#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 5.42 0.09 3.03 0.00 -1.26 -5.05 105.19 107.42 2i0n n GLY 2 Ca 0.00 -1.91 -0.14 0.00 0.00 0.00 0.00 46.02 43.97 2i0n n GLY 2 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i0n h PRO 3 N 0.00 0.16 0.00 1.61 0.13 -2.14 -3.46 132.00 128.30 2i0n h PRO 3 Ca 0.00 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2i0n h PRO 3 Cb 0.00 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.16 2i0n h PRO 3 CO 0.00 0.78 0.00 1.28 -0.23 0.00 0.00 178.00 179.83 2i0n n LEU 4 N -4.61 0.00 0.00 1.56 4.32 -1.26 -4.87 117.00 112.13 2i0n n LEU 4 Ca -0.09 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.90 2i0n n LEU 4 Cb 0.41 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 2i0n n LEU 4 CO 0.37 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.15 2i0n n GLY 5 N 0.00 1.31 2.96 -0.72 0.00 -1.26 -5.03 105.19 102.45 2i0n n GLY 5 Ca 0.00 -1.98 0.01 0.00 0.00 0.00 0.00 46.02 44.05 2i0n n GLY 5 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i0n s SER 6 N -0.15 -0.97 -1.14 1.61 0.15 -1.26 -5.04 113.70 106.91 2i0n s SER 6 Ca 0.00 -0.59 -0.07 0.00 0.70 0.00 0.00 55.95 55.99 2i0n s SER 6 Cb 0.00 1.24 -0.07 0.00 -1.71 0.00 0.00 66.02 65.48 2i0n s SER 6 CO 0.00 -0.10 2.42 -0.81 1.20 0.00 0.00 173.24 175.95 2i0n n PRO 7 N 3.88 2.62 -2.40 5.44 -0.04 -1.26 -4.49 135.00 138.76 2i0n n PRO 7 Ca 0.09 -1.69 -0.11 0.00 -0.04 0.00 0.00 63.50 61.75 2i0n n PRO 7 Cb 0.60 -2.55 -0.01 0.00 -0.04 0.00 0.00 33.50 31.50 2i0n n PRO 7 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2i0n n GLU 8 N 3.95 -2.26 -3.30 0.54 0.00 -1.26 -4.90 120.64 113.41 2i0n n GLU 8 Ca 0.56 0.54 -0.42 0.00 0.00 0.00 0.00 57.16 57.84 2i0n n GLU 8 Cb 0.18 -5.11 -0.08 0.00 0.00 0.00 0.00 31.44 26.42 2i0n n GLU 8 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 2i0n s PHE 9 N -2.52 3.18 0.43 4.31 5.36 -1.26 -5.05 117.98 122.43 2i0n s PHE 9 Ca 0.00 -0.03 0.03 0.00 -0.96 0.00 0.00 56.93 55.97 2i0n s PHE 9 Cb 0.00 -2.86 -0.01 0.00 -0.34 0.00 0.00 43.02 39.81 2i0n s PHE 9 CO 0.00 -0.56 0.11 0.00 -1.46 0.00 0.00 175.22 173.31 2i0n n ALA 10 N 5.62 0.53 0.00 11.12 0.00 -1.26 -4.87 120.51 131.65 2i0n n ALA 10 Ca -0.07 -2.09 0.00 0.00 0.00 0.00 0.00 53.44 51.28 2i0n n ALA 10 Cb 0.49 1.34 0.00 0.00 0.00 0.00 0.00 19.45 21.28 2i0n n ALA 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2i0n n LYS 11 N -0.99 0.00 -3.30 0.00 3.00 -1.24 -5.00 118.16 110.63 2i0n n LYS 11 Ca -0.09 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.07 2i0n n LYS 11 Cb 0.61 -0.23 -0.04 0.00 0.00 0.00 0.00 35.03 35.37 2i0n n LYS 11 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2i0n n TYR 12 N -1.79 0.24 -3.60 5.64 4.01 -1.10 -4.25 117.16 116.30 2i0n n TYR 12 Ca 0.00 -1.35 -0.16 0.00 -0.16 0.00 0.00 57.90 56.23 2i0n n TYR 12 Cb 0.00 -0.06 -0.07 0.00 -0.31 0.00 0.00 39.34 38.90 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 -2.54 -1.57 -0.20 -0.72 0.00 -1.03 -0.75 121.76 114.94 2i0n s ALA 13 Ca 0.07 1.35 -0.02 0.00 0.00 0.00 0.00 51.96 53.36 2i0n s ALA 13 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.77 2i0n s ALA 13 CO 0.05 -0.33 -0.10 0.50 0.00 0.00 0.00 175.76 175.88 2i0n s ARG 14 N -0.68 3.25 0.04 0.00 6.06 -0.55 0.14 118.95 127.21 2i0n s ARG 14 Ca -0.08 -0.69 -0.33 0.00 -2.50 0.00 0.00 55.73 52.13 2i0n s ARG 14 Cb -0.02 -2.85 -0.12 0.00 0.06 0.00 0.00 34.95 32.01 2i0n s ARG 14 CO 0.06 -0.19 1.78 0.00 -2.50 0.00 0.00 175.30 174.45 2i0n n ALA 15 N 4.69 1.35 0.12 6.12 0.00 0.45 -0.04 120.51 133.19 2i0n n ALA 15 Ca -0.19 0.34 -0.01 0.00 0.00 0.00 0.00 53.44 53.57 2i0n n ALA 15 Cb 0.51 -2.48 0.04 0.00 0.00 0.00 0.00 19.45 17.52 2i0n n ALA 15 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2i0n h LEU 16 N 8.07 0.00 0.00 0.00 7.12 -1.86 -2.28 115.31 126.36 2i0n h LEU 16 Ca -0.47 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.49 2i0n h LEU 16 Cb 1.25 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.37 2i0n h LEU 16 CO 0.93 0.70 -0.04 2.29 -0.13 0.00 0.00 178.44 182.18 2i0n n LYS 17 N -3.42 0.09 -3.53 1.25 2.85 -1.26 -4.18 118.16 109.96 2i0n n LYS 17 Ca 0.00 -0.46 -0.36 0.00 -1.05 0.00 0.00 58.31 56.44 2i0n n LYS 17 Cb 0.76 0.42 -0.06 0.00 -0.65 0.00 0.00 35.03 35.50 2i0n n LYS 17 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 2i0n s ASP 18 N -1.35 6.71 0.00 -5.58 -4.77 -1.26 -3.03 116.67 107.40 2i0n s ASP 18 Ca 0.05 0.87 -0.08 0.00 -3.30 0.00 0.00 52.55 50.09 2i0n s ASP 18 Cb 0.00 -2.21 0.00 0.00 -1.09 0.00 0.00 42.92 39.62 2i0n s ASP 18 CO 0.04 0.20 0.16 -0.47 0.70 0.00 0.00 175.17 175.80 2i0n s TYR 19 N -1.33 0.02 0.06 2.11 6.14 -0.37 -4.88 117.35 119.10 2i0n s TYR 19 Ca 0.31 -0.10 0.09 0.00 0.64 0.00 0.00 57.07 58.01 2i0n s TYR 19 Cb -0.15 -0.03 -0.03 0.00 0.42 0.00 0.00 41.96 42.17 2i0n s TYR 19 CO 0.17 -0.31 -0.22 1.21 0.64 0.00 0.00 175.55 177.04 2i0n s ASN 20 N -1.43 3.51 -1.13 4.32 3.84 -1.26 -2.66 114.94 120.13 2i0n s ASN 20 Ca -0.14 -0.54 -0.21 0.00 0.21 0.00 0.00 52.86 52.18 2i0n s ASN 20 Cb -0.07 -0.43 0.05 0.00 -0.55 0.00 0.00 41.25 40.24 2i0n s ASN 20 CO 0.02 0.24 1.61 -0.69 -2.79 0.00 0.00 177.10 175.48 2i0n s VAL 21 N -0.92 3.96 -1.33 -5.21 1.01 -1.26 -4.89 120.40 111.76 2i0n s VAL 21 Ca 0.14 -1.20 -0.17 0.00 0.00 0.00 0.00 61.98 60.75 2i0n s VAL 21 Cb -0.10 -5.04 0.07 0.00 0.00 0.00 0.00 36.38 31.30 2i0n s VAL 21 CO 0.05 -1.89 1.84 -1.20 0.00 0.00 0.00 175.10 173.89 2i0n n SER 22 N 9.16 4.72 0.00 3.32 7.64 -1.26 -3.03 113.62 134.18 2i0n n SER 22 Ca 0.40 -2.91 0.00 0.00 1.01 0.00 0.00 58.87 57.37 2i0n n SER 22 Cb 0.49 -1.72 0.00 0.00 -1.01 0.00 0.00 64.21 61.97 2i0n n SER 22 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2i0n n ASP 23 N 7.75 0.00 -0.73 6.43 8.00 -1.26 -4.94 116.55 131.79 2i0n n ASP 23 Ca 0.49 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.92 2i0n n ASP 23 Cb 0.44 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.53 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 -0.24 0.00 -3.53 -1.04 -1.17 -4.87 114.28 103.43 2i0n n THR 24 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2i0n n THR 24 Cb 0.00 -1.25 0.00 0.00 -1.82 0.00 0.00 70.33 67.26 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 0.70 0.56 -3.94 8.00 7.64 -1.26 -5.08 113.62 120.24 2i0n n SER 25 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.80 2i0n n SER 25 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 2i0n n SER 25 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2i0n n LEU 26 N -2.55 0.00 -3.84 -3.43 4.77 -1.26 -1.32 117.00 109.37 2i0n n LEU 26 Ca 0.00 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.78 2i0n n LEU 26 Cb 0.25 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.18 2i0n n LEU 26 CO 0.00 -0.50 -0.39 -1.48 -1.33 0.00 0.00 177.39 173.69 2i0n s LEU 27 N 0.00 1.11 -0.14 2.23 0.05 0.79 -2.89 118.68 119.82 2i0n s LEU 27 Ca 0.00 -0.09 -0.29 0.00 0.05 0.00 0.00 54.13 53.80 2i0n s LEU 27 Cb 0.00 -0.39 -0.01 0.00 -2.05 0.00 0.00 46.19 43.74 2i0n s LEU 27 CO 0.00 -0.10 1.18 -2.16 -0.55 0.00 0.00 176.35 174.72 2i0n s PRO 28 N 1.19 4.29 -0.02 1.48 0.04 -1.26 -4.59 135.00 136.13 2i0n s PRO 28 Ca -0.07 1.58 -0.08 0.00 0.04 0.00 0.00 61.00 62.47 2i0n s PRO 28 Cb -0.14 -3.67 0.01 0.00 0.04 0.00 0.00 34.50 30.75 2i0n s PRO 28 CO -0.02 -0.59 0.17 -0.59 0.04 0.00 0.00 177.00 176.01 2i0n s PHE 29 N 2.97 -0.05 0.59 0.56 -0.12 -1.09 -5.00 117.98 115.85 2i0n s PHE 29 Ca 0.52 0.08 0.00 0.00 -0.05 0.00 0.00 56.93 57.48 2i0n s PHE 29 Cb -0.21 -0.00 0.05 0.00 -0.63 0.00 0.00 43.02 42.23 2i0n s PHE 29 CO 0.15 -0.24 0.83 0.21 -0.05 0.00 0.00 175.22 176.11 2i0n s LYS 30 N -0.97 2.38 1.03 1.99 2.20 -1.26 -1.23 119.74 123.88 2i0n s LYS 30 Ca -0.11 -0.79 -0.17 0.00 -0.36 0.00 0.00 55.97 54.54 2i0n s LYS 30 Cb -0.06 -2.44 0.10 0.00 -1.51 0.00 0.00 37.83 33.93 2i0n s LYS 30 CO 0.01 -0.87 -0.02 -2.13 -0.36 0.00 0.00 175.35 171.98 2i0n n ARG 31 N -2.46 -1.73 -3.73 4.03 0.63 -1.17 -3.08 116.66 109.14 2i0n n ARG 31 Ca 0.09 -0.50 -0.25 0.00 -0.92 0.00 0.00 57.85 56.27 2i0n n ARG 31 Cb 0.60 -1.48 -0.07 0.00 0.45 0.00 0.00 32.46 31.96 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 -0.73 -0.07 -4.84 6.15 0.23 -0.88 -4.89 115.26 110.24 2i0n n ASN 32 Ca 0.03 -0.89 -0.22 0.00 -0.53 0.00 0.00 54.58 52.97 2i0n n ASN 32 Cb 0.48 -1.12 -0.04 0.00 -2.08 0.00 0.00 39.78 37.02 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 -3.46 5.63 -0.46 0.53 1.11 -1.11 -4.66 116.67 114.26 2i0n s ASP 33 Ca 0.22 -0.21 -0.08 0.00 0.18 0.00 0.00 52.55 52.67 2i0n s ASP 33 Cb -0.13 -1.47 0.12 0.00 1.07 0.00 0.00 42.92 42.51 2i0n s ASP 33 CO 0.71 -0.04 0.31 -0.63 1.18 0.00 0.00 175.17 176.70 2i0n s ILE 34 N -2.11 4.00 -0.28 0.77 1.09 -1.26 0.17 121.20 123.57 2i0n s ILE 34 Ca 0.33 -1.84 -0.29 0.00 -1.10 0.00 0.00 60.65 57.75 2i0n s ILE 34 Cb -0.08 -3.65 -0.01 0.00 -1.06 0.00 0.00 42.46 37.66 2i0n s ILE 34 CO 0.25 -0.75 1.42 -0.63 -0.10 0.00 0.00 174.94 175.14 2i0n s ILE 35 N 1.31 3.96 -1.24 2.92 1.09 0.36 -4.70 121.20 124.91 2i0n s ILE 35 Ca 0.06 1.07 -0.20 0.00 -1.10 0.00 0.00 60.65 60.48 2i0n s ILE 35 Cb -0.25 -4.00 -0.01 0.00 -1.06 0.00 0.00 42.46 37.13 2i0n s ILE 35 CO -0.01 -0.44 1.85 0.41 -0.10 0.00 0.00 174.94 176.64 2i0n n THR 36 N 6.38 2.94 -1.51 2.92 -1.04 0.79 -2.47 114.28 122.27 2i0n n THR 36 Ca 0.16 -3.04 -0.43 0.00 -2.04 0.00 0.00 64.05 58.71 2i0n n THR 36 Cb 0.46 -2.27 -0.06 0.00 -1.82 0.00 0.00 70.33 66.64 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 7.03 0.09 -0.00 12.58 5.41 -1.26 -2.14 119.36 141.07 2i0n n ILE 37 Ca 0.47 -0.45 0.06 0.00 1.00 0.00 0.00 62.75 63.83 2i0n n ILE 37 Cb 0.46 -2.04 -0.09 0.00 -0.71 0.00 0.00 39.64 37.27 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 7.62 0.00 -3.40 1.39 5.66 -1.13 -4.79 114.28 119.63 2i0n n THR 38 Ca 0.42 -0.26 -0.15 0.00 -3.05 0.00 0.00 64.05 61.01 2i0n n THR 38 Cb 0.35 0.24 -0.10 0.00 -1.55 0.00 0.00 70.33 69.27 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 -2.79 -0.55 0.23 1.09 5.36 -0.74 -5.04 117.98 115.54 2i0n s PHE 39 Ca -0.04 0.21 0.02 0.00 -0.96 0.00 0.00 56.93 56.16 2i0n s PHE 39 Cb 0.07 -0.29 -0.04 0.00 -0.34 0.00 0.00 43.02 42.42 2i0n s PHE 39 CO 0.47 -0.79 0.39 0.15 -1.46 0.00 0.00 175.22 173.98 2i0n s LYS 40 N 2.41 3.48 0.50 10.12 1.02 -1.26 -2.42 119.74 133.59 2i0n s LYS 40 Ca 0.10 -0.51 0.05 0.00 0.02 0.00 0.00 55.97 55.63 2i0n s LYS 40 Cb -0.15 -2.84 0.01 0.00 -0.52 0.00 0.00 37.83 34.33 2i0n s LYS 40 CO -0.23 0.38 0.28 -0.51 -0.92 0.00 0.00 175.35 174.35 2i0n s ASP 41 N -3.59 4.52 -0.35 2.83 1.01 -1.26 -4.99 116.67 114.84 2i0n s ASP 41 Ca 0.37 -1.26 0.05 0.00 0.71 0.00 0.00 52.55 52.42 2i0n s ASP 41 Cb -0.10 0.20 0.61 0.00 1.01 0.00 0.00 42.92 44.64 2i0n s ASP 41 CO 0.30 -0.92 1.75 1.67 0.21 0.00 0.00 175.17 178.18 2i0n n GLN 42 N -1.55 2.57 -0.00 8.23 7.27 -1.26 -4.09 117.38 128.56 2i0n n GLN 42 Ca -0.05 -2.62 0.01 0.00 0.07 0.00 0.00 57.00 54.42 2i0n n GLN 42 Cb 0.65 -2.05 -0.01 0.00 2.41 0.00 0.00 30.24 31.23 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 -0.60 3.01 -2.06 3.69 4.71 -1.26 -4.99 120.64 123.13 2i0n n GLU 43 Ca 0.46 -0.01 -0.15 0.00 -0.01 0.00 0.00 57.16 57.44 2i0n n GLU 43 Cb 1.42 -0.84 -0.03 0.00 -1.01 0.00 0.00 31.44 30.98 2i0n n GLU 43 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2i0n n ASN 44 N -1.33 -4.40 0.00 1.62 5.15 -1.26 -4.75 115.26 110.29 2i0n n ASN 44 Ca -0.00 0.22 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 2i0n n ASN 44 Cb 0.05 -3.82 0.00 0.00 -0.53 0.00 0.00 39.78 35.48 2i0n n ASN 44 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 2i0n n LYS 45 N -2.55 0.00 -3.95 1.20 4.81 -1.26 -4.66 118.16 111.75 2i0n n LYS 45 Ca -0.17 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 56.96 2i0n n LYS 45 Cb 0.59 -0.93 -0.15 0.00 0.02 0.00 0.00 35.03 34.55 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 -1.95 3.07 0.44 5.64 0.23 -1.26 -2.52 118.94 122.58 2i0n s TRP 46 Ca 0.00 -2.50 -0.04 0.00 -2.03 0.00 0.00 56.10 51.53 2i0n s TRP 46 Cb 0.00 -2.40 -0.04 0.00 0.03 0.00 0.00 33.47 31.07 2i0n s TRP 46 CO 0.00 -0.91 0.71 -0.06 0.96 0.00 0.00 176.95 177.66 2i0n s PHE 47 N 1.15 3.54 -0.16 -1.98 0.08 -0.93 -4.52 117.98 115.16 2i0n s PHE 47 Ca 0.07 0.69 -0.01 0.00 0.12 0.00 0.00 56.93 57.80 2i0n s PHE 47 Cb -0.19 -2.19 0.04 0.00 -0.57 0.00 0.00 43.02 40.12 2i0n s PHE 47 CO -0.12 -0.15 -0.05 1.41 -0.10 0.00 0.00 175.22 176.21 2i0n s MET 48 N -4.58 1.42 0.22 0.44 -2.45 -1.02 -2.31 119.30 111.02 2i0n s MET 48 Ca 0.45 -0.48 -0.03 0.00 -1.25 0.00 0.00 55.69 54.39 2i0n s MET 48 Cb -0.10 -1.95 0.01 0.00 1.25 0.00 0.00 34.83 34.04 2i0n s MET 48 CO 0.42 -0.42 0.34 0.41 1.05 0.00 0.00 175.02 176.82 2i0n n GLY 49 N 4.89 2.26 1.86 2.11 0.00 -0.93 -1.80 105.19 113.58 2i0n n GLY 49 Ca -0.12 -1.45 -0.15 0.00 0.00 0.00 0.00 46.02 44.30 2i0n n GLY 49 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2i0n n GLN 50 N -0.35 1.03 0.00 1.61 3.00 -0.91 -2.24 117.38 119.52 2i0n n GLN 50 Ca -0.01 -1.90 0.00 0.00 -0.01 0.00 0.00 57.00 55.08 2i0n n GLN 50 Cb 0.37 0.78 0.00 0.00 0.00 0.00 0.00 30.24 31.38 2i0n n GLN 50 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.06 178.53 2i0n n LEU 51 N 0.00 0.00 -4.53 1.08 -0.00 -0.76 -0.15 117.00 112.64 2i0n n LEU 51 Ca -0.07 0.00 -0.16 0.00 -0.00 0.00 0.00 56.01 55.79 2i0n n LEU 51 Cb 0.33 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.63 2i0n n LEU 51 CO 0.18 0.00 1.47 -0.46 -0.00 0.00 0.00 177.39 178.58 2i0n n ASN 52 N 0.00 0.69 -1.97 1.45 0.23 -1.26 -2.72 115.26 111.68 2i0n n ASN 52 Ca 0.00 -1.25 -0.10 0.00 -0.53 0.00 0.00 54.58 52.70 2i0n n ASN 52 Cb 0.00 -1.30 -0.02 0.00 -2.08 0.00 0.00 39.78 36.38 2i0n n ASN 52 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2i0n n GLY 53 N 6.33 0.08 3.48 4.83 0.00 -1.26 -4.91 105.19 113.74 2i0n n GLY 53 Ca 0.52 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.11 1.68 -0.21 1.61 3.01 -1.10 -5.16 119.74 115.46 2i0n s LYS 54 Ca 0.00 -1.90 -0.22 0.00 -1.01 0.00 0.00 55.97 52.84 2i0n s LYS 54 Cb 0.00 -1.20 0.06 0.00 -1.01 0.00 0.00 37.83 35.68 2i0n s LYS 54 CO 0.00 -0.04 0.61 -1.83 0.51 0.00 0.00 175.35 174.60 2i0n s GLU 55 N -3.77 0.74 0.00 1.68 -1.05 -1.26 -1.83 118.70 113.21 2i0n s GLU 55 Ca 0.33 0.78 0.00 0.00 -0.15 0.00 0.00 54.97 55.93 2i0n s GLU 55 Cb 0.06 0.36 0.00 0.00 -0.44 0.00 0.00 34.13 34.11 2i0n s GLU 55 CO 0.15 -0.11 0.00 0.41 0.95 0.00 0.00 175.26 176.66 2i0n n GLY 56 N 2.56 -1.40 2.75 -3.83 0.00 -0.95 -4.70 105.19 99.63 2i0n n GLY 56 Ca -0.14 -1.12 -0.15 0.00 0.00 0.00 0.00 46.02 44.61 2i0n n GLY 56 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2i0n n SER 57 N 2.20 1.70 -3.64 1.61 7.64 -0.44 -2.20 113.62 120.49 2i0n n SER 57 Ca 0.00 -2.16 -0.02 0.00 1.01 0.00 0.00 58.87 57.70 2i0n n SER 57 Cb 0.00 -0.23 -0.05 0.00 -1.01 0.00 0.00 64.21 62.92 2i0n n SER 57 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2i0n s PHE 58 N -1.65 -0.05 0.22 1.43 -0.12 -0.98 0.28 117.98 117.10 2i0n s PHE 58 Ca 0.38 0.10 -0.30 0.00 -0.05 0.00 0.00 56.93 57.05 2i0n s PHE 58 Cb -0.03 0.49 -0.09 0.00 -0.63 0.00 0.00 43.02 42.76 2i0n s PHE 58 CO 0.24 -0.04 1.24 -1.25 -0.05 0.00 0.00 175.22 175.35 2i0n s PRO 59 N -0.84 4.46 0.00 1.99 0.04 -1.26 -2.20 135.00 137.19 2i0n s PRO 59 Ca 0.08 1.98 0.09 0.00 0.04 0.00 0.00 61.00 63.18 2i0n s PRO 59 Cb -0.02 -3.19 0.37 0.00 0.04 0.00 0.00 34.50 31.70 2i0n s PRO 59 CO -0.09 -0.12 1.27 0.28 0.04 0.00 0.00 177.00 178.38 2i0n n VAL 60 N 2.14 1.36 0.22 -0.36 0.31 -1.05 -2.78 118.33 118.17 2i0n n VAL 60 Ca 0.04 0.34 0.14 0.00 -0.01 0.00 0.00 64.34 64.85 2i0n n VAL 60 Cb 0.44 -1.19 0.76 0.00 -0.91 0.00 0.00 33.84 32.94 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 -1.76 4.52 3.58 -1.90 -3.25 116.42 117.61 2i0n h ASP 61 Ca 0.00 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.96 2i0n h ASP 61 Cb 0.14 0.00 -0.36 0.00 1.72 0.00 0.00 39.33 40.83 2i0n h ASP 61 CO 0.00 0.00 -1.07 0.00 -2.88 0.00 0.00 179.24 175.29 2i0n n HIS 62 N -2.49 -0.48 -3.66 0.28 1.44 -1.12 -5.07 115.22 104.12 2i0n n HIS 62 Ca -0.02 -3.47 -0.11 0.00 -2.01 0.00 0.00 57.72 52.11 2i0n n HIS 62 Cb 0.05 -0.14 -0.08 0.00 0.12 0.00 0.00 29.99 29.94 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 -1.48 -0.00 0.53 0.61 -7.23 -1.23 -3.47 120.40 108.13 2i0n s VAL 63 Ca 0.36 0.01 0.03 0.00 -1.81 0.00 0.00 61.98 60.57 2i0n s VAL 63 Cb 0.25 -0.88 0.03 0.00 0.56 0.00 0.00 36.38 36.34 2i0n s VAL 63 CO -0.10 0.01 0.74 -0.70 -0.31 0.00 0.00 175.10 174.73 2i0n s GLU 64 N 0.91 2.58 -0.21 4.82 2.12 0.94 -4.86 118.70 125.01 2i0n s GLU 64 Ca -0.05 -0.88 0.01 0.00 0.36 0.00 0.00 54.97 54.41 2i0n s GLU 64 Cb -0.05 -2.54 0.04 0.00 0.26 0.00 0.00 34.13 31.84 2i0n s GLU 64 CO -0.08 -0.64 -0.13 0.42 -0.54 0.00 0.00 175.26 174.29 2i0n s ILE 65 N -2.69 1.89 -0.48 -3.70 -1.09 -1.26 -1.48 121.20 112.39 2i0n s ILE 65 Ca 0.57 -1.15 -0.24 0.00 -2.23 0.00 0.00 60.65 57.59 2i0n s ILE 65 Cb -0.10 -1.90 0.03 0.00 -1.58 0.00 0.00 42.46 38.91 2i0n s ILE 65 CO 0.37 0.22 0.88 -0.76 -1.23 0.00 0.00 174.94 174.42 2i0n s LEU 66 N 1.29 4.12 0.00 2.97 1.43 0.07 -4.88 118.68 123.69 2i0n s LEU 66 Ca -0.02 -0.08 0.31 0.00 -1.03 0.00 0.00 54.13 53.30 2i0n s LEU 66 Cb -0.16 -3.02 1.70 0.00 0.03 0.00 0.00 46.19 44.73 2i0n s LEU 66 CO -0.09 -1.05 2.11 0.18 0.23 0.00 0.00 176.35 177.74 2i0n n LEU 67 N 7.08 0.30 0.25 1.79 4.77 -1.26 -2.72 117.00 127.21 2i0n n LEU 67 Ca 0.04 -0.10 0.17 0.00 -0.03 0.00 0.00 56.01 56.08 2i0n n LEU 67 Cb 0.48 -0.00 0.90 0.00 -2.33 0.00 0.00 43.42 42.46 2i0n n LEU 67 CO 0.62 0.05 1.01 0.77 -1.33 0.00 0.00 177.39 178.51 2i0n h SER 68 N 0.46 0.00 -2.37 -1.43 4.64 -1.96 -3.45 113.55 109.45 2i0n h SER 68 Ca 0.00 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.92 2i0n h SER 68 Cb 0.10 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.14 2i0n h SER 68 CO 0.00 0.00 -0.47 -0.67 -0.87 0.00 0.00 176.83 174.82 2i0n n ASP 69 N -2.67 -5.59 -3.81 4.97 2.03 -1.25 -4.97 116.55 105.26 2i0n n ASP 69 Ca -0.02 0.10 -0.12 0.00 0.52 0.00 0.00 54.79 55.27 2i0n n ASP 69 Cb 0.06 -4.67 -0.11 0.00 -0.72 0.00 0.00 41.12 35.68 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 -2.93 0.03 -0.36 5.18 -7.23 -1.26 -5.04 120.40 108.80 2i0n s VAL 70 Ca 0.00 -0.22 -0.29 0.00 -1.81 0.00 0.00 61.98 59.66 2i0n s VAL 70 Cb 0.00 -0.39 0.00 0.00 0.56 0.00 0.00 36.38 36.55 2i0n s VAL 70 CO 0.00 -0.12 1.45 -2.16 -0.31 0.00 0.00 175.10 173.96 2i0n s PRO 71 N -0.41 3.65 0.85 4.82 0.04 -1.26 -4.96 135.00 137.72 2i0n s PRO 71 Ca -0.05 1.14 -0.13 0.00 0.04 0.00 0.00 61.00 62.00 2i0n s PRO 71 Cb -0.03 -4.01 0.11 0.00 0.04 0.00 0.00 34.50 30.60 2i0n s PRO 71 CO 0.01 -1.47 1.22 -1.25 0.04 0.00 0.00 177.00 175.55 2i0n s PRO 72 N 4.82 1.61 -0.28 0.56 0.04 -1.26 -4.98 135.00 135.51 2i0n s PRO 72 Ca 0.63 -0.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.36 2i0n s PRO 72 Cb -0.16 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 2i0n s PRO 72 CO 0.30 -1.82 1.46 -1.25 0.04 0.00 0.00 177.00 175.73 2i0n s PRO 73 N -5.66 3.82 0.34 0.56 0.04 -1.26 -5.01 135.00 127.83 2i0n s PRO 73 Ca 0.65 1.40 -0.02 0.00 0.04 0.00 0.00 61.00 63.07 2i0n s PRO 73 Cb -0.09 -3.97 -0.04 0.00 0.04 0.00 0.00 34.50 30.44 2i0n s PRO 73 CO 0.50 -1.26 0.57 1.14 0.04 0.00 0.00 177.00 178.00 2i0n s GLN 74 N 4.50 3.54 0.69 4.56 -2.07 -1.26 -5.04 119.66 124.58 2i0n s GLN 74 Ca 0.64 -0.15 -0.12 0.00 -1.82 0.00 0.00 55.36 53.91 2i0n s GLN 74 Cb -0.20 -2.63 0.01 0.00 -1.09 0.00 0.00 33.01 29.10 2i0n s GLN 74 CO 0.27 0.13 1.07 -1.25 -1.32 0.00 0.00 175.29 174.19 2i0n s PRO 75 N -4.08 2.84 -0.22 9.60 0.04 -1.26 -5.06 135.00 136.86 2i0n s PRO 75 Ca 0.42 1.07 -0.04 0.00 0.04 0.00 0.00 61.00 62.50 2i0n s PRO 75 Cb -0.10 -1.97 0.10 0.00 0.04 0.00 0.00 34.50 32.57 2i0n s PRO 75 CO 0.35 -1.18 0.25 0.08 0.04 0.00 0.00 177.00 176.54 2i0n s VAL 76 N -2.87 -0.38 -0.00 -0.36 1.01 -1.26 -5.01 120.40 111.52 2i0n s VAL 76 Ca 0.60 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 62.23 2i0n s VAL 76 Cb -0.15 -0.73 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 2i0n s VAL 76 CO 0.51 -0.21 0.63 -2.28 0.00 0.00 0.00 175.10 173.75 2i0n s HIS 77 N 2.37 3.68 0.05 5.22 2.46 -1.26 -5.03 115.29 122.78 2i0n s HIS 77 Ca 0.08 1.24 -0.31 0.00 0.47 0.00 0.00 55.06 56.55 2i0n s HIS 77 Cb -0.16 -2.65 -0.06 0.00 -0.13 0.00 0.00 32.58 29.59 2i0n s HIS 77 CO -0.14 0.32 1.23 -1.25 -2.47 0.00 0.00 174.74 172.43 2i0n s PRO 78 N -0.10 4.40 0.85 2.88 0.04 -1.26 -5.00 135.00 136.81 2i0n s PRO 78 Ca 0.32 1.80 -0.11 0.00 0.04 0.00 0.00 61.00 63.06 2i0n s PRO 78 Cb -0.18 -3.37 0.11 0.00 0.04 0.00 0.00 34.50 31.09 2i0n s PRO 78 CO 0.18 -0.31 1.14 0.08 0.04 0.00 0.00 177.00 178.12 2i0n s VAL 79 N 1.26 2.47 -2.00 -0.36 1.01 -1.26 -5.38 120.40 116.15 2i0n s VAL 79 Ca 0.59 0.16 0.29 0.00 0.00 0.00 0.00 61.98 63.02 2i0n s VAL 79 Cb -0.30 -2.38 0.83 0.00 0.00 0.00 0.00 36.38 34.53 2i0n s VAL 79 CO 0.28 -0.19 2.07 0.00 0.00 0.00 0.00 175.10 177.27