#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i0n n GLY 2 N 0.00 1.22 3.77 3.17 0.00 -1.26 -5.10 105.19 106.98 2i0n n GLY 2 Ca 0.00 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 2i0n n GLY 2 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2i0n s PRO 3 N 0.00 1.69 -1.25 1.61 0.04 -1.26 -3.59 135.00 132.24 2i0n s PRO 3 Ca 0.00 0.70 -0.02 0.00 0.04 0.00 0.00 61.00 61.71 2i0n s PRO 3 Cb 0.00 -1.87 0.02 0.00 0.04 0.00 0.00 34.50 32.69 2i0n s PRO 3 CO 0.00 -1.91 0.17 -0.11 0.04 0.00 0.00 177.00 175.19 2i0n n LEU 4 N -3.64 -1.51 0.00 -3.56 -0.00 -1.26 -4.83 117.00 102.20 2i0n n LEU 4 Ca 0.07 -0.01 0.00 0.00 -0.00 0.00 0.00 56.01 56.07 2i0n n LEU 4 Cb 0.56 -2.34 0.00 0.00 -0.00 0.00 0.00 43.42 41.64 2i0n n LEU 4 CO 0.56 -0.04 0.00 0.61 -0.00 0.00 0.00 177.39 178.52 2i0n n GLY 5 N -0.99 -1.65 3.18 -3.96 0.00 -1.24 -5.17 105.19 95.36 2i0n n GLY 5 Ca -0.13 1.01 -0.15 0.00 0.00 0.00 0.00 46.02 46.75 2i0n n GLY 5 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i0n s SER 6 N 0.00 1.55 -0.95 1.61 0.01 -1.26 -4.54 113.70 110.12 2i0n s SER 6 Ca 0.00 -0.79 -0.21 0.00 1.31 0.00 0.00 55.95 56.26 2i0n s SER 6 Cb 0.00 -0.01 -0.11 0.00 0.21 0.00 0.00 66.02 66.11 2i0n s SER 6 CO 0.00 -0.22 1.95 -0.81 0.41 0.00 0.00 173.24 174.57 2i0n n PRO 7 N 0.65 1.74 0.06 12.44 -0.04 -1.26 -4.19 135.00 144.40 2i0n n PRO 7 Ca -0.17 -2.12 0.00 0.00 -0.04 0.00 0.00 63.50 61.18 2i0n n PRO 7 Cb 0.57 -3.15 0.00 0.00 -0.04 0.00 0.00 33.50 30.88 2i0n n PRO 7 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2i0n n GLU 8 N 7.25 0.00 -2.81 0.54 1.02 -1.26 -5.09 120.64 120.29 2i0n n GLU 8 Ca 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.61 2i0n n GLU 8 Cb 0.42 -0.05 -0.02 0.00 -0.02 0.00 0.00 31.44 31.77 2i0n n GLU 8 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2i0n n PHE 9 N -2.99 -2.91 0.00 -0.32 3.72 -1.26 -4.96 117.46 108.74 2i0n n PHE 9 Ca 0.00 1.51 0.00 0.00 -0.05 0.00 0.00 57.45 58.91 2i0n n PHE 9 Cb 0.00 -3.02 0.00 0.00 -0.94 0.00 0.00 39.48 35.52 2i0n n PHE 9 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2i0n n ALA 10 N 1.47 0.00 -0.67 4.37 0.00 -1.26 -5.06 120.51 119.36 2i0n n ALA 10 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2i0n n ALA 10 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 2i0n n ALA 10 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2i0n n LYS 11 N -0.89 0.00 -2.86 0.00 5.02 -1.26 -3.96 118.16 114.20 2i0n n LYS 11 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 2i0n n LYS 11 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 34.98 2i0n n LYS 11 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2i0n n TYR 12 N 0.00 -0.25 -3.75 2.13 4.01 -1.09 -4.12 117.16 114.10 2i0n n TYR 12 Ca 0.00 -1.06 -0.13 0.00 -0.16 0.00 0.00 57.90 56.55 2i0n n TYR 12 Cb 0.00 0.09 -0.08 0.00 -0.31 0.00 0.00 39.34 39.04 2i0n n TYR 12 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2i0n s ALA 13 N -2.50 -0.81 -0.29 -0.72 0.00 -1.08 -0.49 121.76 115.87 2i0n s ALA 13 Ca 0.14 0.32 0.02 0.00 0.00 0.00 0.00 51.96 52.44 2i0n s ALA 13 Cb 0.01 0.11 0.06 0.00 0.00 0.00 0.00 23.12 23.30 2i0n s ALA 13 CO 0.10 -0.28 -0.05 0.50 0.00 0.00 0.00 175.76 176.03 2i0n s ARG 14 N -1.49 2.19 -0.24 0.00 6.06 0.95 0.09 118.95 126.52 2i0n s ARG 14 Ca -0.12 -1.41 -0.39 0.00 -2.50 0.00 0.00 55.73 51.31 2i0n s ARG 14 Cb -0.04 -3.04 -0.15 0.00 0.06 0.00 0.00 34.95 31.78 2i0n s ARG 14 CO 0.03 -0.65 1.79 0.00 -2.50 0.00 0.00 175.30 173.98 2i0n n ALA 15 N 4.47 0.11 0.39 6.12 0.00 0.40 -0.27 120.51 131.73 2i0n n ALA 15 Ca -0.11 0.35 0.14 0.00 0.00 0.00 0.00 53.44 53.82 2i0n n ALA 15 Cb 0.42 -2.30 0.46 0.00 0.00 0.00 0.00 19.45 18.03 2i0n n ALA 15 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2i0n h LEU 16 N 7.85 0.00 -7.00 0.00 3.38 -0.07 -0.92 115.31 118.56 2i0n h LEU 16 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2i0n h LEU 16 Cb 1.31 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.85 2i0n h LEU 16 CO 0.96 0.00 0.34 -1.59 0.09 0.00 0.00 178.44 178.24 2i0n s LYS 17 N -3.33 0.85 0.34 1.13 -2.85 -1.22 -4.31 119.74 110.34 2i0n s LYS 17 Ca 0.06 0.24 -0.27 0.00 -1.00 0.00 0.00 55.97 55.00 2i0n s LYS 17 Cb 0.09 0.40 -0.13 0.00 -2.06 0.00 0.00 37.83 36.13 2i0n s LYS 17 CO 0.53 -0.26 0.99 -0.40 0.10 0.00 0.00 175.35 176.32 2i0n n ASP 18 N 0.92 1.21 -4.26 0.03 5.68 -1.26 -4.18 116.55 114.68 2i0n n ASP 18 Ca -0.15 1.12 -0.24 0.00 -0.50 0.00 0.00 54.79 55.02 2i0n n ASP 18 Cb 0.57 -1.31 -0.13 0.00 -1.14 0.00 0.00 41.12 39.12 2i0n n ASP 18 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2i0n s TYR 19 N -1.15 1.73 -0.03 2.11 5.04 0.08 -4.80 117.35 120.33 2i0n s TYR 19 Ca 0.60 -0.40 0.04 0.00 -2.44 0.00 0.00 57.07 54.86 2i0n s TYR 19 Cb -0.65 -0.98 -0.00 0.00 0.35 0.00 0.00 41.96 40.68 2i0n s TYR 19 CO 0.59 0.16 -0.15 1.21 -1.34 0.00 0.00 175.55 176.02 2i0n s ASN 20 N -1.65 1.90 -0.03 4.32 2.47 -1.26 -2.71 114.94 117.97 2i0n s ASN 20 Ca 0.06 -0.31 -0.04 0.00 0.42 0.00 0.00 52.86 53.00 2i0n s ASN 20 Cb -0.10 -0.47 0.01 0.00 -1.45 0.00 0.00 41.25 39.24 2i0n s ASN 20 CO 0.03 0.14 0.10 0.68 -3.72 0.00 0.00 177.10 174.34 2i0n s VAL 21 N 0.01 0.01 -0.43 -5.21 -7.23 -1.26 -5.02 120.40 101.27 2i0n s VAL 21 Ca -0.02 -0.08 0.02 0.00 -1.81 0.00 0.00 61.98 60.09 2i0n s VAL 21 Cb -0.10 -0.18 0.14 0.00 0.56 0.00 0.00 36.38 36.81 2i0n s VAL 21 CO 0.01 -0.05 0.26 -0.44 -0.31 0.00 0.00 175.10 174.58 2i0n s SER 22 N -0.10 3.20 0.00 4.85 0.01 -1.26 -4.88 113.70 115.52 2i0n s SER 22 Ca -0.02 -2.65 0.00 0.00 1.31 0.00 0.00 55.95 54.60 2i0n s SER 22 Cb -0.02 -0.80 0.00 0.00 0.21 0.00 0.00 66.02 65.41 2i0n s SER 22 CO 0.00 -0.25 0.00 0.47 0.41 0.00 0.00 173.24 173.87 2i0n n ASP 23 N 3.48 0.00 0.00 2.44 8.00 -1.26 -5.10 116.55 124.11 2i0n n ASP 23 Ca 0.13 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.63 2i0n n ASP 23 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 2i0n n ASP 23 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2i0n n THR 24 N -0.58 0.00 -2.55 -3.53 -2.24 -1.26 -4.98 114.28 99.14 2i0n n THR 24 Ca 0.00 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.52 2i0n n THR 24 Cb 0.00 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2i0n n THR 24 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2i0n n SER 25 N -2.14 4.45 -4.97 3.42 3.41 -1.26 -5.06 113.62 111.47 2i0n n SER 25 Ca 0.00 -3.65 -0.19 0.00 -0.26 0.00 0.00 58.87 54.77 2i0n n SER 25 Cb 0.00 -0.48 -0.01 0.00 -0.26 0.00 0.00 64.21 63.47 2i0n n SER 25 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2i0n s LEU 26 N -3.50 3.81 -0.46 1.04 2.01 -1.26 -2.92 118.68 117.39 2i0n s LEU 26 Ca 0.47 -0.32 0.03 0.00 0.01 0.00 0.00 54.13 54.31 2i0n s LEU 26 Cb 0.39 -2.61 0.14 0.00 0.01 0.00 0.00 46.19 44.12 2i0n s LEU 26 CO -0.17 -0.51 0.26 -0.22 1.01 0.00 0.00 176.35 176.72 2i0n s LEU 27 N -4.19 3.01 0.35 1.79 2.96 -1.10 -4.04 118.68 117.45 2i0n s LEU 27 Ca 0.47 -2.76 -0.26 0.00 -0.22 0.00 0.00 54.13 51.36 2i0n s LEU 27 Cb -0.09 -1.14 -0.09 0.00 0.50 0.00 0.00 46.19 45.37 2i0n s LEU 27 CO 0.31 -0.25 1.06 -2.16 -1.32 0.00 0.00 176.35 173.98 2i0n s PRO 28 N 0.16 4.38 0.29 0.98 0.04 -1.26 -4.79 135.00 134.80 2i0n s PRO 28 Ca 0.18 1.61 -0.06 0.00 0.04 0.00 0.00 61.00 62.78 2i0n s PRO 28 Cb -0.23 -2.82 0.02 0.00 0.04 0.00 0.00 34.50 31.52 2i0n s PRO 28 CO -0.01 0.03 0.48 1.97 0.04 0.00 0.00 177.00 179.50 2i0n n PHE 29 N 0.47 -1.57 -4.21 0.56 1.16 -1.10 -4.97 117.46 107.80 2i0n n PHE 29 Ca 0.02 -1.67 -0.24 0.00 -1.87 0.00 0.00 57.45 53.69 2i0n n PHE 29 Cb 0.48 0.55 -0.08 0.00 -1.61 0.00 0.00 39.48 38.82 2i0n n PHE 29 CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 2i0n s LYS 30 N -2.40 2.20 1.06 3.97 2.20 -1.26 -0.74 119.74 124.77 2i0n s LYS 30 Ca 0.18 -1.76 -0.17 0.00 -0.36 0.00 0.00 55.97 53.86 2i0n s LYS 30 Cb -0.02 -1.99 0.13 0.00 -1.51 0.00 0.00 37.83 34.44 2i0n s LYS 30 CO 0.13 0.02 0.08 -2.13 -0.36 0.00 0.00 175.35 173.09 2i0n n ARG 31 N -1.11 -1.95 -3.60 4.03 0.63 -1.26 -3.25 116.66 110.15 2i0n n ARG 31 Ca -0.03 -0.57 -0.19 0.00 -0.92 0.00 0.00 57.85 56.15 2i0n n ARG 31 Cb 0.63 -1.54 -0.06 0.00 0.45 0.00 0.00 32.46 31.95 2i0n n ARG 31 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2i0n n ASN 32 N -1.21 0.53 -4.35 6.15 6.94 -0.36 -4.77 115.26 118.19 2i0n n ASN 32 Ca 0.03 -0.77 -0.32 0.00 -0.02 0.00 0.00 54.58 53.51 2i0n n ASN 32 Cb 0.49 -0.95 -0.15 0.00 -2.36 0.00 0.00 39.78 36.80 2i0n n ASN 32 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2i0n s ASP 33 N -3.84 3.34 -0.50 0.53 2.15 -1.14 -4.46 116.67 112.75 2i0n s ASP 33 Ca 0.00 -0.40 -0.21 0.00 0.43 0.00 0.00 52.55 52.37 2i0n s ASP 33 Cb -0.00 -0.63 0.04 0.00 -0.30 0.00 0.00 42.92 42.04 2i0n s ASP 33 CO 0.60 0.30 0.71 -0.63 -0.17 0.00 0.00 175.17 175.99 2i0n s ILE 34 N -0.51 4.74 -0.06 4.11 1.09 -1.26 0.15 121.20 129.46 2i0n s ILE 34 Ca 0.07 -0.13 -0.19 0.00 -1.10 0.00 0.00 60.65 59.30 2i0n s ILE 34 Cb -0.11 -4.34 -0.05 0.00 -1.06 0.00 0.00 42.46 36.90 2i0n s ILE 34 CO 0.01 -0.83 0.53 -0.63 -0.10 0.00 0.00 174.94 173.91 2i0n s ILE 35 N 3.02 5.06 -0.65 2.92 1.09 0.11 -4.95 121.20 127.80 2i0n s ILE 35 Ca 0.21 1.08 -0.26 0.00 -1.10 0.00 0.00 60.65 60.58 2i0n s ILE 35 Cb -0.16 -3.86 -0.03 0.00 -1.06 0.00 0.00 42.46 37.34 2i0n s ILE 35 CO 0.16 0.38 1.95 -0.89 -0.10 0.00 0.00 174.94 176.44 2i0n s THR 36 N 0.15 3.32 -0.81 2.92 2.01 -1.01 -2.64 115.64 119.59 2i0n s THR 36 Ca 0.28 0.08 -0.26 0.00 0.31 0.00 0.00 61.69 62.10 2i0n s THR 36 Cb -0.17 -3.83 -0.14 0.00 0.01 0.00 0.00 72.50 68.37 2i0n s THR 36 CO 0.14 -0.80 2.38 -0.63 -0.69 0.00 0.00 174.62 175.02 2i0n s ILE 37 N 9.74 3.02 0.03 1.82 -1.09 -1.26 -2.27 121.20 131.19 2i0n s ILE 37 Ca 0.71 -0.02 0.06 0.00 -2.23 0.00 0.00 60.65 59.18 2i0n s ILE 37 Cb -0.12 -3.10 -0.23 0.00 -1.58 0.00 0.00 42.46 37.43 2i0n s ILE 37 CO 0.17 -0.05 0.95 0.71 -1.23 0.00 0.00 174.94 175.50 2i0n h THR 38 N 7.63 1.26 -0.64 2.92 1.35 -1.86 -3.45 112.91 120.12 2i0n h THR 38 Ca 0.00 -3.01 0.15 0.00 -0.55 0.00 0.00 66.41 63.00 2i0n h THR 38 Cb 1.00 2.67 -0.20 0.00 -1.73 0.00 0.00 68.15 69.89 2i0n h THR 38 CO 1.01 0.77 -0.13 0.12 -0.25 0.00 0.00 175.52 177.04 2i0n s PHE 39 N -2.65 -1.11 0.00 4.73 5.36 0.35 -5.01 117.98 119.65 2i0n s PHE 39 Ca -0.04 0.90 0.00 0.00 -0.96 0.00 0.00 56.93 56.83 2i0n s PHE 39 Cb 0.08 0.29 0.00 0.00 -0.34 0.00 0.00 43.02 43.05 2i0n s PHE 39 CO 0.83 -0.63 0.00 0.36 -1.46 0.00 0.00 175.22 174.32 2i0n n LYS 40 N 5.36 1.09 -4.35 10.12 2.85 -1.26 -0.26 118.16 131.71 2i0n n LYS 40 Ca 0.01 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 56.99 2i0n n LYS 40 Cb 0.54 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.86 2i0n n LYS 40 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2i0n n ASP 41 N -1.13 2.99 -0.00 -5.58 9.92 -1.12 -4.61 116.55 117.03 2i0n n ASP 41 Ca 0.00 -2.98 0.05 0.00 -0.53 0.00 0.00 54.79 51.33 2i0n n ASP 41 Cb 0.00 0.39 -0.07 0.00 -0.64 0.00 0.00 41.12 40.81 2i0n n ASP 41 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2i0n n GLN 42 N -1.09 2.09 -0.01 -1.24 6.02 -1.26 -4.44 117.38 117.45 2i0n n GLN 42 Ca -0.17 -0.04 0.12 0.00 -0.01 0.00 0.00 57.00 56.89 2i0n n GLN 42 Cb 0.57 -1.09 0.63 0.00 1.02 0.00 0.00 30.24 31.37 2i0n n GLN 42 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2i0n n GLU 43 N -1.53 1.16 -3.30 -1.09 4.07 -1.26 -4.89 120.64 113.80 2i0n n GLU 43 Ca 0.00 -0.24 -0.24 0.00 -0.06 0.00 0.00 57.16 56.62 2i0n n GLU 43 Cb 0.20 -1.38 0.02 0.00 -0.06 0.00 0.00 31.44 30.22 2i0n n GLU 43 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2i0n n ASN 44 N -0.61 -5.02 0.00 4.31 5.15 -1.26 -4.80 115.26 113.04 2i0n n ASN 44 Ca 0.17 -0.40 0.00 0.00 -0.60 0.00 0.00 54.58 53.75 2i0n n ASN 44 Cb 0.14 -4.07 0.00 0.00 -0.53 0.00 0.00 39.78 35.32 2i0n n ASN 44 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2i0n n LYS 45 N -4.05 0.00 -3.52 1.20 5.02 -1.26 -4.84 118.16 110.72 2i0n n LYS 45 Ca -0.05 -0.34 -0.18 0.00 -2.02 0.00 0.00 58.31 55.73 2i0n n LYS 45 Cb 0.57 -0.46 -0.06 0.00 -0.02 0.00 0.00 35.03 35.07 2i0n n LYS 45 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2i0n s TRP 46 N 0.00 -0.64 -0.04 2.13 0.52 -1.26 -4.01 118.94 115.63 2i0n s TRP 46 Ca 0.00 1.06 -0.03 0.00 0.02 0.00 0.00 56.10 57.15 2i0n s TRP 46 Cb 0.00 0.41 0.02 0.00 -1.15 0.00 0.00 33.47 32.76 2i0n s TRP 46 CO 0.00 -0.62 0.10 -0.06 0.02 0.00 0.00 176.95 176.39 2i0n s PHE 47 N -1.36 -0.10 -0.27 -1.98 0.40 0.40 -2.77 117.98 112.29 2i0n s PHE 47 Ca -0.10 0.32 -0.06 0.00 -0.60 0.00 0.00 56.93 56.48 2i0n s PHE 47 Cb -0.00 -0.05 -0.00 0.00 0.51 0.00 0.00 43.02 43.48 2i0n s PHE 47 CO 0.08 -0.10 0.06 1.41 0.70 0.00 0.00 175.22 177.38 2i0n s MET 48 N 0.62 3.26 0.19 0.44 1.75 0.64 -1.16 119.30 125.04 2i0n s MET 48 Ca -0.05 -0.74 0.04 0.00 -1.25 0.00 0.00 55.69 53.69 2i0n s MET 48 Cb -0.07 -3.31 -0.01 0.00 2.84 0.00 0.00 34.83 34.28 2i0n s MET 48 CO -0.03 -0.35 0.14 0.41 -0.65 0.00 0.00 175.02 174.54 2i0n n GLY 49 N 4.87 3.46 3.29 2.11 0.00 -1.03 -0.50 105.19 117.39 2i0n n GLY 49 Ca -0.15 -1.83 -0.15 0.00 0.00 0.00 0.00 46.02 43.88 2i0n n GLY 49 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2i0n s GLN 50 N -2.77 1.23 0.00 1.61 -0.44 -0.96 -1.93 119.66 116.40 2i0n s GLN 50 Ca 0.20 -1.61 0.00 0.00 -2.50 0.00 0.00 55.36 51.45 2i0n s GLN 50 Cb 0.01 -0.44 0.00 0.00 -1.64 0.00 0.00 33.01 30.94 2i0n s GLN 50 CO 0.14 -0.12 0.00 -0.11 0.50 0.00 0.00 175.29 175.70 2i0n n LEU 51 N -0.33 0.00 -4.56 3.68 7.94 0.30 -2.39 117.00 121.64 2i0n n LEU 51 Ca -0.06 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.71 2i0n n LEU 51 Cb 0.64 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.50 2i0n n LEU 51 CO 0.35 0.00 1.27 0.59 -1.11 0.00 0.00 177.39 178.49 2i0n n ASN 52 N 0.00 1.56 -3.65 1.96 3.02 -1.26 -2.62 115.26 114.28 2i0n n ASN 52 Ca 0.00 -1.45 -0.24 0.00 -0.03 0.00 0.00 54.58 52.86 2i0n n ASN 52 Cb 0.00 -1.59 0.07 0.00 -0.61 0.00 0.00 39.78 37.65 2i0n n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2i0n n GLY 53 N 6.71 -0.49 3.15 7.41 0.00 -1.26 -4.98 105.19 115.73 2i0n n GLY 53 Ca 0.48 0.21 -0.08 0.00 0.00 0.00 0.00 46.02 46.63 2i0n n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i0n s LYS 54 N -6.20 0.35 -0.20 1.61 -0.14 -1.08 -5.13 119.74 108.96 2i0n s LYS 54 Ca 0.46 0.88 0.01 0.00 -1.36 0.00 0.00 55.97 55.96 2i0n s LYS 54 Cb -0.21 0.09 0.03 0.00 -1.68 0.00 0.00 37.83 36.06 2i0n s LYS 54 CO 0.76 -0.40 -0.14 -2.00 -0.76 0.00 0.00 175.35 172.80 2i0n s GLU 55 N 2.61 2.43 0.00 1.68 2.12 -1.26 0.11 118.70 126.39 2i0n s GLU 55 Ca 0.04 -0.88 0.00 0.00 0.36 0.00 0.00 54.97 54.49 2i0n s GLU 55 Cb -0.13 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 31.76 2i0n s GLU 55 CO -0.14 -0.35 0.00 0.41 -0.54 0.00 0.00 175.26 174.64 2i0n n GLY 56 N 4.63 4.26 3.33 -1.50 0.00 -0.81 -4.52 105.19 110.58 2i0n n GLY 56 Ca -0.17 -0.36 -0.20 0.00 0.00 0.00 0.00 46.02 45.29 2i0n n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i0n s SER 57 N 1.67 1.79 -0.27 1.61 0.01 -1.15 -2.46 113.70 114.90 2i0n s SER 57 Ca 0.00 -1.71 -0.29 0.00 1.31 0.00 0.00 55.95 55.26 2i0n s SER 57 Cb 0.00 0.53 0.18 0.00 0.21 0.00 0.00 66.02 66.95 2i0n s SER 57 CO 0.00 -1.02 1.32 0.72 0.41 0.00 0.00 173.24 174.67 2i0n s PHE 58 N -3.45 -0.09 0.29 2.43 -0.12 -0.31 -2.73 117.98 114.00 2i0n s PHE 58 Ca 0.37 0.16 -0.29 0.00 -0.05 0.00 0.00 56.93 57.12 2i0n s PHE 58 Cb 0.03 0.49 -0.10 0.00 -0.63 0.00 0.00 43.02 42.80 2i0n s PHE 58 CO 0.24 -0.08 1.29 -1.25 -0.05 0.00 0.00 175.22 175.37 2i0n s PRO 59 N -0.88 4.39 0.22 1.99 0.04 -1.26 -0.45 135.00 139.05 2i0n s PRO 59 Ca 0.07 2.13 0.18 0.00 0.04 0.00 0.00 61.00 63.43 2i0n s PRO 59 Cb -0.01 -3.12 0.88 0.00 0.04 0.00 0.00 34.50 32.28 2i0n s PRO 59 CO -0.08 -0.17 1.56 1.55 0.04 0.00 0.00 177.00 179.90 2i0n n VAL 60 N 1.41 1.10 0.20 -0.36 3.14 -1.26 -2.74 118.33 119.83 2i0n n VAL 60 Ca 0.02 0.47 0.12 0.00 -2.96 0.00 0.00 64.34 61.99 2i0n n VAL 60 Cb 0.42 -1.42 0.61 0.00 -1.06 0.00 0.00 33.84 32.39 2i0n n VAL 60 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 2i0n h ASP 61 N 0.00 0.00 -0.03 6.55 3.58 -1.90 -2.99 116.42 121.64 2i0n h ASP 61 Ca 0.00 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.32 2i0n h ASP 61 Cb 0.16 0.00 -0.27 0.00 1.72 0.00 0.00 39.33 40.93 2i0n h ASP 61 CO 0.00 0.00 -0.87 0.00 -2.88 0.00 0.00 179.24 175.49 2i0n n HIS 62 N -2.30 0.09 -3.78 0.28 1.44 -1.11 -5.00 115.22 104.85 2i0n n HIS 62 Ca -0.01 -0.89 -0.15 0.00 -2.01 0.00 0.00 57.72 54.67 2i0n n HIS 62 Cb 0.06 -0.19 -0.16 0.00 0.12 0.00 0.00 29.99 29.83 2i0n n HIS 62 CO 0.00 0.00 0.00 0.14 -2.81 0.00 0.00 176.34 173.67 2i0n s VAL 63 N -1.19 -0.05 0.57 0.61 -7.23 -1.13 0.68 120.40 112.66 2i0n s VAL 63 Ca 0.35 0.19 0.02 0.00 -1.81 0.00 0.00 61.98 60.73 2i0n s VAL 63 Cb 0.38 -0.09 0.05 0.00 0.56 0.00 0.00 36.38 37.28 2i0n s VAL 63 CO -0.13 0.08 0.80 -0.70 -0.31 0.00 0.00 175.10 174.84 2i0n s GLU 64 N 0.97 2.39 -0.18 4.82 2.12 0.63 -4.82 118.70 124.64 2i0n s GLU 64 Ca -0.08 -0.92 0.00 0.00 0.36 0.00 0.00 54.97 54.33 2i0n s GLU 64 Cb -0.11 -2.49 0.01 0.00 0.26 0.00 0.00 34.13 31.80 2i0n s GLU 64 CO -0.03 -0.83 -0.17 0.42 -0.54 0.00 0.00 175.26 174.11 2i0n s ILE 65 N -2.80 2.34 -0.59 -3.70 -1.09 -1.26 -0.03 121.20 114.07 2i0n s ILE 65 Ca 0.59 -0.85 -0.21 0.00 -2.23 0.00 0.00 60.65 57.95 2i0n s ILE 65 Cb -0.09 -2.00 0.08 0.00 -1.58 0.00 0.00 42.46 38.87 2i0n s ILE 65 CO 0.39 0.52 0.80 -0.76 -1.23 0.00 0.00 174.94 174.66 2i0n s LEU 66 N 1.24 4.81 0.00 2.97 1.43 0.36 -4.86 118.68 124.62 2i0n s LEU 66 Ca 0.03 -1.05 0.26 0.00 -1.03 0.00 0.00 54.13 52.34 2i0n s LEU 66 Cb -0.14 -2.43 0.78 0.00 0.03 0.00 0.00 46.19 44.43 2i0n s LEU 66 CO -0.09 -1.19 1.59 -0.11 0.23 0.00 0.00 176.35 176.78 2i0n n LEU 67 N 6.90 1.96 -2.65 1.79 7.94 -1.25 -2.66 117.00 129.03 2i0n n LEU 67 Ca -0.06 -0.69 -0.19 0.00 -1.11 0.00 0.00 56.01 53.96 2i0n n LEU 67 Cb 0.45 -0.03 -0.08 0.00 0.53 0.00 0.00 43.42 44.29 2i0n n LEU 67 CO 0.60 0.34 2.09 -0.24 -1.11 0.00 0.00 177.39 179.07 2i0n n SER 68 N 0.53 5.39 0.00 1.96 2.88 -1.26 -4.82 113.62 118.29 2i0n n SER 68 Ca 0.17 -2.35 0.00 0.00 -1.33 0.00 0.00 58.87 55.37 2i0n n SER 68 Cb 0.42 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.67 2i0n n SER 68 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2i0n n ASP 69 N 3.22 0.00 -3.92 -3.46 8.00 -1.26 -4.46 116.55 114.67 2i0n n ASP 69 Ca 0.47 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.77 2i0n n ASP 69 Cb 0.46 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 41.40 2i0n n ASP 69 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2i0n s VAL 70 N 0.00 0.62 0.85 2.53 1.01 -1.26 -4.79 120.40 119.35 2i0n s VAL 70 Ca 0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 61.98 61.67 2i0n s VAL 70 Cb 0.00 -0.61 0.10 0.00 0.00 0.00 0.00 36.38 35.87 2i0n s VAL 70 CO 0.00 0.23 1.13 -2.16 0.00 0.00 0.00 175.10 174.31 2i0n s PRO 71 N 0.74 1.68 1.01 2.72 0.04 -1.26 -5.05 135.00 134.87 2i0n s PRO 71 Ca -0.11 0.34 -0.14 0.00 0.04 0.00 0.00 61.00 61.13 2i0n s PRO 71 Cb -0.13 -1.90 0.19 0.00 0.04 0.00 0.00 34.50 32.70 2i0n s PRO 71 CO 0.01 -1.84 1.15 -1.25 0.04 0.00 0.00 177.00 175.10 2i0n s PRO 72 N -5.33 0.33 -0.03 0.56 0.04 -1.26 -4.96 135.00 124.35 2i0n s PRO 72 Ca 0.62 0.15 -0.30 0.00 0.04 0.00 0.00 61.00 61.51 2i0n s PRO 72 Cb -0.14 -1.76 -0.05 0.00 0.04 0.00 0.00 34.50 32.60 2i0n s PRO 72 CO 0.52 -2.72 1.38 -1.25 0.04 0.00 0.00 177.00 174.98 2i0n s PRO 73 N -5.33 4.28 0.58 0.56 0.04 -1.26 -4.94 135.00 128.93 2i0n s PRO 73 Ca 0.67 1.92 -0.21 0.00 0.04 0.00 0.00 61.00 63.43 2i0n s PRO 73 Cb -0.13 -3.63 -0.04 0.00 0.04 0.00 0.00 34.50 30.75 2i0n s PRO 73 CO 0.55 -0.60 1.35 1.14 0.04 0.00 0.00 177.00 179.48 2i0n s GLN 74 N 2.63 2.93 -0.15 4.56 -2.07 -1.26 -4.91 119.66 121.40 2i0n s GLN 74 Ca 0.63 2.20 -0.29 0.00 -1.82 0.00 0.00 55.36 56.08 2i0n s GLN 74 Cb -0.30 -2.12 -0.02 0.00 -1.09 0.00 0.00 33.01 29.48 2i0n s GLN 74 CO 0.25 -1.34 1.33 -1.25 -1.32 0.00 0.00 175.29 172.96 2i0n s PRO 75 N -3.06 4.22 -0.19 9.60 0.04 -1.26 -4.99 135.00 139.35 2i0n s PRO 75 Ca 0.75 1.76 -0.04 0.00 0.04 0.00 0.00 61.00 63.51 2i0n s PRO 75 Cb -0.40 -3.80 0.10 0.00 0.04 0.00 0.00 34.50 30.43 2i0n s PRO 75 CO 0.46 -0.73 0.30 0.08 0.04 0.00 0.00 177.00 177.14 2i0n s VAL 76 N 3.60 -0.46 0.38 -0.36 1.01 -1.26 -5.03 120.40 118.28 2i0n s VAL 76 Ca 0.58 0.05 -0.26 0.00 0.00 0.00 0.00 61.98 62.35 2i0n s VAL 76 Cb -0.24 -0.64 -0.11 0.00 0.00 0.00 0.00 36.38 35.39 2i0n s VAL 76 CO 0.17 -0.05 1.08 1.41 0.00 0.00 0.00 175.10 177.71 2i0n n HIS 77 N 5.35 1.48 -0.99 5.22 8.25 -1.26 -4.78 115.22 128.49 2i0n n HIS 77 Ca -0.05 0.58 -0.31 0.00 -0.26 0.00 0.00 57.72 57.67 2i0n n HIS 77 Cb 0.50 -2.28 -0.03 0.00 1.12 0.00 0.00 29.99 29.30 2i0n n HIS 77 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2i0n n PRO 78 N 0.31 2.22 -3.75 -0.41 -0.04 -1.26 -4.90 135.00 127.17 2i0n n PRO 78 Ca 0.08 -1.74 -0.36 0.00 -0.04 0.00 0.00 63.50 61.44 2i0n n PRO 78 Cb 0.37 -2.67 -0.06 0.00 -0.04 0.00 0.00 33.50 31.10 2i0n n PRO 78 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2i0n s VAL 79 N 3.61 5.32 0.00 0.52 0.11 -1.26 -5.38 120.40 123.31 2i0n s VAL 79 Ca 0.48 0.30 0.00 0.00 -2.93 0.00 0.00 61.98 59.83 2i0n s VAL 79 Cb 0.13 -3.54 0.00 0.00 -1.53 0.00 0.00 36.38 31.44 2i0n s VAL 79 CO -0.01 0.48 0.24 0.00 -3.33 0.00 0.00 175.10 172.49