#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 -0.78 0.00 -5.12 0.00 -1.26 -4.88 105.19 93.15 2i0n n GLY 2 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.33 -0.04 1.61 -0.04 -1.26 -5.00 135.00 129.95 2i0n n PRO 3 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 2i0n n PRO 3 Cb 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.33 2i0n n PRO 3 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2i0n h LEU 4 N 0.00 0.12 0.00 1.53 5.85 -2.07 -3.50 115.31 117.25 2i0n h LEU 4 Ca 0.00 -0.96 0.00 0.00 0.84 0.00 0.00 57.88 57.76 2i0n h LEU 4 Cb 0.00 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.99 2i0n h LEU 4 CO 0.00 1.07 0.00 0.61 -0.34 0.00 0.00 178.44 179.78 2i0n n GLY 5 N 1.54 0.85 3.78 3.75 0.00 -1.26 -5.00 105.19 108.86 2i0n n GLY 5 Ca -0.11 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 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 -4.00 4.59 0.49 1.61 0.01 -1.26 -5.00 113.70 110.14 2i0n s SER 6 Ca 0.00 1.68 -0.20 0.00 1.31 0.00 0.00 55.95 58.74 2i0n s SER 6 Cb 0.00 -2.43 -0.08 0.00 0.21 0.00 0.00 66.02 63.72 2i0n s SER 6 CO 0.00 -1.96 1.08 -2.16 0.41 0.00 0.00 173.24 170.61 2i0n s PRO 7 N -4.96 3.69 -0.43 12.44 0.04 -1.26 -5.03 135.00 139.49 2i0n s PRO 7 Ca 0.61 1.48 0.02 0.00 0.04 0.00 0.00 61.00 63.14 2i0n s PRO 7 Cb -0.16 -2.12 0.13 0.00 0.04 0.00 0.00 34.50 32.38 2i0n s PRO 7 CO 0.56 -0.54 0.21 -1.21 0.04 0.00 0.00 177.00 176.06 2i0n s GLU 8 N -3.15 1.32 0.37 4.56 0.41 -1.26 -5.11 118.70 115.84 2i0n s GLU 8 Ca 0.68 -1.97 0.09 0.00 -0.41 0.00 0.00 54.97 53.35 2i0n s GLU 8 Cb -0.20 -2.48 -0.07 0.00 -1.78 0.00 0.00 34.13 29.61 2i0n s GLU 8 CO 0.24 -1.12 -0.03 -0.06 -0.49 0.00 0.00 175.26 173.79 2i0n s PHE 9 N 0.45 2.47 0.12 1.61 0.08 -1.26 -5.00 117.98 116.45 2i0n s PHE 9 Ca 0.16 -0.54 0.00 0.00 0.12 0.00 0.00 56.93 56.67 2i0n s PHE 9 Cb -0.24 -1.55 0.00 0.00 -0.57 0.00 0.00 43.02 40.67 2i0n s PHE 9 CO -0.03 0.51 0.00 0.00 -0.10 0.00 0.00 175.22 175.60 2i0n n ALA 10 N -0.90 -1.83 -0.08 5.36 0.00 -1.26 -4.97 120.51 116.82 2i0n n ALA 10 Ca -0.05 0.42 -0.10 0.00 0.00 0.00 0.00 53.44 53.71 2i0n n ALA 10 Cb 0.64 -1.33 -0.11 0.00 0.00 0.00 0.00 19.45 18.65 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 1.90 1.13 -3.60 0.00 4.81 -1.21 -5.01 118.16 116.18 2i0n n LYS 11 Ca 0.00 0.04 -0.13 0.00 -0.87 0.00 0.00 58.31 57.35 2i0n n LYS 11 Cb 0.00 -1.39 -0.04 0.00 0.02 0.00 0.00 35.03 33.62 2i0n n LYS 11 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2i0n n TYR 12 N -2.75 -1.03 -4.09 5.64 4.02 -1.11 -4.65 117.16 113.18 2i0n n TYR 12 Ca -0.28 -2.01 -0.12 0.00 -0.01 0.00 0.00 57.90 55.48 2i0n n TYR 12 Cb 0.95 0.37 -0.06 0.00 -0.02 0.00 0.00 39.34 40.58 2i0n n TYR 12 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2i0n s ALA 13 N -2.73 0.49 -0.07 -0.72 0.00 -1.09 -0.00 121.76 117.63 2i0n s ALA 13 Ca 0.26 -1.32 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 2i0n s ALA 13 Cb 0.00 1.19 0.03 0.00 0.00 0.00 0.00 23.12 24.35 2i0n s ALA 13 CO 0.19 -0.76 0.04 0.50 0.00 0.00 0.00 175.76 175.72 2i0n s ARG 14 N -3.76 0.25 -0.27 0.00 6.06 0.26 -1.31 118.95 120.19 2i0n s ARG 14 Ca 0.30 0.19 -0.38 0.00 -2.50 0.00 0.00 55.73 53.34 2i0n s ARG 14 Cb 0.02 -0.88 -0.14 0.00 0.06 0.00 0.00 34.95 34.01 2i0n s ARG 14 CO 0.14 -0.36 1.88 0.00 -2.50 0.00 0.00 175.30 174.46 2i0n n ALA 15 N 5.22 0.31 0.36 6.12 0.00 0.57 -0.05 120.51 133.03 2i0n n ALA 15 Ca -0.05 0.26 0.12 0.00 0.00 0.00 0.00 53.44 53.77 2i0n n ALA 15 Cb 0.50 -2.34 0.24 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 8.79 0.00 0.00 0.00 3.38 0.45 -1.26 115.31 126.68 2i0n h LEU 16 Ca -0.42 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.54 2i0n h LEU 16 Cb 1.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 2i0n h LEU 16 CO 0.98 0.00 0.00 2.29 0.09 0.00 0.00 178.44 181.80 2i0n n LYS 17 N -2.76 0.02 -3.49 1.13 2.85 -1.25 -4.43 118.16 110.23 2i0n n LYS 17 Ca 0.04 -0.05 -0.36 0.00 -1.05 0.00 0.00 58.31 56.89 2i0n n LYS 17 Cb 0.50 0.05 -0.06 0.00 -0.65 0.00 0.00 35.03 34.87 2i0n n LYS 17 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2i0n s ASP 18 N -1.04 6.75 0.06 -5.58 1.11 -1.26 -2.55 116.67 114.15 2i0n s ASP 18 Ca 0.00 0.93 0.05 0.00 0.18 0.00 0.00 52.55 53.71 2i0n s ASP 18 Cb -0.00 -2.23 -0.03 0.00 1.07 0.00 0.00 42.92 41.73 2i0n s ASP 18 CO 0.00 0.19 -0.14 -0.47 1.18 0.00 0.00 175.17 175.93 2i0n s TYR 19 N -1.33 1.23 -0.29 4.23 5.04 -0.47 -4.93 117.35 120.83 2i0n s TYR 19 Ca 0.32 -0.42 -0.03 0.00 -2.44 0.00 0.00 57.07 54.50 2i0n s TYR 19 Cb -0.15 -0.71 0.11 0.00 0.35 0.00 0.00 41.96 41.56 2i0n s TYR 19 CO 0.17 0.05 0.16 1.21 -1.34 0.00 0.00 175.55 175.80 2i0n s ASN 20 N -1.52 3.26 -0.10 4.32 2.47 -1.26 -2.70 114.94 119.40 2i0n s ASN 20 Ca -0.01 -1.28 0.02 0.00 0.42 0.00 0.00 52.86 52.01 2i0n s ASN 20 Cb -0.09 -0.24 0.01 0.00 -1.45 0.00 0.00 41.25 39.48 2i0n s ASN 20 CO 0.02 -0.42 -0.14 0.68 -3.72 0.00 0.00 177.10 173.52 2i0n s VAL 21 N 2.06 1.38 -0.48 -5.21 -7.23 -1.26 -5.02 120.40 104.64 2i0n s VAL 21 Ca 0.10 -0.58 0.04 0.00 -1.81 0.00 0.00 61.98 59.73 2i0n s VAL 21 Cb -0.16 -1.27 0.16 0.00 0.56 0.00 0.00 36.38 35.68 2i0n s VAL 21 CO -0.34 0.42 0.36 -0.44 -0.31 0.00 0.00 175.10 174.79 2i0n s SER 22 N 0.95 2.58 0.04 4.85 0.01 -1.26 -4.47 113.70 116.40 2i0n s SER 22 Ca -0.08 -3.16 0.00 0.00 1.31 0.00 0.00 55.95 54.02 2i0n s SER 22 Cb -0.15 -0.79 0.00 0.00 0.21 0.00 0.00 66.02 65.29 2i0n s SER 22 CO -0.00 -0.17 0.00 -0.67 0.41 0.00 0.00 173.24 172.81 2i0n n ASP 23 N 2.77 0.45 0.17 2.44 2.03 -1.26 -5.07 116.55 118.09 2i0n n ASP 23 Ca 0.24 0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.61 2i0n n ASP 23 Cb 0.43 -0.13 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 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 -2.92 0.00 -2.32 5.18 -2.24 -1.26 -4.96 114.28 105.76 2i0n n THR 24 Ca 0.00 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.58 2i0n n THR 24 Cb 0.00 -0.15 0.02 0.00 -2.10 0.00 0.00 70.33 68.10 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 -3.29 4.05 -4.56 3.42 2.88 -1.26 -5.07 113.62 109.79 2i0n n SER 25 Ca 0.00 -3.38 -0.25 0.00 -1.33 0.00 0.00 58.87 53.90 2i0n n SER 25 Cb 0.00 -0.41 0.12 0.00 -0.75 0.00 0.00 64.21 63.17 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 -3.58 2.91 -0.31 2.46 2.01 -1.26 -4.06 118.68 116.85 2i0n s LEU 26 Ca 0.44 -0.15 0.01 0.00 0.01 0.00 0.00 54.13 54.44 2i0n s LEU 26 Cb 0.40 -2.15 0.15 0.00 0.01 0.00 0.00 46.19 44.60 2i0n s LEU 26 CO -0.03 -2.05 0.35 -0.22 1.01 0.00 0.00 176.35 175.41 2i0n s LEU 27 N -5.32 -0.38 0.54 1.79 0.20 -1.26 -4.16 118.68 110.09 2i0n s LEU 27 Ca 0.68 -0.80 -0.15 0.00 0.69 0.00 0.00 54.13 54.55 2i0n s LEU 27 Cb -0.05 0.71 -0.07 0.00 -0.43 0.00 0.00 46.19 46.34 2i0n s LEU 27 CO 0.46 -0.35 1.00 -2.16 -0.29 0.00 0.00 176.35 175.01 2i0n s PRO 28 N 2.24 3.84 0.38 0.98 0.04 -1.26 -4.65 135.00 136.57 2i0n s PRO 28 Ca 0.11 0.92 -0.14 0.00 0.04 0.00 0.00 61.00 61.93 2i0n s PRO 28 Cb -0.14 -2.12 0.05 0.00 0.04 0.00 0.00 34.50 32.33 2i0n s PRO 28 CO -0.27 -0.36 0.74 -0.59 0.04 0.00 0.00 177.00 176.56 2i0n s PHE 29 N -2.74 0.26 0.25 0.56 -0.12 -1.10 -4.97 117.98 110.13 2i0n s PHE 29 Ca 0.58 -0.86 0.09 0.00 -0.05 0.00 0.00 56.93 56.69 2i0n s PHE 29 Cb -0.10 0.69 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 2i0n s PHE 29 CO 0.36 -1.49 0.02 0.21 -0.05 0.00 0.00 175.22 174.27 2i0n s LYS 30 N -2.49 2.37 1.10 1.99 2.20 -1.26 -1.37 119.74 122.29 2i0n s LYS 30 Ca 0.18 -1.34 -0.16 0.00 -0.36 0.00 0.00 55.97 54.28 2i0n s LYS 30 Cb -0.04 -2.22 0.18 0.00 -1.51 0.00 0.00 37.83 34.23 2i0n s LYS 30 CO 0.13 0.38 0.30 -2.13 -0.36 0.00 0.00 175.35 173.67 2i0n n ARG 31 N -0.84 -2.43 -3.75 4.03 0.63 -1.06 -3.36 116.66 109.88 2i0n n ARG 31 Ca -0.07 -0.71 -0.22 0.00 -0.92 0.00 0.00 57.85 55.93 2i0n n ARG 31 Cb 0.58 -1.60 -0.06 0.00 0.45 0.00 0.00 32.46 31.84 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 -1.97 0.42 -4.37 6.15 0.23 -0.49 -4.89 115.26 110.35 2i0n n ASN 32 Ca 0.05 -0.87 -0.28 0.00 -0.53 0.00 0.00 54.58 52.95 2i0n n ASN 32 Cb 0.46 -1.08 -0.13 0.00 -2.08 0.00 0.00 39.78 36.95 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 -3.95 3.15 -0.47 0.53 -1.08 -1.12 -4.92 116.67 108.81 2i0n s ASP 33 Ca 0.02 -0.73 -0.19 0.00 -0.52 0.00 0.00 52.55 51.13 2i0n s ASP 33 Cb -0.01 -0.20 0.04 0.00 -1.46 0.00 0.00 42.92 41.29 2i0n s ASP 33 CO 0.68 0.16 0.57 -0.63 0.52 0.00 0.00 175.17 176.46 2i0n s ILE 34 N -1.07 4.94 -0.29 4.11 1.09 -1.26 0.21 121.20 128.92 2i0n s ILE 34 Ca 0.12 -0.39 -0.16 0.00 -1.10 0.00 0.00 60.65 59.13 2i0n s ILE 34 Cb -0.10 -4.21 -0.02 0.00 -1.06 0.00 0.00 42.46 37.07 2i0n s ILE 34 CO 0.06 -0.66 0.43 -0.63 -0.10 0.00 0.00 174.94 174.03 2i0n s ILE 35 N 2.48 5.12 -1.12 2.92 1.01 -0.42 -4.90 121.20 126.28 2i0n s ILE 35 Ca 0.15 0.51 -0.23 0.00 0.00 0.00 0.00 60.65 61.08 2i0n s ILE 35 Cb -0.18 -3.80 -0.07 0.00 0.01 0.00 0.00 42.46 38.42 2i0n s ILE 35 CO 0.13 0.03 1.92 -0.89 0.00 0.00 0.00 174.94 176.13 2i0n s THR 36 N 2.18 3.56 -0.34 2.92 2.01 -0.98 -2.67 115.64 122.33 2i0n s THR 36 Ca 0.17 -0.85 -0.38 0.00 0.31 0.00 0.00 61.69 60.93 2i0n s THR 36 Cb -0.16 -4.49 -0.14 0.00 0.01 0.00 0.00 72.50 67.72 2i0n s THR 36 CO 0.11 -1.06 2.00 -0.38 -0.69 0.00 0.00 174.62 174.60 2i0n n ILE 37 N 7.73 0.22 -0.02 1.82 5.41 -1.26 -2.61 119.36 130.64 2i0n n ILE 37 Ca 0.44 -0.14 -0.12 0.00 1.00 0.00 0.00 62.75 63.93 2i0n n ILE 37 Cb 0.47 -1.32 -0.14 0.00 -0.71 0.00 0.00 39.64 37.94 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 6.01 1.65 -3.04 1.39 -2.24 -0.20 -4.83 114.28 113.03 2i0n n THR 38 Ca 0.37 -0.76 0.01 0.00 -2.27 0.00 0.00 64.05 61.40 2i0n n THR 38 Cb 0.15 -1.22 -0.00 0.00 -2.10 0.00 0.00 70.33 67.15 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 -2.58 -1.29 0.00 4.78 5.36 -0.72 -5.04 117.98 118.49 2i0n s PHE 39 Ca -0.10 0.14 0.00 0.00 -0.96 0.00 0.00 56.93 56.01 2i0n s PHE 39 Cb 0.08 0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.99 2i0n s PHE 39 CO 0.81 -0.88 0.00 0.36 -1.46 0.00 0.00 175.22 174.04 2i0n n LYS 40 N 4.07 1.71 0.00 10.12 2.85 -1.26 -2.28 118.16 133.37 2i0n n LYS 40 Ca 0.10 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.36 2i0n n LYS 40 Cb 0.59 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.97 2i0n n LYS 40 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2i0n n ASP 41 N 0.00 0.00 0.00 -5.58 8.00 -1.26 -4.52 116.55 113.19 2i0n n ASP 41 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2i0n n ASP 41 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2i0n n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i0n n GLN 42 N 0.00 0.00 -1.12 -1.24 6.02 -1.26 -1.04 117.38 118.74 2i0n n GLN 42 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.95 2i0n n GLN 42 Cb 0.00 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.22 2i0n n GLN 42 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2i0n n GLU 43 N 0.00 0.00 -1.51 -1.09 0.28 -1.26 -4.97 120.64 112.08 2i0n n GLU 43 Ca 0.00 -1.25 -0.18 0.00 -0.16 0.00 0.00 57.16 55.58 2i0n n GLU 43 Cb 0.00 0.35 -0.08 0.00 1.43 0.00 0.00 31.44 33.14 2i0n n GLU 43 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2i0n n ASN 44 N 0.13 -4.69 -0.22 -1.84 5.15 -0.21 -4.65 115.26 108.94 2i0n n ASN 44 Ca -0.18 0.44 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 2i0n n ASN 44 Cb 0.82 -4.21 0.00 0.00 -0.53 0.00 0.00 39.78 35.86 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 -2.16 0.00 -2.74 1.20 3.00 -1.26 -4.83 118.16 111.37 2i0n n LYS 45 Ca -0.18 -0.25 -0.05 0.00 -0.00 0.00 0.00 58.31 57.83 2i0n n LYS 45 Cb 0.58 -0.17 0.03 0.00 0.00 0.00 0.00 35.03 35.47 2i0n n LYS 45 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.40 178.31 2i0n n TRP 46 N 0.00 -3.22 -1.68 5.64 7.02 -1.25 -4.42 117.44 119.53 2i0n n TRP 46 Ca 0.00 -1.36 -0.35 0.00 -1.02 0.00 0.00 57.50 54.77 2i0n n TRP 46 Cb 0.53 1.45 0.07 0.00 -2.42 0.00 0.00 31.31 30.94 2i0n n TRP 46 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 2i0n s PHE 47 N 0.80 2.18 -0.31 -5.99 0.40 0.11 -4.62 117.98 110.54 2i0n s PHE 47 Ca 0.30 1.55 -0.07 0.00 -0.60 0.00 0.00 56.93 58.11 2i0n s PHE 47 Cb 0.09 -3.51 0.02 0.00 0.51 0.00 0.00 43.02 40.13 2i0n s PHE 47 CO -0.11 -2.52 0.09 1.41 0.70 0.00 0.00 175.22 174.78 2i0n s MET 48 N -3.63 2.89 0.21 0.44 1.75 -0.96 -2.05 119.30 117.94 2i0n s MET 48 Ca 0.77 -0.99 0.06 0.00 -1.25 0.00 0.00 55.69 54.27 2i0n s MET 48 Cb -0.31 -3.41 -0.05 0.00 2.84 0.00 0.00 34.83 33.91 2i0n s MET 48 CO 0.40 -0.54 -0.09 0.20 -0.65 0.00 0.00 175.02 174.35 2i0n s GLY 49 N 1.46 1.44 -0.01 2.11 0.00 -1.06 -1.03 107.32 110.23 2i0n s GLY 49 Ca 0.01 -1.69 -0.04 0.00 0.00 0.00 0.00 44.72 43.00 2i0n s GLY 49 CO 0.02 -1.71 0.08 1.62 0.00 0.00 0.00 173.10 173.11 2i0n s GLN 50 N -3.73 0.28 0.00 2.90 -0.44 -1.07 -1.18 119.66 116.42 2i0n s GLN 50 Ca 0.24 -0.21 0.00 0.00 -2.50 0.00 0.00 55.36 52.89 2i0n s GLN 50 Cb 0.02 0.12 0.00 0.00 -1.64 0.00 0.00 33.01 31.51 2i0n s GLN 50 CO 0.07 -0.06 0.00 1.47 0.50 0.00 0.00 175.29 177.27 2i0n n LEU 51 N 2.18 0.00 -4.43 3.68 -0.00 -0.48 -2.31 117.00 115.63 2i0n n LEU 51 Ca -0.18 0.00 -0.46 0.00 -0.00 0.00 0.00 56.01 55.37 2i0n n LEU 51 Cb 0.57 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.85 2i0n n LEU 51 CO 0.22 0.00 2.09 0.59 -0.00 0.00 0.00 177.39 180.29 2i0n n ASN 52 N -0.05 0.46 0.00 1.45 3.02 -1.26 -1.67 115.26 117.21 2i0n n ASN 52 Ca 0.00 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 2i0n n ASN 52 Cb 0.00 -0.93 0.00 0.00 -0.61 0.00 0.00 39.78 38.24 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 6.76 2.31 0.00 7.41 0.00 -1.26 -5.06 105.19 115.35 2i0n n GLY 53 Ca 0.62 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2i0n n GLY 53 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i0n n LYS 54 N 0.00 0.00 -4.58 1.61 4.76 -0.67 -5.16 118.16 114.12 2i0n n LYS 54 Ca 0.00 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.14 2i0n n LYS 54 Cb 0.00 0.00 -0.13 0.00 -1.84 0.00 0.00 35.03 33.06 2i0n n LYS 54 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2i0n s GLU 55 N 0.97 1.70 0.00 1.97 -1.05 -1.26 -1.39 118.70 119.65 2i0n s GLU 55 Ca 0.00 -1.18 0.00 0.00 -0.15 0.00 0.00 54.97 53.64 2i0n s GLU 55 Cb 0.00 -2.01 0.00 0.00 -0.44 0.00 0.00 34.13 31.68 2i0n s GLU 55 CO 0.00 0.49 0.00 0.41 0.95 0.00 0.00 175.26 177.11 2i0n n GLY 56 N 1.27 3.02 3.33 -3.83 0.00 -0.33 -4.47 105.19 104.18 2i0n n GLY 56 Ca -0.17 -0.30 -0.18 0.00 0.00 0.00 0.00 46.02 45.37 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 1.44 -0.10 1.61 0.01 -1.26 -2.56 113.70 114.84 2i0n s SER 57 Ca 0.00 -1.50 -0.33 0.00 1.31 0.00 0.00 55.95 55.43 2i0n s SER 57 Cb 0.00 0.32 0.13 0.00 0.21 0.00 0.00 66.02 66.68 2i0n s SER 57 CO 0.00 -0.84 1.27 0.72 0.41 0.00 0.00 173.24 174.80 2i0n s PHE 58 N -3.65 -0.07 0.32 2.43 -0.12 -0.87 -4.11 117.98 111.91 2i0n s PHE 58 Ca 0.36 -0.00 -0.29 0.00 -0.05 0.00 0.00 56.93 56.95 2i0n s PHE 58 Cb 0.06 0.53 -0.10 0.00 -0.63 0.00 0.00 43.02 42.88 2i0n s PHE 58 CO 0.16 -0.22 1.32 -1.25 -0.05 0.00 0.00 175.22 175.18 2i0n s PRO 59 N -2.38 4.35 0.22 1.99 0.04 -1.26 -0.71 135.00 137.24 2i0n s PRO 59 Ca 0.12 2.22 -0.08 0.00 0.04 0.00 0.00 61.00 63.30 2i0n s PRO 59 Cb 0.02 -3.08 0.35 0.00 0.04 0.00 0.00 34.50 31.84 2i0n s PRO 59 CO -0.04 -0.21 1.69 0.28 0.04 0.00 0.00 177.00 178.77 2i0n h VAL 60 N 3.10 0.58 0.00 -0.36 2.07 -1.88 0.37 116.25 120.14 2i0n h VAL 60 Ca -0.49 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2i0n h VAL 60 Cb 1.23 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2i0n h VAL 60 CO 0.67 0.05 0.00 -0.67 0.02 0.00 0.00 177.57 177.63 2i0n n ASP 61 N -5.15 0.07 0.00 0.57 2.03 -1.26 -1.93 116.55 110.89 2i0n n ASP 61 Ca 0.11 0.53 0.12 0.00 0.52 0.00 0.00 54.79 56.06 2i0n n ASP 61 Cb 0.37 -0.54 0.55 0.00 -0.72 0.00 0.00 41.12 40.78 2i0n n ASP 61 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2i0n n HIS 62 N -1.59 0.00 -3.80 -0.67 -0.00 0.13 -4.65 115.22 104.64 2i0n n HIS 62 Ca 0.01 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.07 2i0n n HIS 62 Cb 0.08 -0.45 -0.14 0.00 -0.12 0.00 0.00 29.99 29.37 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 -2.90 -0.02 -0.03 3.57 -7.23 -0.81 0.11 120.40 113.08 2i0n s VAL 63 Ca 0.15 0.07 -0.17 0.00 -1.81 0.00 0.00 61.98 60.22 2i0n s VAL 63 Cb 0.16 -0.18 -0.05 0.00 0.56 0.00 0.00 36.38 36.87 2i0n s VAL 63 CO 0.44 0.03 0.46 -0.70 -0.31 0.00 0.00 175.10 175.02 2i0n s GLU 64 N 0.49 4.12 -0.04 4.82 2.12 0.92 -4.73 118.70 126.40 2i0n s GLU 64 Ca -0.04 0.48 -0.25 0.00 0.36 0.00 0.00 54.97 55.52 2i0n s GLU 64 Cb -0.05 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 31.00 2i0n s GLU 64 CO -0.02 0.50 0.79 0.42 -0.54 0.00 0.00 175.26 176.40 2i0n s ILE 65 N -0.49 4.98 -0.39 -3.70 -1.09 -1.26 0.91 121.20 120.16 2i0n s ILE 65 Ca 0.25 1.64 -0.11 0.00 -2.23 0.00 0.00 60.65 60.20 2i0n s ILE 65 Cb -0.17 -4.13 0.04 0.00 -1.58 0.00 0.00 42.46 36.62 2i0n s ILE 65 CO 0.13 0.23 0.22 -0.76 -1.23 0.00 0.00 174.94 173.54 2i0n s LEU 66 N 0.82 4.84 0.00 2.97 1.43 0.99 -4.92 118.68 124.81 2i0n s LEU 66 Ca 0.42 -1.10 0.27 0.00 -1.03 0.00 0.00 54.13 52.69 2i0n s LEU 66 Cb -0.19 -2.02 1.03 0.00 0.03 0.00 0.00 46.19 45.04 2i0n s LEU 66 CO 0.21 -0.42 1.73 0.18 0.23 0.00 0.00 176.35 178.28 2i0n n LEU 67 N 4.99 1.47 -2.68 1.79 4.32 -1.26 -2.77 117.00 122.86 2i0n n LEU 67 Ca -0.12 -0.51 -0.16 0.00 -0.02 0.00 0.00 56.01 55.20 2i0n n LEU 67 Cb 0.45 -0.02 -0.07 0.00 -1.62 0.00 0.00 43.42 42.17 2i0n n LEU 67 CO 0.37 0.26 1.89 -0.24 -1.22 0.00 0.00 177.39 178.45 2i0n n SER 68 N 0.15 4.55 0.00 -1.43 2.88 -1.26 -4.80 113.62 113.71 2i0n n SER 68 Ca 0.19 -2.25 0.00 0.00 -1.33 0.00 0.00 58.87 55.47 2i0n n SER 68 Cb 0.34 -1.06 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 2i0n n SER 68 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2i0n n ASP 69 N 3.37 0.00 -4.32 -3.46 2.03 -1.26 -4.54 116.55 108.37 2i0n n ASP 69 Ca 0.40 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.41 2i0n n ASP 69 Cb 0.38 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.63 2i0n n ASP 69 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2i0n s VAL 70 N 0.00 2.03 0.46 5.18 1.01 -1.26 -4.63 120.40 123.19 2i0n s VAL 70 Ca 0.00 -1.24 -0.21 0.00 0.00 0.00 0.00 61.98 60.53 2i0n s VAL 70 Cb 0.00 -1.72 -0.09 0.00 0.00 0.00 0.00 36.38 34.57 2i0n s VAL 70 CO 0.00 0.43 1.03 -2.16 0.00 0.00 0.00 175.10 174.40 2i0n s PRO 71 N -0.97 3.95 0.30 2.72 0.04 -1.26 -5.01 135.00 134.77 2i0n s PRO 71 Ca 0.10 1.36 -0.28 0.00 0.04 0.00 0.00 61.00 62.22 2i0n s PRO 71 Cb -0.10 -2.21 -0.09 0.00 0.04 0.00 0.00 34.50 32.14 2i0n s PRO 71 CO 0.01 -0.30 1.10 -1.25 0.04 0.00 0.00 177.00 176.59 2i0n s PRO 72 N -3.05 4.54 -0.43 0.56 0.04 -1.26 -4.96 135.00 130.44 2i0n s PRO 72 Ca 0.64 1.77 -0.28 0.00 0.04 0.00 0.00 61.00 63.17 2i0n s PRO 72 Cb -0.16 -3.08 -0.00 0.00 0.04 0.00 0.00 34.50 31.30 2i0n s PRO 72 CO 0.20 0.13 1.58 -1.25 0.04 0.00 0.00 177.00 177.71 2i0n s PRO 73 N -1.63 3.35 -0.01 0.56 0.04 -1.26 -4.89 135.00 131.16 2i0n s PRO 73 Ca 0.47 0.97 -0.25 0.00 0.04 0.00 0.00 61.00 62.23 2i0n s PRO 73 Cb -0.31 -4.14 -0.18 0.00 0.04 0.00 0.00 34.50 29.92 2i0n s PRO 73 CO 0.39 -1.85 1.23 0.37 0.04 0.00 0.00 177.00 177.18 2i0n h GLN 74 N 11.92 -0.17 -6.05 4.56 -0.00 -1.92 -3.39 115.11 120.05 2i0n h GLN 74 Ca -0.29 0.01 -0.51 0.00 -0.00 0.00 0.00 58.65 57.86 2i0n h GLN 74 Cb 1.13 0.04 -0.04 0.00 0.00 0.00 0.00 27.48 28.61 2i0n h GLN 74 CO 1.10 0.21 1.29 -1.25 0.00 0.00 0.00 178.83 180.19 2i0n s PRO 75 N -4.40 2.73 -0.30 -2.39 0.04 -1.26 -4.88 135.00 124.54 2i0n s PRO 75 Ca -0.15 0.43 -0.15 0.00 0.04 0.00 0.00 61.00 61.17 2i0n s PRO 75 Cb 0.02 -4.36 0.17 0.00 0.04 0.00 0.00 34.50 30.37 2i0n s PRO 75 CO 0.60 -2.63 1.02 0.54 0.04 0.00 0.00 177.00 176.57 2i0n s VAL 76 N 8.44 -0.46 -0.32 -0.36 0.11 -1.26 -5.05 120.40 121.50 2i0n s VAL 76 Ca 0.61 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.53 2i0n s VAL 76 Cb -0.12 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 2i0n s VAL 76 CO 0.19 0.00 0.33 1.57 -3.33 0.00 0.00 175.10 173.87 2i0n n HIS 77 N 4.94 -2.86 -2.20 1.54 -0.00 -1.26 -4.77 115.22 110.61 2i0n n HIS 77 Ca -0.09 1.21 -0.33 0.00 -0.00 0.00 0.00 57.72 58.51 2i0n n HIS 77 Cb 0.53 -3.04 -0.04 0.00 -0.00 0.00 0.00 29.99 27.43 2i0n n HIS 77 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 2i0n s PRO 78 N -2.01 2.85 0.58 1.57 0.04 -1.26 -4.97 135.00 131.79 2i0n s PRO 78 Ca 0.16 -0.28 -0.17 0.00 0.04 0.00 0.00 61.00 60.75 2i0n s PRO 78 Cb -0.03 -4.91 -0.04 0.00 0.04 0.00 0.00 34.50 29.56 2i0n s PRO 78 CO 0.66 -2.89 1.08 0.54 0.04 0.00 0.00 177.00 176.43 2i0n s VAL 79 N 8.40 3.57 -2.00 -0.36 0.11 -1.26 -5.30 120.40 123.56 2i0n s VAL 79 Ca 0.61 0.83 0.29 0.00 -2.93 0.00 0.00 61.98 60.78 2i0n s VAL 79 Cb -0.07 -3.32 0.84 0.00 -1.53 0.00 0.00 36.38 32.30 2i0n s VAL 79 CO 0.03 -0.36 2.09 0.00 -3.33 0.00 0.00 175.10 173.53