#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 3.18 2.97 -5.12 0.00 -1.26 -5.04 105.19 99.92 2i0n n GLY 2 Ca 0.00 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.27 1.90 -0.01 1.61 -0.04 -1.26 -4.37 135.00 132.56 2i0n n PRO 3 Ca 0.02 -2.01 -0.05 0.00 -0.04 0.00 0.00 63.50 61.42 2i0n n PRO 3 Cb 0.26 -2.98 -0.02 0.00 -0.04 0.00 0.00 33.50 30.72 2i0n n PRO 3 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2i0n n LEU 4 N 6.89 1.31 0.00 1.53 0.00 -1.26 -5.08 117.00 120.39 2i0n n LEU 4 Ca 0.50 0.20 0.00 0.00 0.00 0.00 0.00 56.01 56.71 2i0n n LEU 4 Cb 0.38 -0.46 0.00 0.00 0.00 0.00 0.00 43.42 43.34 2i0n n LEU 4 CO 0.99 -0.42 0.00 0.61 0.00 0.00 0.00 177.39 178.57 2i0n n GLY 5 N 2.64 -0.41 3.77 -3.96 0.00 -1.26 -5.14 105.19 100.82 2i0n n GLY 5 Ca -0.08 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 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 5.50 0.57 1.61 0.01 -1.26 -5.00 113.70 115.12 2i0n s SER 6 Ca 0.00 2.11 -0.17 0.00 1.31 0.00 0.00 55.95 59.19 2i0n s SER 6 Cb 0.00 -2.57 -0.05 0.00 0.21 0.00 0.00 66.02 63.61 2i0n s SER 6 CO 0.00 -1.37 1.07 -2.16 0.41 0.00 0.00 173.24 171.19 2i0n s PRO 7 N -3.59 3.40 -0.09 12.44 0.04 -1.26 -4.98 135.00 140.96 2i0n s PRO 7 Ca 0.71 1.32 0.15 0.00 0.04 0.00 0.00 61.00 63.21 2i0n s PRO 7 Cb -0.23 -2.04 -0.23 0.00 0.04 0.00 0.00 34.50 32.05 2i0n s PRO 7 CO 0.32 -0.76 0.47 -1.91 0.04 0.00 0.00 177.00 175.16 2i0n n GLU 8 N -1.70 0.65 -3.19 4.56 4.07 -1.26 -4.75 120.64 119.02 2i0n n GLU 8 Ca 0.09 0.17 -0.44 0.00 -0.06 0.00 0.00 57.16 56.92 2i0n n GLU 8 Cb 0.52 -1.69 -0.06 0.00 -0.06 0.00 0.00 31.44 30.15 2i0n n GLU 8 CO 0.00 0.00 0.00 -0.06 -0.06 0.00 0.00 177.13 177.01 2i0n s PHE 9 N -2.62 3.08 -0.01 4.31 0.08 -1.26 -4.81 117.98 116.75 2i0n s PHE 9 Ca -0.06 -0.83 0.01 0.00 0.12 0.00 0.00 56.93 56.17 2i0n s PHE 9 Cb 0.08 -3.68 -0.02 0.00 -0.57 0.00 0.00 43.02 38.83 2i0n s PHE 9 CO 0.83 -1.09 0.01 0.00 -0.10 0.00 0.00 175.22 174.87 2i0n n ALA 10 N 5.98 1.99 -2.93 5.36 0.00 -1.26 -5.09 120.51 124.56 2i0n n ALA 10 Ca -0.09 -0.08 -0.05 0.00 0.00 0.00 0.00 53.44 53.22 2i0n n ALA 10 Cb 0.43 0.15 0.01 0.00 0.00 0.00 0.00 19.45 20.04 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 -1.92 -2.38 0.00 0.00 5.02 -1.26 -4.96 118.16 112.66 2i0n n LYS 11 Ca -0.02 2.06 0.00 0.00 -2.02 0.00 0.00 58.31 58.34 2i0n n LYS 11 Cb 0.41 -4.06 0.00 0.00 -0.02 0.00 0.00 35.03 31.36 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 0.59 -1.23 -3.61 2.13 4.01 -0.41 -4.41 117.16 114.23 2i0n n TYR 12 Ca 0.01 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.60 2i0n n TYR 12 Cb 0.27 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.23 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 -2.06 -1.65 -0.21 -0.72 0.00 -0.99 0.28 121.76 116.40 2i0n s ALA 13 Ca 0.00 1.60 -0.02 0.00 0.00 0.00 0.00 51.96 53.54 2i0n s ALA 13 Cb 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 23.12 22.49 2i0n s ALA 13 CO 0.00 -0.33 -0.09 0.50 0.00 0.00 0.00 175.76 175.84 2i0n s ARG 14 N -0.30 3.22 -0.19 0.00 3.00 -0.50 0.15 118.95 124.32 2i0n s ARG 14 Ca -0.05 -0.71 -0.38 0.00 -1.00 0.00 0.00 55.73 53.59 2i0n s ARG 14 Cb -0.03 -2.89 -0.15 0.00 0.00 0.00 0.00 34.95 31.88 2i0n s ARG 14 CO 0.04 -0.22 1.75 0.00 0.00 0.00 0.00 175.30 176.88 2i0n n ALA 15 N 4.74 0.09 0.72 6.12 0.00 0.48 -0.94 120.51 131.73 2i0n n ALA 15 Ca -0.19 0.37 0.13 0.00 0.00 0.00 0.00 53.44 53.75 2i0n n ALA 15 Cb 0.50 -2.29 0.48 0.00 0.00 0.00 0.00 19.45 18.13 2i0n n ALA 15 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2i0n n LEU 16 N 5.51 0.51 -3.49 0.00 4.77 0.31 -1.77 117.00 122.83 2i0n n LEU 16 Ca 0.25 0.56 -0.09 0.00 -0.03 0.00 0.00 56.01 56.69 2i0n n LEU 16 Cb 0.18 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 2i0n n LEU 16 CO 0.77 -0.16 0.61 -1.59 -1.33 0.00 0.00 177.39 175.69 2i0n s LYS 17 N -3.08 0.97 0.34 3.23 -2.85 -1.20 -4.40 119.74 112.75 2i0n s LYS 17 Ca 0.11 -0.36 -0.28 0.00 -1.00 0.00 0.00 55.97 54.44 2i0n s LYS 17 Cb 0.14 0.44 -0.12 0.00 -2.06 0.00 0.00 37.83 36.23 2i0n s LYS 17 CO 0.54 -0.42 1.29 -0.40 0.10 0.00 0.00 175.35 176.46 2i0n n ASP 18 N -0.29 2.77 -4.22 0.03 5.75 -1.26 -4.00 116.55 115.33 2i0n n ASP 18 Ca -0.11 1.21 -0.24 0.00 -0.01 0.00 0.00 54.79 55.63 2i0n n ASP 18 Cb 0.63 -1.49 -0.14 0.00 -1.03 0.00 0.00 41.12 39.09 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 -1.10 1.68 0.27 2.11 5.04 0.11 -4.84 117.35 120.62 2i0n s TYR 19 Ca 0.55 -0.36 0.12 0.00 -2.44 0.00 0.00 57.07 54.94 2i0n s TYR 19 Cb -0.57 -1.01 -0.05 0.00 0.35 0.00 0.00 41.96 40.69 2i0n s TYR 19 CO 0.62 0.07 -0.18 0.54 -1.34 0.00 0.00 175.55 175.26 2i0n s ASN 20 N -1.09 3.69 0.16 4.32 4.22 -1.26 -2.76 114.94 122.23 2i0n s ASN 20 Ca 0.06 -0.98 -0.13 0.00 -2.14 0.00 0.00 52.86 49.67 2i0n s ASN 20 Cb -0.08 -0.36 0.01 0.00 1.28 0.00 0.00 41.25 42.10 2i0n s ASN 20 CO 0.01 0.04 0.39 0.68 -2.04 0.00 0.00 177.10 176.18 2i0n s VAL 21 N -2.44 0.06 -0.47 3.54 -7.23 -1.26 -4.95 120.40 107.64 2i0n s VAL 21 Ca 0.30 -1.00 0.04 0.00 -1.81 0.00 0.00 61.98 59.50 2i0n s VAL 21 Cb -0.05 -1.59 0.16 0.00 0.56 0.00 0.00 36.38 35.47 2i0n s VAL 21 CO 0.15 -0.26 0.35 -0.55 -0.31 0.00 0.00 175.10 174.48 2i0n s SER 22 N -2.90 2.49 0.00 4.85 0.15 -1.26 -5.06 113.70 111.98 2i0n s SER 22 Ca 0.11 -3.12 0.00 0.00 0.70 0.00 0.00 55.95 53.64 2i0n s SER 22 Cb 0.02 -0.74 0.00 0.00 -1.71 0.00 0.00 66.02 63.58 2i0n s SER 22 CO -0.04 -0.17 0.00 -0.67 1.20 0.00 0.00 173.24 173.56 2i0n n ASP 23 N 2.82 0.00 -2.13 5.45 2.03 -1.26 -5.02 116.55 118.45 2i0n n ASP 23 Ca 0.24 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.31 2i0n n ASP 23 Cb 0.43 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.87 2i0n n ASP 23 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2i0n n THR 24 N -0.10 3.13 -1.87 5.18 -2.24 -1.26 -4.04 114.28 113.08 2i0n n THR 24 Ca 0.00 -2.29 -0.02 0.00 -2.27 0.00 0.00 64.05 59.47 2i0n n THR 24 Cb 0.00 -1.31 -0.02 0.00 -2.10 0.00 0.00 70.33 66.90 2i0n n THR 24 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2i0n n SER 25 N -0.01 -0.29 -4.86 3.42 2.88 -1.26 -5.11 113.62 108.39 2i0n n SER 25 Ca 0.43 -1.14 -0.21 0.00 -1.33 0.00 0.00 58.87 56.62 2i0n n SER 25 Cb 0.58 0.09 -0.04 0.00 -0.75 0.00 0.00 64.21 64.10 2i0n n SER 25 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2i0n s LEU 26 N 0.00 3.57 -0.62 2.46 2.01 -1.26 -3.29 118.68 121.56 2i0n s LEU 26 Ca 0.00 -0.52 0.05 0.00 0.01 0.00 0.00 54.13 53.66 2i0n s LEU 26 Cb 0.00 -2.20 0.15 0.00 0.01 0.00 0.00 46.19 44.15 2i0n s LEU 26 CO 0.00 -0.39 0.38 -0.22 1.01 0.00 0.00 176.35 177.13 2i0n s LEU 27 N -4.01 4.57 0.58 1.79 0.20 -0.91 -3.91 118.68 116.98 2i0n s LEU 27 Ca 0.42 -3.46 -0.16 0.00 0.69 0.00 0.00 54.13 51.61 2i0n s LEU 27 Cb -0.05 -1.63 -0.04 0.00 -0.43 0.00 0.00 46.19 44.03 2i0n s LEU 27 CO 0.27 -0.15 1.05 -2.16 -0.29 0.00 0.00 176.35 175.07 2i0n s PRO 28 N -0.91 3.41 0.18 0.98 0.04 -1.26 -4.73 135.00 132.71 2i0n s PRO 28 Ca 0.21 1.20 -0.23 0.00 0.04 0.00 0.00 61.00 62.21 2i0n s PRO 28 Cb -0.14 -2.05 0.07 0.00 0.04 0.00 0.00 34.50 32.42 2i0n s PRO 28 CO -0.09 -0.74 0.99 -0.59 0.04 0.00 0.00 177.00 176.61 2i0n s PHE 29 N -2.43 -0.04 0.38 0.56 -0.12 -1.11 -4.97 117.98 110.25 2i0n s PHE 29 Ca 0.63 -0.32 0.08 0.00 -0.05 0.00 0.00 56.93 57.27 2i0n s PHE 29 Cb -0.16 0.67 -0.02 0.00 -0.63 0.00 0.00 43.02 42.89 2i0n s PHE 29 CO 0.35 -0.90 0.35 0.21 -0.05 0.00 0.00 175.22 175.18 2i0n s LYS 30 N -2.79 2.64 1.02 1.99 2.20 -1.26 0.04 119.74 123.57 2i0n s LYS 30 Ca 0.16 -1.41 -0.16 0.00 -0.36 0.00 0.00 55.97 54.20 2i0n s LYS 30 Cb -0.02 -2.44 0.10 0.00 -1.51 0.00 0.00 37.83 33.96 2i0n s LYS 30 CO 0.04 -0.07 -0.02 -2.13 -0.36 0.00 0.00 175.35 172.81 2i0n n ARG 31 N -1.49 -1.71 -3.97 4.03 0.63 -1.26 -3.52 116.66 109.38 2i0n n ARG 31 Ca 0.01 -0.50 -0.33 0.00 -0.92 0.00 0.00 57.85 56.12 2i0n n ARG 31 Cb 0.61 -1.46 -0.01 0.00 0.45 0.00 0.00 32.46 32.04 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 -0.64 -2.07 -4.13 6.15 0.23 -0.73 -4.83 115.26 109.25 2i0n n ASN 32 Ca 0.03 -0.98 -0.28 0.00 -0.53 0.00 0.00 54.58 52.82 2i0n n ASN 32 Cb 0.47 -1.18 -0.17 0.00 -2.08 0.00 0.00 39.78 36.82 2i0n n ASN 32 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2i0n s ASP 33 N -3.94 2.42 -0.70 0.53 1.01 -1.12 -4.93 116.67 109.93 2i0n s ASP 33 Ca 0.28 -0.42 -0.26 0.00 0.71 0.00 0.00 52.55 52.86 2i0n s ASP 33 Cb -0.15 -1.05 0.04 0.00 1.01 0.00 0.00 42.92 42.77 2i0n s ASP 33 CO 0.74 0.11 1.17 -0.63 0.21 0.00 0.00 175.17 176.77 2i0n s ILE 34 N 0.42 3.93 -0.35 0.77 -1.09 -1.26 0.18 121.20 123.81 2i0n s ILE 34 Ca -0.15 0.22 -0.26 0.00 -2.23 0.00 0.00 60.65 58.23 2i0n s ILE 34 Cb -0.16 -4.83 0.01 0.00 -1.58 0.00 0.00 42.46 35.90 2i0n s ILE 34 CO 0.06 -1.69 0.94 -0.63 -1.23 0.00 0.00 174.94 172.39 2i0n s ILE 35 N 5.15 4.59 -0.70 2.92 1.01 0.39 -4.92 121.20 129.63 2i0n s ILE 35 Ca 0.32 1.30 -0.27 0.00 0.00 0.00 0.00 60.65 62.00 2i0n s ILE 35 Cb -0.11 -4.33 0.02 0.00 0.01 0.00 0.00 42.46 38.05 2i0n s ILE 35 CO 0.14 -0.50 1.38 -0.89 0.00 0.00 0.00 174.94 175.08 2i0n s THR 36 N 3.46 3.67 -0.10 2.92 2.01 -1.09 -2.35 115.64 124.16 2i0n s THR 36 Ca 0.39 0.41 -0.32 0.00 0.31 0.00 0.00 61.69 62.47 2i0n s THR 36 Cb -0.12 -4.72 -0.10 0.00 0.01 0.00 0.00 72.50 67.57 2i0n s THR 36 CO 0.17 -1.64 1.99 -0.38 -0.69 0.00 0.00 174.62 174.07 2i0n n ILE 37 N 6.56 0.56 -0.06 1.82 5.41 -1.26 -1.78 119.36 130.60 2i0n n ILE 37 Ca 0.07 -0.19 -0.07 0.00 1.00 0.00 0.00 62.75 63.56 2i0n n ILE 37 Cb 0.50 -2.08 -0.15 0.00 -0.71 0.00 0.00 39.64 37.20 2i0n n ILE 37 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2i0n n THR 38 N 5.87 1.33 -3.42 1.39 -2.24 0.14 -4.91 114.28 112.44 2i0n n THR 38 Ca 0.25 -0.80 -0.05 0.00 -2.27 0.00 0.00 64.05 61.18 2i0n n THR 38 Cb 0.34 -0.61 -0.06 0.00 -2.10 0.00 0.00 70.33 67.90 2i0n n THR 38 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2i0n s PHE 39 N -2.64 -1.09 -0.46 4.78 5.36 -0.52 -5.03 117.98 118.39 2i0n s PHE 39 Ca -0.08 1.44 -0.20 0.00 -0.96 0.00 0.00 56.93 57.13 2i0n s PHE 39 Cb 0.07 0.34 0.03 0.00 -0.34 0.00 0.00 43.02 43.13 2i0n s PHE 39 CO 0.83 -0.69 0.64 0.15 -1.46 0.00 0.00 175.22 174.69 2i0n s LYS 40 N 2.69 3.22 -0.01 10.12 1.02 -1.26 -2.71 119.74 132.81 2i0n s LYS 40 Ca 0.09 -0.54 0.00 0.00 0.02 0.00 0.00 55.97 55.54 2i0n s LYS 40 Cb -0.14 -4.00 0.01 0.00 -0.52 0.00 0.00 37.83 33.18 2i0n s LYS 40 CO -0.17 -1.09 0.23 -0.25 -0.92 0.00 0.00 175.35 173.15 2i0n n ASP 41 N 6.27 -0.09 -2.95 2.83 8.00 -1.26 -5.03 116.55 124.32 2i0n n ASP 41 Ca -0.03 -0.44 -0.33 0.00 0.71 0.00 0.00 54.79 54.70 2i0n n ASP 41 Cb 0.47 0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 2i0n n ASP 41 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2i0n n GLN 42 N -0.04 3.65 -2.64 -1.24 -0.06 -1.26 -4.84 117.38 110.97 2i0n n GLN 42 Ca -0.02 -4.42 -0.19 0.00 -2.00 0.00 0.00 57.00 50.38 2i0n n GLN 42 Cb 0.36 -2.30 0.00 0.00 -4.06 0.00 0.00 30.24 24.24 2i0n n GLN 42 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 2i0n n GLU 43 N -0.34 -2.68 0.00 3.69 2.13 -1.26 -2.40 120.64 119.77 2i0n n GLU 43 Ca 0.42 0.80 0.00 0.00 0.66 0.00 0.00 57.16 59.04 2i0n n GLU 43 Cb 0.41 -5.49 0.00 0.00 0.27 0.00 0.00 31.44 26.62 2i0n n GLU 43 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2i0n n ASN 44 N -2.08 0.00 -0.03 4.31 4.05 -1.26 -4.53 115.26 115.72 2i0n n ASN 44 Ca -0.17 0.00 -0.02 0.00 0.45 0.00 0.00 54.58 54.84 2i0n n ASN 44 Cb 0.64 0.00 -0.02 0.00 1.23 0.00 0.00 39.78 41.63 2i0n n ASN 44 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 177.26 174.71 2i0n h LYS 45 N 0.00 -0.04 -7.38 1.20 1.63 -1.95 -3.41 116.57 106.61 2i0n h LYS 45 Ca 0.00 0.00 -0.51 0.00 -0.85 0.00 0.00 60.65 59.30 2i0n h LYS 45 Cb 0.00 0.01 0.08 0.00 -0.60 0.00 0.00 32.23 31.72 2i0n h LYS 45 CO 0.00 -0.03 0.39 -1.58 -3.45 0.00 0.00 179.45 174.78 2i0n s TRP 46 N -3.39 3.33 -0.10 1.91 0.52 -1.01 0.97 118.94 121.16 2i0n s TRP 46 Ca -0.02 1.28 -0.06 0.00 0.02 0.00 0.00 56.10 57.32 2i0n s TRP 46 Cb 0.01 -2.87 0.04 0.00 -1.15 0.00 0.00 33.47 29.50 2i0n s TRP 46 CO 0.09 -1.06 0.24 -0.06 0.02 0.00 0.00 176.95 176.18 2i0n s PHE 47 N -3.16 -0.30 -0.75 -1.98 0.08 -0.62 -4.06 117.98 107.18 2i0n s PHE 47 Ca 0.57 0.72 -0.26 0.00 0.12 0.00 0.00 56.93 58.09 2i0n s PHE 47 Cb -0.12 0.05 0.04 0.00 -0.57 0.00 0.00 43.02 42.42 2i0n s PHE 47 CO 0.54 -0.20 1.22 1.41 -0.10 0.00 0.00 175.22 178.09 2i0n s MET 48 N 0.93 3.21 0.49 0.44 1.75 -1.10 -2.47 119.30 122.55 2i0n s MET 48 Ca -0.07 -0.47 0.02 0.00 -1.25 0.00 0.00 55.69 53.92 2i0n s MET 48 Cb -0.08 -4.29 -0.03 0.00 2.84 0.00 0.00 34.83 33.27 2i0n s MET 48 CO -0.06 -2.07 0.01 0.20 -0.65 0.00 0.00 175.02 172.45 2i0n s GLY 49 N 3.82 2.92 -0.01 2.11 0.00 -1.07 0.23 107.32 115.32 2i0n s GLY 49 Ca 0.33 -0.77 -0.08 0.00 0.00 0.00 0.00 44.72 44.20 2i0n s GLY 49 CO 0.12 -2.17 0.16 1.62 0.00 0.00 0.00 173.10 172.82 2i0n s GLN 50 N -3.84 0.46 0.00 2.90 0.74 -0.73 -2.08 119.66 117.10 2i0n s GLN 50 Ca 0.12 -0.28 0.00 0.00 0.05 0.00 0.00 55.36 55.24 2i0n s GLN 50 Cb 0.03 0.19 0.00 0.00 1.10 0.00 0.00 33.01 34.34 2i0n s GLN 50 CO 0.06 -0.11 0.00 -0.11 -0.55 0.00 0.00 175.29 174.58 2i0n n LEU 51 N 1.67 0.00 -4.55 3.68 7.94 0.12 -2.68 117.00 123.17 2i0n n LEU 51 Ca -0.21 0.00 -0.26 0.00 -1.11 0.00 0.00 56.01 54.43 2i0n n LEU 51 Cb 0.56 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.46 2i0n n LEU 51 CO 0.21 0.00 1.67 0.20 -1.11 0.00 0.00 177.39 178.36 2i0n s ASN 52 N 1.00 4.19 -0.94 1.96 0.02 -1.26 -1.96 114.94 117.95 2i0n s ASN 52 Ca 0.00 0.63 0.00 0.00 -1.02 0.00 0.00 52.86 52.47 2i0n s ASN 52 Cb 0.00 -2.52 0.00 0.00 0.02 0.00 0.00 41.25 38.75 2i0n s ASN 52 CO 0.00 -3.32 0.00 0.61 0.02 0.00 0.00 177.10 174.41 2i0n n GLY 53 N 6.36 0.97 3.41 0.66 0.00 -1.26 -4.98 105.19 110.35 2i0n n GLY 53 Ca 0.41 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.51 1.51 -0.30 1.61 3.01 -0.83 -5.12 119.74 117.12 2i0n s LYS 54 Ca 0.00 -1.30 -0.08 0.00 -1.01 0.00 0.00 55.97 53.59 2i0n s LYS 54 Cb 0.00 -1.96 0.17 0.00 -1.01 0.00 0.00 37.83 35.03 2i0n s LYS 54 CO 0.00 0.46 0.75 -2.00 0.51 0.00 0.00 175.35 175.07 2i0n s GLU 55 N -2.05 0.46 0.00 1.68 2.12 -1.26 0.14 118.70 119.80 2i0n s GLU 55 Ca 0.15 0.96 0.00 0.00 0.36 0.00 0.00 54.97 56.43 2i0n s GLU 55 Cb -0.10 0.55 0.00 0.00 0.26 0.00 0.00 34.13 34.84 2i0n s GLU 55 CO 0.07 -0.36 0.00 0.41 -0.54 0.00 0.00 175.26 174.84 2i0n n GLY 56 N 5.37 1.49 3.14 -1.50 0.00 -0.88 -4.45 105.19 108.36 2i0n n GLY 56 Ca -0.06 0.29 -0.09 0.00 0.00 0.00 0.00 46.02 46.16 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 0.33 -0.28 1.61 0.01 -1.21 -2.60 113.70 113.57 2i0n s SER 57 Ca 0.00 -1.17 -0.18 0.00 1.31 0.00 0.00 55.95 55.91 2i0n s SER 57 Cb 0.00 0.28 0.11 0.00 0.21 0.00 0.00 66.02 66.62 2i0n s SER 57 CO 0.00 -0.71 0.84 0.72 0.41 0.00 0.00 173.24 174.50 2i0n s PHE 58 N -4.03 -0.79 0.51 2.43 -0.71 -1.03 -2.14 117.98 112.23 2i0n s PHE 58 Ca 0.21 1.63 -0.21 0.00 -1.04 0.00 0.00 56.93 57.52 2i0n s PHE 58 Cb 0.08 0.46 -0.06 0.00 -1.21 0.00 0.00 43.02 42.28 2i0n s PHE 58 CO -0.00 -0.39 1.14 -1.25 -1.34 0.00 0.00 175.22 173.38 2i0n s PRO 59 N 1.26 3.50 0.00 1.99 0.04 -1.26 -1.60 135.00 138.93 2i0n s PRO 59 Ca -0.07 1.67 0.10 0.00 0.04 0.00 0.00 61.00 62.73 2i0n s PRO 59 Cb -0.04 -2.15 0.45 0.00 0.04 0.00 0.00 34.50 32.80 2i0n s PRO 59 CO -0.15 -0.74 1.24 0.28 0.04 0.00 0.00 177.00 177.67 2i0n n VAL 60 N -1.01 1.02 0.26 -0.36 0.31 0.27 -2.85 118.33 115.97 2i0n n VAL 60 Ca 0.10 0.26 0.12 0.00 -0.01 0.00 0.00 64.34 64.81 2i0n n VAL 60 Cb 0.50 -1.10 0.58 0.00 -0.91 0.00 0.00 33.84 32.92 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 0.00 0.00 4.52 3.58 -1.91 -3.15 116.42 119.46 2i0n h ASP 61 Ca 0.00 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.34 2i0n h ASP 61 Cb 0.12 0.00 -0.23 0.00 1.72 0.00 0.00 39.33 40.94 2i0n h ASP 61 CO 0.00 0.00 -0.81 0.00 -2.88 0.00 0.00 179.24 175.55 2i0n n HIS 62 N -2.31 0.00 -3.90 0.28 1.44 -1.13 -5.03 115.22 104.57 2i0n n HIS 62 Ca -0.00 -0.30 -0.13 0.00 -2.01 0.00 0.00 57.72 55.28 2i0n n HIS 62 Cb 0.11 -0.10 -0.14 0.00 0.12 0.00 0.00 29.99 29.98 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 0.00 0.05 0.58 0.61 -7.23 -1.19 0.11 120.40 113.32 2i0n s VAL 63 Ca 0.20 -0.00 0.02 0.00 -1.81 0.00 0.00 61.98 60.38 2i0n s VAL 63 Cb 0.23 -0.06 0.05 0.00 0.56 0.00 0.00 36.38 37.15 2i0n s VAL 63 CO -0.10 0.03 0.80 -0.70 -0.31 0.00 0.00 175.10 174.82 2i0n s GLU 64 N 0.11 2.40 -0.15 4.82 2.12 -0.11 -4.81 118.70 123.07 2i0n s GLU 64 Ca -0.01 -0.90 0.01 0.00 0.36 0.00 0.00 54.97 54.44 2i0n s GLU 64 Cb -0.02 -2.48 0.00 0.00 0.26 0.00 0.00 34.13 31.89 2i0n s GLU 64 CO -0.00 -0.83 -0.17 0.42 -0.54 0.00 0.00 175.26 174.14 2i0n s ILE 65 N -2.81 2.52 -0.52 -3.70 -1.09 -1.26 -1.41 121.20 112.93 2i0n s ILE 65 Ca 0.59 -0.82 -0.17 0.00 -2.23 0.00 0.00 60.65 58.01 2i0n s ILE 65 Cb -0.09 -2.05 0.09 0.00 -1.58 0.00 0.00 42.46 38.83 2i0n s ILE 65 CO 0.39 0.52 0.56 -0.76 -1.23 0.00 0.00 174.94 174.42 2i0n s LEU 66 N 0.78 5.49 0.13 2.97 1.43 0.14 -4.88 118.68 124.76 2i0n s LEU 66 Ca -0.06 -1.33 0.20 0.00 -1.03 0.00 0.00 54.13 51.91 2i0n s LEU 66 Cb -0.15 -2.29 -0.07 0.00 0.03 0.00 0.00 46.19 43.70 2i0n s LEU 66 CO 0.00 -0.87 0.92 -0.11 0.23 0.00 0.00 176.35 176.52 2i0n n LEU 67 N 5.76 0.80 0.32 1.79 0.00 -1.26 -1.28 117.00 123.13 2i0n n LEU 67 Ca -0.10 0.33 0.19 0.00 0.00 0.00 0.00 56.01 56.42 2i0n n LEU 67 Cb 0.43 -0.00 0.99 0.00 0.00 0.00 0.00 43.42 44.84 2i0n n LEU 67 CO 0.53 -0.05 1.16 -1.28 0.00 0.00 0.00 177.39 177.75 2i0n h SER 68 N 0.00 0.00 -1.89 1.96 0.87 -1.98 -3.45 113.55 109.05 2i0n h SER 68 Ca -0.07 0.00 -0.40 0.00 -1.23 0.00 0.00 61.79 60.09 2i0n h SER 68 Cb 1.23 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.10 2i0n h SER 68 CO 0.02 0.00 -0.44 -0.67 -0.53 0.00 0.00 176.83 175.21 2i0n n ASP 69 N -3.11 -5.55 -4.92 6.23 2.03 -1.25 -4.97 116.55 105.02 2i0n n ASP 69 Ca -0.02 0.24 -0.30 0.00 0.52 0.00 0.00 54.79 55.23 2i0n n ASP 69 Cb 0.25 -4.68 -0.04 0.00 -0.72 0.00 0.00 41.12 35.93 2i0n n ASP 69 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2i0n s VAL 70 N -2.87 5.25 -0.34 5.18 -7.23 -1.26 -5.03 120.40 114.11 2i0n s VAL 70 Ca 0.00 -0.27 -0.29 0.00 -1.81 0.00 0.00 61.98 59.61 2i0n s VAL 70 Cb 0.00 -3.67 -0.01 0.00 0.56 0.00 0.00 36.38 33.26 2i0n s VAL 70 CO 0.00 -0.01 1.54 -2.16 -0.31 0.00 0.00 175.10 174.16 2i0n s PRO 71 N -2.88 3.59 0.76 4.82 0.04 -1.26 -5.00 135.00 135.08 2i0n s PRO 71 Ca 0.38 1.24 -0.10 0.00 0.04 0.00 0.00 61.00 62.57 2i0n s PRO 71 Cb -0.12 -4.06 0.07 0.00 0.04 0.00 0.00 34.50 30.44 2i0n s PRO 71 CO 0.27 -1.54 1.11 -1.25 0.04 0.00 0.00 177.00 175.63 2i0n s PRO 72 N 4.98 2.05 -0.77 0.56 0.04 -1.26 -4.96 135.00 135.65 2i0n s PRO 72 Ca 0.68 -0.06 -0.26 0.00 0.04 0.00 0.00 61.00 61.40 2i0n s PRO 72 Cb -0.18 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.30 2i0n s PRO 72 CO 0.31 -1.44 1.68 -1.25 0.04 0.00 0.00 177.00 176.34 2i0n s PRO 73 N -5.43 2.88 -0.41 0.56 0.04 -1.26 -4.95 135.00 126.43 2i0n s PRO 73 Ca 0.61 -0.05 -0.24 0.00 0.04 0.00 0.00 61.00 61.36 2i0n s PRO 73 Cb -0.11 -4.64 0.02 0.00 0.04 0.00 0.00 34.50 29.81 2i0n s PRO 73 CO 0.47 -2.67 0.81 -0.65 0.04 0.00 0.00 177.00 175.00 2i0n s GLN 74 N 6.43 3.58 0.63 4.56 -0.21 -1.26 -4.92 119.66 128.47 2i0n s GLN 74 Ca 0.57 0.13 -0.14 0.00 0.02 0.00 0.00 55.36 55.94 2i0n s GLN 74 Cb -0.08 -3.88 -0.02 0.00 1.00 0.00 0.00 33.01 30.03 2i0n s GLN 74 CO 0.10 -1.01 1.06 -1.25 -2.12 0.00 0.00 175.29 172.07 2i0n s PRO 75 N 3.28 3.13 -0.22 2.91 0.04 -1.26 -5.06 135.00 137.82 2i0n s PRO 75 Ca 0.32 1.15 -0.04 0.00 0.04 0.00 0.00 61.00 62.47 2i0n s PRO 75 Cb -0.12 -2.01 0.11 0.00 0.04 0.00 0.00 34.50 32.52 2i0n s PRO 75 CO 0.21 -0.96 0.27 0.08 0.04 0.00 0.00 177.00 176.64 2i0n s VAL 76 N -2.63 -0.42 -0.59 -0.36 1.01 -1.26 -5.08 120.40 111.08 2i0n s VAL 76 Ca 0.62 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.54 2i0n s VAL 76 Cb -0.16 -0.72 0.16 0.00 0.00 0.00 0.00 36.38 35.66 2i0n s VAL 76 CO 0.43 -0.18 0.40 -2.28 0.00 0.00 0.00 175.10 173.47 2i0n s HIS 77 N 2.40 2.81 0.09 5.22 2.46 -1.26 -5.09 115.29 121.92 2i0n s HIS 77 Ca 0.09 -2.99 -0.31 0.00 0.47 0.00 0.00 55.06 52.32 2i0n s HIS 77 Cb -0.16 -2.25 -0.06 0.00 -0.13 0.00 0.00 32.58 29.98 2i0n s HIS 77 CO -0.13 -0.66 1.23 -1.25 -2.47 0.00 0.00 174.74 171.46 2i0n s PRO 78 N -0.76 4.42 0.07 2.88 0.04 -1.26 -5.02 135.00 135.36 2i0n s PRO 78 Ca 0.24 1.84 -0.12 0.00 0.04 0.00 0.00 61.00 63.00 2i0n s PRO 78 Cb -0.08 -3.32 0.01 0.00 0.04 0.00 0.00 34.50 31.16 2i0n s PRO 78 CO -0.13 -0.27 0.28 0.54 0.04 0.00 0.00 177.00 177.46 2i0n s VAL 79 N 0.93 0.10 0.00 -0.36 0.11 -1.26 -5.37 120.40 114.56 2i0n s VAL 79 Ca 0.59 -0.83 0.00 0.00 -2.93 0.00 0.00 61.98 58.81 2i0n s VAL 79 Cb -0.31 -1.10 0.00 0.00 -1.53 0.00 0.00 36.38 33.43 2i0n s VAL 79 CO 0.30 -0.46 0.31 0.00 -3.33 0.00 0.00 175.10 171.92