#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 1.23 2.67 3.03 0.00 -1.26 -5.08 105.19 105.78 2i0n n GLY 2 Ca 0.00 -1.72 -0.22 0.00 0.00 0.00 0.00 46.02 44.08 2i0n n GLY 2 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2i0n n PRO 3 N 0.00 -2.12 -3.01 1.61 -0.04 -1.26 -4.96 135.00 125.21 2i0n n PRO 3 Ca 0.00 -1.36 -0.43 0.00 -0.04 0.00 0.00 63.50 61.66 2i0n n PRO 3 Cb 0.00 -1.16 -0.05 0.00 -0.04 0.00 0.00 33.50 32.25 2i0n n PRO 3 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2i0n s LEU 4 N 0.00 4.67 -0.02 1.53 2.01 -1.26 -4.79 118.68 120.83 2i0n s LEU 4 Ca 0.54 -0.82 0.00 0.00 0.01 0.00 0.00 54.13 53.86 2i0n s LEU 4 Cb -0.04 -2.54 -0.01 0.00 0.01 0.00 0.00 46.19 43.61 2i0n s LEU 4 CO 0.40 -1.10 -0.01 0.61 1.01 0.00 0.00 176.35 177.26 2i0n n GLY 5 N 5.19 -0.03 1.45 -3.19 0.00 -1.26 -5.14 105.19 102.22 2i0n n GLY 5 Ca -0.04 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 45.99 2i0n n GLY 5 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2i0n n SER 6 N -2.47 -7.83 -4.79 1.61 2.88 -1.26 -4.87 113.62 96.89 2i0n n SER 6 Ca -0.03 1.70 -0.33 0.00 -1.33 0.00 0.00 58.87 58.88 2i0n n SER 6 Cb 0.53 -4.68 0.02 0.00 -0.75 0.00 0.00 64.21 59.33 2i0n n SER 6 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2i0n s PRO 7 N -5.17 3.20 0.00 -1.46 0.04 -1.26 -4.98 135.00 125.38 2i0n s PRO 7 Ca 0.00 1.28 0.06 0.00 0.04 0.00 0.00 61.00 62.38 2i0n s PRO 7 Cb 0.00 -2.01 0.10 0.00 0.04 0.00 0.00 34.50 32.63 2i0n s PRO 7 CO 0.00 -0.91 1.02 -0.85 0.04 0.00 0.00 177.00 176.29 2i0n n GLU 8 N -2.06 0.00 -1.99 4.56 -0.00 -1.26 -5.13 120.64 114.76 2i0n n GLU 8 Ca 0.09 -1.19 -0.36 0.00 -0.00 0.00 0.00 57.16 55.70 2i0n n GLU 8 Cb 0.52 0.34 0.04 0.00 -0.00 0.00 0.00 31.44 32.34 2i0n n GLU 8 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 2i0n s PHE 9 N 0.00 2.37 -0.40 -1.84 0.08 -1.26 -5.00 117.98 111.92 2i0n s PHE 9 Ca 0.08 1.51 0.01 0.00 0.12 0.00 0.00 56.93 58.65 2i0n s PHE 9 Cb 0.09 -3.51 0.19 0.00 -0.57 0.00 0.00 43.02 39.22 2i0n s PHE 9 CO -0.04 -2.28 0.83 0.00 -0.10 0.00 0.00 175.22 173.63 2i0n s ALA 10 N -1.56 -3.18 0.18 5.36 0.00 -1.26 -4.95 121.76 116.35 2i0n s ALA 10 Ca 0.77 0.41 -0.10 0.00 0.00 0.00 0.00 51.96 53.04 2i0n s ALA 10 Cb -0.31 -2.84 0.08 0.00 0.00 0.00 0.00 23.12 20.04 2i0n s ALA 10 CO 0.34 -2.34 1.68 0.87 0.00 0.00 0.00 175.76 176.30 2i0n h LYS 11 N 5.71 1.05 0.00 0.00 1.79 -1.90 -3.47 116.57 119.75 2i0n h LYS 11 Ca 0.02 -0.28 -0.26 0.00 -2.18 0.00 0.00 60.65 57.95 2i0n h LYS 11 Cb 1.18 -0.12 -0.06 0.00 -1.58 0.00 0.00 32.23 31.64 2i0n h LYS 11 CO 0.00 0.97 -0.17 0.66 -1.08 0.00 0.00 179.45 179.84 2i0n n TYR 12 N -4.26 -1.16 -3.90 -1.35 4.01 -1.08 -4.28 117.16 105.13 2i0n n TYR 12 Ca 0.04 -2.00 -0.09 0.00 -0.16 0.00 0.00 57.90 55.69 2i0n n TYR 12 Cb 0.28 0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 39.68 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 -2.66 -0.62 -0.04 -0.72 0.00 -1.05 0.36 121.76 117.02 2i0n s ALA 13 Ca 0.25 -0.59 -0.01 0.00 0.00 0.00 0.00 51.96 51.61 2i0n s ALA 13 Cb -0.00 0.95 0.03 0.00 0.00 0.00 0.00 23.12 24.10 2i0n s ALA 13 CO 0.18 -0.87 0.04 0.50 0.00 0.00 0.00 175.76 175.61 2i0n s ARG 14 N -3.96 0.05 -0.02 0.00 3.00 -0.77 0.74 118.95 118.00 2i0n s ARG 14 Ca 0.16 0.29 -0.35 0.00 -1.00 0.00 0.00 55.73 54.83 2i0n s ARG 14 Cb -0.02 -0.54 -0.14 0.00 0.00 0.00 0.00 34.95 34.26 2i0n s ARG 14 CO 0.05 -0.29 1.70 0.00 0.00 0.00 0.00 175.30 176.77 2i0n n ALA 15 N 5.04 0.63 0.49 6.12 0.00 0.53 -0.85 120.51 132.47 2i0n n ALA 15 Ca -0.09 0.38 0.12 0.00 0.00 0.00 0.00 53.44 53.85 2i0n n ALA 15 Cb 0.50 -2.36 0.25 0.00 0.00 0.00 0.00 19.45 17.84 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 7.36 0.00 -7.00 0.00 3.38 -1.41 -1.83 115.31 115.81 2i0n h LEU 16 Ca -0.47 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 57.47 2i0n h LEU 16 Cb 1.28 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.86 2i0n h LEU 16 CO 0.91 0.03 0.39 -1.59 0.09 0.00 0.00 178.44 178.27 2i0n s LYS 17 N -3.17 0.90 0.36 1.13 -2.85 -1.26 -4.36 119.74 110.50 2i0n s LYS 17 Ca 0.08 -0.08 -0.26 0.00 -1.00 0.00 0.00 55.97 54.71 2i0n s LYS 17 Cb 0.11 0.42 -0.12 0.00 -2.06 0.00 0.00 37.83 36.18 2i0n s LYS 17 CO 0.67 -0.34 0.96 -0.40 0.10 0.00 0.00 175.35 176.33 2i0n n ASP 18 N 0.26 1.03 -4.06 0.03 5.75 -1.26 -4.13 116.55 114.18 2i0n n ASP 18 Ca -0.13 1.08 -0.18 0.00 -0.01 0.00 0.00 54.79 55.55 2i0n n ASP 18 Cb 0.60 -1.30 -0.14 0.00 -1.03 0.00 0.00 41.12 39.26 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 -1.21 0.88 -0.19 2.11 5.04 0.80 -4.84 117.35 119.95 2i0n s TYR 19 Ca 0.61 -0.26 -0.01 0.00 -2.44 0.00 0.00 57.07 54.97 2i0n s TYR 19 Cb -0.62 -0.55 0.00 0.00 0.35 0.00 0.00 41.96 41.14 2i0n s TYR 19 CO 0.58 -0.01 -0.12 1.21 -1.34 0.00 0.00 175.55 175.88 2i0n s ASN 20 N -0.68 3.82 -0.85 4.32 2.47 -1.26 -2.71 114.94 120.04 2i0n s ASN 20 Ca 0.01 -0.47 -0.25 0.00 0.42 0.00 0.00 52.86 52.56 2i0n s ASN 20 Cb -0.06 -1.62 0.02 0.00 -1.45 0.00 0.00 41.25 38.15 2i0n s ASN 20 CO 0.00 0.02 1.47 0.68 -3.72 0.00 0.00 177.10 175.56 2i0n s VAL 21 N 1.20 3.73 -0.97 -5.21 -7.23 -1.26 -4.91 120.40 105.75 2i0n s VAL 21 Ca 0.02 -0.14 -0.04 0.00 -1.81 0.00 0.00 61.98 60.00 2i0n s VAL 21 Cb -0.14 -4.78 0.24 0.00 0.56 0.00 0.00 36.38 32.26 2i0n s VAL 21 CO -0.05 -1.70 0.90 -0.55 -0.31 0.00 0.00 175.10 173.39 2i0n s SER 22 N 5.11 6.48 0.03 4.85 0.15 -1.26 -4.69 113.70 124.36 2i0n s SER 22 Ca 0.46 -3.68 0.00 0.00 0.70 0.00 0.00 55.95 53.43 2i0n s SER 22 Cb -0.05 -2.02 0.00 0.00 -1.71 0.00 0.00 66.02 62.24 2i0n s SER 22 CO 0.04 -0.22 0.00 -0.67 1.20 0.00 0.00 173.24 173.59 2i0n n ASP 23 N 2.46 -0.23 0.12 5.45 2.03 -1.26 -5.09 116.55 120.03 2i0n n ASP 23 Ca 0.22 0.05 0.00 0.00 0.52 0.00 0.00 54.79 55.59 2i0n n ASP 23 Cb 0.38 0.62 0.00 0.00 -0.72 0.00 0.00 41.12 41.40 2i0n n ASP 23 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2i0n n THR 24 N -2.42 0.00 -2.56 5.18 -1.04 -1.26 -5.01 114.28 107.17 2i0n n THR 24 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 2i0n n THR 24 Cb 0.00 -0.10 0.05 0.00 -1.82 0.00 0.00 70.33 68.47 2i0n n THR 24 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2i0n n SER 25 N -3.06 -0.24 -3.55 8.00 2.88 -1.26 -5.13 113.62 111.27 2i0n n SER 25 Ca 0.00 -2.09 0.00 0.00 -1.33 0.00 0.00 58.87 55.45 2i0n n SER 25 Cb 0.00 0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 2i0n n SER 25 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2i0n n LEU 26 N -0.71 0.00 -4.11 2.46 4.77 -1.26 -4.44 117.00 113.71 2i0n n LEU 26 Ca -0.10 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.54 2i0n n LEU 26 Cb 0.86 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.81 2i0n n LEU 26 CO -0.08 -0.89 -0.40 -0.22 -1.33 0.00 0.00 177.39 174.47 2i0n s LEU 27 N 0.00 3.78 0.39 2.23 2.96 0.32 -4.15 118.68 124.21 2i0n s LEU 27 Ca 0.00 -1.41 -0.11 0.00 -0.22 0.00 0.00 54.13 52.39 2i0n s LEU 27 Cb 0.00 -1.63 -0.07 0.00 0.50 0.00 0.00 46.19 44.99 2i0n s LEU 27 CO 0.00 -0.24 0.77 -2.16 -1.32 0.00 0.00 176.35 173.40 2i0n s PRO 28 N 1.15 3.82 0.07 0.98 0.04 -1.26 -4.64 135.00 135.16 2i0n s PRO 28 Ca -0.06 0.52 -0.27 0.00 0.04 0.00 0.00 61.00 61.23 2i0n s PRO 28 Cb -0.20 -2.39 0.09 0.00 0.04 0.00 0.00 34.50 32.04 2i0n s PRO 28 CO -0.03 -0.01 1.08 -0.59 0.04 0.00 0.00 177.00 177.49 2i0n s PHE 29 N -2.31 -0.11 0.38 0.56 -0.12 -1.10 -4.86 117.98 110.42 2i0n s PHE 29 Ca 0.52 -0.11 0.07 0.00 -0.05 0.00 0.00 56.93 57.37 2i0n s PHE 29 Cb -0.10 0.60 -0.01 0.00 -0.63 0.00 0.00 43.02 42.87 2i0n s PHE 29 CO 0.29 -0.59 0.43 0.21 -0.05 0.00 0.00 175.22 175.51 2i0n s LYS 30 N -2.94 2.79 1.12 1.99 2.20 -1.26 -0.14 119.74 123.50 2i0n s LYS 30 Ca 0.12 -1.28 -0.17 0.00 -0.36 0.00 0.00 55.97 54.28 2i0n s LYS 30 Cb 0.01 -2.61 0.18 0.00 -1.51 0.00 0.00 37.83 33.90 2i0n s LYS 30 CO -0.01 -0.09 0.29 -2.13 -0.36 0.00 0.00 175.35 173.05 2i0n n ARG 31 N -1.62 -2.40 -3.87 4.03 0.63 -1.26 -3.56 116.66 108.63 2i0n n ARG 31 Ca 0.03 -0.70 -0.27 0.00 -0.92 0.00 0.00 57.85 55.99 2i0n n ARG 31 Cb 0.60 -1.64 -0.01 0.00 0.45 0.00 0.00 32.46 31.86 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 -2.16 -1.63 -4.29 6.15 0.23 -0.70 -4.83 115.26 108.02 2i0n n ASN 32 Ca 0.05 -0.82 -0.22 0.00 -0.53 0.00 0.00 54.58 53.06 2i0n n ASN 32 Cb 0.50 -0.99 -0.12 0.00 -2.08 0.00 0.00 39.78 37.09 2i0n n ASN 32 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2i0n s ASP 33 N -4.02 2.45 0.39 0.53 2.15 -1.12 -4.93 116.67 112.12 2i0n s ASP 33 Ca 0.22 -0.77 -0.06 0.00 0.43 0.00 0.00 52.55 52.37 2i0n s ASP 33 Cb -0.12 -0.13 -0.05 0.00 -0.30 0.00 0.00 42.92 42.32 2i0n s ASP 33 CO 0.62 -0.02 0.69 -0.63 -0.17 0.00 0.00 175.17 175.65 2i0n s ILE 34 N -1.69 4.92 -0.24 4.11 -1.09 -1.26 0.20 121.20 126.15 2i0n s ILE 34 Ca 0.10 0.22 -0.03 0.00 -2.23 0.00 0.00 60.65 58.71 2i0n s ILE 34 Cb -0.07 -3.78 0.08 0.00 -1.58 0.00 0.00 42.46 37.10 2i0n s ILE 34 CO 0.05 -0.56 0.08 -0.63 -1.23 0.00 0.00 174.94 172.64 2i0n s ILE 35 N -2.39 0.45 -1.06 2.92 1.01 0.23 -4.68 121.20 117.69 2i0n s ILE 35 Ca 0.47 -0.80 -0.25 0.00 0.00 0.00 0.00 60.65 60.07 2i0n s ILE 35 Cb -0.10 -1.16 -0.16 0.00 0.01 0.00 0.00 42.46 41.04 2i0n s ILE 35 CO 0.35 -0.45 2.10 -0.89 0.00 0.00 0.00 174.94 176.05 2i0n s THR 36 N 1.86 3.20 -0.36 2.92 2.01 0.29 -2.53 115.64 123.02 2i0n s THR 36 Ca 0.04 -0.30 -0.30 0.00 0.31 0.00 0.00 61.69 61.44 2i0n s THR 36 Cb -0.17 -4.02 -0.09 0.00 0.01 0.00 0.00 72.50 68.24 2i0n s THR 36 CO -0.19 -0.37 2.28 -0.38 -0.69 0.00 0.00 174.62 175.28 2i0n n ILE 37 N 8.60 0.18 -0.01 1.82 5.41 -1.26 -2.49 119.36 131.61 2i0n n ILE 37 Ca 0.43 -0.44 0.07 0.00 1.00 0.00 0.00 62.75 63.82 2i0n n ILE 37 Cb 0.46 -2.19 -0.13 0.00 -0.71 0.00 0.00 39.64 37.08 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 7.61 0.06 -3.45 1.39 5.66 -1.21 -4.82 114.28 119.51 2i0n n THR 38 Ca 0.37 -0.39 -0.09 0.00 -3.05 0.00 0.00 64.05 60.89 2i0n n THR 38 Cb 0.37 0.08 -0.09 0.00 -1.55 0.00 0.00 70.33 69.15 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 -3.10 -0.78 0.78 1.09 5.36 -0.75 -5.04 117.98 115.54 2i0n s PHE 39 Ca -0.06 1.00 -0.05 0.00 -0.96 0.00 0.00 56.93 56.85 2i0n s PHE 39 Cb 0.10 0.08 0.17 0.00 -0.34 0.00 0.00 43.02 43.02 2i0n s PHE 39 CO 0.68 -0.64 1.07 1.63 -1.46 0.00 0.00 175.22 176.50 2i0n n LYS 40 N 5.37 -0.47 -3.11 10.12 5.02 -1.26 -2.52 118.16 131.31 2i0n n LYS 40 Ca -0.05 -2.43 -0.13 0.00 -2.02 0.00 0.00 58.31 53.68 2i0n n LYS 40 Cb 0.50 -0.86 -0.03 0.00 -0.02 0.00 0.00 35.03 34.62 2i0n n LYS 40 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2i0n n ASP 41 N -3.20 1.89 -0.23 4.39 2.03 -1.26 -4.87 116.55 115.28 2i0n n ASP 41 Ca 0.16 -1.96 0.10 0.00 0.52 0.00 0.00 54.79 53.61 2i0n n ASP 41 Cb 0.57 0.29 0.16 0.00 -0.72 0.00 0.00 41.12 41.43 2i0n n ASP 41 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2i0n n GLN 42 N -0.48 1.61 0.00 -0.67 7.27 -1.26 -4.58 117.38 119.27 2i0n n GLN 42 Ca -0.06 -2.63 0.00 0.00 0.07 0.00 0.00 57.00 54.38 2i0n n GLN 42 Cb 0.27 -1.57 0.00 0.00 2.41 0.00 0.00 30.24 31.35 2i0n n GLN 42 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2i0n n GLU 43 N -1.25 0.51 -2.52 3.69 1.02 -1.26 -5.00 120.64 115.83 2i0n n GLU 43 Ca 0.17 -0.29 -0.14 0.00 -0.02 0.00 0.00 57.16 56.87 2i0n n GLU 43 Cb 0.69 -0.77 -0.00 0.00 -0.02 0.00 0.00 31.44 31.34 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 -0.16 -4.18 0.00 1.62 2.85 -1.26 -4.75 115.26 109.37 2i0n n ASN 44 Ca 0.00 0.12 0.00 0.00 -0.11 0.00 0.00 54.58 54.59 2i0n n ASN 44 Cb 0.05 -3.53 0.00 0.00 1.24 0.00 0.00 39.78 37.54 2i0n n ASN 44 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2i0n n LYS 45 N -2.93 0.56 -4.27 1.20 4.76 -1.26 -4.68 118.16 111.53 2i0n n LYS 45 Ca -0.15 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.06 2i0n n LYS 45 Cb 0.61 -0.89 -0.12 0.00 -1.84 0.00 0.00 35.03 32.79 2i0n n LYS 45 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2i0n s TRP 46 N -1.78 1.71 0.24 2.13 0.52 -1.26 -1.84 118.94 118.66 2i0n s TRP 46 Ca 0.00 -0.43 0.01 0.00 0.02 0.00 0.00 56.10 55.70 2i0n s TRP 46 Cb 0.00 -0.93 -0.05 0.00 -1.15 0.00 0.00 33.47 31.34 2i0n s TRP 46 CO 0.00 0.19 0.09 -0.06 0.02 0.00 0.00 176.95 177.19 2i0n s PHE 47 N -1.25 1.46 -0.21 -1.98 0.08 -0.94 -4.29 117.98 110.86 2i0n s PHE 47 Ca 0.06 -1.19 -0.04 0.00 0.12 0.00 0.00 56.93 55.88 2i0n s PHE 47 Cb -0.10 -0.84 0.08 0.00 -0.57 0.00 0.00 43.02 41.60 2i0n s PHE 47 CO 0.04 -0.36 0.16 1.41 -0.10 0.00 0.00 175.22 176.37 2i0n s MET 48 N -4.04 0.15 0.00 0.44 -2.45 -1.05 -2.61 119.30 109.74 2i0n s MET 48 Ca 0.36 -0.05 0.00 0.00 -1.25 0.00 0.00 55.69 54.75 2i0n s MET 48 Cb 0.08 -1.42 0.00 0.00 1.25 0.00 0.00 34.83 34.74 2i0n s MET 48 CO 0.12 -0.75 0.00 0.41 1.05 0.00 0.00 175.02 175.86 2i0n n GLY 49 N 5.29 4.85 3.71 2.11 0.00 -0.99 -1.82 105.19 118.34 2i0n n GLY 49 Ca -0.06 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.76 2i0n n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2i0n s GLN 50 N 1.55 1.73 0.00 1.61 -0.21 -1.04 -2.62 119.66 120.68 2i0n s GLN 50 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 55.36 54.17 2i0n s GLN 50 Cb 0.00 0.54 0.00 0.00 1.00 0.00 0.00 33.01 34.55 2i0n s GLN 50 CO 0.00 -0.76 0.00 1.47 -2.12 0.00 0.00 175.29 173.88 2i0n n LEU 51 N -0.44 0.00 -4.50 2.90 -0.00 -0.84 0.10 117.00 114.22 2i0n n LEU 51 Ca -0.03 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.69 2i0n n LEU 51 Cb 0.61 0.00 -0.19 0.00 -0.00 0.00 0.00 43.42 43.84 2i0n n LEU 51 CO 0.20 0.00 2.10 -3.20 -0.00 0.00 0.00 177.39 176.49 2i0n n ASN 52 N 0.00 -0.57 -1.87 1.45 5.15 -1.26 -1.81 115.26 116.35 2i0n n ASN 52 Ca 0.00 -0.33 -0.06 0.00 -0.60 0.00 0.00 54.58 53.60 2i0n n ASN 52 Cb 0.00 -0.76 -0.01 0.00 -0.53 0.00 0.00 39.78 38.48 2i0n n ASN 52 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2i0n n GLY 53 N 5.94 -0.01 3.37 8.20 0.00 -1.26 -4.90 105.19 116.53 2i0n n GLY 53 Ca 0.65 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.48 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 -3.85 1.41 -0.19 1.61 3.01 -0.75 -5.14 119.74 115.84 2i0n s LYS 54 Ca 0.00 -1.68 -0.28 0.00 -1.01 0.00 0.00 55.97 53.00 2i0n s LYS 54 Cb 0.00 -1.02 0.11 0.00 -1.01 0.00 0.00 37.83 35.91 2i0n s LYS 54 CO 0.00 0.07 0.92 -2.00 0.51 0.00 0.00 175.35 174.85 2i0n s GLU 55 N -3.72 0.67 0.00 1.68 2.12 -1.26 -1.98 118.70 116.21 2i0n s GLU 55 Ca 0.26 0.39 0.00 0.00 0.36 0.00 0.00 54.97 55.98 2i0n s GLU 55 Cb 0.03 0.32 0.00 0.00 0.26 0.00 0.00 34.13 34.74 2i0n s GLU 55 CO 0.09 -0.16 0.00 0.41 -0.54 0.00 0.00 175.26 175.06 2i0n n GLY 56 N 1.41 0.11 3.68 -1.50 0.00 -1.08 -3.97 105.19 103.83 2i0n n GLY 56 Ca -0.13 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 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 -4.00 3.64 -0.30 1.61 0.01 -1.26 -2.35 113.70 111.06 2i0n s SER 57 Ca 0.00 -1.72 -0.18 0.00 1.31 0.00 0.00 55.95 55.36 2i0n s SER 57 Cb 0.00 0.64 0.20 0.00 0.21 0.00 0.00 66.02 67.07 2i0n s SER 57 CO 0.00 -0.95 1.28 0.72 0.41 0.00 0.00 173.24 174.71 2i0n s PHE 58 N -3.02 -0.10 0.60 2.43 -0.12 -1.07 -0.52 117.98 116.17 2i0n s PHE 58 Ca 0.10 0.21 -0.18 0.00 -0.05 0.00 0.00 56.93 57.01 2i0n s PHE 58 Cb 0.01 0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.54 2i0n s PHE 58 CO 0.07 -0.05 1.18 -1.25 -0.05 0.00 0.00 175.22 175.12 2i0n s PRO 59 N 0.80 2.99 0.00 1.99 0.04 -1.26 -2.21 135.00 137.35 2i0n s PRO 59 Ca -0.04 1.74 0.11 0.00 0.04 0.00 0.00 61.00 62.84 2i0n s PRO 59 Cb -0.03 -1.94 0.49 0.00 0.04 0.00 0.00 34.50 33.06 2i0n s PRO 59 CO -0.11 -1.17 1.30 0.28 0.04 0.00 0.00 177.00 177.33 2i0n n VAL 60 N -1.67 1.06 0.21 -0.36 0.31 -0.77 -2.81 118.33 114.30 2i0n n VAL 60 Ca 0.13 0.26 0.08 0.00 -0.01 0.00 0.00 64.34 64.80 2i0n n VAL 60 Cb 0.50 -1.09 0.39 0.00 -0.91 0.00 0.00 33.84 32.74 2i0n n VAL 60 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2i0n n ASP 61 N -1.41 0.39 -2.78 4.52 -0.08 -1.26 -3.58 116.55 112.34 2i0n n ASP 61 Ca 0.04 0.65 -0.10 0.00 -1.51 0.00 0.00 54.79 53.86 2i0n n ASP 61 Cb 0.11 -0.71 0.06 0.00 2.34 0.00 0.00 41.12 42.91 2i0n n ASP 61 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2i0n n HIS 62 N -1.99 -0.87 -3.66 -0.67 1.44 -1.13 -4.98 115.22 103.37 2i0n n HIS 62 Ca 0.00 -2.59 -0.08 0.00 -2.01 0.00 0.00 57.72 53.04 2i0n n HIS 62 Cb 0.08 0.59 -0.08 0.00 0.12 0.00 0.00 29.99 30.70 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 -1.36 -0.09 0.63 0.61 -7.23 -1.23 -1.09 120.40 110.65 2i0n s VAL 63 Ca 0.27 0.04 0.02 0.00 -1.81 0.00 0.00 61.98 60.50 2i0n s VAL 63 Cb 0.39 -0.84 0.09 0.00 0.56 0.00 0.00 36.38 36.58 2i0n s VAL 63 CO -0.04 0.02 0.87 -0.70 -0.31 0.00 0.00 175.10 174.94 2i0n s GLU 64 N 1.65 2.09 -0.19 4.82 -6.30 -0.03 -4.82 118.70 115.93 2i0n s GLU 64 Ca -0.09 -1.13 0.01 0.00 -2.50 0.00 0.00 54.97 51.26 2i0n s GLU 64 Cb -0.07 -2.46 0.03 0.00 0.00 0.00 0.00 34.13 31.64 2i0n s GLU 64 CO -0.17 -1.07 -0.14 0.42 0.02 0.00 0.00 175.26 174.31 2i0n s ILE 65 N -2.91 1.84 -0.80 -3.70 -1.09 -1.26 -1.84 121.20 111.44 2i0n s ILE 65 Ca 0.62 -1.01 -0.21 0.00 -2.23 0.00 0.00 60.65 57.82 2i0n s ILE 65 Cb -0.07 -1.80 0.09 0.00 -1.58 0.00 0.00 42.46 39.10 2i0n s ILE 65 CO 0.41 0.31 1.09 -0.76 -1.23 0.00 0.00 174.94 174.77 2i0n s LEU 66 N 1.34 4.47 0.00 2.97 1.43 0.16 -4.83 118.68 124.21 2i0n s LEU 66 Ca 0.01 -1.39 0.30 0.00 -1.03 0.00 0.00 54.13 52.01 2i0n s LEU 66 Cb -0.15 -2.43 1.51 0.00 0.03 0.00 0.00 46.19 45.14 2i0n s LEU 66 CO -0.10 -1.33 2.00 0.18 0.23 0.00 0.00 176.35 177.33 2i0n n LEU 67 N 7.51 0.64 0.03 1.79 4.77 -1.26 -2.62 117.00 127.86 2i0n n LEU 67 Ca 0.10 -0.22 0.08 0.00 -0.03 0.00 0.00 56.01 55.94 2i0n n LEU 67 Cb 0.47 -0.00 0.34 0.00 -2.33 0.00 0.00 43.42 41.90 2i0n n LEU 67 CO 0.60 0.11 0.75 -1.54 -1.33 0.00 0.00 177.39 175.98 2i0n n SER 68 N -0.49 0.16 -2.04 -1.43 3.41 -1.26 -4.84 113.62 107.13 2i0n n SER 68 Ca 0.21 0.54 -0.19 0.00 -0.26 0.00 0.00 58.87 59.17 2i0n n SER 68 Cb 0.21 -0.57 -0.04 0.00 -0.26 0.00 0.00 64.21 63.55 2i0n n SER 68 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2i0n n ASP 69 N -1.68 -5.37 -4.26 4.04 -0.08 -1.24 -4.96 116.55 102.99 2i0n n ASP 69 Ca 0.03 0.22 -0.31 0.00 -1.51 0.00 0.00 54.79 53.22 2i0n n ASP 69 Cb 0.17 -4.61 -0.16 0.00 2.34 0.00 0.00 41.12 38.86 2i0n n ASP 69 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2i0n s VAL 70 N -2.83 2.03 -0.33 5.18 1.01 -1.26 -5.08 120.40 119.12 2i0n s VAL 70 Ca 0.00 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 2i0n s VAL 70 Cb 0.00 -1.72 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 2i0n s VAL 70 CO 0.00 0.56 1.44 -2.16 0.00 0.00 0.00 175.10 174.94 2i0n s PRO 71 N -0.15 3.71 0.64 2.72 0.04 -1.26 -5.00 135.00 135.70 2i0n s PRO 71 Ca -0.04 1.21 -0.13 0.00 0.04 0.00 0.00 61.00 62.08 2i0n s PRO 71 Cb -0.14 -3.99 -0.02 0.00 0.04 0.00 0.00 34.50 30.40 2i0n s PRO 71 CO 0.04 -1.39 1.05 -1.25 0.04 0.00 0.00 177.00 175.49 2i0n s PRO 72 N 4.68 3.17 -0.50 0.56 0.04 -1.26 -4.95 135.00 136.74 2i0n s PRO 72 Ca 0.63 1.06 -0.28 0.00 0.04 0.00 0.00 61.00 62.45 2i0n s PRO 72 Cb -0.17 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2i0n s PRO 72 CO 0.29 -0.92 1.56 -1.25 0.04 0.00 0.00 177.00 176.72 2i0n s PRO 73 N -4.56 3.23 0.25 0.56 0.04 -1.26 -4.99 135.00 128.27 2i0n s PRO 73 Ca 0.60 0.74 -0.24 0.00 0.04 0.00 0.00 61.00 62.14 2i0n s PRO 73 Cb -0.15 -4.17 -0.09 0.00 0.04 0.00 0.00 34.50 30.14 2i0n s PRO 73 CO 0.46 -2.00 0.83 -0.65 0.04 0.00 0.00 177.00 175.67 2i0n s GLN 74 N 5.71 4.49 0.34 4.56 -0.21 -1.26 -5.03 119.66 128.26 2i0n s GLN 74 Ca 0.61 1.14 -0.27 0.00 0.02 0.00 0.00 55.36 56.87 2i0n s GLN 74 Cb -0.14 -2.97 -0.09 0.00 1.00 0.00 0.00 33.01 30.81 2i0n s GLN 74 CO 0.27 0.41 1.09 -1.25 -2.12 0.00 0.00 175.29 173.69 2i0n s PRO 75 N -1.75 4.37 -0.23 2.91 0.04 -1.26 -5.04 135.00 134.03 2i0n s PRO 75 Ca 0.44 1.70 -0.03 0.00 0.04 0.00 0.00 61.00 63.15 2i0n s PRO 75 Cb -0.20 -2.87 0.12 0.00 0.04 0.00 0.00 34.50 31.59 2i0n s PRO 75 CO 0.24 -0.00 0.30 0.14 0.04 0.00 0.00 177.00 177.71 2i0n s VAL 76 N -1.39 -0.45 -0.37 -0.36 -7.23 -1.26 -5.08 120.40 104.26 2i0n s VAL 76 Ca 0.51 -0.15 -0.02 0.00 -1.81 0.00 0.00 61.98 60.51 2i0n s VAL 76 Cb -0.28 -0.78 0.19 0.00 0.56 0.00 0.00 36.38 36.07 2i0n s VAL 76 CO 0.36 -0.21 0.89 -2.28 -0.31 0.00 0.00 175.10 173.55 2i0n s HIS 77 N 2.42 -0.90 0.32 2.82 5.04 -1.26 -5.15 115.29 118.58 2i0n s HIS 77 Ca 0.10 0.05 -0.28 0.00 -1.54 0.00 0.00 55.06 53.38 2i0n s HIS 77 Cb -0.15 0.17 -0.09 0.00 0.04 0.00 0.00 32.58 32.54 2i0n s HIS 77 CO -0.17 -0.63 1.13 -1.25 -2.34 0.00 0.00 174.74 171.49 2i0n s PRO 78 N 1.71 4.46 0.06 2.88 0.04 -1.26 -5.01 135.00 137.88 2i0n s PRO 78 Ca 0.17 1.83 -0.23 0.00 0.04 0.00 0.00 61.00 62.82 2i0n s PRO 78 Cb 0.02 -3.02 -0.06 0.00 0.04 0.00 0.00 34.50 31.47 2i0n s PRO 78 CO -0.11 0.04 0.70 0.08 0.04 0.00 0.00 177.00 177.75 2i0n s VAL 79 N -1.25 4.72 -2.09 -0.36 1.01 -1.26 -5.37 120.40 115.80 2i0n s VAL 79 Ca 0.48 1.50 0.31 0.00 0.00 0.00 0.00 61.98 64.27 2i0n s VAL 79 Cb -0.32 -4.05 0.84 0.00 0.00 0.00 0.00 36.38 32.86 2i0n s VAL 79 CO 0.41 0.42 2.14 0.00 0.00 0.00 0.00 175.10 178.07