#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 -1.69 3.70 -5.12 0.00 -1.26 -5.13 105.19 95.69 2i0n n GLY 2 Ca 0.00 0.66 -0.42 0.00 0.00 0.00 0.00 46.02 46.26 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 4.36 -0.14 1.61 0.04 -1.26 -5.01 135.00 134.60 2i0n s PRO 3 Ca 0.00 1.82 -0.17 0.00 0.04 0.00 0.00 61.00 62.70 2i0n s PRO 3 Cb 0.00 -3.45 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 2i0n s PRO 3 CO 0.00 -0.41 0.43 -0.51 0.04 0.00 0.00 177.00 176.55 2i0n s LEU 4 N 1.70 4.25 0.00 -3.56 1.02 -1.26 -4.93 118.68 115.90 2i0n s LEU 4 Ca 0.60 0.70 0.00 0.00 0.02 0.00 0.00 54.13 55.45 2i0n s LEU 4 Cb -0.29 -2.60 0.00 0.00 0.02 0.00 0.00 46.19 43.32 2i0n s LEU 4 CO 0.27 0.01 0.00 0.61 0.02 0.00 0.00 176.35 177.25 2i0n n GLY 5 N 3.39 0.00 3.44 -3.19 0.00 -1.26 -5.11 105.19 102.46 2i0n n GLY 5 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 -4.40 -0.16 -1.09 1.61 0.01 -1.26 -5.07 113.70 103.33 2i0n s SER 6 Ca 0.00 -0.58 -0.23 0.00 1.31 0.00 0.00 55.95 56.46 2i0n s SER 6 Cb 0.00 0.52 -0.03 0.00 0.21 0.00 0.00 66.02 66.72 2i0n s SER 6 CO 0.00 -0.98 1.84 -2.16 0.41 0.00 0.00 173.24 172.35 2i0n s PRO 7 N -3.89 2.92 -0.25 12.44 0.04 -1.26 -4.69 135.00 140.31 2i0n s PRO 7 Ca 0.11 -1.03 0.11 0.00 0.04 0.00 0.00 61.00 60.23 2i0n s PRO 7 Cb 0.01 -5.25 0.47 0.00 0.04 0.00 0.00 34.50 29.76 2i0n s PRO 7 CO -0.03 -3.25 1.37 -0.85 0.04 0.00 0.00 177.00 174.27 2i0n n GLU 8 N 8.57 1.81 -4.42 4.56 0.28 -1.26 -5.02 120.64 125.16 2i0n n GLU 8 Ca 0.42 -3.15 -0.24 0.00 -0.16 0.00 0.00 57.16 54.04 2i0n n GLU 8 Cb 0.47 -1.74 -0.09 0.00 1.43 0.00 0.00 31.44 31.51 2i0n n GLU 8 CO 0.00 0.00 0.00 -0.59 -0.16 0.00 0.00 177.13 176.38 2i0n s PHE 9 N -3.18 2.40 -0.18 -1.84 -0.12 -1.26 -4.71 117.98 109.09 2i0n s PHE 9 Ca 0.42 -0.31 0.13 0.00 -0.05 0.00 0.00 56.93 57.11 2i0n s PHE 9 Cb 0.38 -1.07 0.40 0.00 -0.63 0.00 0.00 43.02 42.10 2i0n s PHE 9 CO -0.01 0.68 1.21 0.00 -0.05 0.00 0.00 175.22 177.04 2i0n n ALA 10 N -0.71 3.38 -0.98 1.99 0.00 -1.26 -5.03 120.51 117.90 2i0n n ALA 10 Ca -0.05 -3.12 0.00 0.00 0.00 0.00 0.00 53.44 50.26 2i0n n ALA 10 Cb 0.60 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.66 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 -1.00 0.00 -3.43 0.00 4.76 -1.26 -4.36 118.16 112.87 2i0n n LYS 11 Ca 0.17 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.52 2i0n n LYS 11 Cb 0.72 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.92 2i0n n LYS 11 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2i0n n TYR 12 N 0.00 -1.87 -3.88 2.13 4.01 -1.11 -4.46 117.16 111.98 2i0n n TYR 12 Ca 0.00 -1.72 -0.10 0.00 -0.16 0.00 0.00 57.90 55.93 2i0n n TYR 12 Cb 0.00 0.68 -0.06 0.00 -0.31 0.00 0.00 39.34 39.65 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 -2.14 -0.35 -0.11 -0.72 0.00 -1.10 -0.34 121.76 117.01 2i0n s ALA 13 Ca 0.17 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.51 2i0n s ALA 13 Cb -0.03 0.85 0.02 0.00 0.00 0.00 0.00 23.12 23.95 2i0n s ALA 13 CO 0.13 -0.70 -0.14 0.50 0.00 0.00 0.00 175.76 175.54 2i0n s ARG 14 N -3.93 2.17 -0.05 0.00 3.00 0.18 -1.50 118.95 118.82 2i0n s ARG 14 Ca 0.14 -0.54 -0.33 0.00 -1.00 0.00 0.00 55.73 54.00 2i0n s ARG 14 Cb 0.02 -1.89 -0.11 0.00 0.00 0.00 0.00 34.95 32.97 2i0n s ARG 14 CO -0.01 -0.10 1.89 0.00 0.00 0.00 0.00 175.30 177.08 2i0n n ALA 15 N 4.34 1.08 0.13 6.12 0.00 0.39 -0.64 120.51 131.93 2i0n n ALA 15 Ca -0.18 0.27 0.01 0.00 0.00 0.00 0.00 53.44 53.54 2i0n n ALA 15 Cb 0.51 -2.54 0.03 0.00 0.00 0.00 0.00 19.45 17.45 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 9.39 0.00 0.00 0.00 3.38 0.11 -1.29 115.31 126.90 2i0n h LEU 16 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2i0n h LEU 16 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2i0n h LEU 16 CO 0.94 0.57 0.00 2.29 0.09 0.00 0.00 178.44 182.33 2i0n n LYS 17 N -3.27 0.00 -3.59 1.13 2.85 -1.25 -4.35 118.16 109.68 2i0n n LYS 17 Ca 0.01 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.91 2i0n n LYS 17 Cb 0.75 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 35.07 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 -0.31 6.67 0.10 -5.58 1.47 -1.26 -2.43 116.67 115.33 2i0n s ASP 18 Ca 0.00 0.81 0.06 0.00 1.18 0.00 0.00 52.55 54.60 2i0n s ASP 18 Cb 0.00 -2.19 -0.03 0.00 -0.34 0.00 0.00 42.92 40.36 2i0n s ASP 18 CO 0.00 0.27 -0.15 -0.47 0.68 0.00 0.00 175.17 175.49 2i0n s TYR 19 N -1.22 1.39 -0.35 2.11 5.04 -0.67 -4.92 117.35 118.73 2i0n s TYR 19 Ca 0.27 -0.49 0.01 0.00 -2.44 0.00 0.00 57.07 54.42 2i0n s TYR 19 Cb -0.15 -0.75 0.14 0.00 0.35 0.00 0.00 41.96 41.55 2i0n s TYR 19 CO 0.15 0.12 0.30 1.21 -1.34 0.00 0.00 175.55 175.98 2i0n s ASN 20 N -2.04 1.93 -0.06 4.32 2.47 -1.26 -2.66 114.94 117.64 2i0n s ASN 20 Ca 0.04 -1.64 0.03 0.00 0.42 0.00 0.00 52.86 51.70 2i0n s ASN 20 Cb -0.08 0.21 0.01 0.00 -1.45 0.00 0.00 41.25 39.94 2i0n s ASN 20 CO 0.03 -0.30 -0.12 0.68 -3.72 0.00 0.00 177.10 173.66 2i0n s VAL 21 N 1.48 1.11 -0.47 -5.21 -7.23 -1.26 -5.02 120.40 103.81 2i0n s VAL 21 Ca 0.16 -0.48 0.04 0.00 -1.81 0.00 0.00 61.98 59.88 2i0n s VAL 21 Cb -0.17 -1.01 0.16 0.00 0.56 0.00 0.00 36.38 35.92 2i0n s VAL 21 CO -0.08 0.35 0.35 -0.44 -0.31 0.00 0.00 175.10 174.97 2i0n s SER 22 N 0.54 2.50 -0.34 4.85 0.01 -1.26 -4.26 113.70 115.74 2i0n s SER 22 Ca -0.12 -3.13 0.07 0.00 1.31 0.00 0.00 55.95 54.09 2i0n s SER 22 Cb -0.14 -0.75 0.45 0.00 0.21 0.00 0.00 66.02 65.79 2i0n s SER 22 CO 0.03 -0.17 1.15 -0.67 0.41 0.00 0.00 173.24 173.99 2i0n n ASP 23 N 2.82 4.59 -0.94 2.44 -0.08 -1.26 -4.90 116.55 119.22 2i0n n ASP 23 Ca 0.24 -3.63 -0.12 0.00 -1.51 0.00 0.00 54.79 49.78 2i0n n ASP 23 Cb 0.43 -0.39 -0.05 0.00 2.34 0.00 0.00 41.12 43.45 2i0n n ASP 23 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2i0n n THR 24 N -0.61 0.00 -1.44 5.18 -1.04 -1.26 -4.50 114.28 110.61 2i0n n THR 24 Ca 0.40 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.40 2i0n n THR 24 Cb 0.85 -1.54 -0.01 0.00 -1.82 0.00 0.00 70.33 67.82 2i0n n THR 24 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2i0n n SER 25 N -1.13 -0.13 -4.75 8.00 3.41 -1.26 -5.14 113.62 112.61 2i0n n SER 25 Ca -0.12 -0.40 -0.22 0.00 -0.26 0.00 0.00 58.87 57.87 2i0n n SER 25 Cb 0.59 0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.53 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 0.00 3.55 -0.30 1.04 2.01 -1.26 -3.68 118.68 120.04 2i0n s LEU 26 Ca 0.00 -0.43 0.01 0.00 0.01 0.00 0.00 54.13 53.72 2i0n s LEU 26 Cb 0.00 -2.08 0.09 0.00 0.01 0.00 0.00 46.19 44.21 2i0n s LEU 26 CO 0.00 -0.04 0.06 -0.22 1.01 0.00 0.00 176.35 177.15 2i0n s LEU 27 N -3.78 3.10 0.38 1.79 2.96 -1.21 -4.29 118.68 117.63 2i0n s LEU 27 Ca 0.33 -1.71 -0.17 0.00 -0.22 0.00 0.00 54.13 52.36 2i0n s LEU 27 Cb -0.07 -1.16 -0.09 0.00 0.50 0.00 0.00 46.19 45.37 2i0n s LEU 27 CO 0.23 -0.37 0.84 -2.16 -1.32 0.00 0.00 176.35 173.56 2i0n s PRO 28 N 1.35 4.06 0.08 0.98 0.04 -1.26 -4.60 135.00 135.65 2i0n s PRO 28 Ca 0.07 0.83 -0.02 0.00 0.04 0.00 0.00 61.00 61.92 2i0n s PRO 28 Cb -0.18 -2.31 0.01 0.00 0.04 0.00 0.00 34.50 32.06 2i0n s PRO 28 CO -0.16 0.03 0.15 1.97 0.04 0.00 0.00 177.00 179.03 2i0n n PHE 29 N -0.66 -1.16 -4.49 0.56 1.16 -1.09 -4.98 117.46 106.81 2i0n n PHE 29 Ca 0.05 -0.39 -0.26 0.00 -1.87 0.00 0.00 57.45 54.97 2i0n n PHE 29 Cb 0.54 0.17 -0.10 0.00 -1.61 0.00 0.00 39.48 38.48 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 -2.04 1.96 1.28 3.97 2.20 -1.26 -1.67 119.74 124.18 2i0n s LYS 30 Ca 0.04 -1.95 -0.19 0.00 -0.36 0.00 0.00 55.97 53.51 2i0n s LYS 30 Cb -0.01 -1.75 0.29 0.00 -1.51 0.00 0.00 37.83 34.85 2i0n s LYS 30 CO 0.03 0.04 0.72 -2.13 -0.36 0.00 0.00 175.35 173.65 2i0n n ARG 31 N -0.93 -3.43 -3.82 4.03 0.63 -1.02 -3.64 116.66 108.48 2i0n n ARG 31 Ca -0.04 -1.00 -0.25 0.00 -0.92 0.00 0.00 57.85 55.63 2i0n n ARG 31 Cb 0.65 -1.89 -0.03 0.00 0.45 0.00 0.00 32.46 31.63 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 -4.37 -0.78 -4.62 6.15 0.23 -0.50 -4.89 115.26 106.47 2i0n n ASN 32 Ca 0.07 -0.86 -0.28 0.00 -0.53 0.00 0.00 54.58 52.98 2i0n n ASN 32 Cb 0.55 -1.05 -0.10 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 -3.97 3.74 -0.30 0.53 -1.08 -1.12 -4.89 116.67 109.59 2i0n s ASP 33 Ca 0.14 -1.44 0.03 0.00 -0.52 0.00 0.00 52.55 50.76 2i0n s ASP 33 Cb -0.08 -0.15 0.09 0.00 -1.46 0.00 0.00 42.92 41.32 2i0n s ASP 33 CO 0.66 -0.56 0.01 -0.63 0.52 0.00 0.00 175.17 175.16 2i0n s ILE 34 N -2.82 1.99 -0.02 4.11 1.09 -1.26 0.15 121.20 124.43 2i0n s ILE 34 Ca 0.29 -1.92 -0.20 0.00 -1.10 0.00 0.00 60.65 57.72 2i0n s ILE 34 Cb 0.08 -2.35 -0.05 0.00 -1.06 0.00 0.00 42.46 39.07 2i0n s ILE 34 CO 0.14 -0.41 0.56 -0.63 -0.10 0.00 0.00 174.94 174.50 2i0n s ILE 35 N 1.10 4.96 -0.98 2.92 1.01 -0.56 -4.88 121.20 124.78 2i0n s ILE 35 Ca 0.04 1.16 -0.24 0.00 0.00 0.00 0.00 60.65 61.61 2i0n s ILE 35 Cb -0.19 -3.89 -0.01 0.00 0.01 0.00 0.00 42.46 38.38 2i0n s ILE 35 CO -0.09 0.42 1.77 -0.89 0.00 0.00 0.00 174.94 176.15 2i0n s THR 36 N -0.16 3.64 -0.52 2.92 2.01 0.10 -2.70 115.64 120.94 2i0n s THR 36 Ca 0.29 -0.60 -0.31 0.00 0.31 0.00 0.00 61.69 61.39 2i0n s THR 36 Cb -0.18 -4.45 -0.12 0.00 0.01 0.00 0.00 72.50 67.77 2i0n s THR 36 CO 0.16 -1.33 2.37 -0.38 -0.69 0.00 0.00 174.62 174.75 2i0n n ILE 37 N 7.47 0.07 -0.01 1.82 2.08 -1.26 -2.57 119.36 126.96 2i0n n ILE 37 Ca 0.38 -0.40 0.10 0.00 0.56 0.00 0.00 62.75 63.39 2i0n n ILE 37 Cb 0.48 -1.86 -0.15 0.00 -0.75 0.00 0.00 39.64 37.36 2i0n n ILE 37 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 2i0n n THR 38 N 7.57 0.01 -3.15 1.39 5.66 -1.12 -4.77 114.28 119.87 2i0n n THR 38 Ca 0.44 -0.45 0.05 0.00 -3.05 0.00 0.00 64.05 61.04 2i0n n THR 38 Cb 0.31 0.05 -0.01 0.00 -1.55 0.00 0.00 70.33 69.13 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 -3.34 -1.00 0.00 1.09 5.36 -0.91 -5.04 117.98 114.13 2i0n s PHE 39 Ca -0.07 1.06 0.00 0.00 -0.96 0.00 0.00 56.93 56.96 2i0n s PHE 39 Cb 0.12 0.35 0.00 0.00 -0.34 0.00 0.00 43.02 43.15 2i0n s PHE 39 CO 0.81 -0.55 0.00 1.63 -1.46 0.00 0.00 175.22 175.65 2i0n n LYS 40 N 5.45 1.16 -4.02 10.12 5.02 -1.26 -1.86 118.16 132.78 2i0n n LYS 40 Ca -0.04 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.16 2i0n n LYS 40 Cb 0.53 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.43 2i0n n LYS 40 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2i0n s ASP 41 N -1.43 0.35 -0.34 4.39 2.15 -1.26 -4.53 116.67 116.00 2i0n s ASP 41 Ca 0.00 -0.64 0.06 0.00 0.43 0.00 0.00 52.55 52.40 2i0n s ASP 41 Cb 0.00 0.12 0.61 0.00 -0.30 0.00 0.00 42.92 43.35 2i0n s ASP 41 CO 0.00 -0.38 1.73 1.67 -0.17 0.00 0.00 175.17 178.02 2i0n n GLN 42 N 1.18 2.68 0.00 4.34 7.27 -1.26 -4.05 117.38 127.54 2i0n n GLN 42 Ca -0.21 -2.61 0.00 0.00 0.07 0.00 0.00 57.00 54.25 2i0n n GLN 42 Cb 0.57 -2.05 0.00 0.00 2.41 0.00 0.00 30.24 31.17 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 -0.53 0.13 -3.95 3.69 -0.58 -1.26 -5.01 120.64 113.14 2i0n n GLU 43 Ca 0.44 -0.36 -0.30 0.00 -0.42 0.00 0.00 57.16 56.52 2i0n n GLU 43 Cb 1.39 -0.85 0.02 0.00 -0.57 0.00 0.00 31.44 31.44 2i0n n GLU 43 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2i0n n ASN 44 N -0.12 -4.34 0.02 1.62 5.15 -1.26 -4.75 115.26 111.59 2i0n n ASN 44 Ca 0.00 -0.82 0.00 0.00 -0.60 0.00 0.00 54.58 53.16 2i0n n ASN 44 Cb 0.04 -3.73 0.00 0.00 -0.53 0.00 0.00 39.78 35.55 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 -4.62 0.00 -4.00 1.20 5.02 -1.26 -4.88 118.16 109.62 2i0n n LYS 45 Ca 0.02 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.08 2i0n n LYS 45 Cb 0.53 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.48 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 -2.00 2.67 0.35 2.13 0.52 -1.26 -2.30 118.94 119.05 2i0n s TRP 46 Ca 0.00 -0.49 -0.02 0.00 0.02 0.00 0.00 56.10 55.61 2i0n s TRP 46 Cb 0.00 -1.89 0.00 0.00 -1.15 0.00 0.00 33.47 30.44 2i0n s TRP 46 CO 0.00 0.18 0.48 -0.06 0.02 0.00 0.00 176.95 177.57 2i0n s PHE 47 N -2.51 1.11 -0.11 -1.98 0.40 0.10 -4.12 117.98 110.87 2i0n s PHE 47 Ca 0.41 -1.33 -0.03 0.00 -0.60 0.00 0.00 56.93 55.38 2i0n s PHE 47 Cb -0.00 -0.09 0.05 0.00 0.51 0.00 0.00 43.02 43.49 2i0n s PHE 47 CO 0.24 -1.16 0.13 -1.64 0.70 0.00 0.00 175.22 173.49 2i0n s MET 48 N -2.96 0.04 0.29 0.44 -1.94 -0.77 -2.57 119.30 111.83 2i0n s MET 48 Ca 0.31 0.33 0.06 0.00 -1.71 0.00 0.00 55.69 54.68 2i0n s MET 48 Cb -0.01 -0.80 -0.02 0.00 2.01 0.00 0.00 34.83 36.02 2i0n s MET 48 CO 0.21 -0.44 0.28 0.41 -0.01 0.00 0.00 175.02 175.47 2i0n n GLY 49 N 5.31 2.92 3.29 -0.03 0.00 -1.07 -2.15 105.19 113.46 2i0n n GLY 49 Ca -0.05 -1.82 -0.14 0.00 0.00 0.00 0.00 46.02 44.01 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 -3.12 0.79 0.00 1.61 0.74 -1.06 -2.52 119.66 116.10 2i0n s GLN 50 Ca 0.34 -0.21 0.00 0.00 0.05 0.00 0.00 55.36 55.53 2i0n s GLN 50 Cb 0.01 0.35 0.00 0.00 1.10 0.00 0.00 33.01 34.48 2i0n s GLN 50 CO 0.24 -0.24 0.00 1.47 -0.55 0.00 0.00 175.29 176.21 2i0n n LEU 51 N 0.97 0.00 -4.52 3.68 -0.00 -0.56 0.02 117.00 116.59 2i0n n LEU 51 Ca -0.20 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.63 2i0n n LEU 51 Cb 0.57 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.83 2i0n n LEU 51 CO 0.22 0.00 1.72 0.59 -0.00 0.00 0.00 177.39 179.91 2i0n n ASN 52 N 0.00 -0.18 -4.35 1.45 3.02 -1.26 -2.71 115.26 111.23 2i0n n ASN 52 Ca 0.00 -0.96 -0.35 0.00 -0.03 0.00 0.00 54.58 53.25 2i0n n ASN 52 Cb 0.00 -0.99 -0.08 0.00 -0.61 0.00 0.00 39.78 38.10 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 6.00 -0.24 2.96 7.41 0.00 -1.26 -4.91 105.19 115.15 2i0n n GLY 53 Ca 0.58 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.61 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 -7.24 0.20 0.12 1.61 -0.14 -1.10 -5.15 119.74 108.05 2i0n s LYS 54 Ca 0.32 0.63 0.08 0.00 -1.36 0.00 0.00 55.97 55.65 2i0n s LYS 54 Cb -0.18 -0.31 -0.04 0.00 -1.68 0.00 0.00 37.83 35.62 2i0n s LYS 54 CO 0.99 -0.41 -0.15 -2.00 -0.76 0.00 0.00 175.35 173.02 2i0n s GLU 55 N 2.44 1.91 0.00 1.68 2.12 -1.26 -1.50 118.70 124.08 2i0n s GLU 55 Ca 0.04 -1.15 0.00 0.00 0.36 0.00 0.00 54.97 54.22 2i0n s GLU 55 Cb -0.13 -2.17 0.00 0.00 0.26 0.00 0.00 34.13 32.09 2i0n s GLU 55 CO -0.11 0.48 0.00 0.41 -0.54 0.00 0.00 175.26 175.50 2i0n n GLY 56 N 0.67 -0.71 3.26 -1.50 0.00 -1.05 -4.06 105.19 101.80 2i0n n GLY 56 Ca -0.14 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.41 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 1.15 -0.06 1.61 0.01 -1.24 -2.61 113.70 108.56 2i0n s SER 57 Ca 0.00 -1.63 -0.31 0.00 1.31 0.00 0.00 55.95 55.32 2i0n s SER 57 Cb 0.00 0.50 0.11 0.00 0.21 0.00 0.00 66.02 66.84 2i0n s SER 57 CO 0.00 -0.99 1.04 0.72 0.41 0.00 0.00 173.24 174.42 2i0n s PHE 58 N -3.68 -0.22 0.46 2.43 -0.12 -1.06 -3.32 117.98 112.47 2i0n s PHE 58 Ca 0.40 0.10 -0.23 0.00 -0.05 0.00 0.00 56.93 57.16 2i0n s PHE 58 Cb 0.04 0.54 -0.07 0.00 -0.63 0.00 0.00 43.02 42.89 2i0n s PHE 58 CO 0.22 -0.43 1.15 -1.25 -0.05 0.00 0.00 175.22 174.87 2i0n s PRO 59 N -2.82 3.75 0.11 1.99 0.04 -1.26 0.01 135.00 136.81 2i0n s PRO 59 Ca 0.08 1.73 -0.30 0.00 0.04 0.00 0.00 61.00 62.55 2i0n s PRO 59 Cb -0.01 -2.37 -0.09 0.00 0.04 0.00 0.00 34.50 32.07 2i0n s PRO 59 CO -0.06 -0.55 1.60 0.28 0.04 0.00 0.00 177.00 178.31 2i0n h VAL 60 N 1.82 0.22 0.00 -0.36 2.07 -1.73 0.08 116.25 118.35 2i0n h VAL 60 Ca -0.49 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.03 2i0n h VAL 60 Cb 1.25 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2i0n h VAL 60 CO 0.60 0.00 0.23 -2.24 0.02 0.00 0.00 177.57 176.18 2i0n h ASP 61 N -0.62 0.00 1.19 0.57 2.03 -1.93 0.19 116.42 117.85 2i0n h ASP 61 Ca 0.02 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.32 2i0n h ASP 61 Cb 0.64 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.14 2i0n h ASP 61 CO -0.22 0.00 0.00 1.57 -1.03 0.00 0.00 179.24 179.56 2i0n n HIS 62 N -2.34 0.77 -3.73 4.15 -0.00 0.01 -4.54 115.22 109.56 2i0n n HIS 62 Ca -0.01 0.25 -0.14 0.00 0.46 0.00 0.00 57.72 58.27 2i0n n HIS 62 Cb 0.27 -0.90 -0.15 0.00 -0.12 0.00 0.00 29.99 29.08 2i0n n HIS 62 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 2i0n s VAL 63 N -3.15 -0.10 -0.04 3.57 -7.23 0.65 0.15 120.40 114.25 2i0n s VAL 63 Ca 0.09 0.23 -0.17 0.00 -1.81 0.00 0.00 61.98 60.32 2i0n s VAL 63 Cb 0.12 -0.25 -0.05 0.00 0.56 0.00 0.00 36.38 36.76 2i0n s VAL 63 CO 0.52 0.09 0.48 -0.70 -0.31 0.00 0.00 175.10 175.18 2i0n s GLU 64 N 1.46 4.18 -0.11 4.82 2.12 0.19 -4.74 118.70 126.62 2i0n s GLU 64 Ca -0.06 0.50 -0.25 0.00 0.36 0.00 0.00 54.97 55.52 2i0n s GLU 64 Cb -0.12 -3.33 -0.02 0.00 0.26 0.00 0.00 34.13 30.92 2i0n s GLU 64 CO -0.06 0.43 0.81 0.42 -0.54 0.00 0.00 175.26 176.32 2i0n s ILE 65 N -0.28 4.94 -0.21 -3.70 -1.09 -1.26 0.48 121.20 120.08 2i0n s ILE 65 Ca 0.26 1.63 -0.08 0.00 -2.23 0.00 0.00 60.65 60.23 2i0n s ILE 65 Cb -0.17 -4.13 -0.04 0.00 -1.58 0.00 0.00 42.46 36.55 2i0n s ILE 65 CO 0.13 0.13 0.07 -0.76 -1.23 0.00 0.00 174.94 173.28 2i0n s LEU 66 N 1.49 3.70 0.00 2.97 1.43 0.54 -4.94 118.68 123.87 2i0n s LEU 66 Ca 0.40 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.48 2i0n s LEU 66 Cb -0.18 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.08 2i0n s LEU 66 CO 0.17 0.09 0.00 0.18 0.23 0.00 0.00 176.35 177.02 2i0n n LEU 67 N 4.12 0.82 0.10 1.79 4.32 -1.26 -2.77 117.00 124.11 2i0n n LEU 67 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.83 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 0.34 0.00 -0.03 -0.24 -1.22 0.00 0.00 177.39 176.24 2i0n n SER 68 N -0.55 0.29 0.26 -1.43 2.88 -1.26 -4.79 113.62 109.02 2i0n n SER 68 Ca 0.00 0.31 0.12 0.00 -1.33 0.00 0.00 58.87 57.98 2i0n n SER 68 Cb 0.00 0.11 0.53 0.00 -0.75 0.00 0.00 64.21 64.10 2i0n n SER 68 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2i0n h ASP 69 N 0.00 0.00 -3.57 -3.46 3.32 -2.03 -3.34 116.42 107.34 2i0n h ASP 69 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 2i0n h ASP 69 Cb 0.05 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 39.32 2i0n h ASP 69 CO 0.00 0.00 -0.67 0.68 -1.72 0.00 0.00 179.24 177.53 2i0n s VAL 70 N -4.16 3.50 -0.25 -1.35 -7.23 -1.26 -5.07 120.40 104.58 2i0n s VAL 70 Ca -0.02 -0.84 -0.23 0.00 -1.81 0.00 0.00 61.98 59.08 2i0n s VAL 70 Cb 0.07 -2.80 -0.01 0.00 0.56 0.00 0.00 36.38 34.21 2i0n s VAL 70 CO 0.24 0.13 0.78 -2.16 -0.31 0.00 0.00 175.10 173.78 2i0n s PRO 71 N 1.42 4.15 -0.31 4.82 0.04 -1.26 -4.53 135.00 139.33 2i0n s PRO 71 Ca 0.01 0.81 -0.29 0.00 0.04 0.00 0.00 61.00 61.58 2i0n s PRO 71 Cb -0.17 -3.65 -0.00 0.00 0.04 0.00 0.00 34.50 30.71 2i0n s PRO 71 CO -0.00 -0.51 1.42 -1.25 0.04 0.00 0.00 177.00 176.70 2i0n s PRO 72 N 2.77 3.77 0.49 0.56 0.04 -1.26 -5.01 135.00 136.37 2i0n s PRO 72 Ca 0.32 1.27 -0.08 0.00 0.04 0.00 0.00 61.00 62.55 2i0n s PRO 72 Cb -0.15 -3.97 0.12 0.00 0.04 0.00 0.00 34.50 30.54 2i0n s PRO 72 CO 0.08 -1.31 0.48 -0.35 0.04 0.00 0.00 177.00 175.94 2i0n n PRO 73 N 7.64 -1.63 -2.97 0.56 -0.04 -1.26 -5.06 135.00 132.24 2i0n n PRO 73 Ca 0.16 -0.75 -0.13 0.00 -0.04 0.00 0.00 63.50 62.74 2i0n n PRO 73 Cb 0.47 -0.66 -0.02 0.00 -0.04 0.00 0.00 33.50 33.25 2i0n n PRO 73 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2i0n n GLN 74 N -2.75 0.53 -1.39 0.54 1.13 -1.26 -4.75 117.38 109.43 2i0n n GLN 74 Ca 0.06 -2.41 -0.29 0.00 -1.94 0.00 0.00 57.00 52.42 2i0n n GLN 74 Cb 0.24 -1.48 0.13 0.00 0.11 0.00 0.00 30.24 29.24 2i0n n GLN 74 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2i0n s PRO 75 N 0.36 1.32 -0.30 -1.09 0.04 -1.26 -5.08 135.00 128.99 2i0n s PRO 75 Ca 0.32 0.57 -0.14 0.00 0.04 0.00 0.00 61.00 61.79 2i0n s PRO 75 Cb 0.08 -1.84 0.15 0.00 0.04 0.00 0.00 34.50 32.94 2i0n s PRO 75 CO -0.14 -2.14 0.90 0.54 0.04 0.00 0.00 177.00 176.21 2i0n s VAL 76 N -3.09 -0.45 -0.44 -0.36 0.11 -1.26 -5.06 120.40 109.85 2i0n s VAL 76 Ca 0.63 0.00 -0.21 0.00 -2.93 0.00 0.00 61.98 59.47 2i0n s VAL 76 Cb -0.16 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.71 2i0n s VAL 76 CO 0.55 0.00 0.66 -1.00 -3.33 0.00 0.00 175.10 171.99 2i0n s HIS 77 N 2.23 3.06 0.03 1.54 3.76 -1.26 -5.02 115.29 119.61 2i0n s HIS 77 Ca -0.05 -0.01 -0.30 0.00 -0.15 0.00 0.00 55.06 54.55 2i0n s HIS 77 Cb -0.07 -3.39 -0.05 0.00 1.11 0.00 0.00 32.58 30.19 2i0n s HIS 77 CO -0.17 -0.88 1.26 -1.25 -0.85 0.00 0.00 174.74 172.85 2i0n s PRO 78 N 2.88 4.37 -0.83 8.40 0.04 -1.26 -4.95 135.00 143.65 2i0n s PRO 78 Ca 0.24 1.82 -0.26 0.00 0.04 0.00 0.00 61.00 62.84 2i0n s PRO 78 Cb -0.14 -3.43 0.03 0.00 0.04 0.00 0.00 34.50 31.00 2i0n s PRO 78 CO 0.19 -0.39 1.40 0.08 0.04 0.00 0.00 177.00 178.33 2i0n s VAL 79 N 1.62 3.75 -2.58 -0.36 1.01 -1.26 -5.38 120.40 117.21 2i0n s VAL 79 Ca 0.60 -0.02 0.27 0.00 0.00 0.00 0.00 61.98 62.83 2i0n s VAL 79 Cb -0.29 -4.86 0.49 0.00 0.00 0.00 0.00 36.38 31.72 2i0n s VAL 79 CO 0.27 -1.78 1.67 0.00 0.00 0.00 0.00 175.10 175.25