#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nyb s PHE 2 N 0.00 2.75 0.08 7.33 0.08 -1.26 -5.13 117.98 121.84 2nyb s PHE 2 Ca 0.00 -0.13 0.03 0.00 0.12 0.00 0.00 56.93 56.96 2nyb s PHE 2 Cb 0.00 -1.59 -0.04 0.00 -0.57 0.00 0.00 43.02 40.82 2nyb s PHE 2 CO 0.00 0.28 0.07 -1.21 -0.10 0.00 0.00 175.22 174.26 2nyb s GLU 3 N -1.14 2.84 -0.33 0.44 0.41 -1.26 -4.94 118.70 114.72 2nyb s GLU 3 Ca 0.14 -0.71 -0.29 0.00 -0.41 0.00 0.00 54.97 53.70 2nyb s GLU 3 Cb -0.11 -2.70 -0.00 0.00 -1.78 0.00 0.00 34.13 29.54 2nyb s GLU 3 CO 0.04 0.56 1.46 -1.17 -0.49 0.00 0.00 175.26 175.66 2nyb s LEU 4 N -2.40 3.73 0.48 1.80 2.96 -1.26 -4.99 118.68 118.99 2nyb s LEU 4 Ca 0.29 1.15 -0.24 0.00 -0.22 0.00 0.00 54.13 55.11 2nyb s LEU 4 Cb -0.12 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 42.96 2nyb s LEU 4 CO 0.22 -1.32 1.32 -2.84 -1.32 0.00 0.00 176.35 172.40 2nyb s PRO 5 N 4.72 3.55 0.39 0.98 0.02 -1.26 -4.92 135.00 138.49 2nyb s PRO 5 Ca 0.64 2.15 -0.26 0.00 0.02 0.00 0.00 61.00 63.55 2nyb s PRO 5 Cb -0.18 -2.47 -0.11 0.00 0.02 0.00 0.00 34.50 31.76 2nyb s PRO 5 CO 0.29 -0.83 1.15 0.00 -0.33 0.00 0.00 177.00 177.28 2nyb n ALA 6 N -0.50 0.72 -1.75 -1.55 0.00 -1.26 -4.94 120.51 111.23 2nyb n ALA 6 Ca 0.07 0.29 -0.41 0.00 0.00 0.00 0.00 53.44 53.39 2nyb n ALA 6 Cb 0.45 -2.17 0.01 0.00 0.00 0.00 0.00 19.45 17.73 2nyb n ALA 6 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2nyb n LEU 7 N 0.54 4.60 0.00 0.00 4.77 -1.26 -4.90 117.00 120.75 2nyb n LEU 7 Ca 0.08 1.17 0.08 0.00 -0.03 0.00 0.00 56.01 57.31 2nyb n LEU 7 Cb 0.38 -1.58 0.49 0.00 -2.33 0.00 0.00 43.42 40.38 2nyb n LEU 7 CO 0.59 -0.15 0.70 -2.65 -1.33 0.00 0.00 177.39 174.55 2nyb n PRO 8 N 0.20 0.58 -3.77 3.23 -0.02 -1.26 -4.83 135.00 129.13 2nyb n PRO 8 Ca 0.04 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.44 2nyb n PRO 8 Cb 0.39 -1.44 -0.02 0.00 -0.02 0.00 0.00 33.50 32.41 2nyb n PRO 8 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2nyb s TYR 9 N -2.00 -0.25 0.82 6.00 -0.85 -1.26 -5.09 117.35 114.71 2nyb s TYR 9 Ca 0.25 -0.14 -0.11 0.00 -0.52 0.00 0.00 57.07 56.54 2nyb s TYR 9 Cb 0.11 0.67 0.08 0.00 0.38 0.00 0.00 41.96 43.21 2nyb s TYR 9 CO 0.19 -1.13 1.09 0.00 -1.52 0.00 0.00 175.55 174.18 2nyb s ALA 10 N -3.83 2.01 -0.74 9.51 0.00 -1.26 -4.93 121.76 122.51 2nyb s ALA 10 Ca 0.09 0.13 0.20 0.00 0.00 0.00 0.00 51.96 52.38 2nyb s ALA 10 Cb -0.05 -3.24 0.82 0.00 0.00 0.00 0.00 23.12 20.66 2nyb s ALA 10 CO 0.03 -1.97 1.61 0.36 0.00 0.00 0.00 175.76 175.79 2nyb n LYS 11 N -3.64 0.10 -0.01 0.00 2.85 -1.26 -1.78 118.16 114.42 2nyb n LYS 11 Ca 0.08 0.32 0.13 0.00 -1.05 0.00 0.00 58.31 57.80 2nyb n LYS 11 Cb 0.54 -1.69 0.41 0.00 -0.65 0.00 0.00 35.03 33.64 2nyb n LYS 11 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 2nyb n ASP 12 N -1.88 1.88 0.24 -5.58 5.75 -1.26 -3.73 116.55 111.97 2nyb n ASP 12 Ca 0.03 -1.63 0.10 0.00 -0.01 0.00 0.00 54.79 53.28 2nyb n ASP 12 Cb 0.21 -0.01 0.59 0.00 -1.03 0.00 0.00 41.12 40.88 2nyb n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2nyb h ALA 13 N 4.42 1.22 -0.02 2.12 0.00 -1.70 -2.58 119.26 122.72 2nyb h ALA 13 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2nyb h ALA 13 Cb 0.62 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2nyb h ALA 13 CO 0.00 0.24 -0.12 1.28 0.00 0.00 0.00 179.25 180.65 2nyb n LEU 14 N -3.65 2.38 -4.78 0.00 4.77 -1.26 -4.27 117.00 110.19 2nyb n LEU 14 Ca -0.01 -0.80 -0.36 0.00 -0.03 0.00 0.00 56.01 54.81 2nyb n LEU 14 Cb 0.32 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 2nyb n LEU 14 CO 0.32 0.41 0.77 0.00 -1.33 0.00 0.00 177.39 177.56 2nyb s ALA 15 N -2.14 2.93 -2.26 -1.18 0.00 -0.97 -1.47 121.76 116.67 2nyb s ALA 15 Ca 0.28 0.77 0.29 0.00 0.00 0.00 0.00 51.96 53.29 2nyb s ALA 15 Cb 0.20 -3.32 1.38 0.00 0.00 0.00 0.00 23.12 21.38 2nyb s ALA 15 CO 0.38 -0.47 1.93 -0.35 0.00 0.00 0.00 175.76 177.25 2nyb n PRO 16 N -0.64 1.37 -0.16 0.00 -0.04 -1.26 -4.88 135.00 129.39 2nyb n PRO 16 Ca 0.08 -0.54 -0.08 0.00 -0.04 0.00 0.00 63.50 62.92 2nyb n PRO 16 Cb 0.50 -1.47 0.01 0.00 -0.04 0.00 0.00 33.50 32.49 2nyb n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2nyb h HIS 17 N 1.28 0.66 -3.36 0.54 3.86 -1.61 -3.39 115.15 113.12 2nyb h HIS 17 Ca 0.00 -0.03 -0.46 0.00 -1.16 0.00 0.00 60.37 58.71 2nyb h HIS 17 Cb 0.27 -0.20 -0.35 0.00 1.06 0.00 0.00 27.41 28.19 2nyb h HIS 17 CO 0.01 0.53 -0.79 0.42 0.86 0.00 0.00 177.93 178.96 2nyb s ILE 18 N -5.71 0.77 0.70 2.45 1.01 -0.76 -4.84 121.20 114.82 2nyb s ILE 18 Ca -0.13 -0.22 -0.11 0.00 0.00 0.00 0.00 60.65 60.19 2nyb s ILE 18 Cb 0.11 -0.78 0.01 0.00 0.01 0.00 0.00 42.46 41.81 2nyb s ILE 18 CO 0.75 0.29 1.06 -0.94 0.00 0.00 0.00 174.94 176.11 2nyb s SER 19 N 1.15 5.36 0.27 3.58 1.04 -1.26 -2.29 113.70 121.55 2nyb s SER 19 Ca -0.07 1.59 -0.02 0.00 0.48 0.00 0.00 55.95 57.94 2nyb s SER 19 Cb -0.14 -2.47 0.42 0.00 0.10 0.00 0.00 66.02 63.93 2nyb s SER 19 CO -0.01 -1.45 1.87 0.00 0.98 0.00 0.00 173.24 174.62 2nyb h ALA 20 N -0.72 1.39 -0.89 5.32 0.00 -1.90 -1.85 119.26 120.61 2nyb h ALA 20 Ca -0.44 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 2nyb h ALA 20 Cb 1.21 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2nyb h ALA 20 CO 0.57 0.39 0.49 1.49 0.00 0.00 0.00 179.25 182.19 2nyb h GLU 21 N 1.12 1.23 -0.38 0.00 4.81 -1.93 0.12 114.58 119.56 2nyb h GLU 21 Ca 0.44 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.45 2nyb h GLU 21 Cb 0.23 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 2nyb h GLU 21 CO -0.19 0.89 -0.12 0.00 -0.73 0.00 0.00 179.01 178.86 2nyb h THR 22 N 1.24 1.25 -0.53 0.32 1.03 -1.78 -1.93 112.91 112.51 2nyb h THR 22 Ca 0.31 -1.12 -0.07 0.00 -0.01 0.00 0.00 66.41 65.52 2nyb h THR 22 Cb 0.01 1.09 -0.02 0.00 -1.07 0.00 0.00 68.15 68.17 2nyb h THR 22 CO -0.05 0.38 0.05 0.40 -0.01 0.00 0.00 175.52 176.28 2nyb h ILE 23 N 0.60 1.26 -0.50 0.00 1.08 -0.68 0.41 117.51 119.68 2nyb h ILE 23 Ca 0.11 -1.02 0.10 0.00 -0.39 0.00 0.00 64.86 63.66 2nyb h ILE 23 Cb 0.56 0.88 -0.10 0.00 -3.07 0.00 0.00 36.82 35.09 2nyb h ILE 23 CO 0.03 0.36 -0.18 -0.08 -0.69 0.00 0.00 178.15 177.60 2nyb h GLU 24 N 0.78 -0.06 0.03 2.37 4.81 -0.43 -0.41 114.58 121.67 2nyb h GLU 24 Ca 0.16 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 2nyb h GLU 24 Cb 0.46 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2nyb h GLU 24 CO 0.02 -0.04 -0.18 1.88 -0.73 0.00 0.00 179.01 179.95 2nyb h TYR 25 N -0.07 0.13 -0.25 0.92 0.05 -1.20 -1.77 116.97 114.79 2nyb h TYR 25 Ca 0.24 -0.09 -0.03 0.00 0.05 0.00 0.00 58.73 58.90 2nyb h TYR 25 Cb 0.43 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 2nyb h TYR 25 CO -0.47 1.04 0.05 1.25 -1.05 0.00 0.00 178.16 178.98 2nyb h HIS 26 N -0.82 0.43 0.00 4.88 2.76 -0.07 0.85 115.15 123.18 2nyb h HIS 26 Ca -0.03 -0.06 -0.02 0.00 -2.20 0.00 0.00 60.37 58.06 2nyb h HIS 26 Cb 1.11 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 29.95 2nyb h HIS 26 CO 0.25 0.51 -0.13 -0.92 -1.30 0.00 0.00 177.93 176.34 2nyb h TYR 27 N 0.22 0.00 0.00 5.26 3.20 -1.23 -0.51 116.97 123.90 2nyb h TYR 27 Ca 0.08 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2nyb h TYR 27 Cb 0.31 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 2nyb h TYR 27 CO 0.02 0.63 -0.04 0.78 -1.64 0.00 0.00 178.16 177.91 2nyb h GLY 28 N -1.00 0.00 0.00 1.82 0.00 -1.24 -2.59 103.07 100.06 2nyb h GLY 28 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2nyb h GLY 28 CO -0.02 0.00 -0.28 0.28 0.00 0.00 0.00 176.54 176.52 2nyb n LYS 29 N -3.12 0.15 0.24 4.80 4.76 0.08 -4.57 118.16 120.50 2nyb n LYS 29 Ca 0.02 0.06 -0.15 0.00 -2.87 0.00 0.00 58.31 55.37 2nyb n LYS 29 Cb 0.42 -0.68 -0.08 0.00 -1.84 0.00 0.00 35.03 32.85 2nyb n LYS 29 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2nyb h HIS 30 N -0.28 -0.56 -0.36 2.13 3.86 -0.92 0.16 115.15 119.17 2nyb h HIS 30 Ca 0.00 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.18 2nyb h HIS 30 Cb 0.28 0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.92 2nyb h HIS 30 CO -0.12 -0.27 0.15 1.25 0.86 0.00 0.00 177.93 179.80 2nyb h HIS 31 N -0.76 0.55 -0.61 2.45 -0.00 -1.10 -1.68 115.15 113.99 2nyb h HIS 31 Ca -0.06 -0.04 0.06 0.00 -0.00 0.00 0.00 60.37 60.34 2nyb h HIS 31 Cb 0.54 -0.17 -0.06 0.00 -0.00 0.00 0.00 27.41 27.73 2nyb h HIS 31 CO -0.01 0.49 0.30 0.37 -0.00 0.00 0.00 177.93 179.08 2nyb h GLN 32 N 0.44 0.55 -0.84 5.26 5.75 -1.42 -2.20 115.11 122.66 2nyb h GLN 32 Ca 0.12 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.56 2nyb h GLN 32 Cb 0.17 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.56 2nyb h GLN 32 CO -0.01 0.36 0.41 1.15 -2.65 0.00 0.00 178.83 178.09 2nyb h THR 33 N 0.56 1.25 -0.83 2.39 2.02 -0.24 -0.44 112.91 117.63 2nyb h THR 33 Ca 0.28 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2nyb h THR 33 Cb 0.22 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.76 2nyb h THR 33 CO -0.21 0.30 0.53 1.88 0.37 0.00 0.00 175.52 178.40 2nyb h TYR 34 N 1.18 1.07 -0.05 3.16 0.05 -0.85 0.11 116.97 121.64 2nyb h TYR 34 Ca 0.29 0.01 -0.00 0.00 0.05 0.00 0.00 58.73 59.08 2nyb h TYR 34 Cb 0.10 -0.36 -0.00 0.00 1.01 0.00 0.00 36.73 37.48 2nyb h TYR 34 CO 0.01 0.69 0.02 0.28 -1.05 0.00 0.00 178.16 178.12 2nyb h VAL 35 N 1.13 1.11 -0.29 -2.88 2.07 -0.79 -0.55 116.25 116.06 2nyb h VAL 35 Ca 0.30 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.52 2nyb h VAL 35 Cb -0.09 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 2nyb h VAL 35 CO -0.06 0.09 0.13 0.74 0.02 0.00 0.00 177.57 178.49 2nyb h THR 36 N -0.04 0.97 -0.60 2.57 2.02 -0.86 -0.97 112.91 116.00 2nyb h THR 36 Ca 0.02 -0.10 -0.09 0.00 0.77 0.00 0.00 66.41 67.01 2nyb h THR 36 Cb 0.12 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 2nyb h THR 36 CO -0.00 0.05 0.00 0.78 0.37 0.00 0.00 175.52 176.72 2nyb h ASN 37 N 0.28 1.02 0.08 4.18 2.35 -0.72 -1.75 115.58 121.02 2nyb h ASN 37 Ca 0.12 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 2nyb h ASN 37 Cb 0.05 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 2nyb h ASN 37 CO -0.09 1.07 -0.08 0.25 -1.65 0.00 0.00 177.43 176.92 2nyb h LEU 38 N 0.96 -0.22 -0.72 1.61 5.85 -0.87 -1.92 115.31 119.99 2nyb h LEU 38 Ca 0.17 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.99 2nyb h LEU 38 Cb 0.55 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 2nyb h LEU 38 CO 0.03 -0.13 0.39 0.78 -0.34 0.00 0.00 178.44 179.17 2nyb h ASN 39 N -0.19 0.57 -0.43 1.25 2.35 -0.99 -1.56 115.58 116.59 2nyb h ASN 39 Ca 0.01 0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.73 2nyb h ASN 39 Cb 0.18 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 2nyb h ASN 39 CO -0.03 0.35 0.05 0.78 -1.65 0.00 0.00 177.43 176.93 2nyb h ASN 40 N 0.70 0.76 0.50 5.81 2.35 -1.19 -1.86 115.58 122.64 2nyb h ASN 40 Ca 0.34 -0.16 -0.15 0.00 -0.55 0.00 0.00 56.30 55.77 2nyb h ASN 40 Cb 0.27 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2nyb h ASN 40 CO -0.22 0.80 -0.66 -0.07 -1.65 0.00 0.00 177.43 175.62 2nyb h LEU 41 N 0.76 0.18 0.00 1.61 3.38 -0.65 -3.33 115.31 117.26 2nyb h LEU 41 Ca 0.16 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2nyb h LEU 41 Cb 0.38 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2nyb h LEU 41 CO 0.01 0.79 -1.23 2.30 0.09 0.00 0.00 178.44 180.40 2nyb n ILE 42 N -3.80 0.05 -1.68 1.22 -5.35 -0.65 -4.87 119.36 104.27 2nyb n ILE 42 Ca -0.02 -0.19 -0.46 0.00 -0.27 0.00 0.00 62.75 61.81 2nyb n ILE 42 Cb 0.66 0.51 -0.04 0.00 -1.74 0.00 0.00 39.64 39.03 2nyb n ILE 42 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2nyb n LYS 43 N -1.81 2.33 -1.01 6.28 4.81 -0.71 -1.46 118.16 126.59 2nyb n LYS 43 Ca 0.02 0.85 -0.00 0.00 -0.87 0.00 0.00 58.31 58.30 2nyb n LYS 43 Cb 0.42 -2.70 -0.00 0.00 0.02 0.00 0.00 35.03 32.77 2nyb n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2nyb n GLY 44 N 4.15 0.47 3.77 3.14 0.00 -1.26 -5.04 105.19 110.43 2nyb n GLY 44 Ca 0.20 -0.17 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 2nyb n GLY 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2nyb s THR 45 N -1.94 2.14 -1.68 2.61 -4.23 -0.54 -5.01 115.64 106.99 2nyb s THR 45 Ca 0.00 -1.67 0.15 0.00 -1.18 0.00 0.00 61.69 59.00 2nyb s THR 45 Cb 0.00 -2.81 0.35 0.00 1.34 0.00 0.00 72.50 71.38 2nyb s THR 45 CO 0.00 0.00 1.40 0.00 -0.54 0.00 0.00 174.62 175.48 2nyb n ALA 46 N -1.34 1.96 0.73 3.99 0.00 -1.26 -1.84 120.51 122.75 2nyb n ALA 46 Ca -0.02 -0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.46 2nyb n ALA 46 Cb 0.65 -1.25 0.48 0.00 0.00 0.00 0.00 19.45 19.32 2nyb n ALA 46 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2nyb n PHE 47 N -1.16 0.59 -2.28 0.00 3.72 -1.26 -4.75 117.46 112.31 2nyb n PHE 47 Ca 0.09 0.18 -0.40 0.00 -0.05 0.00 0.00 57.45 57.26 2nyb n PHE 47 Cb 0.09 -0.79 -0.03 0.00 -0.94 0.00 0.00 39.48 37.81 2nyb n PHE 47 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2nyb s GLU 48 N -3.08 4.49 0.00 -1.08 2.02 -0.77 -2.68 118.70 117.60 2nyb s GLU 48 Ca 0.11 2.02 0.00 0.00 0.02 0.00 0.00 54.97 57.13 2nyb s GLU 48 Cb 0.14 -3.13 0.00 0.00 0.10 0.00 0.00 34.13 31.25 2nyb s GLU 48 CO 0.55 -0.00 0.00 0.41 0.02 0.00 0.00 175.26 176.24 2nyb n GLY 49 N 1.00 3.24 3.77 -1.39 0.00 -1.26 -5.04 105.19 105.51 2nyb n GLY 49 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2nyb n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nyb s LYS 50 N -0.69 4.65 0.95 1.61 1.02 -1.09 -5.07 119.74 121.12 2nyb s LYS 50 Ca 0.00 1.26 -0.12 0.00 0.02 0.00 0.00 55.97 57.13 2nyb s LYS 50 Cb 0.00 -3.24 0.16 0.00 -0.52 0.00 0.00 37.83 34.23 2nyb s LYS 50 CO 0.00 0.54 1.09 -1.54 -0.92 0.00 0.00 175.35 174.52 2nyb s SER 51 N -1.19 2.95 0.20 2.83 1.04 -1.26 -4.82 113.70 113.45 2nyb s SER 51 Ca 0.38 1.59 -0.11 0.00 0.48 0.00 0.00 55.95 58.29 2nyb s SER 51 Cb -0.24 -2.25 0.21 0.00 0.10 0.00 0.00 66.02 63.84 2nyb s SER 51 CO 0.28 -2.99 1.78 0.25 0.98 0.00 0.00 173.24 173.55 2nyb h LEU 52 N -1.79 0.40 -1.01 2.42 5.85 -1.97 -1.42 115.31 117.78 2nyb h LEU 52 Ca -0.51 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.15 2nyb h LEU 52 Cb 1.29 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2nyb h LEU 52 CO 0.52 0.26 -0.44 -0.33 -0.34 0.00 0.00 178.44 178.11 2nyb h GLU 53 N 0.54 0.12 -0.45 1.25 5.08 -1.95 -1.27 114.58 117.90 2nyb h GLU 53 Ca 0.27 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.49 2nyb h GLU 53 Cb 0.21 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2nyb h GLU 53 CO -0.20 0.54 -0.05 0.93 -1.00 0.00 0.00 179.01 179.22 2nyb h GLU 54 N 0.10 0.83 -0.10 2.33 5.08 -1.82 -2.26 114.58 118.75 2nyb h GLU 54 Ca 0.01 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2nyb h GLU 54 Cb 0.82 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.00 2nyb h GLU 54 CO 0.06 0.91 0.06 0.82 -1.00 0.00 0.00 179.01 179.86 2nyb h ILE 55 N 0.67 1.06 -0.97 3.13 2.04 -0.99 -2.62 117.51 119.83 2nyb h ILE 55 Ca 0.12 -0.17 0.10 0.00 1.00 0.00 0.00 64.86 65.91 2nyb h ILE 55 Cb 0.57 1.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.58 2nyb h ILE 55 CO 0.03 0.06 0.62 0.40 0.00 0.00 0.00 178.15 179.26 2nyb h ILE 56 N 0.09 0.97 -0.04 -0.67 2.04 -1.19 -1.51 117.51 117.19 2nyb h ILE 56 Ca 0.03 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2nyb h ILE 56 Cb 0.04 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.00 2nyb h ILE 56 CO -0.01 0.18 0.00 0.54 0.00 0.00 0.00 178.15 178.87 2nyb n ARG 57 N -4.56 1.43 -0.50 2.37 1.74 -0.86 -4.02 116.66 112.26 2nyb n ARG 57 Ca 0.17 -0.63 0.01 0.00 -0.77 0.00 0.00 57.85 56.63 2nyb n ARG 57 Cb 0.30 -1.44 0.01 0.00 -1.02 0.00 0.00 32.46 30.32 2nyb n ARG 57 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2nyb n SER 58 N -0.21 0.21 -4.31 0.55 3.41 -0.63 -5.07 113.62 107.57 2nyb n SER 58 Ca 0.19 -2.08 -0.16 0.00 -0.26 0.00 0.00 58.87 56.55 2nyb n SER 58 Cb 0.25 -0.22 -0.10 0.00 -0.26 0.00 0.00 64.21 63.88 2nyb n SER 58 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2nyb s SER 59 N -1.17 1.55 0.28 4.04 1.04 -0.84 -5.01 113.70 113.59 2nyb s SER 59 Ca 0.03 -1.25 0.04 0.00 0.48 0.00 0.00 55.95 55.25 2nyb s SER 59 Cb 0.03 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.19 2nyb s SER 59 CO -0.00 -0.58 0.20 -1.61 0.98 0.00 0.00 173.24 172.23 2nyb s GLU 60 N -3.92 1.55 4.79 4.02 2.02 -1.26 -4.72 118.70 121.18 2nyb s GLU 60 Ca 0.30 -1.88 0.00 0.00 0.02 0.00 0.00 54.97 53.41 2nyb s GLU 60 Cb 0.06 0.20 0.00 0.00 0.10 0.00 0.00 34.13 34.49 2nyb s GLU 60 CO 0.09 -0.52 0.00 0.41 0.02 0.00 0.00 175.26 175.26 2nyb n GLY 61 N -0.51 2.72 0.33 -1.39 0.00 -1.26 -2.51 105.19 102.58 2nyb n GLY 61 Ca 0.04 -0.29 -0.05 0.00 0.00 0.00 0.00 46.02 45.72 2nyb n GLY 61 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2nyb h GLY 62 N 0.00 1.25 0.90 -0.02 0.00 -1.99 -0.22 103.07 102.98 2nyb h GLY 62 Ca 0.00 -0.60 0.01 0.00 0.00 0.00 0.00 47.33 46.74 2nyb h GLY 62 CO 0.00 0.57 0.05 -2.08 0.00 0.00 0.00 176.54 175.08 2nyb h VAL 63 N 1.15 0.97 0.15 4.60 2.07 -1.95 -1.73 116.25 121.51 2nyb h VAL 63 Ca 0.28 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.76 2nyb h VAL 63 Cb 0.09 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 2nyb h VAL 63 CO -0.04 0.02 -0.09 0.15 0.02 0.00 0.00 177.57 177.63 2nyb h PHE 64 N 0.12 -0.24 -0.60 1.57 3.57 -1.17 -0.75 116.94 119.45 2nyb h PHE 64 Ca 0.06 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.62 2nyb h PHE 64 Cb 0.03 0.09 -0.06 0.00 2.79 0.00 0.00 35.95 38.80 2nyb h PHE 64 CO -0.11 -0.15 0.29 -0.91 -2.23 0.00 0.00 178.31 175.21 2nyb h ASN 65 N -0.24 0.40 -0.15 0.41 2.35 -0.87 0.55 115.58 118.03 2nyb h ASN 65 Ca -0.01 0.04 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 2nyb h ASN 65 Cb 0.20 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 2nyb h ASN 65 CO 0.01 0.26 -0.26 0.78 -1.65 0.00 0.00 177.43 176.57 2nyb h ASN 66 N 0.55 0.49 -0.23 5.81 4.21 -1.27 -2.10 115.58 123.04 2nyb h ASN 66 Ca 0.28 -0.54 -0.01 0.00 1.21 0.00 0.00 56.30 57.24 2nyb h ASN 66 Cb 0.22 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.27 2nyb h ASN 66 CO -0.21 0.94 0.12 0.00 -1.29 0.00 0.00 177.43 176.99 2nyb h ALA 67 N 0.57 0.30 -0.46 -0.83 0.00 -0.80 -0.35 119.26 117.69 2nyb h ALA 67 Ca 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2nyb h ALA 67 Cb 0.84 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2nyb h ALA 67 CO 0.06 -0.15 0.26 0.00 0.00 0.00 0.00 179.25 179.42 2nyb h ALA 68 N 0.99 0.59 -0.39 0.00 0.00 -0.97 -2.06 119.26 117.42 2nyb h ALA 68 Ca 0.08 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2nyb h ALA 68 Cb 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2nyb h ALA 68 CO -0.01 0.10 0.03 0.93 0.00 0.00 0.00 179.25 180.30 2nyb h GLU 69 N 0.61 0.61 -0.13 0.00 4.39 -1.17 0.18 114.58 119.06 2nyb h GLU 69 Ca 0.16 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2nyb h GLU 69 Cb 0.03 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 2nyb h GLU 69 CO -0.03 0.61 0.09 0.28 -1.16 0.00 0.00 179.01 178.80 2nyb h VAL 70 N 0.58 1.03 -0.33 3.13 2.07 -0.65 -1.50 116.25 120.59 2nyb h VAL 70 Ca 0.13 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.55 2nyb h VAL 70 Cb 0.33 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 2nyb h VAL 70 CO 0.01 0.03 0.06 -0.25 0.02 0.00 0.00 177.57 177.45 2nyb h TRP 71 N 0.18 0.57 -0.58 1.57 7.01 -0.97 -2.50 115.95 121.23 2nyb h TRP 71 Ca 0.05 -0.07 0.03 0.00 2.11 0.00 0.00 58.89 61.01 2nyb h TRP 71 Cb -0.02 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 26.84 2nyb h TRP 71 CO -0.07 0.60 0.34 -0.91 -2.79 0.00 0.00 178.44 175.61 2nyb h ASN 72 N 0.37 0.54 -0.48 2.65 2.35 -0.52 -1.11 115.58 119.39 2nyb h ASN 72 Ca 0.10 0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 2nyb h ASN 72 Cb 0.33 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 2nyb h ASN 72 CO 0.00 0.37 -0.06 0.45 -1.65 0.00 0.00 177.43 176.54 2nyb h HIS 73 N 0.66 0.98 -0.47 1.19 3.86 -1.20 0.24 115.15 120.41 2nyb h HIS 73 Ca 0.24 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.22 2nyb h HIS 73 Cb 0.06 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.26 2nyb h HIS 73 CO -0.07 0.94 0.16 1.79 0.86 0.00 0.00 177.93 181.61 2nyb h THR 74 N 0.73 1.19 -0.17 2.45 1.35 -1.14 -0.47 112.91 116.85 2nyb h THR 74 Ca 0.13 -0.63 -0.03 0.00 -0.55 0.00 0.00 66.41 65.32 2nyb h THR 74 Cb 0.60 0.66 -0.01 0.00 -1.73 0.00 0.00 68.15 67.67 2nyb h THR 74 CO 0.04 0.24 -0.02 0.15 -0.25 0.00 0.00 175.52 175.67 2nyb h PHE 75 N 0.68 0.36 -0.39 4.73 3.57 -1.04 -2.99 116.94 121.85 2nyb h PHE 75 Ca 0.16 -0.07 0.06 0.00 3.53 0.00 0.00 57.97 61.65 2nyb h PHE 75 Cb 0.19 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 2nyb h PHE 75 CO 0.01 0.56 0.08 -0.92 -2.23 0.00 0.00 178.31 175.81 2nyb h TYR 76 N 0.05 0.12 -0.41 0.41 3.20 -0.44 -1.47 116.97 118.43 2nyb h TYR 76 Ca 0.05 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 2nyb h TYR 76 Cb 0.44 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 2nyb h TYR 76 CO 0.04 0.01 0.12 -1.49 -1.64 0.00 0.00 178.16 175.21 2nyb h TRP 77 N 0.20 0.60 0.00 -3.82 -0.00 -1.13 -1.04 115.95 110.75 2nyb h TRP 77 Ca 0.19 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 59.02 2nyb h TRP 77 Cb 0.23 -0.18 -0.00 0.00 -0.00 0.00 0.00 29.16 29.20 2nyb h TRP 77 CO -0.20 0.50 -0.11 -0.91 -0.00 0.00 0.00 178.44 177.72 2nyb h ASN 78 N 0.59 0.00 0.79 -3.49 2.35 -1.26 -2.81 115.58 111.75 2nyb h ASN 78 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2nyb h ASN 78 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2nyb h ASN 78 CO -0.01 0.11 0.00 0.00 -1.65 0.00 0.00 177.43 175.88 2nyb s LEU 80 N -2.94 2.35 -0.02 0.00 1.43 -1.06 -0.32 118.68 118.12 2nyb s LEU 80 Ca 0.14 -0.75 -0.29 0.00 -1.03 0.00 0.00 54.13 52.20 2nyb s LEU 80 Cb 0.16 -1.24 0.08 0.00 0.03 0.00 0.00 46.19 45.23 2nyb s LEU 80 CO 0.44 0.18 0.75 0.00 0.23 0.00 0.00 176.35 177.94 2nyb s ALA 81 N -1.10 -1.77 0.75 4.21 0.00 0.14 -4.71 121.76 119.27 2nyb s ALA 81 Ca 0.15 1.14 -0.11 0.00 0.00 0.00 0.00 51.96 53.14 2nyb s ALA 81 Cb -0.10 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.19 2nyb s ALA 81 CO 0.06 -0.49 1.09 -1.25 0.00 0.00 0.00 175.76 175.18 2nyb s PRO 82 N -2.00 2.38 -1.44 0.00 0.04 -1.26 -3.91 135.00 128.82 2nyb s PRO 82 Ca -0.05 1.19 -0.04 0.00 0.04 0.00 0.00 61.00 62.14 2nyb s PRO 82 Cb -0.00 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.66 2nyb s PRO 82 CO 0.01 -1.55 0.58 -1.71 0.04 0.00 0.00 177.00 174.37 2nyb n ASN 83 N -3.32 -1.38 0.00 6.66 5.15 -1.26 -4.92 115.26 116.19 2nyb n ASN 83 Ca 0.09 -0.95 0.00 0.00 -0.60 0.00 0.00 54.58 53.12 2nyb n ASN 83 Cb 0.53 -3.29 0.00 0.00 -0.53 0.00 0.00 39.78 36.48 2nyb n ASN 83 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2nyb n ALA 84 N -4.41 0.00 -0.48 5.20 0.00 -1.25 -5.12 120.51 114.45 2nyb n ALA 84 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2nyb n ALA 84 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 2nyb n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nyb n GLY 85 N 0.57 0.21 7.00 0.00 0.00 0.18 -4.77 105.19 108.38 2nyb n GLY 85 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2nyb n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nyb n GLY 86 N 0.00 2.39 3.33 -0.02 0.00 -1.24 -4.81 105.19 104.84 2nyb n GLY 86 Ca 0.00 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 2nyb n GLY 86 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nyb s GLU 87 N 0.00 1.49 0.77 1.61 2.02 -1.26 -4.99 118.70 118.34 2nyb s GLU 87 Ca 0.00 -1.15 -0.11 0.00 0.02 0.00 0.00 54.97 53.73 2nyb s GLU 87 Cb 0.00 -1.76 0.05 0.00 0.10 0.00 0.00 34.13 32.52 2nyb s GLU 87 CO 0.00 0.44 1.08 -1.25 0.02 0.00 0.00 175.26 175.55 2nyb s PRO 88 N -1.57 2.29 0.49 0.39 0.04 -1.26 -5.07 135.00 130.31 2nyb s PRO 88 Ca 0.11 0.96 0.02 0.00 0.04 0.00 0.00 61.00 62.12 2nyb s PRO 88 Cb -0.10 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 2nyb s PRO 88 CO 0.03 -1.56 0.05 0.95 0.04 0.00 0.00 177.00 176.51 2nyb s THR 89 N -3.00 0.89 0.00 1.26 -4.23 -1.26 -4.47 115.64 104.84 2nyb s THR 89 Ca 0.60 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 2nyb s THR 89 Cb -0.16 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.54 2nyb s THR 89 CO 0.56 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.25 2nyb n GLY 90 N -1.18 2.76 0.35 3.99 0.00 -1.26 -2.23 105.19 107.62 2nyb n GLY 90 Ca -0.16 -0.17 -0.03 0.00 0.00 0.00 0.00 46.02 45.66 2nyb n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nyb h LYS 91 N 0.00 1.21 -0.14 1.61 1.79 -1.99 -1.29 116.57 117.77 2nyb h LYS 91 Ca 0.00 -0.09 -0.02 0.00 -2.18 0.00 0.00 60.65 58.37 2nyb h LYS 91 Cb 0.00 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.38 2nyb h LYS 91 CO 0.00 0.82 0.03 0.28 -1.08 0.00 0.00 179.45 179.50 2nyb h VAL 92 N 1.24 1.21 -0.65 0.50 2.07 -1.93 -1.01 116.25 117.68 2nyb h VAL 92 Ca 0.33 -0.66 0.07 0.00 0.82 0.00 0.00 66.70 67.26 2nyb h VAL 92 Cb -0.10 1.38 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 2nyb h VAL 92 CO -0.07 0.20 0.33 0.00 0.02 0.00 0.00 177.57 178.05 2nyb h ALA 93 N 0.82 0.87 -0.23 1.67 0.00 -1.10 -1.37 119.26 119.92 2nyb h ALA 93 Ca 0.04 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 2nyb h ALA 93 Cb 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2nyb h ALA 93 CO 0.00 -0.03 -0.42 1.05 0.00 0.00 0.00 179.25 179.85 2nyb h GLU 94 N 0.60 0.57 -0.36 0.00 4.11 -1.11 -1.40 114.58 116.99 2nyb h GLU 94 Ca 0.30 -0.30 -0.11 0.00 0.07 0.00 0.00 59.36 59.33 2nyb h GLU 94 Cb 0.25 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2nyb h GLU 94 CO -0.22 0.88 -0.19 0.00 0.07 0.00 0.00 179.01 179.56 2nyb h ALA 95 N 1.08 0.51 -0.27 1.06 0.00 -0.90 -1.40 119.26 119.34 2nyb h ALA 95 Ca 0.04 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 2nyb h ALA 95 Cb 0.93 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2nyb h ALA 95 CO 0.08 0.45 -0.01 0.82 0.00 0.00 0.00 179.25 180.59 2nyb h ILE 96 N 0.55 1.26 -0.85 0.00 2.04 -1.22 -2.04 117.51 117.26 2nyb h ILE 96 Ca 0.08 -0.95 0.02 0.00 1.00 0.00 0.00 64.86 65.01 2nyb h ILE 96 Cb 0.74 1.35 -0.05 0.00 -0.74 0.00 0.00 36.82 38.12 2nyb h ILE 96 CO 0.06 0.30 0.55 0.00 0.00 0.00 0.00 178.15 179.06 2nyb h ALA 97 N 0.81 1.10 -0.40 1.87 0.00 -1.25 0.12 119.26 121.50 2nyb h ALA 97 Ca 0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2nyb h ALA 97 Cb 0.44 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2nyb h ALA 97 CO 0.02 0.42 -0.10 0.00 0.00 0.00 0.00 179.25 179.58 2nyb h ALA 98 N 1.33 1.07 0.18 0.00 0.00 -1.12 0.77 119.26 121.50 2nyb h ALA 98 Ca 0.33 -0.30 -0.35 0.00 0.00 0.00 0.00 54.91 54.58 2nyb h ALA 98 Cb -0.05 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.58 2nyb h ALA 98 CO -0.09 0.57 -1.77 1.03 0.00 0.00 0.00 179.25 178.99 2nyb h SER 99 N 0.64 0.60 -0.01 0.00 0.87 -1.10 -3.40 113.55 111.15 2nyb h SER 99 Ca 0.11 -0.92 0.00 0.00 -1.23 0.00 0.00 61.79 59.75 2nyb h SER 99 Cb 0.55 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 2nyb h SER 99 CO 0.03 1.78 -0.10 0.49 -0.53 0.00 0.00 176.83 178.50 2nyb n PHE 100 N -3.58 0.00 0.00 2.24 3.72 0.39 -5.01 117.46 115.23 2nyb n PHE 100 Ca -0.25 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.15 2nyb n PHE 100 Cb 1.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.61 2nyb n PHE 100 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2nyb n GLY 101 N 0.74 2.34 3.35 1.37 0.00 0.26 -4.50 105.19 108.75 2nyb n GLY 101 Ca 0.05 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 2nyb n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nyb s SER 102 N 0.00 -0.10 0.23 1.61 1.04 -1.26 -4.73 113.70 110.48 2nyb s SER 102 Ca 0.00 -0.57 -0.08 0.00 0.48 0.00 0.00 55.95 55.78 2nyb s SER 102 Cb 0.00 0.47 0.20 0.00 0.10 0.00 0.00 66.02 66.78 2nyb s SER 102 CO 0.00 -0.89 1.89 0.15 0.98 0.00 0.00 173.24 175.36 2nyb h PHE 103 N 2.44 1.11 -0.99 5.02 3.57 -1.90 -2.16 116.94 124.03 2nyb h PHE 103 Ca -0.32 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.22 2nyb h PHE 103 Cb 1.24 -0.37 -0.06 0.00 2.79 0.00 0.00 35.95 39.55 2nyb h PHE 103 CO 0.37 0.72 0.65 0.00 -2.23 0.00 0.00 178.31 177.82 2nyb h ALA 104 N 1.30 1.31 -0.25 2.41 0.00 -1.96 0.20 119.26 122.27 2nyb h ALA 104 Ca 0.31 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2nyb h ALA 104 Cb -0.09 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 2nyb h ALA 104 CO -0.06 0.55 0.02 -0.44 0.00 0.00 0.00 179.25 179.33 2nyb h ASP 105 N 1.26 0.41 -0.37 0.00 3.32 -1.79 -1.25 116.42 118.00 2nyb h ASP 105 Ca 0.39 -0.28 0.05 0.00 0.02 0.00 0.00 57.03 57.22 2nyb h ASP 105 Cb -0.02 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.37 2nyb h ASP 105 CO -0.12 0.59 0.08 0.15 -1.72 0.00 0.00 179.24 178.22 2nyb h PHE 106 N 0.22 0.14 -0.32 4.55 3.57 -0.86 -1.06 116.94 123.17 2nyb h PHE 106 Ca 0.07 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.62 2nyb h PHE 106 Cb 0.36 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 2nyb h PHE 106 CO 0.03 0.03 0.16 -0.22 -2.23 0.00 0.00 178.31 176.08 2nyb h LYS 107 N 0.21 0.33 -0.47 1.11 3.64 -0.43 0.93 116.57 121.90 2nyb h LYS 107 Ca 0.18 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2nyb h LYS 107 Cb 0.20 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2nyb h LYS 107 CO -0.23 0.22 0.30 0.00 -2.27 0.00 0.00 179.45 177.47 2nyb h ALA 108 N 1.16 0.59 -0.51 5.00 0.00 -1.05 -1.16 119.26 123.30 2nyb h ALA 108 Ca 0.13 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 2nyb h ALA 108 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2nyb h ALA 108 CO -0.09 0.05 -0.09 1.96 0.00 0.00 0.00 179.25 181.08 2nyb h GLN 109 N 0.63 0.96 -0.30 0.00 4.20 -0.74 -0.77 115.11 119.10 2nyb h GLN 109 Ca 0.17 -0.35 -0.04 0.00 0.06 0.00 0.00 58.65 58.48 2nyb h GLN 109 Cb -0.05 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2nyb h GLN 109 CO -0.04 1.02 0.02 0.35 -0.67 0.00 0.00 178.83 179.52 2nyb h PHE 110 N 0.83 0.57 -0.22 2.96 3.04 -0.76 -1.50 116.94 121.86 2nyb h PHE 110 Ca 0.13 -0.09 0.02 0.00 3.98 0.00 0.00 57.97 62.01 2nyb h PHE 110 Cb 0.65 -0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.98 2nyb h PHE 110 CO 0.05 0.64 0.07 1.15 -2.02 0.00 0.00 178.31 178.20 2nyb h THR 111 N 0.33 0.94 -0.58 4.41 2.02 -1.12 -0.94 112.91 117.99 2nyb h THR 111 Ca 0.09 -0.06 -0.05 0.00 0.77 0.00 0.00 66.41 67.16 2nyb h THR 111 Cb 0.40 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2nyb h THR 111 CO 0.01 0.03 0.17 0.44 0.37 0.00 0.00 175.52 176.54 2nyb h ASP 112 N 0.17 0.81 -0.47 4.18 3.45 -1.03 -0.51 116.42 123.02 2nyb h ASP 112 Ca 0.10 -0.13 -0.08 0.00 0.43 0.00 0.00 57.03 57.34 2nyb h ASP 112 Cb 0.07 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 2nyb h ASP 112 CO -0.10 0.77 -0.01 0.00 -1.57 0.00 0.00 179.24 178.33 2nyb h ALA 113 N 1.34 0.64 -0.54 3.45 0.00 -1.04 -2.12 119.26 121.00 2nyb h ALA 113 Ca 0.19 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 2nyb h ALA 113 Cb 0.26 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2nyb h ALA 113 CO -0.01 0.45 -0.08 0.00 0.00 0.00 0.00 179.25 179.61 2nyb h ALA 114 N 0.92 0.84 -0.40 0.00 0.00 -0.75 -2.02 119.26 117.85 2nyb h ALA 114 Ca 0.13 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2nyb h ALA 114 Cb 0.52 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2nyb h ALA 114 CO 0.03 0.66 0.11 0.82 0.00 0.00 0.00 179.25 180.87 2nyb h ILE 115 N 0.88 1.22 0.00 0.00 1.08 -1.09 -3.16 117.51 116.45 2nyb h ILE 115 Ca 0.14 -0.73 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 2nyb h ILE 115 Cb 0.63 0.95 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 2nyb h ILE 115 CO 0.04 0.26 0.00 0.11 -0.69 0.00 0.00 178.15 177.87 2nyb h LYS 116 N 0.49 0.00 -6.05 2.37 1.57 -1.19 -3.44 116.57 110.32 2nyb h LYS 116 Ca 0.13 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.34 2nyb h LYS 116 Cb 0.28 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2nyb h LYS 116 CO -0.00 0.00 1.41 1.21 -0.57 0.00 0.00 179.45 181.50 2nyb s ASN 117 N -5.01 5.48 0.05 0.86 3.84 -0.78 -4.91 114.94 114.48 2nyb s ASN 117 Ca 0.05 1.44 -0.27 0.00 0.21 0.00 0.00 52.86 54.29 2nyb s ASN 117 Cb 0.09 -2.52 -0.05 0.00 -0.55 0.00 0.00 41.25 38.22 2nyb s ASN 117 CO 0.53 -2.01 0.87 0.12 -2.79 0.00 0.00 177.10 173.81 2nyb s PHE 118 N 8.30 3.74 0.00 0.43 5.36 -1.26 -4.81 117.98 129.73 2nyb s PHE 118 Ca 0.89 1.61 0.00 0.00 -0.96 0.00 0.00 56.93 58.48 2nyb s PHE 118 Cb -0.25 -2.95 0.00 0.00 -0.34 0.00 0.00 43.02 39.47 2nyb s PHE 118 CO 0.32 0.19 0.00 0.41 -1.46 0.00 0.00 175.22 174.68 2nyb n GLY 119 N 2.48 -0.70 3.83 13.12 0.00 -1.26 -4.84 105.19 117.82 2nyb n GLY 119 Ca 0.01 -1.18 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 2nyb n GLY 119 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nyb s SER 120 N -4.00 6.90 0.00 1.61 0.01 -1.26 -4.73 113.70 112.24 2nyb s SER 120 Ca 0.00 1.28 0.00 0.00 1.31 0.00 0.00 55.95 58.54 2nyb s SER 120 Cb 0.00 -2.37 0.00 0.00 0.21 0.00 0.00 66.02 63.86 2nyb s SER 120 CO 0.00 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2nyb n GLY 121 N 0.38 -0.53 3.04 3.44 0.00 -1.26 -0.70 105.19 109.57 2nyb n GLY 121 Ca -0.01 -0.88 -0.11 0.00 0.00 0.00 0.00 46.02 45.02 2nyb n GLY 121 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2nyb s TRP 122 N -3.34 0.06 -0.05 1.61 0.52 -0.63 -0.65 118.94 116.46 2nyb s TRP 122 Ca 0.00 -0.13 0.06 0.00 0.02 0.00 0.00 56.10 56.04 2nyb s TRP 122 Cb 0.00 -0.06 -0.01 0.00 -1.15 0.00 0.00 33.47 32.25 2nyb s TRP 122 CO 0.00 -0.20 -0.23 0.99 0.02 0.00 0.00 176.95 177.53 2nyb s THR 123 N -1.04 1.88 0.04 2.01 2.01 -0.69 -0.45 115.64 119.41 2nyb s THR 123 Ca -0.11 -0.98 0.05 0.00 0.31 0.00 0.00 61.69 60.96 2nyb s THR 123 Cb -0.07 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 2nyb s THR 123 CO 0.01 0.53 -0.16 0.26 -0.69 0.00 0.00 174.62 174.57 2nyb s TRP 124 N -0.17 1.36 -0.22 4.92 0.52 0.29 -1.14 118.94 124.49 2nyb s TRP 124 Ca -0.02 -0.36 -0.11 0.00 0.02 0.00 0.00 56.10 55.63 2nyb s TRP 124 Cb -0.13 -0.80 -0.05 0.00 -1.15 0.00 0.00 33.47 31.35 2nyb s TRP 124 CO 0.03 0.05 0.19 -1.17 0.02 0.00 0.00 176.95 176.07 2nyb s LEU 125 N -1.20 4.16 0.18 2.99 2.96 -0.30 -1.34 118.68 126.13 2nyb s LEU 125 Ca 0.03 0.23 0.08 0.00 -0.22 0.00 0.00 54.13 54.25 2nyb s LEU 125 Cb -0.08 -2.18 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 2nyb s LEU 125 CO 0.01 0.09 -0.15 0.68 -1.32 0.00 0.00 176.35 175.66 2nyb s VAL 126 N 0.82 1.70 -0.24 1.68 -7.23 0.11 -0.20 120.40 117.04 2nyb s VAL 126 Ca 0.10 -2.07 -0.04 0.00 -1.81 0.00 0.00 61.98 58.15 2nyb s VAL 126 Cb -0.13 -1.92 -0.00 0.00 0.56 0.00 0.00 36.38 34.88 2nyb s VAL 126 CO 0.03 -0.50 -0.01 -0.75 -0.31 0.00 0.00 175.10 173.55 2nyb s LYS 127 N -3.30 3.30 0.83 4.82 2.20 0.14 -1.32 119.74 126.41 2nyb s LYS 127 Ca 0.19 -0.69 -0.11 0.00 -0.36 0.00 0.00 55.97 55.00 2nyb s LYS 127 Cb -0.02 -3.11 0.09 0.00 -1.51 0.00 0.00 37.83 33.28 2nyb s LYS 127 CO 0.06 -0.26 1.09 -0.80 -0.36 0.00 0.00 175.35 175.08 2nyb s ASN 128 N 1.48 4.11 0.31 1.43 0.02 0.12 -0.57 114.94 121.84 2nyb s ASN 128 Ca 0.05 1.48 0.25 0.00 -1.02 0.00 0.00 52.86 53.62 2nyb s ASN 128 Cb -0.15 -2.20 1.06 0.00 0.02 0.00 0.00 41.25 39.98 2nyb s ASN 128 CO -0.02 -2.23 1.75 0.77 0.02 0.00 0.00 177.10 177.39 2nyb h SER 129 N -1.27 0.00 -0.18 -1.22 4.64 -1.87 0.24 113.55 113.89 2nyb h SER 129 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2nyb h SER 129 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2nyb h SER 129 CO 0.56 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.62 2nyb n ASP 130 N -2.37 1.66 0.00 4.97 5.68 -1.26 -4.94 116.55 120.29 2nyb n ASP 130 Ca 0.02 -1.73 0.00 0.00 -0.50 0.00 0.00 54.79 52.58 2nyb n ASP 130 Cb 0.23 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 2nyb n ASP 130 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2nyb n GLY 131 N 1.12 1.19 3.77 6.12 0.00 0.07 -5.05 105.19 112.41 2nyb n GLY 131 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2nyb n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nyb s LYS 132 N -0.64 4.22 0.11 1.61 1.02 -1.26 -4.71 119.74 120.09 2nyb s LYS 132 Ca 0.00 2.17 -0.06 0.00 0.02 0.00 0.00 55.97 58.10 2nyb s LYS 132 Cb 0.00 -2.95 -0.06 0.00 -0.52 0.00 0.00 37.83 34.31 2nyb s LYS 132 CO 0.00 -0.29 0.37 -0.51 -0.92 0.00 0.00 175.35 174.00 2nyb s LEU 133 N -2.04 4.30 -0.00 3.17 1.43 -1.26 0.11 118.68 124.38 2nyb s LEU 133 Ca 0.52 0.63 -0.14 0.00 -1.03 0.00 0.00 54.13 54.11 2nyb s LEU 133 Cb -0.38 -3.17 0.02 0.00 0.03 0.00 0.00 46.19 42.68 2nyb s LEU 133 CO 0.51 0.10 0.28 0.00 0.23 0.00 0.00 176.35 177.47 2nyb s ALA 134 N -1.56 -0.70 -0.21 4.21 0.00 -0.43 -4.95 121.76 118.13 2nyb s ALA 134 Ca 0.38 0.21 -0.12 0.00 0.00 0.00 0.00 51.96 52.42 2nyb s ALA 134 Cb -0.13 0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.06 2nyb s ALA 134 CO 0.22 -0.27 0.23 0.42 0.00 0.00 0.00 175.76 176.35 2nyb s ILE 135 N -1.52 5.33 0.00 0.00 1.01 -1.26 -0.71 121.20 124.06 2nyb s ILE 135 Ca -0.12 0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.89 2nyb s ILE 135 Cb -0.05 -3.56 -0.00 0.00 0.01 0.00 0.00 42.46 38.85 2nyb s ILE 135 CO 0.03 0.36 -0.02 0.54 0.00 0.00 0.00 174.94 175.85 2nyb s VAL 136 N 0.80 0.15 0.02 2.92 0.11 -0.45 -4.99 120.40 118.96 2nyb s VAL 136 Ca 0.12 -0.20 0.03 0.00 -2.93 0.00 0.00 61.98 58.99 2nyb s VAL 136 Cb -0.13 -0.16 -0.04 0.00 -1.53 0.00 0.00 36.38 34.53 2nyb s VAL 136 CO 0.03 -0.04 -0.01 -0.44 -3.33 0.00 0.00 175.10 171.32 2nyb s SER 137 N -0.25 5.00 0.20 3.54 0.01 -1.26 -0.55 113.70 120.39 2nyb s SER 137 Ca -0.02 -0.08 0.08 0.00 1.31 0.00 0.00 55.95 57.25 2nyb s SER 137 Cb -0.02 -1.25 -0.05 0.00 0.21 0.00 0.00 66.02 64.91 2nyb s SER 137 CO -0.00 0.25 -0.16 0.42 0.41 0.00 0.00 173.24 174.16 2nyb s THR 138 N -1.13 1.83 -0.11 1.44 -4.23 0.40 -5.00 115.64 108.84 2nyb s THR 138 Ca 0.21 -2.15 -0.04 0.00 -1.18 0.00 0.00 61.69 58.53 2nyb s THR 138 Cb -0.11 -2.01 -0.04 0.00 1.34 0.00 0.00 72.50 71.68 2nyb s THR 138 CO 0.12 -0.50 0.05 -0.44 -0.54 0.00 0.00 174.62 173.31 2nyb s SER 139 N -3.15 5.65 1.87 3.99 0.01 -1.26 -1.61 113.70 119.20 2nyb s SER 139 Ca 0.21 0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.70 2nyb s SER 139 Cb -0.03 -1.75 0.00 0.00 0.21 0.00 0.00 66.02 64.46 2nyb s SER 139 CO 0.08 0.35 0.00 0.59 0.41 0.00 0.00 173.24 174.66 2nyb n ASN 140 N 2.37 0.00 -0.45 2.44 3.02 0.13 -1.44 115.26 121.32 2nyb n ASN 140 Ca -0.19 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.50 2nyb n ASN 140 Cb 0.54 0.00 0.50 0.00 -0.61 0.00 0.00 39.78 40.21 2nyb n ASN 140 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2nyb n ALA 141 N 11.56 2.64 -1.61 5.41 0.00 -1.26 -4.36 120.51 132.88 2nyb n ALA 141 Ca 0.00 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 52.58 2nyb n ALA 141 Cb 0.00 -1.16 0.01 0.00 0.00 0.00 0.00 19.45 18.30 2nyb n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nyb n GLY 142 N 1.20 -0.18 3.15 0.00 0.00 -0.52 -4.53 105.19 104.31 2nyb n GLY 142 Ca 0.18 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.25 2nyb n GLY 142 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2nyb s THR 143 N -1.24 0.03 -0.64 2.61 -1.32 -1.26 -4.71 115.64 109.10 2nyb s THR 143 Ca 0.62 -0.22 0.10 0.00 -1.21 0.00 0.00 61.69 60.99 2nyb s THR 143 Cb -0.57 -0.42 0.10 0.00 -1.51 0.00 0.00 72.50 70.10 2nyb s THR 143 CO 0.57 -0.12 1.32 -2.65 -2.21 0.00 0.00 174.62 171.54 2nyb n PRO 144 N 2.36 0.07 0.30 7.08 -0.02 -1.26 -2.51 135.00 141.02 2nyb n PRO 144 Ca -0.16 0.55 0.16 0.00 -2.02 0.00 0.00 63.50 62.03 2nyb n PRO 144 Cb 0.57 -1.71 0.97 0.00 -0.02 0.00 0.00 33.50 33.32 2nyb n PRO 144 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2nyb h LEU 145 N 0.00 0.00 -0.40 2.45 3.38 -1.96 0.40 115.31 119.18 2nyb h LEU 145 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2nyb h LEU 145 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2nyb h LEU 145 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.88 2nyb n THR 146 N -3.72 0.03 -4.10 0.22 -2.24 -1.04 -4.81 114.28 98.61 2nyb n THR 146 Ca -0.03 -0.11 -0.26 0.00 -2.27 0.00 0.00 64.05 61.38 2nyb n THR 146 Cb 0.08 -0.08 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 2nyb n THR 146 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2nyb n THR 147 N -0.47 0.00 -0.20 4.28 -2.24 0.13 -5.04 114.28 110.73 2nyb n THR 147 Ca 0.20 -2.04 0.09 0.00 -2.27 0.00 0.00 64.05 60.03 2nyb n THR 147 Cb 0.19 0.08 0.30 0.00 -2.10 0.00 0.00 70.33 68.81 2nyb n THR 147 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2nyb n ASP 148 N -1.68 3.86 -4.84 3.42 5.75 -1.26 -4.93 116.55 116.88 2nyb n ASP 148 Ca -0.07 -2.19 -0.34 0.00 -0.01 0.00 0.00 54.79 52.18 2nyb n ASP 148 Cb 0.57 -0.49 -0.06 0.00 -1.03 0.00 0.00 41.12 40.11 2nyb n ASP 148 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2nyb s ALA 149 N -1.46 3.32 -0.27 2.12 0.00 -1.26 -4.21 121.76 119.99 2nyb s ALA 149 Ca 0.44 0.12 -0.13 0.00 0.00 0.00 0.00 51.96 52.39 2nyb s ALA 149 Cb 0.26 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 20.51 2nyb s ALA 149 CO 0.26 0.31 0.30 0.99 0.00 0.00 0.00 175.76 177.62 2nyb s THR 150 N -1.87 5.23 0.23 0.00 2.01 0.26 -4.54 115.64 116.97 2nyb s THR 150 Ca 0.52 0.41 -0.30 0.00 0.31 0.00 0.00 61.69 62.63 2nyb s THR 150 Cb -0.12 -3.63 -0.10 0.00 0.01 0.00 0.00 72.50 68.66 2nyb s THR 150 CO 0.18 0.19 1.40 -2.84 -0.69 0.00 0.00 174.62 172.87 2nyb s PRO 151 N 1.94 4.30 -0.10 4.92 0.02 -1.26 -0.68 135.00 144.14 2nyb s PRO 151 Ca 0.12 2.23 0.03 0.00 0.02 0.00 0.00 61.00 63.39 2nyb s PRO 151 Cb -0.16 -3.14 -0.08 0.00 0.02 0.00 0.00 34.50 31.15 2nyb s PRO 151 CO 0.10 -0.37 -0.06 1.28 -0.33 0.00 0.00 177.00 177.62 2nyb n LEU 152 N 2.46 2.17 -3.67 -5.54 4.77 0.72 -4.87 117.00 113.04 2nyb n LEU 152 Ca 0.07 -0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 55.86 2nyb n LEU 152 Cb 0.41 -0.21 -0.08 0.00 -2.33 0.00 0.00 43.42 41.21 2nyb n LEU 152 CO 0.60 0.55 0.20 -0.22 -1.33 0.00 0.00 177.39 177.18 2nyb s LEU 153 N -5.34 0.15 0.05 2.23 2.96 -1.09 -4.34 118.68 113.30 2nyb s LEU 153 Ca -0.11 0.59 -0.04 0.00 -0.22 0.00 0.00 54.13 54.35 2nyb s LEU 153 Cb 0.03 1.79 -0.02 0.00 0.50 0.00 0.00 46.19 48.49 2nyb s LEU 153 CO 0.27 -0.40 0.05 0.28 -1.32 0.00 0.00 176.35 175.23 2nyb s THR 154 N -0.74 0.17 -0.05 3.68 -1.32 -1.26 -1.15 115.64 114.97 2nyb s THR 154 Ca -0.08 -1.38 0.03 0.00 -1.21 0.00 0.00 61.69 59.04 2nyb s THR 154 Cb -0.03 -1.17 0.01 0.00 -1.51 0.00 0.00 72.50 69.79 2nyb s THR 154 CO 0.05 -0.76 -0.12 0.54 -2.21 0.00 0.00 174.62 172.11 2nyb s VAL 155 N -3.27 1.06 -0.18 5.08 0.11 -0.29 -4.91 120.40 118.00 2nyb s VAL 155 Ca 0.01 -0.48 -0.29 0.00 -2.93 0.00 0.00 61.98 58.29 2nyb s VAL 155 Cb 0.03 -0.95 0.00 0.00 -1.53 0.00 0.00 36.38 33.93 2nyb s VAL 155 CO -0.08 0.33 1.02 -0.62 -3.33 0.00 0.00 175.10 172.42 2nyb s ASP 156 N 0.40 7.15 -0.04 3.54 -1.08 -1.26 -1.70 116.67 123.68 2nyb s ASP 156 Ca -0.09 1.43 0.11 0.00 -0.52 0.00 0.00 52.55 53.48 2nyb s ASP 156 Cb -0.13 -2.54 0.31 0.00 -1.46 0.00 0.00 42.92 39.10 2nyb s ASP 156 CO 0.02 -0.58 1.25 1.33 0.52 0.00 0.00 175.17 177.71 2nyb n VAL 157 N 5.03 1.31 -1.68 1.11 0.24 0.18 -4.84 118.33 119.68 2nyb n VAL 157 Ca 0.11 -1.24 -0.42 0.00 -2.04 0.00 0.00 64.34 60.74 2nyb n VAL 157 Cb 0.47 0.31 -0.00 0.00 -1.47 0.00 0.00 33.84 33.14 2nyb n VAL 157 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 2nyb n TRP 158 N 0.06 2.03 0.06 6.34 7.02 -1.14 -4.44 117.44 127.37 2nyb n TRP 158 Ca 0.12 0.56 0.10 0.00 -1.02 0.00 0.00 57.50 57.27 2nyb n TRP 158 Cb 0.51 -2.37 0.56 0.00 -2.42 0.00 0.00 31.31 27.58 2nyb n TRP 158 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 2nyb h GLU 159 N 2.30 0.24 -0.07 -0.99 5.08 -1.93 -0.87 114.58 118.35 2nyb h GLU 159 Ca -0.45 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 57.91 2nyb h GLU 159 Cb 1.30 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 2nyb h GLU 159 CO 0.61 0.16 0.09 1.12 -1.00 0.00 0.00 179.01 180.00 2nyb h HIS 160 N 0.25 0.00 0.00 4.33 2.07 -1.98 0.17 115.15 119.99 2nyb h HIS 160 Ca 0.16 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.65 2nyb h HIS 160 Cb 0.31 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.28 2nyb h HIS 160 CO -0.00 0.00 -0.12 0.00 -3.07 0.00 0.00 177.93 174.74 2nyb h ALA 161 N 1.88 1.13 0.00 6.11 0.00 -1.47 -3.37 119.26 123.53 2nyb h ALA 161 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2nyb h ALA 161 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2nyb h ALA 161 CO -0.00 0.15 -0.01 2.48 0.00 0.00 0.00 179.25 181.87 2nyb n TYR 162 N -3.43 0.00 -0.09 0.00 0.18 -0.68 -4.93 117.16 108.21 2nyb n TYR 162 Ca -0.01 0.00 -0.00 0.00 1.88 0.00 0.00 57.90 59.77 2nyb n TYR 162 Cb 0.29 0.00 0.27 0.00 -0.38 0.00 0.00 39.34 39.53 2nyb n TYR 162 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 2nyb h TYR 163 N 0.00 0.73 -0.68 -3.48 3.20 -0.86 0.17 116.97 116.05 2nyb h TYR 163 Ca 0.00 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.79 2nyb h TYR 163 Cb 0.00 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 2nyb h TYR 163 CO 0.00 0.57 0.26 0.82 -1.64 0.00 0.00 178.16 178.17 2nyb h ILE 164 N 0.72 1.24 0.01 1.81 2.04 -1.85 -0.94 117.51 120.54 2nyb h ILE 164 Ca 0.17 -0.76 -0.34 0.00 1.00 0.00 0.00 64.86 64.94 2nyb h ILE 164 Cb 0.15 0.44 -0.06 0.00 -0.74 0.00 0.00 36.82 36.61 2nyb h ILE 164 CO -0.02 0.30 -2.06 0.47 0.00 0.00 0.00 178.15 176.85 2nyb n ASP 165 N -4.29 0.67 0.00 1.72 8.00 -0.76 -4.63 116.55 117.26 2nyb n ASP 165 Ca 0.06 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.75 2nyb n ASP 165 Cb 0.19 0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 2nyb n ASP 165 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2nyb n TYR 166 N -2.97 0.00 -0.66 1.24 4.01 0.52 -5.08 117.16 114.22 2nyb n TYR 166 Ca -0.26 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.48 2nyb n TYR 166 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.12 2nyb n TYR 166 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2nyb n ARG 167 N -0.41 0.00 0.00 -0.72 5.12 -0.36 -1.06 116.66 119.23 2nyb n ARG 167 Ca 0.00 0.00 0.09 0.00 -1.93 0.00 0.00 57.85 56.01 2nyb n ARG 167 Cb 0.03 0.00 0.42 0.00 -1.16 0.00 0.00 32.46 31.75 2nyb n ARG 167 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2nyb n ASN 168 N 2.74 0.00 -3.64 0.55 6.94 -1.26 -4.40 115.26 116.19 2nyb n ASN 168 Ca 0.00 0.29 -0.41 0.00 -0.02 0.00 0.00 54.58 54.44 2nyb n ASN 168 Cb 0.00 -0.41 -0.01 0.00 -2.36 0.00 0.00 39.78 37.01 2nyb n ASN 168 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2nyb n ALA 169 N -1.41 6.09 -0.33 -2.53 0.00 -0.23 -4.73 120.51 117.37 2nyb n ALA 169 Ca 0.06 -3.94 0.11 0.00 0.00 0.00 0.00 53.44 49.67 2nyb n ALA 169 Cb 0.18 -3.27 0.32 0.00 0.00 0.00 0.00 19.45 16.68 2nyb n ALA 169 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2nyb h ARG 170 N 5.56 0.78 -0.38 0.00 2.43 -1.83 -1.26 114.38 119.68 2nyb h ARG 170 Ca 0.61 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.76 2nyb h ARG 170 Cb 0.52 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2nyb h ARG 170 CO 1.76 0.52 0.25 -1.35 -1.51 0.00 0.00 179.97 179.64 2nyb h PRO 171 N 0.81 0.40 -0.35 0.20 0.11 -1.97 -0.87 132.00 130.34 2nyb h PRO 171 Ca 0.51 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.56 2nyb h PRO 171 Cb 0.73 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 2nyb h PRO 171 CO -0.29 0.27 0.07 0.78 -0.21 0.00 0.00 178.00 178.62 2nyb h GLY 172 N 0.42 0.61 0.62 -0.55 0.00 -1.63 -1.71 103.07 100.82 2nyb h GLY 172 Ca 0.15 -0.40 0.06 0.00 0.00 0.00 0.00 47.33 47.14 2nyb h GLY 172 CO -0.04 0.37 0.21 -1.82 0.00 0.00 0.00 176.54 175.26 2nyb h TYR 173 N 0.41 0.37 -0.16 5.60 3.20 -1.19 -2.16 116.97 123.04 2nyb h TYR 173 Ca 0.11 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.93 2nyb h TYR 173 Cb 0.33 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 2nyb h TYR 173 CO 0.02 0.15 -0.22 -0.07 -1.64 0.00 0.00 178.16 176.40 2nyb h LEU 174 N 0.41 0.27 -0.54 2.82 3.38 -0.97 0.88 115.31 121.55 2nyb h LEU 174 Ca 0.23 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2nyb h LEU 174 Cb 0.20 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2nyb h LEU 174 CO -0.20 0.51 -0.04 -0.33 0.09 0.00 0.00 178.44 178.46 2nyb h GLU 175 N 0.26 0.99 0.00 1.13 4.39 -1.02 -3.08 114.58 117.25 2nyb h GLU 175 Ca 0.04 -0.34 -0.14 0.00 0.34 0.00 0.00 59.36 59.27 2nyb h GLU 175 Cb 0.54 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.09 2nyb h GLU 175 CO 0.04 1.01 -0.65 0.45 -1.16 0.00 0.00 179.01 178.70 2nyb h HIS 176 N 0.87 0.00 -0.78 4.33 3.86 -0.87 -3.07 115.15 119.49 2nyb h HIS 176 Ca 0.15 0.00 0.15 0.00 -1.16 0.00 0.00 60.37 59.50 2nyb h HIS 176 Cb 0.59 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.97 2nyb h HIS 176 CO 0.04 0.65 0.33 0.35 0.86 0.00 0.00 177.93 180.16 2nyb h PHE 177 N 0.00 0.57 0.00 2.45 3.57 -0.75 -1.69 116.94 121.08 2nyb h PHE 177 Ca -0.01 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 2nyb h PHE 177 Cb 1.18 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 2nyb h PHE 177 CO 0.00 0.08 -0.06 -1.49 -2.23 0.00 0.00 178.31 174.61 2nyb h TRP 178 N 0.48 0.00 0.00 0.41 4.06 -1.51 -0.09 115.95 119.30 2nyb h TRP 178 Ca 0.43 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.38 2nyb h TRP 178 Cb 0.65 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.81 2nyb h TRP 178 CO -0.15 0.06 0.00 0.00 -3.56 0.00 0.00 178.44 174.79 2nyb n ALA 179 N -2.45 1.66 0.44 1.49 0.00 -0.64 -3.48 120.51 117.53 2nyb n ALA 179 Ca -0.03 0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.48 2nyb n ALA 179 Cb 0.15 -1.32 -0.06 0.00 0.00 0.00 0.00 19.45 18.22 2nyb n ALA 179 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2nyb n LEU 180 N -1.91 0.44 -4.71 0.00 4.77 -0.06 -3.34 117.00 112.18 2nyb n LEU 180 Ca 0.03 -0.48 -0.42 0.00 -0.03 0.00 0.00 56.01 55.11 2nyb n LEU 180 Cb 0.20 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2nyb n LEU 180 CO 0.17 0.11 1.37 -0.69 -1.33 0.00 0.00 177.39 177.02 2nyb s VAL 181 N -1.96 2.23 -0.88 4.08 1.01 -1.13 -0.69 120.40 123.06 2nyb s VAL 181 Ca 0.03 0.09 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 2nyb s VAL 181 Cb 0.07 -3.06 0.14 0.00 0.00 0.00 0.00 36.38 33.53 2nyb s VAL 181 CO 0.40 0.01 1.04 0.21 0.00 0.00 0.00 175.10 176.75 2nyb s ASN 182 N 1.51 6.60 0.55 3.32 2.47 0.57 -0.65 114.94 129.30 2nyb s ASN 182 Ca 0.75 -2.05 0.33 0.00 0.42 0.00 0.00 52.86 52.31 2nyb s ASN 182 Cb -0.48 -2.36 1.50 0.00 -1.45 0.00 0.00 41.25 38.46 2nyb s ASN 182 CO 0.33 -1.01 2.05 -0.50 -3.72 0.00 0.00 177.10 174.24 2nyb h TRP 183 N 8.73 0.00 -0.81 0.43 4.06 -1.89 -2.10 115.95 124.36 2nyb h TRP 183 Ca 0.10 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.03 2nyb h TRP 183 Cb 1.03 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.15 2nyb h TRP 183 CO 1.12 0.06 0.44 0.93 -3.56 0.00 0.00 178.44 177.43 2nyb h GLU 184 N 0.00 1.13 -0.31 0.49 4.39 -1.96 0.21 114.58 118.54 2nyb h GLU 184 Ca -0.00 -0.13 -0.10 0.00 0.34 0.00 0.00 59.36 59.47 2nyb h GLU 184 Cb 0.42 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2nyb h GLU 184 CO 0.01 0.84 -0.19 0.35 -1.16 0.00 0.00 179.01 178.86 2nyb h PHE 185 N 1.12 0.78 -0.79 4.33 3.57 -1.66 -1.85 116.94 122.44 2nyb h PHE 185 Ca 0.28 -0.21 0.06 0.00 3.53 0.00 0.00 57.97 61.64 2nyb h PHE 185 Cb 0.04 -0.18 -0.06 0.00 2.79 0.00 0.00 35.95 38.54 2nyb h PHE 185 CO 0.00 0.91 0.48 0.28 -2.23 0.00 0.00 178.31 177.75 2nyb h VAL 186 N 0.42 1.03 -0.83 1.41 2.07 -1.26 -0.90 116.25 118.20 2nyb h VAL 186 Ca 0.06 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 2nyb h VAL 186 Cb 0.73 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 2nyb h VAL 186 CO 0.05 0.16 0.47 0.00 0.02 0.00 0.00 177.57 178.27 2nyb h ALA 187 N 1.38 1.06 -0.84 1.67 0.00 -0.78 -0.86 119.26 120.88 2nyb h ALA 187 Ca 0.34 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2nyb h ALA 187 Cb 0.15 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2nyb h ALA 187 CO -0.17 0.56 0.39 -0.22 0.00 0.00 0.00 179.25 179.81 2nyb h LYS 188 N 1.15 1.22 -0.61 0.00 3.64 -0.62 -0.70 116.57 120.65 2nyb h LYS 188 Ca 0.29 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 2nyb h LYS 188 Cb 0.01 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 2nyb h LYS 188 CO -0.05 0.95 0.08 -0.91 -2.27 0.00 0.00 179.45 177.25 2nyb h ASN 189 N 1.21 0.99 -0.06 4.20 2.35 -0.73 -2.63 115.58 120.91 2nyb h ASN 189 Ca 0.29 -0.27 -0.14 0.00 -0.55 0.00 0.00 56.30 55.63 2nyb h ASN 189 Cb 0.14 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 2nyb h ASN 189 CO -0.03 1.01 -0.42 0.25 -1.65 0.00 0.00 177.43 176.58 2nyb h LEU 190 N 0.93 0.63 0.00 1.61 5.85 -0.93 -3.20 115.31 120.20 2nyb h LEU 190 Ca 0.18 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2nyb h LEU 190 Cb 0.46 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2nyb h LEU 190 CO 0.02 0.97 -0.03 0.00 -0.34 0.00 0.00 178.44 179.06 2nyb n ALA 191 N -2.51 2.32 0.53 1.25 0.00 -0.29 -5.10 120.51 116.71 2nyb n ALA 191 Ca -0.02 -0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.42 2nyb n ALA 191 Cb 0.53 -1.46 0.25 0.00 0.00 0.00 0.00 19.45 18.78 2nyb n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50