#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k90 h GLU 6 N 0.00 0.00 0.00 -0.78 5.08 -2.03 0.66 114.58 117.51 1k90 h GLU 6 Ca 0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 1k90 h GLU 6 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1k90 h GLU 6 CO 0.00 0.00 -1.70 0.39 -1.00 0.00 0.00 179.01 176.70 1k90 n GLU 7 N -2.83 0.28 -0.23 2.33 1.02 -1.26 -3.95 120.64 116.00 1k90 n GLU 7 Ca -0.02 0.10 -0.03 0.00 -0.02 0.00 0.00 57.16 57.20 1k90 n GLU 7 Cb 0.42 -1.04 0.08 0.00 -0.02 0.00 0.00 31.44 30.88 1k90 n GLU 7 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1k90 h GLN 8 N -0.31 0.72 0.00 3.49 5.75 -1.90 -0.73 115.11 122.12 1k90 h GLN 8 Ca -0.31 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.15 1k90 h GLN 8 Cb 1.32 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.71 1k90 h GLN 8 CO -0.15 0.47 -0.16 -0.89 -2.65 0.00 0.00 178.83 175.45 1k90 n ILE 9 N -4.75 0.18 0.79 2.39 2.08 0.23 -3.29 119.36 116.99 1k90 n ILE 9 Ca 0.08 -0.10 0.11 0.00 0.56 0.00 0.00 62.75 63.40 1k90 n ILE 9 Cb 0.13 -0.34 0.28 0.00 -0.75 0.00 0.00 39.64 38.96 1k90 n ILE 9 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1k90 n ALA 10 N -1.60 2.47 -0.12 -1.39 0.00 -0.36 -3.81 120.51 115.70 1k90 n ALA 10 Ca 0.06 -0.75 -0.23 0.00 0.00 0.00 0.00 53.44 52.52 1k90 n ALA 10 Cb 0.37 -0.97 -0.09 0.00 0.00 0.00 0.00 19.45 18.76 1k90 n ALA 10 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1k90 n GLU 11 N 0.95 0.54 0.11 0.00 1.02 -0.76 -3.69 120.64 118.81 1k90 n GLU 11 Ca 0.18 0.20 -0.13 0.00 -0.02 0.00 0.00 57.16 57.38 1k90 n GLU 11 Cb 0.48 -1.40 -0.08 0.00 -0.02 0.00 0.00 31.44 30.42 1k90 n GLU 11 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1k90 h PHE 12 N -0.58 -0.20 0.00 -0.32 0.04 -1.73 0.63 116.94 114.78 1k90 h PHE 12 Ca -0.59 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.18 1k90 h PHE 12 Cb 1.63 0.07 -0.00 0.00 2.20 0.00 0.00 35.95 39.85 1k90 h PHE 12 CO -0.04 -0.10 -0.02 -0.22 -0.60 0.00 0.00 178.31 177.33 1k90 h LYS 13 N -0.24 0.00 0.00 1.51 3.64 -1.81 -1.38 116.57 118.29 1k90 h LYS 13 Ca -0.02 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1k90 h LYS 13 Cb 0.19 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1k90 h LYS 13 CO 0.04 0.02 -0.00 1.49 -2.27 0.00 0.00 179.45 178.72 1k90 h GLU 14 N 0.00 0.00 0.00 1.90 4.22 -1.20 -3.30 114.58 116.20 1k90 h GLU 14 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1k90 h GLU 14 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1k90 h GLU 14 CO 0.00 0.64 0.00 0.00 -2.18 0.00 0.00 179.01 177.48 1k90 n ALA 15 N -2.67 1.58 -0.28 2.92 0.00 0.20 -2.44 120.51 119.82 1k90 n ALA 15 Ca -0.07 0.04 -0.04 0.00 0.00 0.00 0.00 53.44 53.37 1k90 n ALA 15 Cb 0.31 -1.31 0.10 0.00 0.00 0.00 0.00 19.45 18.55 1k90 n ALA 15 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1k90 h PHE 16 N 0.00 1.16 -1.39 0.00 3.57 -1.33 -2.93 116.94 116.03 1k90 h PHE 16 Ca 0.00 -0.07 -0.66 0.00 3.53 0.00 0.00 57.97 60.78 1k90 h PHE 16 Cb 0.28 -0.36 -0.19 0.00 2.79 0.00 0.00 35.95 38.48 1k90 h PHE 16 CO 0.00 0.86 1.20 0.43 -2.23 0.00 0.00 178.31 178.57 1k90 n SER 17 N -4.30 7.24 -0.00 0.41 7.64 -1.02 -4.09 113.62 119.50 1k90 n SER 17 Ca 0.08 -3.34 0.00 0.00 1.01 0.00 0.00 58.87 56.61 1k90 n SER 17 Cb 0.16 -1.24 -0.00 0.00 -1.01 0.00 0.00 64.21 62.12 1k90 n SER 17 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1k90 n LEU 18 N 0.80 0.00 -2.81 -3.43 4.77 -1.11 -4.87 117.00 110.36 1k90 n LEU 18 Ca 0.54 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.42 1k90 n LEU 18 Cb 0.37 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1k90 n LEU 18 CO 0.49 0.00 0.13 0.33 -1.33 0.00 0.00 177.39 177.01 1k90 n PHE 19 N -1.60 -3.11 -2.99 -1.77 -0.00 -1.26 -5.03 117.46 101.71 1k90 n PHE 19 Ca -0.00 -1.89 -0.16 0.00 -0.00 0.00 0.00 57.45 55.40 1k90 n PHE 19 Cb 0.10 1.35 0.00 0.00 -0.00 0.00 0.00 39.48 40.93 1k90 n PHE 19 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1k90 n ASP 20 N 1.85 -0.92 -4.44 -2.13 -0.08 -1.26 -4.90 116.55 104.67 1k90 n ASP 20 Ca 0.12 -3.12 -0.35 0.00 -1.51 0.00 0.00 54.79 49.93 1k90 n ASP 20 Cb 0.61 0.48 -0.04 0.00 2.34 0.00 0.00 41.12 44.51 1k90 n ASP 20 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1k90 n LYS 21 N 0.99 2.18 0.00 -0.67 0.00 -1.26 -3.39 118.16 116.01 1k90 n LYS 21 Ca 0.16 -2.68 0.00 0.00 0.00 0.00 0.00 58.31 55.79 1k90 n LYS 21 Cb 0.62 -3.55 0.00 0.00 0.00 0.00 0.00 35.03 32.10 1k90 n LYS 21 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1k90 n ASP 22 N 11.32 0.00 0.00 3.14 -0.08 -1.26 -5.05 116.55 124.62 1k90 n ASP 22 Ca 0.47 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.75 1k90 n ASP 22 Cb 0.45 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.91 1k90 n ASP 22 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1k90 n GLY 23 N 0.00 1.26 0.46 0.27 0.00 -1.22 -4.60 105.19 101.37 1k90 n GLY 23 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1k90 n GLY 23 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1k90 n ASP 24 N 2.98 0.35 -4.26 1.61 8.00 -1.26 -4.77 116.55 119.18 1k90 n ASP 24 Ca 0.00 -0.74 -0.31 0.00 0.71 0.00 0.00 54.79 54.45 1k90 n ASP 24 Cb 0.00 -0.17 -0.08 0.00 -0.02 0.00 0.00 41.12 40.84 1k90 n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k90 n GLY 25 N 0.28 -0.15 2.89 0.44 0.00 -1.26 -4.86 105.19 102.53 1k90 n GLY 25 Ca 0.00 0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1k90 n GLY 25 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k90 n THR 26 N -4.53 2.87 -1.43 2.61 -2.24 -1.21 -3.49 114.28 106.86 1k90 n THR 26 Ca -0.30 -5.19 -0.33 0.00 -2.27 0.00 0.00 64.05 55.95 1k90 n THR 26 Cb 0.69 -2.24 0.09 0.00 -2.10 0.00 0.00 70.33 66.76 1k90 n THR 26 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1k90 s ILE 27 N -1.84 2.63 0.36 2.28 -4.36 -0.02 -4.39 121.20 115.86 1k90 s ILE 27 Ca 0.31 0.28 0.01 0.00 -0.26 0.00 0.00 60.65 60.99 1k90 s ILE 27 Cb 0.00 -2.77 -0.03 0.00 1.25 0.00 0.00 42.46 40.92 1k90 s ILE 27 CO -0.08 -0.19 0.56 0.42 0.24 0.00 0.00 174.94 175.89 1k90 s THR 28 N -2.24 4.92 0.13 8.37 -4.23 -1.26 -0.76 115.64 120.57 1k90 s THR 28 Ca 0.70 -0.50 0.33 0.00 -1.18 0.00 0.00 61.69 61.05 1k90 s THR 28 Cb -0.25 -3.79 0.35 0.00 1.34 0.00 0.00 72.50 70.15 1k90 s THR 28 CO 0.46 -0.51 2.01 0.74 -0.54 0.00 0.00 174.62 176.78 1k90 h THR 29 N 0.71 0.00 0.14 3.99 2.02 -1.96 0.52 112.91 118.34 1k90 h THR 29 Ca -0.49 -0.19 -0.30 0.00 0.77 0.00 0.00 66.41 66.21 1k90 h THR 29 Cb 1.23 1.03 0.03 0.00 -1.74 0.00 0.00 68.15 68.70 1k90 h THR 29 CO 0.60 0.00 -1.25 0.11 0.37 0.00 0.00 175.52 175.36 1k90 h LYS 30 N 0.00 0.59 -0.01 6.66 6.56 -1.96 -3.23 116.57 125.18 1k90 h LYS 30 Ca 0.00 -0.83 0.00 0.00 -1.06 0.00 0.00 60.65 58.76 1k90 h LYS 30 Cb 0.21 0.28 0.00 0.00 -0.57 0.00 0.00 32.23 32.15 1k90 h LYS 30 CO 0.00 1.38 -0.08 -0.85 -2.06 0.00 0.00 179.45 177.84 1k90 n GLU 31 N -3.81 1.40 0.38 3.15 0.28 -0.81 -4.18 120.64 117.05 1k90 n GLU 31 Ca -0.14 -0.82 -0.16 0.00 -0.16 0.00 0.00 57.16 55.87 1k90 n GLU 31 Cb 0.99 -1.48 -0.08 0.00 1.43 0.00 0.00 31.44 32.30 1k90 n GLU 31 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 1k90 h LEU 32 N 2.01 -0.84 -1.66 -1.84 5.85 -0.93 -2.78 115.31 115.12 1k90 h LEU 32 Ca 0.00 0.02 0.17 0.00 0.84 0.00 0.00 57.88 58.90 1k90 h LEU 32 Cb 0.51 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.71 1k90 h LEU 32 CO 0.00 -0.48 0.51 1.23 -0.34 0.00 0.00 178.44 179.36 1k90 h GLY 33 N -1.22 0.58 1.73 3.75 0.00 -1.73 1.06 103.07 107.24 1k90 h GLY 33 Ca -0.10 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1k90 h GLY 33 CO 0.17 0.04 0.00 2.41 0.00 0.00 0.00 176.54 179.15 1k90 n THR 34 N -4.45 0.65 0.00 4.70 -1.04 -1.12 -1.98 114.28 111.04 1k90 n THR 34 Ca 0.15 0.16 -0.03 0.00 -2.04 0.00 0.00 64.05 62.29 1k90 n THR 34 Cb 0.60 -0.88 -0.01 0.00 -1.82 0.00 0.00 70.33 68.22 1k90 n THR 34 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1k90 n VAL 35 N -1.36 1.27 0.26 12.58 0.31 0.31 -3.37 118.33 128.33 1k90 n VAL 35 Ca 0.06 0.32 0.09 0.00 -0.01 0.00 0.00 64.34 64.81 1k90 n VAL 35 Cb 0.15 -1.81 0.50 0.00 -0.91 0.00 0.00 33.84 31.78 1k90 n VAL 35 CO 0.00 0.00 0.00 -0.03 -1.32 0.00 0.00 176.83 175.48 1k90 h MET 36 N -0.31 0.00 0.00 5.55 -1.53 0.13 -0.35 114.93 118.42 1k90 h MET 36 Ca 0.00 0.00 -0.05 0.00 -3.44 0.00 0.00 59.70 56.21 1k90 h MET 36 Cb 0.31 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.35 1k90 h MET 36 CO 0.00 0.00 -1.29 0.54 0.14 0.00 0.00 176.91 176.30 1k90 n ARG 37 N -2.46 1.80 0.00 0.39 1.74 -0.84 -4.00 116.66 113.28 1k90 n ARG 37 Ca -0.01 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1k90 n ARG 37 Cb 0.45 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1k90 n ARG 37 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1k90 n SER 38 N -1.95 0.00 -4.65 0.55 3.41 -0.16 -4.07 113.62 106.76 1k90 n SER 38 Ca -0.05 0.46 -0.26 0.00 -0.26 0.00 0.00 58.87 58.76 1k90 n SER 38 Cb 0.42 -0.46 -0.09 0.00 -0.26 0.00 0.00 64.21 63.82 1k90 n SER 38 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1k90 s LEU 39 N -2.91 2.95 0.00 1.04 1.43 -1.12 -4.96 118.68 115.11 1k90 s LEU 39 Ca 0.00 -1.18 0.00 0.00 -1.03 0.00 0.00 54.13 51.92 1k90 s LEU 39 Cb 0.00 -1.17 0.00 0.00 0.03 0.00 0.00 46.19 45.05 1k90 s LEU 39 CO 0.00 -0.39 0.00 0.61 0.23 0.00 0.00 176.35 176.80 1k90 n GLY 40 N -1.02 0.00 3.19 -3.19 0.00 -1.26 -4.67 105.19 98.24 1k90 n GLY 40 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 1k90 n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k90 s GLN 41 N 0.00 0.90 -0.31 1.61 -0.21 -1.26 -5.07 119.66 115.32 1k90 s GLN 41 Ca 0.00 -1.34 0.18 0.00 0.02 0.00 0.00 55.36 54.22 1k90 s GLN 41 Cb 0.00 -0.38 0.46 0.00 1.00 0.00 0.00 33.01 34.10 1k90 s GLN 41 CO 0.00 0.02 1.13 0.09 -2.12 0.00 0.00 175.29 174.41 1k90 n ASN 42 N 0.01 0.74 -4.56 5.90 3.02 -1.26 -4.15 115.26 114.97 1k90 n ASN 42 Ca -0.12 -2.36 -0.31 0.00 -0.03 0.00 0.00 54.58 51.76 1k90 n ASN 42 Cb 0.60 -0.18 0.18 0.00 -0.61 0.00 0.00 39.78 39.77 1k90 n ASN 42 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1k90 n PRO 43 N -0.50 -0.90 -2.02 3.52 -0.04 -1.26 -5.00 135.00 128.79 1k90 n PRO 43 Ca 0.04 -0.21 -0.30 0.00 -0.04 0.00 0.00 63.50 62.98 1k90 n PRO 43 Cb 0.82 -2.20 0.01 0.00 -0.04 0.00 0.00 33.50 32.09 1k90 n PRO 43 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1k90 s THR 44 N -2.52 4.75 -0.25 0.52 -1.32 -1.26 -4.91 115.64 110.65 1k90 s THR 44 Ca 0.65 0.74 0.08 0.00 -1.21 0.00 0.00 61.69 61.95 1k90 s THR 44 Cb -0.22 -3.87 0.08 0.00 -1.51 0.00 0.00 72.50 66.98 1k90 s THR 44 CO 0.62 -1.09 1.13 -0.62 -2.21 0.00 0.00 174.62 172.45 1k90 n GLU 45 N -2.65 0.06 0.20 7.08 -0.58 -1.26 -2.42 120.64 121.07 1k90 n GLU 45 Ca 0.05 0.47 -0.08 0.00 -0.42 0.00 0.00 57.16 57.18 1k90 n GLU 45 Cb 0.54 -1.92 -0.04 0.00 -0.57 0.00 0.00 31.44 29.45 1k90 n GLU 45 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1k90 h ALA 46 N 1.27 -0.78 -0.51 0.62 0.00 -1.99 -3.17 119.26 114.70 1k90 h ALA 46 Ca 0.00 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 54.94 1k90 h ALA 46 Cb 0.47 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1k90 h ALA 46 CO 0.00 -0.74 0.39 0.93 0.00 0.00 0.00 179.25 179.83 1k90 h GLU 47 N -0.77 0.00 0.00 0.00 3.07 -1.86 1.26 114.58 116.28 1k90 h GLU 47 Ca -0.05 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1k90 h GLU 47 Cb 0.41 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1k90 h GLU 47 CO 0.09 0.00 -0.01 -0.07 -1.40 0.00 0.00 179.01 177.62 1k90 h LEU 48 N 0.00 0.00 0.00 1.33 3.38 -1.59 -2.49 115.31 115.94 1k90 h LEU 48 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1k90 h LEU 48 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1k90 h LEU 48 CO -0.00 0.01 -0.69 0.00 0.09 0.00 0.00 178.44 177.85 1k90 n GLN 49 N -3.13 2.31 0.08 1.13 1.13 0.16 -4.19 117.38 114.86 1k90 n GLN 49 Ca -0.01 -0.00 -0.10 0.00 -1.94 0.00 0.00 57.00 54.94 1k90 n GLN 49 Cb 0.18 -0.85 -0.05 0.00 0.11 0.00 0.00 30.24 29.64 1k90 n GLN 49 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1k90 h ASP 50 N 0.00 0.30 -0.01 1.08 3.58 0.15 -3.34 116.42 118.18 1k90 h ASP 50 Ca 0.00 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.19 1k90 h ASP 50 Cb 0.02 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 40.97 1k90 h ASP 50 CO 0.00 1.10 -0.01 0.23 -2.88 0.00 0.00 179.24 177.68 1k90 n MET 51 N -3.62 0.05 0.08 0.28 2.81 -0.96 -4.44 117.12 111.33 1k90 n MET 51 Ca -0.05 -0.84 0.13 0.00 -1.81 0.00 0.00 57.70 55.14 1k90 n MET 51 Cb 0.86 -1.11 0.46 0.00 -0.71 0.00 0.00 33.22 32.73 1k90 n MET 51 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 1k90 n ILE 52 N 0.30 0.48 0.22 2.02 0.13 -1.25 -3.14 119.36 118.12 1k90 n ILE 52 Ca 0.04 -0.16 0.03 0.00 -1.10 0.00 0.00 62.75 61.55 1k90 n ILE 52 Cb 0.15 -0.62 0.02 0.00 -0.84 0.00 0.00 39.64 38.35 1k90 n ILE 52 CO 0.00 0.00 0.00 -3.20 2.80 0.00 0.00 176.55 176.15 1k90 n ASN 53 N -2.05 1.47 0.00 9.51 5.15 -1.25 -4.03 115.26 124.06 1k90 n ASN 53 Ca 0.06 -1.24 0.00 0.00 -0.60 0.00 0.00 54.58 52.79 1k90 n ASN 53 Cb 0.38 -0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.63 1k90 n ASN 53 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1k90 n GLU 54 N 0.30 0.00 0.08 1.20 2.13 -1.19 -4.51 120.64 118.65 1k90 n GLU 54 Ca 0.03 0.25 0.13 0.00 0.66 0.00 0.00 57.16 58.23 1k90 n GLU 54 Cb 0.14 -0.72 0.38 0.00 0.27 0.00 0.00 31.44 31.51 1k90 n GLU 54 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1k90 n VAL 55 N -2.09 0.44 -3.85 6.31 3.14 -1.23 -4.50 118.33 116.54 1k90 n VAL 55 Ca 0.00 -0.23 -0.34 0.00 -2.96 0.00 0.00 64.34 60.81 1k90 n VAL 55 Cb 0.00 -0.45 -0.12 0.00 -1.06 0.00 0.00 33.84 32.21 1k90 n VAL 55 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1k90 s ASP 56 N -4.20 4.90 -0.40 6.55 3.68 -1.26 -4.94 116.67 121.01 1k90 s ASP 56 Ca 0.10 -2.58 0.10 0.00 2.13 0.00 0.00 52.55 52.31 1k90 s ASP 56 Cb 0.14 -1.75 0.34 0.00 -1.45 0.00 0.00 42.92 40.20 1k90 s ASP 56 CO 0.62 -0.37 0.85 0.00 0.13 0.00 0.00 175.17 176.39 1k90 n ALA 57 N 3.78 1.12 -0.84 3.66 0.00 -1.26 -3.78 120.51 123.19 1k90 n ALA 57 Ca 0.04 -2.78 0.08 0.00 0.00 0.00 0.00 53.44 50.78 1k90 n ALA 57 Cb 0.38 -1.00 0.27 0.00 0.00 0.00 0.00 19.45 19.09 1k90 n ALA 57 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1k90 n ASP 58 N 0.35 3.99 0.00 0.00 9.92 -1.26 -5.03 116.55 124.53 1k90 n ASP 58 Ca 0.19 -2.83 0.00 0.00 -0.53 0.00 0.00 54.79 51.62 1k90 n ASP 58 Cb 0.67 -0.51 0.00 0.00 -0.64 0.00 0.00 41.12 40.63 1k90 n ASP 58 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1k90 n GLY 59 N -0.15 1.54 0.46 0.44 0.00 -1.26 -4.78 105.19 101.45 1k90 n GLY 59 Ca 0.21 -0.73 -0.16 0.00 0.00 0.00 0.00 46.02 45.34 1k90 n GLY 59 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1k90 h ASN 60 N 0.00 -1.36 0.00 1.61 4.21 -1.98 -3.47 115.58 114.59 1k90 h ASN 60 Ca 0.00 0.13 0.00 0.00 1.21 0.00 0.00 56.30 57.64 1k90 h ASN 60 Cb 0.00 0.48 0.00 0.00 -1.12 0.00 0.00 38.32 37.68 1k90 h ASN 60 CO 0.00 -0.58 0.00 0.61 -1.29 0.00 0.00 177.43 176.17 1k90 n GLY 61 N -1.51 1.89 3.70 2.83 0.00 -1.26 -5.08 105.19 105.77 1k90 n GLY 61 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1k90 n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k90 s THR 62 N -2.00 2.67 -0.04 2.61 -4.23 -1.26 -4.43 115.64 108.96 1k90 s THR 62 Ca 0.00 0.22 0.03 0.00 -1.18 0.00 0.00 61.69 60.76 1k90 s THR 62 Cb 0.00 -2.62 0.01 0.00 1.34 0.00 0.00 72.50 71.23 1k90 s THR 62 CO 0.00 -0.29 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.05 1k90 s ILE 63 N -2.86 0.98 0.55 2.99 1.09 0.06 -4.92 121.20 119.09 1k90 s ILE 63 Ca 0.64 -0.44 0.03 0.00 -1.10 0.00 0.00 60.65 59.78 1k90 s ILE 63 Cb -0.19 -0.88 0.03 0.00 -1.06 0.00 0.00 42.46 40.36 1k90 s ILE 63 CO 0.57 0.31 0.28 1.51 -0.10 0.00 0.00 174.94 177.51 1k90 s ASP 64 N 0.37 4.46 0.06 3.58 1.47 -1.23 -0.84 116.67 124.54 1k90 s ASP 64 Ca -0.07 -1.44 -0.30 0.00 1.18 0.00 0.00 52.55 51.91 1k90 s ASP 64 Cb -0.12 0.62 -0.18 0.00 -0.34 0.00 0.00 42.92 42.90 1k90 s ASP 64 CO 0.02 -1.10 1.56 -0.26 0.68 0.00 0.00 175.17 176.07 1k90 h PHE 65 N 0.88 -0.66 -0.97 2.11 -1.00 -1.92 -1.06 116.94 114.31 1k90 h PHE 65 Ca -0.39 -0.02 0.23 0.00 2.81 0.00 0.00 57.97 60.61 1k90 h PHE 65 Cb 1.32 0.22 -0.08 0.00 3.61 0.00 0.00 35.95 41.02 1k90 h PHE 65 CO 1.26 -0.38 0.64 -1.35 -1.61 0.00 0.00 178.31 176.87 1k90 h PRO 66 N -0.78 0.40 -0.14 1.51 0.11 -1.97 0.27 132.00 131.40 1k90 h PRO 66 Ca -0.07 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 65.78 1k90 h PRO 66 Cb 0.58 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.61 1k90 h PRO 66 CO 0.12 0.27 -0.81 0.93 -0.21 0.00 0.00 178.00 178.30 1k90 h GLU 67 N 0.41 0.78 -0.75 1.05 5.08 -1.93 -2.55 114.58 116.67 1k90 h GLU 67 Ca 0.53 -0.66 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 1k90 h GLU 67 Cb 1.32 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.68 1k90 h GLU 67 CO -0.23 1.26 0.26 0.35 -1.00 0.00 0.00 179.01 179.65 1k90 h PHE 68 N 0.53 1.18 -0.85 4.33 3.57 0.62 -1.77 116.94 124.54 1k90 h PHE 68 Ca -0.06 -0.11 -0.03 0.00 3.53 0.00 0.00 57.97 61.30 1k90 h PHE 68 Cb 1.44 -0.35 -0.04 0.00 2.79 0.00 0.00 35.95 39.79 1k90 h PHE 68 CO 0.09 0.92 0.42 -0.07 -2.23 0.00 0.00 178.31 177.43 1k90 h LEU 69 N 1.11 1.11 -0.04 0.59 3.38 -0.58 0.16 115.31 121.03 1k90 h LEU 69 Ca 0.25 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1k90 h LEU 69 Cb 0.27 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1k90 h LEU 69 CO -0.01 0.92 -0.03 0.74 0.09 0.00 0.00 178.44 180.16 1k90 h THR 70 N 1.21 0.91 -0.29 0.22 2.02 -0.95 0.55 112.91 116.58 1k90 h THR 70 Ca 0.29 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.46 1k90 h THR 70 Cb 0.10 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1k90 h THR 70 CO -0.04 0.00 0.11 0.24 0.37 0.00 0.00 175.52 176.20 1k90 h MET 71 N -0.03 0.44 -0.24 6.66 2.86 -0.93 -2.87 114.93 120.82 1k90 h MET 71 Ca 0.03 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 57.50 1k90 h MET 71 Cb 0.07 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1k90 h MET 71 CO -0.06 0.47 -0.23 0.52 1.06 0.00 0.00 176.91 178.67 1k90 h MET 72 N 0.31 0.43 -0.06 1.72 2.07 -0.51 -1.98 114.93 116.92 1k90 h MET 72 Ca 0.10 -0.15 0.00 0.00 -2.07 0.00 0.00 59.70 57.57 1k90 h MET 72 Cb 0.20 -0.03 0.00 0.00 -1.87 0.00 0.00 31.60 29.90 1k90 h MET 72 CO -0.01 0.64 0.00 0.00 1.07 0.00 0.00 176.91 178.61 1k90 n ALA 73 N -2.48 2.19 -2.00 6.32 0.00 0.19 -3.56 120.51 121.16 1k90 n ALA 73 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1k90 n ALA 73 Cb 0.38 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1k90 n ALA 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1k90 n ARG 74 N -0.45 0.00 -0.39 0.00 5.12 -0.74 -4.75 116.66 115.46 1k90 n ARG 74 Ca 0.00 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.91 1k90 n ARG 74 Cb 0.01 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.30 1k90 n ARG 74 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1k90 n LYS 75 N 0.00 0.77 -2.02 5.56 4.81 -1.24 -2.64 118.16 123.39 1k90 n LYS 75 Ca 0.00 -0.11 0.01 0.00 -0.87 0.00 0.00 58.31 57.35 1k90 n LYS 75 Cb 0.00 -1.28 0.04 0.00 0.02 0.00 0.00 35.03 33.82 1k90 n LYS 75 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 1k90 n MET 76 N 1.83 0.91 -0.05 1.64 1.56 -1.23 -4.68 117.12 117.10 1k90 n MET 76 Ca 0.05 -2.76 -0.06 0.00 -0.27 0.00 0.00 57.70 54.66 1k90 n MET 76 Cb 0.38 -0.82 -0.06 0.00 2.15 0.00 0.00 33.22 34.87 1k90 n MET 76 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1k90 n LYS 77 N -0.07 1.58 0.01 2.12 3.00 -1.08 -4.60 118.16 119.11 1k90 n LYS 77 Ca 0.08 0.03 0.11 0.00 -0.00 0.00 0.00 58.31 58.53 1k90 n LYS 77 Cb 0.98 -1.23 -0.08 0.00 0.00 0.00 0.00 35.03 34.70 1k90 n LYS 77 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1k90 n ASP 78 N -2.55 0.60 0.00 3.14 -0.08 -1.26 -4.09 116.55 112.31 1k90 n ASP 78 Ca -0.17 -0.47 0.05 0.00 -1.51 0.00 0.00 54.79 52.69 1k90 n ASP 78 Cb 0.76 1.20 0.29 0.00 2.34 0.00 0.00 41.12 45.71 1k90 n ASP 78 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1k90 n THR 79 N -1.85 0.00 0.36 5.18 5.66 -1.26 -2.80 114.28 119.57 1k90 n THR 79 Ca 0.01 0.00 0.08 0.00 -3.05 0.00 0.00 64.05 61.09 1k90 n THR 79 Cb 0.43 -0.63 0.33 0.00 -1.55 0.00 0.00 70.33 68.91 1k90 n THR 79 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1k90 n ASP 80 N -0.85 0.23 0.06 1.09 2.03 -1.26 -2.78 116.55 115.07 1k90 n ASP 80 Ca 0.07 0.57 0.04 0.00 0.52 0.00 0.00 54.79 55.99 1k90 n ASP 80 Cb 0.03 -0.61 0.19 0.00 -0.72 0.00 0.00 41.12 40.01 1k90 n ASP 80 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1k90 n SER 81 N -1.77 0.18 -0.33 1.67 7.64 -1.12 -2.83 113.62 117.06 1k90 n SER 81 Ca 0.02 0.56 0.29 0.00 1.01 0.00 0.00 58.87 60.75 1k90 n SER 81 Cb 0.15 -0.58 0.54 0.00 -1.01 0.00 0.00 64.21 63.31 1k90 n SER 81 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1k90 h GLU 82 N 0.00 0.14 0.89 1.43 4.81 -1.84 0.26 114.58 120.27 1k90 h GLU 82 Ca 0.00 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1k90 h GLU 82 Cb 0.07 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.43 1k90 h GLU 82 CO 0.00 0.09 -0.43 0.93 -0.73 0.00 0.00 179.01 178.87 1k90 h GLU 83 N 0.14 -1.15 -0.28 1.92 3.07 -1.85 -2.22 114.58 114.21 1k90 h GLU 83 Ca 0.80 0.08 0.07 0.00 -0.50 0.00 0.00 59.36 59.81 1k90 h GLU 83 Cb 2.02 0.26 -0.08 0.00 -0.84 0.00 0.00 28.75 30.12 1k90 h GLU 83 CO -0.69 -0.77 -0.26 0.93 -1.40 0.00 0.00 179.01 176.82 1k90 h GLU 84 N -1.30 -0.24 -0.36 2.33 3.07 -1.23 -1.22 114.58 115.62 1k90 h GLU 84 Ca -0.12 0.02 0.08 0.00 -0.50 0.00 0.00 59.36 58.83 1k90 h GLU 84 Cb 0.92 0.06 -0.07 0.00 -0.84 0.00 0.00 28.75 28.81 1k90 h GLU 84 CO 0.20 -0.16 -0.14 0.82 -1.40 0.00 0.00 179.01 178.33 1k90 h ILE 85 N -0.25 0.55 -0.28 3.13 2.04 -1.35 0.20 117.51 121.55 1k90 h ILE 85 Ca 0.15 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.07 1k90 h ILE 85 Cb 0.48 0.55 -0.08 0.00 -0.74 0.00 0.00 36.82 37.03 1k90 h ILE 85 CO -0.43 0.00 -0.34 -0.09 0.00 0.00 0.00 178.15 177.29 1k90 h ARG 86 N -0.07 -0.32 -0.97 2.37 2.43 -0.68 0.20 114.38 117.34 1k90 h ARG 86 Ca 0.18 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.47 1k90 h ARG 86 Cb 0.34 0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 29.88 1k90 h ARG 86 CO -0.41 -0.22 0.60 0.93 -1.51 0.00 0.00 179.97 179.37 1k90 h GLU 87 N -0.33 0.98 -0.43 0.20 5.08 -0.18 -1.35 114.58 118.54 1k90 h GLU 87 Ca 0.13 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1k90 h GLU 87 Cb 0.55 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1k90 h GLU 87 CO -0.46 0.65 0.23 0.00 -1.00 0.00 0.00 179.01 178.42 1k90 h ALA 88 N 1.50 0.54 -0.65 3.43 0.00 0.22 -1.86 119.26 122.44 1k90 h ALA 88 Ca 0.46 0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.48 1k90 h ALA 88 Cb 0.37 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 1k90 h ALA 88 CO -0.24 -0.11 0.26 0.35 0.00 0.00 0.00 179.25 179.51 1k90 h PHE 89 N 0.47 0.45 -0.06 0.00 3.57 0.31 0.15 116.94 121.83 1k90 h PHE 89 Ca 0.18 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.73 1k90 h PHE 89 Cb 0.06 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.70 1k90 h PHE 89 CO -0.09 0.11 0.07 0.00 -2.23 0.00 0.00 178.31 176.17 1k90 h ARG 90 N 0.44 0.00 -0.08 1.11 3.08 -0.95 -1.63 114.38 116.35 1k90 h ARG 90 Ca 0.33 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.33 1k90 h ARG 90 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1k90 h ARG 90 CO -0.32 0.00 -0.14 0.28 -1.07 0.00 0.00 179.97 178.72 1k90 h VAL 91 N 0.00 1.40 -0.57 2.04 2.07 -0.40 -3.23 116.25 117.55 1k90 h VAL 91 Ca 0.03 -1.41 -0.08 0.00 0.82 0.00 0.00 66.70 66.07 1k90 h VAL 91 Cb 0.17 2.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1k90 h VAL 91 CO -0.00 0.40 0.05 -0.26 0.02 0.00 0.00 177.57 177.78 1k90 h PHE 92 N -0.21 1.01 -0.45 1.57 -1.00 -1.10 -3.36 116.94 113.39 1k90 h PHE 92 Ca 0.01 -0.14 -0.54 0.00 2.81 0.00 0.00 57.97 60.11 1k90 h PHE 92 Cb 0.71 -0.28 -0.04 0.00 3.61 0.00 0.00 35.95 39.96 1k90 h PHE 92 CO 0.11 0.88 1.87 -3.47 -1.61 0.00 0.00 178.31 176.09 1k90 n ASP 93 N -4.21 3.64 0.36 2.17 2.03 -0.71 -4.78 116.55 115.05 1k90 n ASP 93 Ca 0.03 -2.78 -0.18 0.00 0.52 0.00 0.00 54.79 52.39 1k90 n ASP 93 Cb 0.30 -1.62 -0.09 0.00 -0.72 0.00 0.00 41.12 38.98 1k90 n ASP 93 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1k90 h LYS 94 N 8.31 -0.92 0.00 -0.67 1.57 -1.80 -2.38 116.57 120.67 1k90 h LYS 94 Ca 0.37 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 1k90 h LYS 94 Cb 0.84 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.36 1k90 h LYS 94 CO 1.50 -0.62 0.00 -0.40 -0.57 0.00 0.00 179.45 179.37 1k90 n ASP 95 N -5.52 0.59 -3.12 0.86 5.68 -1.26 -4.90 116.55 108.88 1k90 n ASP 95 Ca -0.13 0.70 -0.14 0.00 -0.50 0.00 0.00 54.79 54.71 1k90 n ASP 95 Cb 0.41 -0.80 0.07 0.00 -1.14 0.00 0.00 41.12 39.66 1k90 n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k90 n GLY 96 N -0.56 -0.53 0.15 6.12 0.00 -0.90 -4.93 105.19 104.55 1k90 n GLY 96 Ca 0.01 0.21 0.09 0.00 0.00 0.00 0.00 46.02 46.33 1k90 n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1k90 n ASN 97 N -2.95 1.22 0.00 1.61 6.94 -1.26 -4.95 115.26 115.87 1k90 n ASN 97 Ca -0.18 -1.11 0.00 0.00 -0.02 0.00 0.00 54.58 53.26 1k90 n ASN 97 Cb 0.63 0.82 0.00 0.00 -2.36 0.00 0.00 39.78 38.88 1k90 n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1k90 n GLY 98 N 1.40 0.57 3.10 4.83 0.00 -1.26 -5.07 105.19 108.76 1k90 n GLY 98 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 1k90 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k90 s TYR 99 N -2.15 1.02 -0.27 1.61 1.51 -1.26 -3.74 117.35 114.06 1k90 s TYR 99 Ca 0.00 -0.32 -0.15 0.00 -1.01 0.00 0.00 57.07 55.59 1k90 s TYR 99 Cb 0.00 -0.61 -0.04 0.00 -0.11 0.00 0.00 41.96 41.20 1k90 s TYR 99 CO 0.00 0.00 0.38 0.42 -1.11 0.00 0.00 175.55 175.24 1k90 s ILE 100 N -0.78 5.17 0.27 2.71 -1.09 0.39 -4.73 121.20 123.15 1k90 s ILE 100 Ca 0.00 0.57 0.04 0.00 -2.23 0.00 0.00 60.65 59.03 1k90 s ILE 100 Cb -0.07 -3.71 -0.03 0.00 -1.58 0.00 0.00 42.46 37.07 1k90 s ILE 100 CO 0.01 0.15 0.42 -0.94 -1.23 0.00 0.00 174.94 173.34 1k90 s SER 101 N 1.64 6.31 0.24 3.58 1.04 -1.26 0.33 113.70 125.59 1k90 s SER 101 Ca 0.15 0.19 0.12 0.00 0.48 0.00 0.00 55.95 56.89 1k90 s SER 101 Cb -0.16 -1.91 0.65 0.00 0.10 0.00 0.00 66.02 64.70 1k90 s SER 101 CO 0.10 -0.14 1.28 0.00 0.98 0.00 0.00 173.24 175.46 1k90 n ALA 102 N -1.51 0.75 0.14 5.32 0.00 -1.26 -1.37 120.51 122.58 1k90 n ALA 102 Ca -0.08 0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.57 1k90 n ALA 102 Cb 0.57 -0.90 -0.15 0.00 0.00 0.00 0.00 19.45 18.97 1k90 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k90 n ALA 103 N -1.57 3.03 0.04 0.00 0.00 -1.26 -4.01 120.51 116.74 1k90 n ALA 103 Ca -0.01 -0.48 -0.04 0.00 0.00 0.00 0.00 53.44 52.91 1k90 n ALA 103 Cb 0.21 -0.68 -0.09 0.00 0.00 0.00 0.00 19.45 18.88 1k90 n ALA 103 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1k90 h GLU 104 N 0.00 0.00 -0.57 0.00 5.08 -1.55 -3.26 114.58 114.29 1k90 h GLU 104 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1k90 h GLU 104 Cb 0.83 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1k90 h GLU 104 CO 0.00 0.53 0.17 1.25 -1.00 0.00 0.00 179.01 179.96 1k90 h LEU 105 N 0.00 0.83 -1.15 1.33 6.46 -1.67 -1.83 115.31 119.28 1k90 h LEU 105 Ca -0.14 -0.21 0.04 0.00 -0.12 0.00 0.00 57.88 57.45 1k90 h LEU 105 Cb 1.72 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 41.38 1k90 h LEU 105 CO 0.08 0.82 0.58 -0.09 -0.62 0.00 0.00 178.44 179.21 1k90 h ARG 106 N 0.80 1.05 0.74 1.25 2.43 -1.69 -0.58 114.38 118.37 1k90 h ARG 106 Ca 0.18 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1k90 h ARG 106 Cb 0.29 -0.24 0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1k90 h ARG 106 CO -0.01 0.69 -0.36 0.45 -1.51 0.00 0.00 179.97 179.24 1k90 h HIS 107 N 1.08 -0.93 -0.99 2.20 3.86 -1.43 0.15 115.15 119.09 1k90 h HIS 107 Ca 0.36 -0.02 0.16 0.00 -1.16 0.00 0.00 60.37 59.70 1k90 h HIS 107 Cb 0.06 0.31 -0.10 0.00 1.06 0.00 0.00 27.41 28.74 1k90 h HIS 107 CO -0.00 -0.58 0.61 0.28 0.86 0.00 0.00 177.93 179.10 1k90 h VAL 108 N -1.14 0.80 0.61 2.45 2.07 -1.24 0.22 116.25 120.03 1k90 h VAL 108 Ca -0.10 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 1k90 h VAL 108 Cb 0.77 -0.13 0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1k90 h VAL 108 CO 0.17 0.16 -0.29 0.24 0.02 0.00 0.00 177.57 177.86 1k90 h MET 109 N 0.86 -0.79 -0.35 1.57 2.07 -1.05 -2.38 114.93 114.86 1k90 h MET 109 Ca 0.53 0.05 0.06 0.00 -2.07 0.00 0.00 59.70 58.28 1k90 h MET 109 Cb 0.70 0.18 -0.05 0.00 -1.87 0.00 0.00 31.60 30.55 1k90 h MET 109 CO -0.33 -0.53 0.01 1.79 1.07 0.00 0.00 176.91 178.92 1k90 h THR 110 N -1.08 0.76 -0.04 2.22 1.35 -0.40 -0.85 112.91 114.87 1k90 h THR 110 Ca -0.08 -0.04 0.01 0.00 -0.55 0.00 0.00 66.41 65.75 1k90 h THR 110 Cb 0.63 0.63 -0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1k90 h THR 110 CO 0.14 0.02 0.04 0.78 -0.25 0.00 0.00 175.52 176.25 1k90 h ASN 111 N 0.11 0.00 -0.31 5.36 4.21 -0.65 0.52 115.58 124.83 1k90 h ASN 111 Ca 0.17 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.68 1k90 h ASN 111 Cb 0.23 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.43 1k90 h ASN 111 CO -0.27 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.05 1k90 n LEU 112 N -3.84 2.37 0.00 1.61 4.77 -0.39 -4.89 117.00 116.64 1k90 n LEU 112 Ca -0.02 -1.19 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 1k90 n LEU 112 Cb 0.13 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1k90 n LEU 112 CO 0.27 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 1k90 n GLY 113 N 0.75 2.93 3.56 -0.72 0.00 0.18 -4.99 105.19 106.90 1k90 n GLY 113 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1k90 n GLY 113 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1k90 s GLU 114 N -0.16 3.43 0.10 1.61 2.56 -0.82 -4.89 118.70 120.52 1k90 s GLU 114 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 54.97 53.72 1k90 s GLU 114 Cb 0.00 -5.24 -0.06 0.00 2.00 0.00 0.00 34.13 30.83 1k90 s GLU 114 CO 0.00 -2.36 1.09 0.21 -0.56 0.00 0.00 175.26 173.65 1k90 s LYS 115 N 5.30 4.55 0.23 4.30 2.36 -1.26 -2.68 119.74 132.54 1k90 s LYS 115 Ca 0.49 1.65 0.04 0.00 -2.55 0.00 0.00 55.97 55.59 1k90 s LYS 115 Cb -0.01 -3.35 -0.05 0.00 -1.05 0.00 0.00 37.83 33.37 1k90 s LYS 115 CO -0.07 -0.04 -0.02 -0.51 1.55 0.00 0.00 175.35 176.26 1k90 s LEU 116 N 0.40 2.24 0.17 5.43 1.02 -1.26 -5.00 118.68 121.68 1k90 s LEU 116 Ca 0.53 -1.20 0.01 0.00 0.02 0.00 0.00 54.13 53.49 1k90 s LEU 116 Cb -0.27 -0.32 -0.04 0.00 0.02 0.00 0.00 46.19 45.59 1k90 s LEU 116 CO 0.31 -0.48 0.32 0.42 0.02 0.00 0.00 176.35 176.94 1k90 s THR 117 N -3.37 5.29 0.42 5.49 -4.23 -1.26 -4.91 115.64 113.08 1k90 s THR 117 Ca 0.28 -0.57 0.22 0.00 -1.18 0.00 0.00 61.69 60.43 1k90 s THR 117 Cb 0.05 -3.74 0.42 0.00 1.34 0.00 0.00 72.50 70.58 1k90 s THR 117 CO 0.08 -0.12 1.77 0.44 -0.54 0.00 0.00 174.62 176.26 1k90 h ASP 118 N 2.11 0.36 0.34 3.99 3.45 -2.00 0.12 116.42 124.78 1k90 h ASP 118 Ca -0.48 0.07 -0.02 0.00 0.43 0.00 0.00 57.03 57.03 1k90 h ASP 118 Cb 1.19 0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 1k90 h ASP 118 CO 0.69 0.05 -0.16 -0.33 -1.57 0.00 0.00 179.24 177.92 1k90 h GLU 119 N 0.31 -0.44 0.73 3.56 4.39 -1.98 -1.64 114.58 119.50 1k90 h GLU 119 Ca 0.60 0.03 -0.04 0.00 0.34 0.00 0.00 59.36 60.29 1k90 h GLU 119 Cb 1.69 0.10 0.01 0.00 -0.10 0.00 0.00 28.75 30.44 1k90 h GLU 119 CO -0.26 -0.23 -0.35 0.93 -1.16 0.00 0.00 179.01 177.95 1k90 h GLU 120 N -0.55 -0.94 -0.11 2.33 5.08 -1.24 -2.66 114.58 116.49 1k90 h GLU 120 Ca -0.05 0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1k90 h GLU 120 Cb 0.41 0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 1k90 h GLU 120 CO 0.08 -0.62 -0.44 0.28 -1.00 0.00 0.00 179.01 177.31 1k90 h VAL 121 N -1.01 0.00 -0.22 3.13 2.07 -1.12 0.18 116.25 119.27 1k90 h VAL 121 Ca -0.10 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1k90 h VAL 121 Cb 0.76 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1k90 h VAL 121 CO 0.16 0.00 0.57 0.44 0.02 0.00 0.00 177.57 178.77 1k90 h ASP 122 N -0.47 0.00 0.13 0.57 3.32 -1.33 0.60 116.42 119.24 1k90 h ASP 122 Ca 0.03 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.86 1k90 h ASP 122 Cb 0.55 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.12 1k90 h ASP 122 CO -0.35 0.00 -0.93 -0.08 -1.72 0.00 0.00 179.24 176.16 1k90 h GLU 123 N 0.00 0.41 -0.16 3.56 4.22 -0.30 -2.94 114.58 119.36 1k90 h GLU 123 Ca 0.10 -0.61 -0.00 0.00 0.08 0.00 0.00 59.36 58.94 1k90 h GLU 123 Cb 1.25 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 1k90 h GLU 123 CO -0.00 1.27 0.09 0.52 -2.18 0.00 0.00 179.01 178.71 1k90 h MET 124 N -0.15 0.22 -0.01 1.92 2.86 -0.27 0.11 114.93 119.61 1k90 h MET 124 Ca -0.15 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.49 1k90 h MET 124 Cb 1.69 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 33.25 1k90 h MET 124 CO 0.18 0.21 -0.52 0.82 1.06 0.00 0.00 176.91 178.65 1k90 h ILE 125 N 0.18 0.00 -0.92 -1.22 1.08 -1.55 0.04 117.51 115.12 1k90 h ILE 125 Ca 0.06 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.68 1k90 h ILE 125 Cb 0.04 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.72 1k90 h ILE 125 CO -0.01 0.00 0.59 0.03 -0.69 0.00 0.00 178.15 178.07 1k90 h ARG 126 N -0.65 0.68 -0.31 2.37 3.08 -1.32 0.45 114.38 118.69 1k90 h ARG 126 Ca 0.01 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.06 1k90 h ARG 126 Cb 0.70 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.56 1k90 h ARG 126 CO -0.35 0.45 0.09 0.93 -1.07 0.00 0.00 179.97 180.02 1k90 h GLU 127 N 0.71 0.21 0.00 0.04 4.39 0.10 -2.73 114.58 117.30 1k90 h GLU 127 Ca 0.47 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 60.05 1k90 h GLU 127 Cb 0.77 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.35 1k90 h GLU 127 CO -0.23 0.14 -0.64 0.00 -1.16 0.00 0.00 179.01 177.12 1k90 h ALA 128 N 1.21 0.66 -2.59 3.43 0.00 0.11 -3.45 119.26 118.62 1k90 h ALA 128 Ca 0.14 -0.51 -0.53 0.00 0.00 0.00 0.00 54.91 54.02 1k90 h ALA 128 Cb 0.13 -0.03 0.04 0.00 0.00 0.00 0.00 17.79 17.92 1k90 h ALA 128 CO -0.16 0.66 0.89 0.34 0.00 0.00 0.00 179.25 180.99 1k90 s ASP 129 N -6.36 6.58 -0.06 0.00 -1.08 0.15 -4.75 116.67 111.15 1k90 s ASP 129 Ca 0.03 2.61 0.03 0.00 -0.52 0.00 0.00 52.55 54.70 1k90 s ASP 129 Cb 0.08 -2.59 -0.06 0.00 -1.46 0.00 0.00 42.92 38.88 1k90 s ASP 129 CO 0.76 -0.83 -0.02 -0.38 0.52 0.00 0.00 175.17 175.22 1k90 n ILE 130 N 4.05 0.41 1.11 4.11 5.41 -1.26 -4.67 119.36 128.52 1k90 n ILE 130 Ca 0.14 -0.21 0.12 0.00 1.00 0.00 0.00 62.75 63.80 1k90 n ILE 130 Cb 0.39 -0.81 0.16 0.00 -0.71 0.00 0.00 39.64 38.67 1k90 n ILE 130 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1k90 n ASP 131 N -2.43 1.69 -0.25 4.38 5.68 -1.26 -4.97 116.55 119.39 1k90 n ASP 131 Ca -0.11 -1.31 -0.03 0.00 -0.50 0.00 0.00 54.79 52.84 1k90 n ASP 131 Cb 0.67 0.31 -0.01 0.00 -1.14 0.00 0.00 41.12 40.95 1k90 n ASP 131 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k90 n GLY 132 N 1.38 0.52 0.24 6.12 0.00 -1.26 -4.92 105.19 107.27 1k90 n GLY 132 Ca 0.11 -0.91 0.11 0.00 0.00 0.00 0.00 46.02 45.33 1k90 n GLY 132 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1k90 h ASP 133 N 0.00 0.00 0.00 1.61 3.04 -1.96 -3.46 116.42 115.65 1k90 h ASP 133 Ca -0.06 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.73 1k90 h ASP 133 Cb 0.38 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.67 1k90 h ASP 133 CO 0.09 0.18 0.00 0.61 -2.04 0.00 0.00 179.24 178.08 1k90 n GLY 134 N -0.15 0.95 3.56 7.15 0.00 -1.26 -5.07 105.19 110.37 1k90 n GLY 134 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1k90 n GLY 134 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1k90 s GLN 135 N -0.81 1.56 -0.25 1.61 -2.07 -1.26 -4.47 119.66 113.97 1k90 s GLN 135 Ca 0.00 -1.32 -0.05 0.00 -1.82 0.00 0.00 55.36 52.18 1k90 s GLN 135 Cb 0.00 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.38 1k90 s GLN 135 CO 0.00 -0.64 0.00 0.08 -1.32 0.00 0.00 175.29 173.41 1k90 s VAL 136 N -3.94 3.57 0.63 3.63 1.01 0.15 -4.69 120.40 120.77 1k90 s VAL 136 Ca 0.24 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 1k90 s VAL 136 Cb -0.00 -2.73 0.04 0.00 0.00 0.00 0.00 36.38 33.69 1k90 s VAL 136 CO 0.10 0.27 0.91 0.54 0.00 0.00 0.00 175.10 176.92 1k90 s ASN 137 N 1.48 5.11 0.12 3.32 2.20 -1.26 0.15 114.94 126.05 1k90 s ASN 137 Ca 0.04 0.33 -0.32 0.00 -0.94 0.00 0.00 52.86 51.97 1k90 s ASN 137 Cb -0.16 -1.12 -0.10 0.00 -2.00 0.00 0.00 41.25 37.87 1k90 s ASN 137 CO -0.01 -1.34 1.57 0.22 -2.94 0.00 0.00 177.10 174.59 1k90 h TYR 138 N -0.28 -1.42 -0.84 1.54 3.20 -1.99 0.82 116.97 117.99 1k90 h TYR 138 Ca -0.44 0.05 0.11 0.00 3.14 0.00 0.00 58.73 61.59 1k90 h TYR 138 Cb 1.30 0.63 -0.13 0.00 1.54 0.00 0.00 36.73 40.07 1k90 h TYR 138 CO 0.37 -0.53 -0.47 0.93 -1.64 0.00 0.00 178.16 176.82 1k90 h GLU 139 N -0.60 -0.08 0.12 1.82 3.07 -1.94 0.43 114.58 117.40 1k90 h GLU 139 Ca 0.04 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.93 1k90 h GLU 139 Cb 0.68 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.57 1k90 h GLU 139 CO -0.38 -0.06 -0.30 0.93 -1.40 0.00 0.00 179.01 177.80 1k90 h GLU 140 N -0.09 -0.50 -0.99 2.33 5.08 -1.76 -1.61 114.58 117.04 1k90 h GLU 140 Ca 0.23 0.03 0.23 0.00 -1.00 0.00 0.00 59.36 58.85 1k90 h GLU 140 Cb 0.53 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.81 1k90 h GLU 140 CO -0.86 -0.33 0.63 0.35 -1.00 0.00 0.00 179.01 177.79 1k90 h PHE 141 N -0.52 0.75 0.46 4.33 3.57 0.16 -2.13 116.94 123.55 1k90 h PHE 141 Ca 0.03 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1k90 h PHE 141 Cb 0.55 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.07 1k90 h PHE 141 CO -0.27 0.14 -0.22 0.28 -2.23 0.00 0.00 178.31 176.00 1k90 h VAL 142 N 0.51 0.49 0.17 1.41 2.07 0.69 -2.49 116.25 119.09 1k90 h VAL 142 Ca 0.55 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.69 1k90 h VAL 142 Cb 1.23 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1k90 h VAL 142 CO -0.29 0.06 -0.34 1.56 0.02 0.00 0.00 177.57 178.59 1k90 h GLN 143 N -0.86 -0.53 -0.17 1.57 4.20 -1.00 -0.03 115.11 118.29 1k90 h GLN 143 Ca -0.06 0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.73 1k90 h GLN 143 Cb 0.57 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 1k90 h GLN 143 CO 0.10 -0.35 0.63 1.98 -0.67 0.00 0.00 178.83 180.53 1k90 h MET 144 N -0.55 0.00 0.00 1.46 4.05 -1.48 0.53 114.93 118.94 1k90 h MET 144 Ca -0.02 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.38 1k90 h MET 144 Cb 0.52 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.31 1k90 h MET 144 CO -0.14 0.00 -1.96 -0.12 0.23 0.00 0.00 176.91 174.92 1k90 n MET 145 N -2.94 0.66 -0.01 0.39 0.00 -0.62 -4.76 117.12 109.84 1k90 n MET 145 Ca 0.03 -0.17 -0.03 0.00 -0.00 0.00 0.00 57.70 57.53 1k90 n MET 145 Cb 0.72 -1.54 -0.01 0.00 0.00 0.00 0.00 33.22 32.39 1k90 n MET 145 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1k90 n THR 146 N -2.32 1.12 0.00 1.12 -2.24 0.11 -5.08 114.28 106.99 1k90 n THR 146 Ca -0.05 0.28 0.00 0.00 -2.27 0.00 0.00 64.05 62.01 1k90 n THR 146 Cb 0.60 -1.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 1k90 n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50