 -0.39 0.20 1.04 0.15 -1.26 -4.88 113.70 103.54 2dhi s SER 98 Ca -0.11 -0.33 -0.20 0.00 0.70 0.00 0.00 55.95 56.01 2dhi s SER 98 Cb 0.28 0.65 0.16 0.00 -1.71 0.00 0.00 66.02 65.40 2dhi s SER 98 CO 0.79 -1.14 1.57 0.74 1.20 0.00 0.00 173.24 176.39 2dhi h THR 99 N 2.03 0.07 -0.88 6.45 2.02 -1.84 0.30 112.91 121.07 2dhi h THR 99 Ca -0.27 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.14 2dhi h THR 99 Cb 1.28 0.07 -0.15 0.00 -1.74 0.00 0.00 68.15 67.61 2dhi h THR 99 CO 0.32 0.00 0.10 -0.78 0.37 0.00 0.00 175.52 175.52 2dhi h ASP 100 N -0.09 -0.27 0.42 4.18 3.58 -1.97 0.15 116.42 122.43 2dhi h ASP 100 Ca 0.28 0.23 -0.02 0.00 0.42 0.00 0.00 57.03 57.93 2dhi h ASP 100 Cb 0.57 0.37 0.00 0.00 1.72 0.00 0.00 39.33 41.99 2dhi h ASP 100 CO -0.84 -0.24 -0.20 0.44 -2.88 0.00 0.00 179.24 175.52 2dhi h ASP 101 N 0.10 -0.48 -0.31 2.28 3.32 -0.83 -2.64 116.42 117.86 2dhi h ASP 101 Ca 0.53 -0.10 0.07 0.00 0.02 0.00 0.00 57.03 57.55 2dhi h ASP 101 Cb 1.05 0.12 -0.08 0.00 0.22 0.00 0.00 39.33 40.64 2dhi h ASP 101 CO -0.75 -0.16 -0.33 0.00 -1.72 0.00 0.00 179.24 176.27 2dhi h LEU 103 N -0.31 -0.86 -0.65 0.00 3.38 -0.81 -0.66 115.31 115.40 2dhi h LEU 103 Ca 0.14 0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.39 2dhi h LEU 103 Cb 0.54 0.44 -0.11 0.00 0.09 0.00 0.00 40.66 41.62 2dhi h LEU 103 CO -0.48 -0.27 -0.45 0.00 0.09 0.00 0.00 178.44 177.33 2dhi h ALA 104 N 1.05 -0.33 0.40 1.53 0.00 -0.95 -0.80 119.26 120.16 2dhi h ALA 104 Ca 0.21 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 2dhi h ALA 104 Cb 0.49 1.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2dhi h ALA 104 CO -0.54 -0.84 -0.26 -1.49 0.00 0.00 0.00 179.25 176.12 2dhi h TRP 105 N -0.19 -0.69 -0.89 0.00 4.06 -1.05 -2.88 115.95 114.30 2dhi h TRP 105 Ca 0.19 -0.01 0.09 0.00 2.06 0.00 0.00 58.89 61.22 2dhi h TRP 105 Cb 0.55 0.25 -0.12 0.00 -1.00 0.00 0.00 29.16 28.85 2dhi h TRP 105 CO -0.76 -0.40 -0.57 -0.22 -3.56 0.00 0.00 178.44 172.93 2dhi h LYS 106 N -0.64 -0.07 -0.68 0.49 3.64 -0.20 0.22 116.57 119.33 2dhi h LYS 106 Ca -0.04 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.48 2dhi h LYS 106 Cb 0.54 0.02 -0.13 0.00 -0.41 0.00 0.00 32.23 32.24 2dhi h LYS 106 CO 0.03 -0.05 -0.16 0.74 -2.27 0.00 0.00 179.45 177.74 2dhi h PHE 107 N -0.07 -0.35 -1.00 1.91 0.04 -1.09 0.32 116.94 116.70 2dhi h PHE 107 Ca 0.16 0.06 0.05 0.00 2.80 0.00 0.00 57.97 61.04 2dhi h PHE 107 Cb 0.46 0.26 -0.06 0.00 2.20 0.00 0.00 35.95 38.81 2dhi h PHE 107 CO -0.96 -0.29 0.65 1.15 -0.60 0.00 0.00 178.31 178.26 2dhi h THR 108 N 0.00 1.14 0.44 -1.55 2.02 -0.44 -0.73 112.91 113.80 2dhi h THR 108 Ca 0.33 -0.42 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 2dhi h THR 108 Cb 0.50 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 2dhi h THR 108 CO -0.70 0.22 -0.21 -0.07 0.37 0.00 0.00 175.52 175.13 2dhi h LEU 109 N 1.22 -0.50 -1.98 2.58 3.38 0.13 0.29 115.31 120.43 2dhi h LEU 109 Ca 0.41 -0.08 0.13 0.00 0.09 0.00 0.00 57.88 58.43 2dhi h LEU 109 Cb 0.07 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2dhi h LEU 109 CO -0.14 -0.09 0.45 1.56 0.09 0.00 0.00 178.44 180.31 2dhi h GLN 110 N -1.04 0.00 0.07 1.13 1.08 -0.43 0.14 115.11 116.06 2dhi h GLN 110 Ca -0.06 0.00 -0.32 0.00 -1.45 0.00 0.00 58.65 56.82 2dhi h GLN 110 Cb 0.55 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.95 2dhi h GLN 110 CO 0.10 0.00 -1.75 0.22 -0.95 0.00 0.00 178.83 176.45 2dhi h ASP 111 N 0.00 0.23 1.13 1.46 3.58 -1.03 -3.28 116.42 118.50 2dhi h ASP 111 Ca 0.22 -0.44 -0.01 0.00 0.42 0.00 0.00 57.03 57.22 2dhi h ASP 111 Cb 1.12 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 42.09 2dhi h ASP 111 CO -0.00 1.39 -0.04 0.77 -2.88 0.00 0.00 179.24 178.47 2dhi h SER 112 N 0.04 0.00 0.61 2.28 4.64 0.21 -2.46 113.55 118.88 2dhi h SER 112 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2dhi h SER 112 Cb 2.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 2dhi h SER 112 CO 0.10 0.04 -0.54 -2.11 -0.87 0.00 0.00 176.83 173.46 2dhi n ARG 113 N -3.15 0.09 -2.57 4.77 1.85 0.05 -4.16 116.66 113.54 2dhi n ARG 113 Ca 0.01 0.02 -0.15 0.00 -1.00 0.00 0.00 57.85 56.73 2dhi n ARG 113 Cb 0.36 -1.55 0.02 0.00 -1.05 0.00 0.00 32.46 30.24 2dhi n ARG 113 CO 0.00 0.00 0.00 -2.37 -0.01 0.00 0.00 177.63 175.25 2dhi n THR 114 N -1.68 1.58 -3.45 8.89 5.66 -0.95 -4.84 114.28 119.50 2dhi n THR 114 Ca 0.05 -3.72 -0.10 0.00 -3.05 0.00 0.00 64.05 57.23 2dhi n THR 114 Cb 0.37 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.06 2dhi n THR 114 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2dhi s SER 115 N -3.38 0.26 0.00 1.09 0.15 -1.07 -4.89 113.70 105.86 2dhi s SER 115 Ca 0.36 0.36 0.00 0.00 0.70 0.00 0.00 55.95 57.37 2dhi s SER 115 Cb 0.42 1.06 0.00 0.00 -1.71 0.00 0.00 66.02 65.79 2dhi s SER 115 CO -0.04 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2dhi n GLY 116 N 5.36 1.82 0.17 9.45 0.00 -1.26 -4.81 105.19 115.92 2dhi n GLY 116 Ca -0.05 -0.59 0.02 0.00 0.00 0.00 0.00 46.02 45.40 2dhi n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhi h PRO 117 N 0.00 0.00 -4.39 1.61 0.13 -1.95 -3.45 132.00 123.95 2dhi h PRO 117 Ca 0.00 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.50 2dhi h PRO 117 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 2dhi h PRO 117 CO 0.00 0.46 0.39 0.43 -0.23 0.00 0.00 178.00 179.05 2dhi n SER 118 N -3.91 0.66 -3.84 1.44 7.64 -1.26 0.11 113.62 114.46 2dhi n SER 118 Ca -0.01 0.87 -0.25 0.00 1.01 0.00 0.00 58.87 60.48 2dhi n SER 118 Cb 0.50 -0.65 0.01 0.00 -1.01 0.00 0.00 64.21 63.06 2dhi n SER 118 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dhi n SER 119 N 2.46 -1.80 0.00 6.43 7.64 -1.26 -5.05 113.62 122.04 2dhi n SER 119 Ca 0.21 -0.87 0.00 0.00 1.01 0.00 0.00 58.87 59.22 2dhi n SER 119 Cb -0.02 -3.69 0.00 0.00 -1.01 0.00 0.00 64.21 59.49 2dhi n SER 119 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64