#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j00 s GLN 3 N 0.00 4.58 -0.30 5.31 -0.21 -1.26 -4.51 119.66 123.27 2j00 s GLN 3 Ca 0.00 1.19 -0.00 0.00 0.02 0.00 0.00 55.36 56.56 2j00 s GLN 3 Cb 0.00 -3.32 0.09 0.00 1.00 0.00 0.00 33.01 30.79 2j00 s GLN 3 CO 0.00 0.41 0.08 0.71 -2.12 0.00 0.00 175.29 174.37 2j00 s TYR 4 N -0.57 1.90 0.10 0.91 1.51 -1.20 -4.92 117.35 115.07 2j00 s TYR 4 Ca 0.39 -1.79 0.07 0.00 -1.01 0.00 0.00 57.07 54.73 2j00 s TYR 4 Cb -0.22 -1.77 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 2j00 s TYR 4 CO 0.26 -0.86 -0.11 -0.47 -1.11 0.00 0.00 175.55 173.26 2j00 s TYR 5 N 1.55 2.71 -0.01 2.71 6.14 -1.25 0.51 117.35 129.72 2j00 s TYR 5 Ca 0.08 -0.17 -0.01 0.00 0.64 0.00 0.00 57.07 57.61 2j00 s TYR 5 Cb -0.17 -1.43 0.01 0.00 0.42 0.00 0.00 41.96 40.79 2j00 s TYR 5 CO -0.21 0.41 0.03 0.20 0.64 0.00 0.00 175.55 176.62 2j00 s GLY 6 N -2.15 0.01 -0.41 8.97 0.00 -0.83 -4.21 107.32 108.69 2j00 s GLY 6 Ca 0.21 0.14 -0.29 0.00 0.00 0.00 0.00 44.72 44.78 2j00 s GLY 6 CO 0.13 0.23 1.45 -1.59 0.00 0.00 0.00 173.10 173.31 2j00 s THR 7 N 0.29 3.86 -0.34 0.90 2.01 -1.26 -2.68 115.64 118.42 2j00 s THR 7 Ca -0.02 0.87 -0.18 0.00 0.31 0.00 0.00 61.69 62.66 2j00 s THR 7 Cb -0.03 -4.17 -0.01 0.00 0.01 0.00 0.00 72.50 68.30 2j00 s THR 7 CO -0.01 -0.75 0.52 -0.83 -0.69 0.00 0.00 174.62 172.86 2j00 s GLY 8 N 4.16 1.81 -0.11 4.40 0.00 0.30 -4.45 107.32 113.43 2j00 s GLY 8 Ca 0.62 -0.94 -0.05 0.00 0.00 0.00 0.00 44.72 44.35 2j00 s GLY 8 CO 0.32 1.28 0.26 -1.60 0.00 0.00 0.00 173.10 173.37 2j00 s ARG 9 N 2.41 0.20 -0.29 2.90 3.52 -1.25 0.39 118.95 126.83 2j00 s ARG 9 Ca 0.20 0.60 0.01 0.00 -0.13 0.00 0.00 55.73 56.41 2j00 s ARG 9 Cb -0.15 -0.09 0.20 0.00 -1.56 0.00 0.00 34.95 33.34 2j00 s ARG 9 CO 0.13 -0.19 0.70 0.50 -0.81 0.00 0.00 175.30 175.63 2j00 s ARG 10 N 1.55 0.46 -0.39 5.12 3.00 0.70 -4.71 118.95 124.68 2j00 s ARG 10 Ca -0.07 0.48 -0.14 0.00 -1.00 0.00 0.00 55.73 55.00 2j00 s ARG 10 Cb -0.11 0.22 0.02 0.00 0.00 0.00 0.00 34.95 35.08 2j00 s ARG 10 CO -0.09 -0.84 0.45 1.17 0.00 0.00 0.00 175.30 176.00 2j00 n LYS 11 N 5.35 -2.56 -3.57 5.12 4.81 -1.26 -3.46 118.16 122.59 2j00 n LYS 11 Ca 0.05 2.19 -0.26 0.00 -0.87 0.00 0.00 58.31 59.43 2j00 n LYS 11 Cb 0.55 -5.21 -0.01 0.00 0.02 0.00 0.00 35.03 30.37 2j00 n LYS 11 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2j00 n GLU 12 N -0.02 -3.10 -3.63 1.64 -0.58 -1.26 -4.78 120.64 108.91 2j00 n GLU 12 Ca 0.07 0.39 -0.22 0.00 -0.42 0.00 0.00 57.16 56.99 2j00 n GLU 12 Cb 0.37 -5.08 -0.17 0.00 -0.57 0.00 0.00 31.44 26.00 2j00 n GLU 12 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2j00 s ALA 13 N -2.96 0.20 -0.32 0.62 0.00 -1.23 -1.43 121.76 116.65 2j00 s ALA 13 Ca 0.48 0.04 -0.06 0.00 0.00 0.00 0.00 51.96 52.42 2j00 s ALA 13 Cb -0.26 -0.89 0.03 0.00 0.00 0.00 0.00 23.12 22.00 2j00 s ALA 13 CO 0.59 -0.86 0.09 0.08 0.00 0.00 0.00 175.76 175.65 2j00 s VAL 14 N 2.19 3.74 -0.12 0.00 1.01 -0.40 -0.22 120.40 126.60 2j00 s VAL 14 Ca 0.04 -1.04 -0.03 0.00 0.00 0.00 0.00 61.98 60.95 2j00 s VAL 14 Cb -0.14 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 2j00 s VAL 14 CO -0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 175.10 174.90 2j00 s ALA 15 N 1.41 3.09 -0.41 5.51 0.00 1.28 0.85 121.76 133.48 2j00 s ALA 15 Ca -0.01 -0.82 -0.14 0.00 0.00 0.00 0.00 51.96 50.99 2j00 s ALA 15 Cb -0.19 -1.49 0.03 0.00 0.00 0.00 0.00 23.12 21.47 2j00 s ALA 15 CO 0.02 0.37 0.29 1.03 0.00 0.00 0.00 175.76 177.47 2j00 s ARG 16 N -0.17 2.92 -0.18 0.00 0.52 -0.26 0.11 118.95 121.89 2j00 s ARG 16 Ca 0.04 -1.09 -0.10 0.00 -0.52 0.00 0.00 55.73 54.05 2j00 s ARG 16 Cb -0.13 -3.93 -0.05 0.00 0.52 0.00 0.00 34.95 31.36 2j00 s ARG 16 CO 0.02 -0.78 0.16 0.08 0.02 0.00 0.00 175.30 174.80 2j00 s VAL 17 N 1.63 5.40 -0.04 3.52 1.01 -1.09 -1.07 120.40 129.76 2j00 s VAL 17 Ca 0.04 0.26 0.03 0.00 0.00 0.00 0.00 61.98 62.31 2j00 s VAL 17 Cb -0.20 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2j00 s VAL 17 CO 0.08 0.46 -0.13 -0.36 0.00 0.00 0.00 175.10 175.16 2j00 s PHE 18 N 0.14 1.37 -0.23 5.22 2.99 -0.95 -1.96 117.98 124.56 2j00 s PHE 18 Ca 0.11 -0.40 0.01 0.00 0.00 0.00 0.00 56.93 56.65 2j00 s PHE 18 Cb -0.12 -0.96 0.05 0.00 0.00 0.00 0.00 43.02 42.00 2j00 s PHE 18 CO 0.00 -0.17 -0.09 -0.51 -0.00 0.00 0.00 175.22 174.46 2j00 s LEU 19 N 0.24 2.64 -0.24 -0.37 1.43 0.18 0.44 118.68 123.00 2j00 s LEU 19 Ca -0.06 -1.10 -0.04 0.00 -1.03 0.00 0.00 54.13 51.89 2j00 s LEU 19 Cb -0.11 -1.28 -0.00 0.00 0.03 0.00 0.00 46.19 44.82 2j00 s LEU 19 CO 0.02 -0.19 -0.02 -0.13 0.23 0.00 0.00 176.35 176.27 2j00 s ARG 20 N 1.33 3.29 0.77 1.70 3.00 -1.12 -3.26 118.95 124.66 2j00 s ARG 20 Ca -0.05 -0.69 -0.15 0.00 0.00 0.00 0.00 55.73 54.84 2j00 s ARG 20 Cb -0.18 -3.09 -0.02 0.00 0.00 0.00 0.00 34.95 31.65 2j00 s ARG 20 CO -0.07 -0.26 0.50 -2.30 0.00 0.00 0.00 175.30 173.17 2j00 n PRO 21 N 4.80 0.17 0.00 3.54 -0.02 -1.25 0.26 135.00 142.51 2j00 n PRO 21 Ca -0.17 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 2j00 n PRO 21 Cb 0.50 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2j00 n PRO 21 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2j00 n GLY 22 N 1.62 0.51 0.00 -1.23 0.00 0.31 -4.43 105.19 101.98 2j00 n GLY 22 Ca 0.09 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2j00 n GLY 22 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2j00 n ASN 23 N 0.00 0.00 0.00 1.61 5.03 -1.26 -3.71 115.26 116.93 2j00 n ASN 23 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 2j00 n ASN 23 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2j00 n ASN 23 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2j00 n GLY 24 N 0.00 0.42 3.53 7.41 0.00 -1.26 -2.81 105.19 112.47 2j00 n GLY 24 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 2j00 n GLY 24 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2j00 n LYS 25 N 0.00 0.84 -4.96 1.61 2.85 -1.26 -4.57 118.16 112.67 2j00 n LYS 25 Ca 0.00 0.30 -0.28 0.00 -1.05 0.00 0.00 58.31 57.28 2j00 n LYS 25 Cb 0.06 -1.59 -0.16 0.00 -0.65 0.00 0.00 35.03 32.69 2j00 n LYS 25 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2j00 s VAL 26 N -0.79 1.62 0.10 0.58 1.01 -1.26 -2.06 120.40 119.60 2j00 s VAL 26 Ca 0.65 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 61.88 2j00 s VAL 26 Cb -0.83 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 2j00 s VAL 26 CO 0.57 0.46 -0.15 -0.89 0.00 0.00 0.00 175.10 175.09 2j00 s THR 27 N 0.07 1.27 -0.11 3.92 2.01 -0.71 -1.62 115.64 120.47 2j00 s THR 27 Ca -0.06 -1.52 -0.07 0.00 0.31 0.00 0.00 61.69 60.35 2j00 s THR 27 Cb -0.13 -1.33 0.04 0.00 0.01 0.00 0.00 72.50 71.09 2j00 s THR 27 CO 0.03 -0.30 0.28 -0.69 -0.69 0.00 0.00 174.62 173.25 2j00 s VAL 28 N -1.67 -0.03 -0.96 3.82 1.01 -0.62 0.39 120.40 122.35 2j00 s VAL 28 Ca 0.04 0.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 2j00 s VAL 28 Cb -0.08 -0.42 0.12 0.00 0.00 0.00 0.00 36.38 36.01 2j00 s VAL 28 CO 0.03 0.04 0.30 0.59 0.00 0.00 0.00 175.10 176.06 2j00 n ASN 29 N 3.84 -1.11 -0.10 3.32 4.13 -1.00 -0.39 115.26 123.96 2j00 n ASN 29 Ca -0.21 -0.54 0.00 0.00 1.68 0.00 0.00 54.58 55.51 2j00 n ASN 29 Cb 0.55 -0.99 0.00 0.00 -1.54 0.00 0.00 39.78 37.80 2j00 n ASN 29 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2j00 n GLY 30 N -0.74 0.86 3.34 7.41 0.00 -1.26 -5.09 105.19 109.71 2j00 n GLY 30 Ca 0.06 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 2j00 n GLY 30 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j00 s GLN 31 N -3.28 1.10 -0.01 1.61 -0.21 0.47 -5.12 119.66 114.22 2j00 s GLN 31 Ca 0.00 -0.62 -0.30 0.00 0.02 0.00 0.00 55.36 54.46 2j00 s GLN 31 Cb 0.00 0.49 -0.06 0.00 1.00 0.00 0.00 33.01 34.44 2j00 s GLN 31 CO 0.00 -0.44 1.54 0.34 -2.12 0.00 0.00 175.29 174.61 2j00 s ASP 32 N -2.71 6.74 0.02 5.90 -1.08 -1.26 -1.59 116.67 122.68 2j00 s ASP 32 Ca 0.02 2.23 -0.03 0.00 -0.52 0.00 0.00 52.55 54.24 2j00 s ASP 32 Cb 0.01 -2.55 -0.01 0.00 -1.46 0.00 0.00 42.92 38.91 2j00 s ASP 32 CO -0.11 -0.83 0.68 0.33 0.52 0.00 0.00 175.17 175.76 2j00 n PHE 33 N 6.02 -0.05 0.18 -5.34 7.35 -0.64 0.15 117.46 125.14 2j00 n PHE 33 Ca 0.15 0.13 0.01 0.00 -0.76 0.00 0.00 57.45 56.98 2j00 n PHE 33 Cb 0.43 -0.35 0.05 0.00 0.35 0.00 0.00 39.48 39.95 2j00 n PHE 33 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 2j00 n ASN 34 N -2.99 0.00 -0.05 -2.13 4.13 -1.26 -2.02 115.26 110.94 2j00 n ASN 34 Ca 0.00 -0.13 -0.07 0.00 1.68 0.00 0.00 54.58 56.06 2j00 n ASN 34 Cb 0.03 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.22 2j00 n ASN 34 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 2j00 n GLU 35 N -0.79 0.29 0.26 3.52 2.13 0.40 -4.05 120.64 122.40 2j00 n GLU 35 Ca 0.01 0.06 0.15 0.00 0.66 0.00 0.00 57.16 58.05 2j00 n GLU 35 Cb 0.01 -1.21 0.60 0.00 0.27 0.00 0.00 31.44 31.10 2j00 n GLU 35 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 2j00 h TYR 36 N 0.00 0.00 -0.90 4.31 3.20 -0.45 -2.92 116.97 120.21 2j00 h TYR 36 Ca -0.24 0.00 -0.56 0.00 3.14 0.00 0.00 58.73 61.07 2j00 h TYR 36 Cb 1.37 0.00 -0.43 0.00 1.54 0.00 0.00 36.73 39.22 2j00 h TYR 36 CO 0.01 0.06 -0.79 1.19 -1.64 0.00 0.00 178.16 176.99 2j00 n PHE 37 N -3.17 2.88 -2.54 -3.82 0.99 -0.85 -5.04 117.46 105.91 2j00 n PHE 37 Ca 0.01 -2.39 -0.43 0.00 -0.00 0.00 0.00 57.45 54.64 2j00 n PHE 37 Cb 0.35 -0.30 -0.02 0.00 -1.00 0.00 0.00 39.48 38.51 2j00 n PHE 37 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.76 175.62 2j00 s GLN 38 N -3.59 4.33 0.00 -1.08 0.74 -1.11 -3.35 119.66 115.60 2j00 s GLN 38 Ca 0.51 1.56 0.00 0.00 0.05 0.00 0.00 55.36 57.47 2j00 s GLN 38 Cb 0.41 -3.61 0.00 0.00 1.10 0.00 0.00 33.01 30.91 2j00 s GLN 38 CO -0.00 -0.50 0.00 0.41 -0.55 0.00 0.00 175.29 174.65 2j00 n GLY 39 N 3.35 3.29 3.60 2.59 0.00 -1.26 -5.05 105.19 111.70 2j00 n GLY 39 Ca 0.11 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2j00 n GLY 39 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2j00 s LEU 40 N 0.00 3.48 0.00 0.99 1.43 -1.21 -4.82 118.68 118.54 2j00 s LEU 40 Ca 0.00 1.36 0.09 0.00 -1.03 0.00 0.00 54.13 54.55 2j00 s LEU 40 Cb 0.00 -3.43 0.57 0.00 0.03 0.00 0.00 46.19 43.36 2j00 s LEU 40 CO 0.00 -1.83 1.13 0.52 0.23 0.00 0.00 176.35 176.40 2j00 n VAL 41 N 7.49 0.00 0.71 -1.59 0.31 -1.26 -1.68 118.33 122.31 2j00 n VAL 41 Ca 0.24 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.66 2j00 n VAL 41 Cb 0.47 -0.36 0.05 0.00 -0.91 0.00 0.00 33.84 33.09 2j00 n VAL 41 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2j00 n ARG 42 N -0.71 1.45 0.41 5.55 0.63 -1.26 -4.56 116.66 118.16 2j00 n ARG 42 Ca 0.07 -1.32 -0.19 0.00 -0.92 0.00 0.00 57.85 55.49 2j00 n ARG 42 Cb 0.03 -1.31 -0.10 0.00 0.45 0.00 0.00 32.46 31.54 2j00 n ARG 42 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2j00 h ALA 43 N 3.18 -1.16 0.00 5.13 0.00 -1.64 -2.00 119.26 122.77 2j00 h ALA 43 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2j00 h ALA 43 Cb 0.66 0.55 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2j00 h ALA 43 CO 0.00 -1.17 0.00 1.33 0.00 0.00 0.00 179.25 179.41 2j00 n VAL 44 N -5.59 0.00 0.01 0.00 0.24 -1.26 -1.43 118.33 110.30 2j00 n VAL 44 Ca -0.14 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.05 2j00 n VAL 44 Cb 0.47 -0.84 -0.14 0.00 -1.47 0.00 0.00 33.84 31.86 2j00 n VAL 44 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2j00 h ALA 45 N 1.42 0.60 0.00 2.33 0.00 -1.66 -3.35 119.26 118.60 2j00 h ALA 45 Ca 0.00 -1.32 -0.03 0.00 0.00 0.00 0.00 54.91 53.57 2j00 h ALA 45 Cb 0.00 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2j00 h ALA 45 CO 0.00 1.45 -0.13 0.00 0.00 0.00 0.00 179.25 180.56 2j00 h ALA 46 N 0.84 1.31 -0.00 0.00 0.00 -1.37 -2.10 119.26 117.94 2j00 h ALA 46 Ca -0.24 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2j00 h ALA 46 Cb 1.97 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2j00 h ALA 46 CO 0.10 0.17 -0.37 1.28 0.00 0.00 0.00 179.25 180.42 2j00 n LEU 47 N -3.69 0.72 -0.15 0.00 4.32 -1.26 -4.17 117.00 112.77 2j00 n LEU 47 Ca -0.02 -0.10 0.28 0.00 -0.02 0.00 0.00 56.01 56.15 2j00 n LEU 47 Cb 0.25 -0.20 0.72 0.00 -1.62 0.00 0.00 43.42 42.57 2j00 n LEU 47 CO 0.31 0.15 1.26 -0.08 -1.22 0.00 0.00 177.39 177.81 2j00 h GLU 48 N 0.54 0.00 -0.58 3.23 4.57 -1.51 -1.77 114.58 119.06 2j00 h GLU 48 Ca 0.00 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.14 2j00 h GLU 48 Cb 0.50 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 2j00 h GLU 48 CO 0.00 0.00 0.21 -1.00 -1.18 0.00 0.00 179.01 177.04 2j00 h PRO 49 N 0.00 0.88 -0.81 0.92 0.13 -1.80 -2.50 132.00 128.81 2j00 h PRO 49 Ca 0.41 -0.17 -0.02 0.00 -0.87 0.00 0.00 66.00 65.35 2j00 h PRO 49 Cb 1.76 -0.14 -0.04 0.00 0.13 0.00 0.00 31.00 32.72 2j00 h PRO 49 CO -0.00 0.76 0.44 -0.07 -0.23 0.00 0.00 178.00 178.91 2j00 h LEU 50 N 0.80 1.01 -0.57 1.56 3.38 -1.65 -2.21 115.31 117.63 2j00 h LEU 50 Ca 0.19 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2j00 h LEU 50 Cb 0.23 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2j00 h LEU 50 CO -0.01 0.81 0.00 0.54 0.09 0.00 0.00 178.44 179.87 2j00 n ARG 51 N -4.35 0.20 -2.74 1.13 1.74 -0.94 0.20 116.66 111.90 2j00 n ARG 51 Ca 0.08 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.08 2j00 n ARG 51 Cb 0.10 -1.06 0.07 0.00 -1.02 0.00 0.00 32.46 30.55 2j00 n ARG 51 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2j00 n ALA 52 N 0.01 -1.24 0.00 7.54 0.00 -0.83 -3.03 120.51 122.96 2j00 n ALA 52 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 53.44 52.06 2j00 n ALA 52 Cb 0.03 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2j00 n ALA 52 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2j00 n VAL 53 N 1.08 0.00 0.00 0.00 0.24 -1.13 -4.96 118.33 113.57 2j00 n VAL 53 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 2j00 n VAL 53 Cb 0.66 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.03 2j00 n VAL 53 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2j00 n ASP 54 N -0.16 0.00 -3.92 -1.34 8.00 0.54 -5.11 116.55 114.55 2j00 n ASP 54 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 2j00 n ASP 54 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2j00 n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j00 n ALA 55 N 0.00 4.40 -0.13 2.24 0.00 -0.96 -4.79 120.51 121.27 2j00 n ALA 55 Ca 0.00 -4.72 -0.27 0.00 0.00 0.00 0.00 53.44 48.45 2j00 n ALA 55 Cb 0.00 -1.80 -0.09 0.00 0.00 0.00 0.00 19.45 17.56 2j00 n ALA 55 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2j00 n LEU 56 N 1.62 1.95 -2.49 0.00 0.00 -1.26 -4.50 117.00 112.32 2j00 n LEU 56 Ca 0.25 0.35 -0.14 0.00 0.00 0.00 0.00 56.01 56.48 2j00 n LEU 56 Cb 0.37 -0.83 -0.08 0.00 0.00 0.00 0.00 43.42 42.88 2j00 n LEU 56 CO 0.51 0.46 1.68 0.61 0.00 0.00 0.00 177.39 180.65 2j00 n GLY 57 N 1.29 2.66 0.00 -3.96 0.00 -1.26 -3.31 105.19 100.61 2j00 n GLY 57 Ca -0.48 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2j00 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j00 n ARG 58 N 3.10 2.83 -4.01 1.61 1.74 -1.12 -4.85 116.66 115.96 2j00 n ARG 58 Ca 0.36 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 57.13 2j00 n ARG 58 Cb 0.47 -0.31 -0.15 0.00 -1.02 0.00 0.00 32.46 31.45 2j00 n ARG 58 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2j00 s PHE 59 N -0.23 3.03 -1.17 -1.55 0.40 -1.21 0.12 117.98 117.36 2j00 s PHE 59 Ca 0.00 -2.23 -0.21 0.00 -0.60 0.00 0.00 56.93 53.89 2j00 s PHE 59 Cb 0.00 -1.95 -0.02 0.00 0.51 0.00 0.00 43.02 41.57 2j00 s PHE 59 CO 0.00 -0.86 1.82 -0.51 0.70 0.00 0.00 175.22 176.38 2j00 s ASP 60 N 1.18 5.78 0.15 1.36 1.01 0.74 -4.53 116.67 122.35 2j00 s ASP 60 Ca -0.05 -1.78 -0.31 0.00 0.71 0.00 0.00 52.55 51.12 2j00 s ASP 60 Cb -0.19 -2.58 -0.09 0.00 1.01 0.00 0.00 42.92 41.07 2j00 s ASP 60 CO -0.06 -2.26 1.45 0.00 0.21 0.00 0.00 175.17 174.51 2j00 s ALA 61 N 8.10 3.66 -0.38 5.23 0.00 -0.87 -2.78 121.76 134.70 2j00 s ALA 61 Ca 0.62 1.22 0.02 0.00 0.00 0.00 0.00 51.96 53.81 2j00 s ALA 61 Cb 0.00 -3.57 0.11 0.00 0.00 0.00 0.00 23.12 19.66 2j00 s ALA 61 CO 0.08 -0.68 0.13 -0.47 0.00 0.00 0.00 175.76 174.81 2j00 s TYR 62 N 0.99 3.66 0.29 0.00 5.04 0.17 -1.73 117.35 125.77 2j00 s TYR 62 Ca 0.66 -2.84 0.08 0.00 -2.44 0.00 0.00 57.07 52.53 2j00 s TYR 62 Cb -0.40 -3.02 -0.04 0.00 0.35 0.00 0.00 41.96 38.86 2j00 s TYR 62 CO 0.32 -0.94 0.18 0.42 -1.34 0.00 0.00 175.55 174.19 2j00 s ILE 63 N 0.85 3.87 -0.35 3.14 1.09 0.16 -2.24 121.20 127.72 2j00 s ILE 63 Ca 0.11 -1.52 0.04 0.00 -1.10 0.00 0.00 60.65 58.18 2j00 s ILE 63 Cb -0.21 -3.20 0.16 0.00 -1.06 0.00 0.00 42.46 38.16 2j00 s ILE 63 CO -0.06 -0.29 0.44 -0.89 -0.10 0.00 0.00 174.94 174.04 2j00 s THR 64 N -2.25 -0.59 -0.09 2.92 2.01 -0.23 -2.37 115.64 115.04 2j00 s THR 64 Ca 0.35 -0.52 -0.13 0.00 0.31 0.00 0.00 61.69 61.70 2j00 s THR 64 Cb -0.06 -0.66 -0.05 0.00 0.01 0.00 0.00 72.50 71.74 2j00 s THR 64 CO 0.24 -0.34 0.33 0.54 -0.69 0.00 0.00 174.62 174.69 2j00 s VAL 65 N 1.95 5.23 -0.01 3.82 0.11 -1.26 -1.10 120.40 129.13 2j00 s VAL 65 Ca 0.14 0.64 0.01 0.00 -2.93 0.00 0.00 61.98 59.84 2j00 s VAL 65 Cb -0.12 -3.64 0.01 0.00 -1.53 0.00 0.00 36.38 31.10 2j00 s VAL 65 CO -0.14 0.49 -0.04 -0.60 -3.33 0.00 0.00 175.10 171.47 2j00 s ARG 66 N -0.29 0.47 0.00 1.54 3.52 0.25 -4.77 118.95 119.67 2j00 s ARG 66 Ca 0.20 -0.13 0.00 0.00 -0.13 0.00 0.00 55.73 55.66 2j00 s ARG 66 Cb -0.14 -0.49 0.00 0.00 -1.56 0.00 0.00 34.95 32.75 2j00 s ARG 66 CO 0.08 0.04 0.00 0.41 -0.81 0.00 0.00 175.30 175.02 2j00 n GLY 67 N 3.32 -0.87 0.00 8.12 0.00 -1.26 -1.27 105.19 113.23 2j00 n GLY 67 Ca -0.17 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2j00 n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j00 n GLY 68 N 0.76 -0.10 3.46 -0.02 0.00 -0.51 -3.64 105.19 105.14 2j00 n GLY 68 Ca 0.00 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 2j00 n GLY 68 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2j00 s GLY 69 N 0.00 1.59 0.29 -0.02 0.00 -1.26 -4.96 107.32 102.96 2j00 s GLY 69 Ca 0.00 -1.23 0.03 0.00 0.00 0.00 0.00 44.72 43.52 2j00 s GLY 69 CO 0.00 -1.13 1.46 1.17 0.00 0.00 0.00 173.10 174.60 2j00 n LYS 70 N 1.42 -0.07 -0.07 2.90 3.00 -1.26 0.15 118.16 124.23 2j00 n LYS 70 Ca -0.16 1.39 -0.12 0.00 -0.00 0.00 0.00 58.31 59.42 2j00 n LYS 70 Cb 0.52 -2.22 -0.06 0.00 0.00 0.00 0.00 35.03 33.27 2j00 n LYS 70 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2j00 h SER 71 N 0.00 0.44 -0.61 3.14 0.87 -1.99 -1.07 113.55 114.34 2j00 h SER 71 Ca 0.57 -0.42 0.08 0.00 -1.23 0.00 0.00 61.79 60.80 2j00 h SER 71 Cb 1.20 -0.12 -0.07 0.00 -0.44 0.00 0.00 62.40 62.98 2j00 h SER 71 CO -0.87 0.76 0.26 1.23 -0.53 0.00 0.00 176.83 177.68 2j00 h GLY 72 N 0.11 0.87 0.44 5.77 0.00 0.11 0.51 103.07 110.87 2j00 h GLY 72 Ca 0.04 -0.15 0.08 0.00 0.00 0.00 0.00 47.33 47.30 2j00 h GLY 72 CO 0.03 0.02 0.14 1.46 0.00 0.00 0.00 176.54 178.19 2j00 h GLN 73 N 0.46 0.28 -0.33 4.80 4.20 0.15 0.36 115.11 125.03 2j00 h GLN 73 Ca 0.30 -0.02 0.10 0.00 0.06 0.00 0.00 58.65 59.09 2j00 h GLN 73 Cb 0.33 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2j00 h GLN 73 CO -0.27 0.19 0.29 0.82 -0.67 0.00 0.00 178.83 179.18 2j00 h ILE 74 N 0.29 0.61 0.01 2.54 2.04 0.40 0.18 117.51 123.58 2j00 h ILE 74 Ca 0.25 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.11 2j00 h ILE 74 Cb 0.30 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 2j00 h ILE 74 CO -0.29 0.00 -0.00 0.44 0.00 0.00 0.00 178.15 178.30 2j00 h ASP 75 N 0.00 -0.01 -0.70 1.72 3.32 0.70 -1.47 116.42 119.99 2j00 h ASP 75 Ca 0.16 -0.77 0.13 0.00 0.02 0.00 0.00 57.03 56.57 2j00 h ASP 75 Cb 0.73 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.19 2j00 h ASP 75 CO -0.00 0.78 0.24 0.00 -1.72 0.00 0.00 179.24 178.53 2j00 h ALA 76 N 0.17 0.94 0.36 3.45 0.00 0.61 -1.68 119.26 123.11 2j00 h ALA 76 Ca -0.00 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2j00 h ALA 76 Cb 0.78 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2j00 h ALA 76 CO 0.00 -0.25 -0.17 0.82 0.00 0.00 0.00 179.25 179.65 2j00 h ILE 77 N 0.37 0.65 0.00 0.00 2.04 -0.77 -1.81 117.51 118.00 2j00 h ILE 77 Ca 0.38 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 66.10 2j00 h ILE 77 Cb 0.58 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2j00 h ILE 77 CO -0.41 0.03 0.24 1.17 0.00 0.00 0.00 178.15 179.18 2j00 n LYS 78 N -5.27 0.06 -0.11 2.37 4.81 -0.55 0.04 118.16 119.51 2j00 n LYS 78 Ca -0.10 0.48 -0.14 0.00 -0.87 0.00 0.00 58.31 57.67 2j00 n LYS 78 Cb 0.23 -1.93 -0.14 0.00 0.02 0.00 0.00 35.03 33.21 2j00 n LYS 78 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2j00 n LEU 79 N -1.78 1.44 -0.01 3.14 -0.00 -0.89 -4.11 117.00 114.79 2j00 n LEU 79 Ca -0.01 -0.05 -0.13 0.00 -0.00 0.00 0.00 56.01 55.83 2j00 n LEU 79 Cb 0.25 -0.19 -0.09 0.00 -0.00 0.00 0.00 43.42 43.39 2j00 n LEU 79 CO 0.04 0.71 0.67 1.23 -0.00 0.00 0.00 177.39 180.03 2j00 h GLY 80 N 3.01 0.04 0.98 -3.96 0.00 0.43 0.86 103.07 104.43 2j00 h GLY 80 Ca -0.56 -0.03 0.07 0.00 0.00 0.00 0.00 47.33 46.81 2j00 h GLY 80 CO -0.02 0.03 0.44 -2.22 0.00 0.00 0.00 176.54 174.77 2j00 h ILE 81 N -0.37 0.21 0.00 2.60 1.08 -1.27 1.16 117.51 120.92 2j00 h ILE 81 Ca 0.00 0.00 -0.34 0.00 -0.39 0.00 0.00 64.86 64.13 2j00 h ILE 81 Cb 0.43 0.62 -0.05 0.00 -3.07 0.00 0.00 36.82 34.74 2j00 h ILE 81 CO 0.00 0.00 -1.88 0.00 -0.69 0.00 0.00 178.15 175.58 2j00 n ALA 82 N -2.13 0.98 0.23 1.87 0.00 -0.90 -3.51 120.51 117.05 2j00 n ALA 82 Ca 0.04 -0.78 0.06 0.00 0.00 0.00 0.00 53.44 52.75 2j00 n ALA 82 Cb 0.56 -0.23 0.51 0.00 0.00 0.00 0.00 19.45 20.30 2j00 n ALA 82 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2j00 h ARG 83 N -1.00 0.00 0.34 0.00 2.43 0.16 0.38 114.38 116.69 2j00 h ARG 83 Ca -0.52 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.63 2j00 h ARG 83 Cb 1.45 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.01 2j00 h ARG 83 CO -0.32 0.18 -0.16 0.00 -1.51 0.00 0.00 179.97 178.16 2j00 h ALA 84 N 1.82 -0.45 0.00 2.80 0.00 0.12 -3.28 119.26 120.27 2j00 h ALA 84 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2j00 h ALA 84 Cb 0.32 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2j00 h ALA 84 CO 0.02 -0.47 0.00 1.47 0.00 0.00 0.00 179.25 180.28 2j00 n LEU 85 N -5.08 0.40 0.07 0.00 -0.00 -1.17 -2.40 117.00 108.82 2j00 n LEU 85 Ca -0.08 0.58 -0.05 0.00 -0.00 0.00 0.00 56.01 56.46 2j00 n LEU 85 Cb 0.24 -0.50 0.14 0.00 -0.00 0.00 0.00 43.42 43.30 2j00 n LEU 85 CO 0.21 -0.34 0.53 1.62 -0.00 0.00 0.00 177.39 179.42 2j00 h VAL 86 N 0.00 1.35 0.90 1.47 3.04 -0.98 -3.21 116.25 118.82 2j00 h VAL 86 Ca 0.00 -1.80 -0.04 0.00 -1.01 0.00 0.00 66.70 63.84 2j00 h VAL 86 Cb 0.41 1.85 0.01 0.00 -2.01 0.00 0.00 31.29 31.55 2j00 h VAL 86 CO 0.00 0.54 -0.43 -0.61 -1.01 0.00 0.00 177.57 176.06 2j00 h GLN 87 N 0.24 -1.17 -2.24 4.17 4.15 -1.53 -3.19 115.11 115.54 2j00 h GLN 87 Ca 0.01 0.08 -0.31 0.00 0.77 0.00 0.00 58.65 59.19 2j00 h GLN 87 Cb 1.01 0.27 -0.05 0.00 0.21 0.00 0.00 27.48 28.92 2j00 h GLN 87 CO 0.09 -0.78 0.66 0.66 -1.93 0.00 0.00 178.83 177.53 2j00 n TYR 88 N -5.59 0.63 0.00 3.99 4.02 -1.21 -4.13 117.16 114.86 2j00 n TYR 88 Ca -0.15 -1.90 0.00 0.00 -0.01 0.00 0.00 57.90 55.84 2j00 n TYR 88 Cb 0.48 -1.81 0.00 0.00 -0.02 0.00 0.00 39.34 37.99 2j00 n TYR 88 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2j00 n ASN 89 N 2.72 0.00 0.00 7.72 3.02 -1.21 -5.01 115.26 122.50 2j00 n ASN 89 Ca 0.52 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 2j00 n ASN 89 Cb 0.74 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.91 2j00 n ASN 89 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2j00 n PRO 90 N 0.00 0.00 -0.00 3.52 -0.04 -1.26 -0.93 135.00 136.29 2j00 n PRO 90 Ca 0.00 0.13 0.04 0.00 -0.04 0.00 0.00 63.50 63.63 2j00 n PRO 90 Cb 0.00 -1.53 -0.06 0.00 -0.04 0.00 0.00 33.50 31.87 2j00 n PRO 90 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2j00 n ASP 91 N -1.07 2.82 -0.21 3.54 8.00 -1.26 -4.57 116.55 123.80 2j00 n ASP 91 Ca 0.00 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.44 2j00 n ASP 91 Cb 0.03 1.35 0.00 0.00 -0.02 0.00 0.00 41.12 42.48 2j00 n ASP 91 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2j00 n TYR 92 N -1.74 0.00 0.26 1.24 4.02 -0.11 -2.72 117.16 118.12 2j00 n TYR 92 Ca -0.01 0.00 0.16 0.00 -0.01 0.00 0.00 57.90 58.03 2j00 n TYR 92 Cb 0.21 -0.02 0.60 0.00 -0.02 0.00 0.00 39.34 40.11 2j00 n TYR 92 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2j00 h ARG 93 N 0.23 0.00 -3.89 -0.72 9.65 -1.81 -3.35 114.38 114.50 2j00 h ARG 93 Ca 0.00 0.00 -0.68 0.00 -1.10 0.00 0.00 59.98 58.20 2j00 h ARG 93 Cb 0.10 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.66 2j00 h ARG 93 CO 0.00 0.04 3.10 0.00 2.80 0.00 0.00 179.97 185.91 2j00 n ALA 94 N -2.12 5.49 0.00 2.80 0.00 -1.10 -3.04 120.51 122.54 2j00 n ALA 94 Ca 0.01 -3.64 0.00 0.00 0.00 0.00 0.00 53.44 49.81 2j00 n ALA 94 Cb 0.35 -3.50 0.00 0.00 0.00 0.00 0.00 19.45 16.29 2j00 n ALA 94 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2j00 n LYS 95 N 5.74 0.00 0.20 0.00 -0.00 -1.25 -4.90 118.16 117.95 2j00 n LYS 95 Ca 0.56 0.00 0.14 0.00 -0.00 0.00 0.00 58.31 59.01 2j00 n LYS 95 Cb 0.35 0.00 0.43 0.00 -0.00 0.00 0.00 35.03 35.81 2j00 n LYS 95 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 2j00 h LEU 96 N 0.00 0.00 0.00 -5.58 5.85 -1.70 -1.14 115.31 112.75 2j00 h LEU 96 Ca 0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.41 2j00 h LEU 96 Cb 0.00 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 2j00 h LEU 96 CO 0.00 0.00 -2.06 1.17 -0.34 0.00 0.00 178.44 177.21 2j00 n LYS 97 N -2.80 0.41 0.07 1.25 3.00 -1.23 -2.97 118.16 115.89 2j00 n LYS 97 Ca 0.03 0.17 -0.13 0.00 -0.00 0.00 0.00 58.31 58.38 2j00 n LYS 97 Cb 0.39 -1.21 -0.09 0.00 0.00 0.00 0.00 35.03 34.13 2j00 n LYS 97 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 2j00 h PRO 98 N -0.58 -0.20 -2.54 1.64 0.11 -1.80 -3.28 132.00 125.35 2j00 h PRO 98 Ca -0.47 0.01 -0.69 0.00 0.11 0.00 0.00 66.00 64.96 2j00 h PRO 98 Cb 1.46 0.05 -0.12 0.00 0.11 0.00 0.00 31.00 32.49 2j00 h PRO 98 CO -0.26 0.17 2.16 -0.11 -0.21 0.00 0.00 178.00 179.75 2j00 n LEU 99 N -5.00 7.83 -0.08 2.35 -0.00 -0.43 -4.91 117.00 116.75 2j00 n LEU 99 Ca -0.09 -4.71 0.00 0.00 -0.00 0.00 0.00 56.01 51.21 2j00 n LEU 99 Cb 0.24 -1.35 0.00 0.00 -0.00 0.00 0.00 43.42 42.30 2j00 n LEU 99 CO 0.31 2.01 0.00 0.61 -0.00 0.00 0.00 177.39 180.32 2j00 n GLY 100 N 1.72 0.00 0.33 -3.96 0.00 -1.24 -4.72 105.19 97.32 2j00 n GLY 100 Ca 0.61 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.68 2j00 n GLY 100 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2j00 n PHE 101 N -0.01 0.27 -3.82 1.61 0.99 -1.18 -4.93 117.46 110.39 2j00 n PHE 101 Ca 0.00 -0.61 -0.29 0.00 -0.00 0.00 0.00 57.45 56.54 2j00 n PHE 101 Cb 0.00 -0.09 -0.16 0.00 -1.00 0.00 0.00 39.48 38.24 2j00 n PHE 101 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 2j00 s LEU 102 N -1.47 2.22 -0.30 4.37 0.20 -1.16 -4.85 118.68 117.69 2j00 s LEU 102 Ca 0.17 -1.30 -0.18 0.00 0.69 0.00 0.00 54.13 53.51 2j00 s LEU 102 Cb 0.12 -0.94 0.19 0.00 -0.43 0.00 0.00 46.19 45.13 2j00 s LEU 102 CO 0.07 -0.33 1.24 -0.89 -0.29 0.00 0.00 176.35 176.15 2j00 s THR 103 N 1.57 -0.11 0.29 3.68 2.01 -1.26 -4.92 115.64 116.90 2j00 s THR 103 Ca 0.02 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.02 2j00 s THR 103 Cb -0.18 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.34 2j00 s THR 103 CO -0.13 0.00 0.76 -1.14 -0.69 0.00 0.00 174.62 173.41 2j00 n ARG 104 N 4.42 0.02 -3.24 4.92 0.63 -1.26 -4.80 116.66 117.35 2j00 n ARG 104 Ca -0.08 0.45 -0.15 0.00 -0.92 0.00 0.00 57.85 57.14 2j00 n ARG 104 Cb 0.55 -2.26 0.02 0.00 0.45 0.00 0.00 32.46 31.22 2j00 n ARG 104 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2j00 n ASP 105 N -1.71 -6.40 0.19 6.15 10.43 -1.26 -4.19 116.55 119.77 2j00 n ASP 105 Ca -0.00 0.30 0.14 0.00 2.57 0.00 0.00 54.79 57.80 2j00 n ASP 105 Cb 0.72 -2.19 0.59 0.00 1.84 0.00 0.00 41.12 42.08 2j00 n ASP 105 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2j00 h ALA 106 N 2.89 1.00 -0.83 2.24 0.00 -2.02 -3.43 119.26 119.11 2j00 h ALA 106 Ca -0.21 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 53.97 2j00 h ALA 106 Cb 1.06 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2j00 h ALA 106 CO 0.11 0.00 1.25 0.54 0.00 0.00 0.00 179.25 181.15 2j00 n ARG 107 N -2.59 0.70 -3.71 0.00 1.74 -1.26 -4.92 116.66 106.62 2j00 n ARG 107 Ca 0.01 0.21 -0.10 0.00 -0.77 0.00 0.00 57.85 57.21 2j00 n ARG 107 Cb 0.25 -2.05 -0.05 0.00 -1.02 0.00 0.00 32.46 29.59 2j00 n ARG 107 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2j00 s VAL 108 N 5.96 0.09 0.38 1.55 -7.23 -1.26 -4.78 120.40 115.11 2j00 s VAL 108 Ca 1.10 -0.78 -0.27 0.00 -1.81 0.00 0.00 61.98 60.22 2j00 s VAL 108 Cb -1.13 -1.27 -0.11 0.00 0.56 0.00 0.00 36.38 34.43 2j00 s VAL 108 CO 0.59 -0.39 1.29 0.52 -0.31 0.00 0.00 175.10 176.80 2j00 n VAL 109 N -0.19 2.25 -4.27 1.32 0.31 -1.26 -5.00 118.33 111.50 2j00 n VAL 109 Ca -0.15 -0.50 -0.31 0.00 -0.01 0.00 0.00 64.34 63.37 2j00 n VAL 109 Cb 0.63 -1.59 -0.09 0.00 -0.91 0.00 0.00 33.84 31.88 2j00 n VAL 109 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2j00 s GLU 110 N -2.04 2.38 0.27 5.55 -1.05 -1.26 -5.08 118.70 117.46 2j00 s GLU 110 Ca 0.58 -0.88 -0.28 0.00 -0.15 0.00 0.00 54.97 54.24 2j00 s GLU 110 Cb -0.53 -2.43 -0.15 0.00 -0.44 0.00 0.00 34.13 30.57 2j00 s GLU 110 CO 0.60 0.54 0.81 -2.13 0.95 0.00 0.00 175.26 176.04 2j00 n ARG 111 N 0.91 0.84 -2.74 -4.83 0.63 -1.26 -4.87 116.66 105.34 2j00 n ARG 111 Ca -0.13 0.29 -0.43 0.00 -0.92 0.00 0.00 57.85 56.66 2j00 n ARG 111 Cb 0.52 -1.53 -0.03 0.00 0.45 0.00 0.00 32.46 31.87 2j00 n ARG 111 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2j00 s LYS 112 N -1.36 3.48 0.34 -0.14 2.36 -1.26 -4.64 119.74 118.51 2j00 s LYS 112 Ca 0.61 0.08 -0.28 0.00 -2.55 0.00 0.00 55.97 53.83 2j00 s LYS 112 Cb -0.78 -3.99 -0.09 0.00 -1.05 0.00 0.00 37.83 31.92 2j00 s LYS 112 CO 0.58 -1.46 1.19 0.15 1.55 0.00 0.00 175.35 177.37 2j00 s LYS 113 N 4.23 4.33 0.23 4.03 3.01 -1.26 -4.81 119.74 129.49 2j00 s LYS 113 Ca 0.37 1.95 -0.31 0.00 -1.01 0.00 0.00 55.97 56.98 2j00 s LYS 113 Cb -0.10 -2.96 -0.11 0.00 -1.01 0.00 0.00 37.83 33.65 2j00 s LYS 113 CO 0.24 -0.12 1.62 1.52 0.51 0.00 0.00 175.35 179.13 2j00 s TYR 114 N -1.25 2.91 0.00 3.18 -0.00 -1.26 -2.93 117.35 118.01 2j00 s TYR 114 Ca 0.51 0.61 0.00 0.00 -0.00 0.00 0.00 57.07 58.18 2j00 s TYR 114 Cb -0.34 -4.04 0.00 0.00 -0.00 0.00 0.00 41.96 37.58 2j00 s TYR 114 CO 0.44 -3.72 0.00 0.41 -0.00 0.00 0.00 175.55 172.68 2j00 n GLY 115 N 3.21 0.87 2.74 5.49 0.00 -1.26 -5.04 105.19 111.19 2j00 n GLY 115 Ca 0.12 -0.51 -0.04 0.00 0.00 0.00 0.00 46.02 45.60 2j00 n GLY 115 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2j00 n LYS 116 N -0.47 0.43 0.00 1.61 4.76 -1.15 -4.63 118.16 118.70 2j00 n LYS 116 Ca 0.00 -1.69 0.00 0.00 -2.87 0.00 0.00 58.31 53.75 2j00 n LYS 116 Cb 0.40 -1.03 0.00 0.00 -1.84 0.00 0.00 35.03 32.55 2j00 n LYS 116 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2j00 n HIS 117 N 2.80 0.00 -3.16 2.13 8.25 -0.46 -0.74 115.22 124.04 2j00 n HIS 117 Ca 0.16 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.43 2j00 n HIS 117 Cb 0.59 -0.37 -0.04 0.00 1.12 0.00 0.00 29.99 31.29 2j00 n HIS 117 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2j00 n LYS 118 N -2.31 0.89 -0.43 -0.41 5.02 -1.21 -4.96 118.16 114.75 2j00 n LYS 118 Ca 0.00 -3.23 0.00 0.00 -2.02 0.00 0.00 58.31 53.06 2j00 n LYS 118 Cb 0.00 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.49 2j00 n LYS 118 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j00 n ALA 119 N 0.67 0.00 0.00 7.82 0.00 0.08 -3.45 120.51 125.62 2j00 n ALA 119 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2j00 n ALA 119 Cb 0.62 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2j00 n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2j00 n ARG 120 N -1.37 0.00 -1.60 0.00 1.74 -1.25 -4.52 116.66 109.65 2j00 n ARG 120 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 2j00 n ARG 120 Cb 0.02 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.42 2j00 n ARG 120 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2j00 n ARG 121 N -1.47 2.00 -2.86 5.56 0.00 -1.22 -4.91 116.66 113.76 2j00 n ARG 121 Ca 0.00 0.57 -0.35 0.00 -0.00 0.00 0.00 57.85 58.07 2j00 n ARG 121 Cb 0.00 -3.19 -0.07 0.00 0.00 0.00 0.00 32.46 29.21 2j00 n ARG 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2j00 s ALA 122 N 7.97 3.16 1.19 5.13 0.00 -1.26 -1.36 121.76 136.59 2j00 s ALA 122 Ca 1.00 0.40 -0.17 0.00 0.00 0.00 0.00 51.96 53.19 2j00 s ALA 122 Cb -0.37 -3.10 0.25 0.00 0.00 0.00 0.00 23.12 19.90 2j00 s ALA 122 CO 0.36 0.18 0.54 -0.35 0.00 0.00 0.00 175.76 176.50 2j00 n PRO 123 N -0.03 -3.18 0.00 0.00 -0.04 -1.26 -4.85 135.00 125.64 2j00 n PRO 123 Ca 0.04 -0.94 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 2j00 n PRO 123 Cb 0.52 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 2j00 n PRO 123 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2j00 n GLN 124 N -3.36 2.85 -3.55 0.54 1.13 -1.26 -5.08 117.38 108.65 2j00 n GLN 124 Ca 0.08 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 55.15 2j00 n GLN 124 Cb 0.46 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.75 2j00 n GLN 124 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 2j00 s TYR 125 N 0.00 -0.26 -0.08 1.08 6.04 -1.26 -5.09 117.35 117.78 2j00 s TYR 125 Ca 0.00 0.50 -0.08 0.00 0.04 0.00 0.00 57.07 57.53 2j00 s TYR 125 Cb 0.00 0.16 -0.03 0.00 -1.04 0.00 0.00 41.96 41.05 2j00 s TYR 125 CO 0.00 -0.13 -0.16 0.43 -1.54 0.00 0.00 175.55 174.15 2j00 n SER 126 N 3.66 0.93 0.00 4.32 7.64 -1.26 -4.96 113.62 123.95 2j00 n SER 126 Ca -0.15 0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.89 2j00 n SER 126 Cb 0.56 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 2j00 n SER 126 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2j00 n LYS 127 N -3.44 0.00 0.00 1.43 4.81 -1.26 -5.38 118.16 114.32 2j00 n LYS 127 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 2j00 n LYS 127 Cb 0.24 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.29 2j00 n LYS 127 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46