#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i0n s GLY 2 N 0.00 1.34 0.28 3.03 0.00 -1.26 -4.97 107.32 105.75 2i0n s GLY 2 Ca 0.00 -1.81 0.10 0.00 0.00 0.00 0.00 44.72 43.01 2i0n s GLY 2 CO 0.00 1.28 1.63 -0.56 0.00 0.00 0.00 173.10 175.44 2i0n h PRO 3 N 7.93 0.02 -5.59 2.90 0.13 -2.11 -3.38 132.00 131.91 2i0n h PRO 3 Ca -0.12 -0.01 -0.59 0.00 -0.87 0.00 0.00 66.00 64.40 2i0n h PRO 3 Cb 1.03 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.10 2i0n h PRO 3 CO 0.47 0.61 2.00 -0.11 -0.23 0.00 0.00 178.00 180.73 2i0n n LEU 4 N -3.84 4.59 0.00 1.56 0.00 -1.26 -4.19 117.00 113.86 2i0n n LEU 4 Ca -0.01 -3.72 0.00 0.00 0.00 0.00 0.00 56.01 52.28 2i0n n LEU 4 Cb 0.60 -1.72 0.00 0.00 0.00 0.00 0.00 43.42 42.29 2i0n n LEU 4 CO 0.42 -0.29 0.00 0.61 0.00 0.00 0.00 177.39 178.13 2i0n n GLY 5 N 5.38 -2.44 1.48 -3.96 0.00 -1.26 -5.17 105.19 99.22 2i0n n GLY 5 Ca 0.48 0.81 0.11 0.00 0.00 0.00 0.00 46.02 47.43 2i0n n GLY 5 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2i0n n SER 6 N -0.48 -8.03 -4.70 1.61 7.64 -1.26 -4.73 113.62 103.66 2i0n n SER 6 Ca 0.00 1.61 -0.42 0.00 1.01 0.00 0.00 58.87 61.07 2i0n n SER 6 Cb 0.00 -5.00 -0.03 0.00 -1.01 0.00 0.00 64.21 58.17 2i0n n SER 6 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2i0n s PRO 7 N -4.71 4.36 -0.36 1.43 0.04 -1.26 -4.95 135.00 129.55 2i0n s PRO 7 Ca 0.00 1.80 0.13 0.00 0.04 0.00 0.00 61.00 62.98 2i0n s PRO 7 Cb 0.00 -3.47 0.38 0.00 0.04 0.00 0.00 34.50 31.45 2i0n s PRO 7 CO 0.00 -0.41 0.79 -0.85 0.04 0.00 0.00 177.00 176.57 2i0n n GLU 8 N 4.71 1.01 -1.62 4.56 0.28 -1.26 -5.10 120.64 123.22 2i0n n GLU 8 Ca 0.11 -3.32 0.00 0.00 -0.16 0.00 0.00 57.16 53.78 2i0n n GLU 8 Cb 0.45 -1.58 0.00 0.00 1.43 0.00 0.00 31.44 31.75 2i0n n GLU 8 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 2i0n n PHE 9 N 0.19 0.00 -3.55 -1.84 -1.74 -1.26 -5.11 117.46 104.16 2i0n n PHE 9 Ca 0.21 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 57.03 2i0n n PHE 9 Cb 0.70 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.68 2i0n n PHE 9 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2i0n s ALA 10 N -2.00 -1.87 -0.02 1.98 0.00 -1.26 -5.08 121.76 113.51 2i0n s ALA 10 Ca 0.00 1.03 -0.01 0.00 0.00 0.00 0.00 51.96 52.98 2i0n s ALA 10 Cb 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 23.12 23.44 2i0n s ALA 10 CO 0.00 -0.72 -0.02 1.17 0.00 0.00 0.00 175.76 176.19 2i0n n LYS 11 N -0.25 0.05 -3.97 0.00 3.00 -1.26 -4.93 118.16 110.81 2i0n n LYS 11 Ca -0.07 0.02 -0.12 0.00 -0.00 0.00 0.00 58.31 58.14 2i0n n LYS 11 Cb 0.61 -0.79 -0.02 0.00 0.00 0.00 0.00 35.03 34.83 2i0n n LYS 11 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 2i0n s TYR 12 N -2.04 0.60 -0.11 5.64 2.02 -1.10 -4.13 117.35 118.23 2i0n s TYR 12 Ca -0.03 -1.02 -0.30 0.00 -0.37 0.00 0.00 57.07 55.35 2i0n s TYR 12 Cb 0.01 0.31 0.08 0.00 -0.40 0.00 0.00 41.96 41.96 2i0n s TYR 12 CO 0.04 -1.29 0.75 0.00 -1.57 0.00 0.00 175.55 173.48 2i0n s ALA 13 N -2.90 -1.80 -0.17 3.71 0.00 -1.02 -0.42 121.76 119.15 2i0n s ALA 13 Ca 0.23 1.50 -0.06 0.00 0.00 0.00 0.00 51.96 53.64 2i0n s ALA 13 Cb -0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 2i0n s ALA 13 CO 0.15 -0.35 0.02 0.50 0.00 0.00 0.00 175.76 176.09 2i0n s ARG 14 N -0.85 3.86 0.02 0.00 3.00 0.19 -0.31 118.95 124.86 2i0n s ARG 14 Ca -0.07 -0.41 -0.30 0.00 -1.00 0.00 0.00 55.73 53.95 2i0n s ARG 14 Cb -0.01 -3.10 -0.07 0.00 0.00 0.00 0.00 34.95 31.77 2i0n s ARG 14 CO 0.07 0.26 1.54 0.00 0.00 0.00 0.00 175.30 177.17 2i0n s ALA 15 N 0.36 3.63 -0.60 6.12 0.00 0.11 -0.26 121.76 131.12 2i0n s ALA 15 Ca 0.00 1.02 0.24 0.00 0.00 0.00 0.00 51.96 53.23 2i0n s ALA 15 Cb -0.13 -3.66 0.46 0.00 0.00 0.00 0.00 23.12 19.79 2i0n s ALA 15 CO 0.01 -1.06 1.48 -0.07 0.00 0.00 0.00 175.76 176.12 2i0n h LEU 16 N 8.70 0.00 -7.00 0.00 -0.00 -1.82 0.91 115.31 116.10 2i0n h LEU 16 Ca -0.40 -0.09 -0.00 0.00 -0.00 0.00 0.00 57.88 57.39 2i0n h LEU 16 Cb 1.19 0.00 -0.21 0.00 -0.00 0.00 0.00 40.66 41.64 2i0n h LEU 16 CO 0.92 0.05 0.33 -1.59 -0.00 0.00 0.00 178.44 178.14 2i0n s LYS 17 N -3.17 0.86 0.36 1.13 -2.85 -1.26 -4.43 119.74 110.37 2i0n s LYS 17 Ca 0.07 0.27 -0.27 0.00 -1.00 0.00 0.00 55.97 55.04 2i0n s LYS 17 Cb 0.12 0.41 -0.12 0.00 -2.06 0.00 0.00 37.83 36.17 2i0n s LYS 17 CO 0.68 -0.26 1.10 -0.40 0.10 0.00 0.00 175.35 176.57 2i0n n ASP 18 N 0.98 1.74 -4.28 0.03 5.75 -1.26 -4.16 116.55 115.36 2i0n n ASP 18 Ca -0.15 1.13 -0.29 0.00 -0.01 0.00 0.00 54.79 55.47 2i0n n ASP 18 Cb 0.57 -1.37 -0.15 0.00 -1.03 0.00 0.00 41.12 39.13 2i0n n ASP 18 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2i0n s TYR 19 N -1.15 2.09 0.23 2.11 5.04 0.12 -4.83 117.35 120.95 2i0n s TYR 19 Ca 0.59 -0.39 0.10 0.00 -2.44 0.00 0.00 57.07 54.93 2i0n s TYR 19 Cb -0.60 -1.31 -0.04 0.00 0.35 0.00 0.00 41.96 40.35 2i0n s TYR 19 CO 0.59 0.01 -0.07 1.21 -1.34 0.00 0.00 175.55 175.95 2i0n s ASN 20 N -0.76 4.28 -0.10 4.32 2.47 -1.26 -2.74 114.94 121.14 2i0n s ASN 20 Ca 0.09 -0.67 -0.27 0.00 0.42 0.00 0.00 52.86 52.43 2i0n s ASN 20 Cb -0.09 -0.71 0.06 0.00 -1.45 0.00 0.00 41.25 39.06 2i0n s ASN 20 CO 0.00 0.05 0.64 0.68 -3.72 0.00 0.00 177.10 174.76 2i0n s VAL 21 N -2.05 0.01 -0.47 -5.21 -7.23 -1.26 -4.95 120.40 99.23 2i0n s VAL 21 Ca 0.28 -0.04 0.04 0.00 -1.81 0.00 0.00 61.98 60.44 2i0n s VAL 21 Cb -0.07 -0.95 0.16 0.00 0.56 0.00 0.00 36.38 36.08 2i0n s VAL 21 CO 0.17 -0.02 0.35 -0.44 -0.31 0.00 0.00 175.10 174.85 2i0n s SER 22 N -0.80 2.51 0.00 4.85 0.01 -1.26 -4.87 113.70 114.14 2i0n s SER 22 Ca -0.08 -3.13 0.00 0.00 1.31 0.00 0.00 55.95 54.05 2i0n s SER 22 Cb -0.02 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.46 2i0n s SER 22 CO 0.07 -0.17 0.47 0.47 0.41 0.00 0.00 173.24 174.49 2i0n n ASP 23 N 2.82 0.00 -1.98 2.44 8.00 -1.26 -4.99 116.55 121.58 2i0n n ASP 23 Ca 0.24 -1.18 -0.10 0.00 0.71 0.00 0.00 54.79 54.46 2i0n n ASP 23 Cb 0.43 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.47 2i0n n ASP 23 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2i0n n THR 24 N 0.00 -0.29 -1.83 -3.53 -1.04 -1.26 -4.59 114.28 101.75 2i0n n THR 24 Ca 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.97 2i0n n THR 24 Cb 0.54 -1.26 -0.04 0.00 -1.82 0.00 0.00 70.33 67.75 2i0n n THR 24 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2i0n n SER 25 N -1.10 -0.54 -4.89 8.00 7.64 -1.26 -5.15 113.62 116.32 2i0n n SER 25 Ca -0.11 -1.26 -0.26 0.00 1.01 0.00 0.00 58.87 58.24 2i0n n SER 25 Cb 0.49 0.16 -0.01 0.00 -1.01 0.00 0.00 64.21 63.84 2i0n n SER 25 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2i0n s LEU 26 N 0.00 2.73 -0.56 -3.43 2.01 -1.26 -3.94 118.68 114.23 2i0n s LEU 26 Ca 0.00 -1.23 0.04 0.00 0.01 0.00 0.00 54.13 52.95 2i0n s LEU 26 Cb 0.00 -1.22 0.15 0.00 0.01 0.00 0.00 46.19 45.13 2i0n s LEU 26 CO 0.00 -1.06 0.35 -0.22 1.01 0.00 0.00 176.35 176.43 2i0n s LEU 27 N -4.25 3.88 0.44 1.79 2.96 -1.21 -3.99 118.68 118.30 2i0n s LEU 27 Ca 0.34 -3.26 -0.22 0.00 -0.22 0.00 0.00 54.13 50.77 2i0n s LEU 27 Cb -0.02 -1.39 -0.09 0.00 0.50 0.00 0.00 46.19 45.19 2i0n s LEU 27 CO 0.21 -0.18 1.03 -2.16 -1.32 0.00 0.00 176.35 173.93 2i0n s PRO 28 N -0.57 4.00 0.32 0.98 0.04 -1.26 -4.84 135.00 133.67 2i0n s PRO 28 Ca 0.22 1.39 -0.16 0.00 0.04 0.00 0.00 61.00 62.49 2i0n s PRO 28 Cb -0.15 -2.29 0.03 0.00 0.04 0.00 0.00 34.50 32.13 2i0n s PRO 28 CO -0.08 -0.26 0.67 -0.59 0.04 0.00 0.00 177.00 176.78 2i0n s PHE 29 N -1.87 0.15 0.33 0.56 -0.12 -1.11 -4.96 117.98 110.96 2i0n s PHE 29 Ca 0.63 -0.64 0.08 0.00 -0.05 0.00 0.00 56.93 56.94 2i0n s PHE 29 Cb -0.18 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 42.76 2i0n s PHE 29 CO 0.22 -1.30 0.25 0.21 -0.05 0.00 0.00 175.22 174.55 2i0n s LYS 30 N -3.30 2.65 1.02 1.99 2.20 -1.26 0.10 119.74 123.14 2i0n s LYS 30 Ca 0.17 -1.34 -0.16 0.00 -0.36 0.00 0.00 55.97 54.28 2i0n s LYS 30 Cb -0.04 -2.41 0.10 0.00 -1.51 0.00 0.00 37.83 33.96 2i0n s LYS 30 CO 0.10 0.12 -0.03 -2.13 -0.36 0.00 0.00 175.35 173.05 2i0n n ARG 31 N -1.30 -1.68 -3.94 4.03 0.00 -1.26 -3.15 116.66 109.36 2i0n n ARG 31 Ca -0.03 -0.49 -0.29 0.00 -0.00 0.00 0.00 57.85 57.05 2i0n n ARG 31 Cb 0.60 -1.46 -0.07 0.00 0.00 0.00 0.00 32.46 31.53 2i0n n ARG 31 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2i0n n ASN 32 N -0.57 -0.15 -4.08 6.15 0.23 0.30 -4.82 115.26 112.31 2i0n n ASN 32 Ca 0.03 -1.01 -0.20 0.00 -0.53 0.00 0.00 54.58 52.87 2i0n n ASN 32 Cb 0.47 -1.27 -0.00 0.00 -2.08 0.00 0.00 39.78 36.89 2i0n n ASN 32 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2i0n n ASP 33 N -2.06 2.36 -3.74 0.53 9.92 -1.11 -4.85 116.55 117.61 2i0n n ASP 33 Ca -0.12 -2.42 -0.29 0.00 -0.53 0.00 0.00 54.79 51.43 2i0n n ASP 33 Cb 0.48 -0.00 -0.15 0.00 -0.64 0.00 0.00 41.12 40.80 2i0n n ASP 33 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2i0n s ILE 34 N -2.04 0.80 -0.07 0.53 -1.09 -1.26 0.09 121.20 118.15 2i0n s ILE 34 Ca 0.21 -1.19 -0.22 0.00 -2.23 0.00 0.00 60.65 57.22 2i0n s ILE 34 Cb -0.02 -1.51 -0.04 0.00 -1.58 0.00 0.00 42.46 39.31 2i0n s ILE 34 CO 0.13 -0.55 0.66 -0.63 -1.23 0.00 0.00 174.94 173.32 2i0n s ILE 35 N 1.68 5.06 -1.29 2.92 1.01 0.58 -4.92 121.20 126.24 2i0n s ILE 35 Ca 0.07 1.35 -0.18 0.00 0.00 0.00 0.00 60.65 61.88 2i0n s ILE 35 Cb -0.17 -4.00 0.03 0.00 0.01 0.00 0.00 42.46 38.34 2i0n s ILE 35 CO -0.21 0.28 1.84 0.41 0.00 0.00 0.00 174.94 177.26 2i0n n THR 36 N 3.69 3.49 -1.54 2.92 -1.04 -0.66 -2.43 114.28 118.70 2i0n n THR 36 Ca -0.03 -3.54 -0.39 0.00 -2.04 0.00 0.00 64.05 58.05 2i0n n THR 36 Cb 0.51 -2.36 -0.05 0.00 -1.82 0.00 0.00 70.33 66.61 2i0n n THR 36 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2i0n n ILE 37 N 6.43 0.01 0.29 12.58 5.41 -1.26 -2.60 119.36 140.22 2i0n n ILE 37 Ca 0.49 -0.58 0.06 0.00 1.00 0.00 0.00 62.75 63.72 2i0n n ILE 37 Cb 0.45 -2.30 -0.08 0.00 -0.71 0.00 0.00 39.64 37.00 2i0n n ILE 37 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 2i0n n THR 38 N 7.81 0.00 -3.50 1.39 5.66 -1.19 -4.46 114.28 119.99 2i0n n THR 38 Ca 0.41 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 61.17 2i0n n THR 38 Cb 0.42 0.63 -0.05 0.00 -1.55 0.00 0.00 70.33 69.77 2i0n n THR 38 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 2i0n s PHE 39 N -2.47 -0.49 0.07 1.09 5.36 -0.82 -5.05 117.98 115.66 2i0n s PHE 39 Ca 0.00 0.91 0.01 0.00 -0.96 0.00 0.00 56.93 56.89 2i0n s PHE 39 Cb 0.08 0.29 0.01 0.00 -0.34 0.00 0.00 43.02 43.07 2i0n s PHE 39 CO 0.50 -0.24 0.08 0.36 -1.46 0.00 0.00 175.22 174.45 2i0n n LYS 40 N 4.19 1.17 -2.70 10.12 0.00 -1.26 0.14 118.16 129.82 2i0n n LYS 40 Ca -0.13 -0.42 -0.02 0.00 -0.00 0.00 0.00 58.31 57.73 2i0n n LYS 40 Cb 0.55 0.01 0.01 0.00 -0.00 0.00 0.00 35.03 35.60 2i0n n LYS 40 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2i0n n ASP 41 N -2.45 -0.95 -3.40 -5.58 2.03 -0.05 -4.71 116.55 101.44 2i0n n ASP 41 Ca 0.01 -1.51 -0.25 0.00 0.52 0.00 0.00 54.79 53.56 2i0n n ASP 41 Cb 0.08 1.54 0.02 0.00 -0.72 0.00 0.00 41.12 42.04 2i0n n ASP 41 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2i0n n GLN 42 N -0.37 -4.51 0.00 -0.67 1.13 -1.26 -2.39 117.38 109.31 2i0n n GLN 42 Ca -0.01 0.64 0.00 0.00 -1.94 0.00 0.00 57.00 55.69 2i0n n GLN 42 Cb 0.31 -5.46 0.00 0.00 0.11 0.00 0.00 30.24 25.20 2i0n n GLN 42 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2i0n n GLU 43 N -4.09 0.00 -1.01 -1.09 1.02 -1.26 -2.92 120.64 111.29 2i0n n GLU 43 Ca -0.03 0.00 -0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2i0n n GLU 43 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.98 2i0n n GLU 43 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2i0n n ASN 44 N 1.81 -0.02 -0.03 1.62 2.85 -1.00 -5.05 115.26 115.43 2i0n n ASN 44 Ca 0.00 -0.52 -0.05 0.00 -0.11 0.00 0.00 54.58 53.90 2i0n n ASN 44 Cb 0.00 0.01 -0.02 0.00 1.24 0.00 0.00 39.78 41.01 2i0n n ASN 44 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2i0n n LYS 45 N -0.01 0.27 -3.45 1.20 4.81 -1.09 -4.72 118.16 115.16 2i0n n LYS 45 Ca -0.00 0.11 -0.37 0.00 -0.87 0.00 0.00 58.31 57.17 2i0n n LYS 45 Cb 0.38 -0.93 -0.06 0.00 0.02 0.00 0.00 35.03 34.43 2i0n n LYS 45 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 2i0n s TRP 46 N -2.27 3.53 -0.20 5.64 0.52 -1.23 -2.35 118.94 122.58 2i0n s TRP 46 Ca -0.15 0.78 -0.03 0.00 0.02 0.00 0.00 56.10 56.72 2i0n s TRP 46 Cb 0.02 -2.41 -0.01 0.00 -1.15 0.00 0.00 33.47 29.92 2i0n s TRP 46 CO 0.22 0.28 -0.07 -0.06 0.02 0.00 0.00 176.95 177.34 2i0n s PHE 47 N 0.26 2.92 -0.66 -1.98 0.40 0.08 -0.87 117.98 118.13 2i0n s PHE 47 Ca 0.21 -0.93 -0.23 0.00 -0.60 0.00 0.00 56.93 55.39 2i0n s PHE 47 Cb -0.14 -2.04 0.07 0.00 0.51 0.00 0.00 43.02 41.42 2i0n s PHE 47 CO 0.08 -0.50 0.97 1.41 0.70 0.00 0.00 175.22 177.88 2i0n s MET 48 N 1.23 3.11 0.42 0.44 1.75 0.36 -2.00 119.30 124.61 2i0n s MET 48 Ca 0.03 -0.83 0.01 0.00 -1.25 0.00 0.00 55.69 53.65 2i0n s MET 48 Cb -0.14 -4.23 0.01 0.00 2.84 0.00 0.00 34.83 33.30 2i0n s MET 48 CO -0.03 -1.82 0.05 0.41 -0.65 0.00 0.00 175.02 172.98 2i0n n GLY 49 N 5.33 3.55 3.29 2.11 0.00 -0.95 -1.95 105.19 116.57 2i0n n GLY 49 Ca -0.04 -2.33 -0.15 0.00 0.00 0.00 0.00 46.02 43.50 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 -3.55 1.25 0.00 1.61 -0.44 -1.07 -2.32 119.66 115.14 2i0n s GLN 50 Ca 0.04 -1.63 0.00 0.00 -2.50 0.00 0.00 55.36 51.27 2i0n s GLN 50 Cb -0.00 -0.38 0.00 0.00 -1.64 0.00 0.00 33.01 30.99 2i0n s GLN 50 CO 0.02 -0.16 0.00 -0.11 0.50 0.00 0.00 175.29 175.55 2i0n n LEU 51 N -0.35 0.00 -4.55 3.68 7.94 0.31 -1.66 117.00 122.37 2i0n n LEU 51 Ca -0.05 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.72 2i0n n LEU 51 Cb 0.64 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.51 2i0n n LEU 51 CO 0.35 0.00 1.29 0.59 -1.11 0.00 0.00 177.39 178.51 2i0n n ASN 52 N 0.00 1.50 -3.27 1.96 5.03 -1.26 -2.61 115.26 116.61 2i0n n ASN 52 Ca 0.00 -1.43 -0.24 0.00 0.87 0.00 0.00 54.58 53.78 2i0n n ASN 52 Cb 0.00 -1.57 0.03 0.00 -1.02 0.00 0.00 39.78 37.22 2i0n n ASN 52 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2i0n n GLY 53 N 6.68 -0.52 2.97 7.41 0.00 -1.26 -4.97 105.19 115.51 2i0n n GLY 53 Ca 0.49 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.52 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 -5.95 0.13 -0.03 1.61 -0.14 -1.07 -5.14 119.74 109.15 2i0n s LYS 54 Ca 0.40 0.38 -0.00 0.00 -1.36 0.00 0.00 55.97 55.39 2i0n s LYS 54 Cb -0.19 -0.12 0.03 0.00 -1.68 0.00 0.00 37.83 35.87 2i0n s LYS 54 CO 0.50 -0.14 0.02 -1.83 -0.76 0.00 0.00 175.35 173.14 2i0n s GLU 55 N 1.02 0.12 0.00 1.68 -1.05 -1.26 0.11 118.70 119.32 2i0n s GLU 55 Ca -0.08 0.18 0.00 0.00 -0.15 0.00 0.00 54.97 54.92 2i0n s GLU 55 Cb -0.10 -0.44 0.00 0.00 -0.44 0.00 0.00 34.13 33.16 2i0n s GLU 55 CO -0.06 -0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.37 2i0n n GLY 56 N 4.45 2.86 3.45 -3.83 0.00 -0.98 -4.39 105.19 106.75 2i0n n GLY 56 Ca -0.21 -0.19 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 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 2.00 2.54 -0.22 1.61 0.01 -1.25 -2.23 113.70 116.16 2i0n s SER 57 Ca 0.00 -1.31 -0.29 0.00 1.31 0.00 0.00 55.95 55.66 2i0n s SER 57 Cb 0.00 -0.12 0.15 0.00 0.21 0.00 0.00 66.02 66.26 2i0n s SER 57 CO 0.00 -0.52 1.12 0.72 0.41 0.00 0.00 173.24 174.98 2i0n s PHE 58 N -3.19 -0.28 0.19 2.43 -0.12 -0.85 -3.33 117.98 112.84 2i0n s PHE 58 Ca 0.34 0.52 -0.30 0.00 -0.05 0.00 0.00 56.93 57.43 2i0n s PHE 58 Cb 0.07 0.45 -0.09 0.00 -0.63 0.00 0.00 43.02 42.82 2i0n s PHE 58 CO 0.14 -0.23 1.40 -1.25 -0.05 0.00 0.00 175.22 175.23 2i0n s PRO 59 N -0.84 4.32 0.00 1.99 0.04 -1.26 -0.74 135.00 138.50 2i0n s PRO 59 Ca 0.02 2.17 0.05 0.00 0.04 0.00 0.00 61.00 63.29 2i0n s PRO 59 Cb -0.01 -3.17 0.24 0.00 0.04 0.00 0.00 34.50 31.59 2i0n s PRO 59 CO -0.03 -0.38 1.11 0.28 0.04 0.00 0.00 177.00 178.01 2i0n n VAL 60 N 2.94 1.37 -0.15 -0.36 0.31 -0.99 -2.78 118.33 118.67 2i0n n VAL 60 Ca 0.08 0.34 -0.11 0.00 -0.01 0.00 0.00 64.34 64.64 2i0n n VAL 60 Cb 0.41 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 2i0n n VAL 60 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 2i0n h ASP 61 N 0.00 1.01 -1.28 4.52 3.58 -1.90 -3.22 116.42 119.14 2i0n h ASP 61 Ca 0.00 -0.39 -0.70 0.00 0.42 0.00 0.00 57.03 56.36 2i0n h ASP 61 Cb 0.07 -0.28 -0.29 0.00 1.72 0.00 0.00 39.33 40.55 2i0n h ASP 61 CO 0.00 1.19 0.84 0.00 -2.88 0.00 0.00 179.24 178.39 2i0n n HIS 62 N -4.10 3.15 -3.65 0.28 1.44 -1.12 -4.90 115.22 106.32 2i0n n HIS 62 Ca -0.00 -2.81 -0.11 0.00 -2.01 0.00 0.00 57.72 52.79 2i0n n HIS 62 Cb 0.47 -1.32 -0.08 0.00 0.12 0.00 0.00 29.99 29.19 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 -4.90 -0.00 0.14 0.61 -7.23 -1.22 -2.51 120.40 105.28 2i0n s VAL 63 Ca 0.61 0.01 -0.07 0.00 -1.81 0.00 0.00 61.98 60.71 2i0n s VAL 63 Cb 0.48 -0.93 -0.06 0.00 0.56 0.00 0.00 36.38 36.44 2i0n s VAL 63 CO -0.13 0.00 0.41 -0.70 -0.31 0.00 0.00 175.10 174.38 2i0n s GLU 64 N 0.92 3.69 -0.31 4.82 2.56 0.64 -4.87 118.70 126.15 2i0n s GLU 64 Ca -0.05 0.05 -0.12 0.00 0.00 0.00 0.00 54.97 54.85 2i0n s GLU 64 Cb -0.05 -2.86 -0.03 0.00 2.00 0.00 0.00 34.13 33.19 2i0n s GLU 64 CO -0.08 0.47 0.22 0.42 -0.56 0.00 0.00 175.26 175.73 2i0n s ILE 65 N -1.61 5.29 -0.20 -3.70 -1.09 -1.26 -0.64 121.20 117.99 2i0n s ILE 65 Ca 0.40 -0.01 -0.13 0.00 -2.23 0.00 0.00 60.65 58.68 2i0n s ILE 65 Cb -0.12 -3.63 -0.05 0.00 -1.58 0.00 0.00 42.46 37.08 2i0n s ILE 65 CO 0.22 0.11 0.26 -0.76 -1.23 0.00 0.00 174.94 173.55 2i0n s LEU 66 N 1.76 4.18 0.00 2.97 1.43 0.43 -4.93 118.68 124.52 2i0n s LEU 66 Ca 0.07 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.54 2i0n s LEU 66 Cb -0.17 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 43.75 2i0n s LEU 66 CO 0.11 0.05 0.00 0.18 0.23 0.00 0.00 176.35 176.92 2i0n n LEU 67 N 4.00 0.02 0.11 1.79 4.32 -1.26 -2.71 117.00 123.27 2i0n n LEU 67 Ca -0.12 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.87 2i0n n LEU 67 Cb 0.52 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 2i0n n LEU 67 CO 0.38 0.00 -0.01 -1.20 -1.22 0.00 0.00 177.39 175.34 2i0n n SER 68 N -0.01 0.27 0.32 -1.43 7.64 -1.26 -4.68 113.62 114.48 2i0n n SER 68 Ca 0.00 0.35 0.15 0.00 1.01 0.00 0.00 58.87 60.39 2i0n n SER 68 Cb 0.00 0.14 0.81 0.00 -1.01 0.00 0.00 64.21 64.14 2i0n n SER 68 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2i0n h ASP 69 N 0.00 0.00 -3.66 6.43 3.32 -2.03 -3.36 116.42 117.12 2i0n h ASP 69 Ca 0.00 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.37 2i0n h ASP 69 Cb 0.02 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 39.35 2i0n h ASP 69 CO 0.00 0.00 -0.54 0.68 -1.72 0.00 0.00 179.24 177.66 2i0n s VAL 70 N -4.12 4.68 0.15 -1.35 -7.23 -1.26 -5.07 120.40 106.19 2i0n s VAL 70 Ca -0.03 -0.44 -0.28 0.00 -1.81 0.00 0.00 61.98 59.41 2i0n s VAL 70 Cb 0.09 -3.41 -0.07 0.00 0.56 0.00 0.00 36.38 33.55 2i0n s VAL 70 CO 0.28 0.03 0.90 -2.16 -0.31 0.00 0.00 175.10 173.84 2i0n s PRO 71 N 1.62 4.69 -0.36 4.82 0.04 -1.26 -4.52 135.00 140.03 2i0n s PRO 71 Ca 0.05 1.36 -0.29 0.00 0.04 0.00 0.00 61.00 62.15 2i0n s PRO 71 Cb -0.17 -3.33 0.01 0.00 0.04 0.00 0.00 34.50 31.05 2i0n s PRO 71 CO 0.07 0.37 1.34 -1.25 0.04 0.00 0.00 177.00 177.57 2i0n s PRO 72 N -0.53 3.74 -0.44 0.56 0.04 -1.26 -4.96 135.00 132.16 2i0n s PRO 72 Ca 0.42 1.06 -0.28 0.00 0.04 0.00 0.00 61.00 62.24 2i0n s PRO 72 Cb -0.24 -3.95 -0.01 0.00 0.04 0.00 0.00 34.50 30.35 2i0n s PRO 72 CO 0.29 -1.34 1.65 -1.25 0.04 0.00 0.00 177.00 176.38 2i0n s PRO 73 N 4.54 3.26 -0.09 0.56 0.04 -1.26 -4.98 135.00 137.08 2i0n s PRO 73 Ca 0.58 1.00 0.03 0.00 0.04 0.00 0.00 61.00 62.65 2i0n s PRO 73 Cb -0.15 -4.17 0.01 0.00 0.04 0.00 0.00 34.50 30.23 2i0n s PRO 73 CO 0.28 -1.95 -0.18 -1.14 0.04 0.00 0.00 177.00 174.05 2i0n s GLN 74 N 5.69 2.34 0.78 4.56 0.74 -1.26 -4.61 119.66 127.90 2i0n s GLN 74 Ca 0.68 -0.63 -0.11 0.00 0.05 0.00 0.00 55.36 55.36 2i0n s GLN 74 Cb -0.16 -1.85 0.06 0.00 1.10 0.00 0.00 33.01 32.15 2i0n s GLN 74 CO 0.30 0.07 1.08 -1.25 -0.55 0.00 0.00 175.29 174.94 2i0n s PRO 75 N 0.58 2.26 -0.21 1.67 0.04 -1.26 -5.07 135.00 133.01 2i0n s PRO 75 Ca -0.15 0.89 -0.04 0.00 0.04 0.00 0.00 61.00 61.74 2i0n s PRO 75 Cb -0.17 -1.92 0.10 0.00 0.04 0.00 0.00 34.50 32.56 2i0n s PRO 75 CO 0.05 -1.56 0.27 0.08 0.04 0.00 0.00 177.00 175.88 2i0n s VAL 76 N -3.03 -0.42 -0.42 -0.36 1.01 -1.26 -5.08 120.40 110.85 2i0n s VAL 76 Ca 0.60 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.55 2i0n s VAL 76 Cb -0.15 -0.70 0.19 0.00 0.00 0.00 0.00 36.38 35.72 2i0n s VAL 76 CO 0.55 -0.15 0.77 -1.38 0.00 0.00 0.00 175.10 174.89 2i0n s HIS 77 N 2.40 -1.35 -0.08 5.22 -3.43 -1.26 -5.13 115.29 111.67 2i0n s HIS 77 Ca 0.08 -0.04 -0.30 0.00 -0.80 0.00 0.00 55.06 54.01 2i0n s HIS 77 Cb -0.15 0.26 -0.04 0.00 -1.43 0.00 0.00 32.58 31.22 2i0n s HIS 77 CO -0.13 -0.97 1.36 -1.25 -2.00 0.00 0.00 174.74 171.75 2i0n s PRO 78 N 1.52 4.26 0.15 -0.38 0.04 -1.26 -5.01 135.00 134.31 2i0n s PRO 78 Ca 0.20 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.10 2i0n s PRO 78 Cb -0.00 -3.71 -0.04 0.00 0.04 0.00 0.00 34.50 30.79 2i0n s PRO 78 CO -0.08 -0.65 0.03 0.54 0.04 0.00 0.00 177.00 176.88 2i0n s VAL 79 N 3.03 0.38 0.00 -0.36 0.11 -1.26 -5.37 120.40 116.93 2i0n s VAL 79 Ca 0.61 -1.94 0.00 0.00 -2.93 0.00 0.00 61.98 57.72 2i0n s VAL 79 Cb -0.27 -2.06 0.00 0.00 -1.53 0.00 0.00 36.38 32.52 2i0n s VAL 79 CO 0.22 -0.49 0.00 0.00 -3.33 0.00 0.00 175.10 171.50