#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b01 h LEU 2 N 0.00 -0.05 -1.67 0.00 5.85 -1.40 -0.29 115.31 117.75 2b01 h LEU 2 Ca 0.00 0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 2b01 h LEU 2 Cb 0.00 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2b01 h LEU 2 CO 0.00 -0.07 -0.17 4.11 -0.34 0.00 0.00 178.44 181.97 2b01 h TRP 3 N 0.23 0.00 0.11 1.25 5.08 -2.00 -2.48 115.95 118.15 2b01 h TRP 3 Ca 0.41 0.00 -0.27 0.00 1.08 0.00 0.00 58.89 60.12 2b01 h TRP 3 Cb 0.72 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.88 2b01 h TRP 3 CO -0.29 0.17 -1.20 1.96 -1.28 0.00 0.00 178.44 177.80 2b01 h GLN 4 N 0.00 0.30 -0.61 0.12 4.20 -1.49 -3.13 115.11 114.49 2b01 h GLN 4 Ca -0.00 -0.47 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2b01 h GLN 4 Cb 0.46 0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.38 2b01 h GLN 4 CO 0.02 1.21 0.39 0.35 -0.67 0.00 0.00 178.83 180.13 2b01 h PHE 5 N 0.10 0.79 -0.82 2.96 3.57 -0.89 0.14 116.94 122.79 2b01 h PHE 5 Ca -0.13 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.40 2b01 h PHE 5 Cb 1.92 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 40.35 2b01 h PHE 5 CO 0.06 0.52 0.54 0.00 -2.23 0.00 0.00 178.31 177.21 2b01 h ARG 6 N 0.83 1.05 -0.08 1.11 3.08 -1.48 -0.66 114.38 118.22 2b01 h ARG 6 Ca 0.22 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 60.05 2b01 h ARG 6 Cb -0.06 -0.24 0.01 0.00 0.08 0.00 0.00 29.97 29.77 2b01 h ARG 6 CO -0.04 0.69 -0.59 0.77 -1.07 0.00 0.00 179.97 179.73 2b01 h SER 7 N 1.08 0.66 -0.96 7.04 0.02 -1.34 -2.86 113.55 117.19 2b01 h SER 7 Ca 0.31 -0.67 0.10 0.00 -0.84 0.00 0.00 61.79 60.69 2b01 h SER 7 Cb -0.06 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.21 2b01 h SER 7 CO -0.08 1.23 0.61 -0.03 -1.14 0.00 0.00 176.83 177.42 2b01 h MET 8 N 0.14 0.95 -0.50 3.45 1.85 -0.33 -0.84 114.93 119.66 2b01 h MET 8 Ca -0.05 -0.06 -0.08 0.00 -0.61 0.00 0.00 59.70 58.90 2b01 h MET 8 Cb 1.24 -0.22 -0.02 0.00 0.43 0.00 0.00 31.60 33.04 2b01 h MET 8 CO 0.12 0.63 0.00 0.82 -0.40 0.00 0.00 176.91 178.08 2b01 h ILE 9 N 0.98 1.26 0.00 1.77 2.04 -1.11 -1.82 117.51 120.63 2b01 h ILE 9 Ca 0.45 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 65.23 2b01 h ILE 9 Cb 0.39 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 2b01 h ILE 9 CO -0.21 0.38 0.00 0.29 0.00 0.00 0.00 178.15 178.61 2b01 n LYS 10 N -4.32 0.19 -0.03 2.37 5.02 -0.54 -0.91 118.16 119.95 2b01 n LYS 10 Ca 0.01 0.42 -0.16 0.00 -2.02 0.00 0.00 58.31 56.56 2b01 n LYS 10 Cb 0.32 -1.87 -0.13 0.00 -0.02 0.00 0.00 35.03 33.32 2b01 n LYS 10 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b01 h ALA 12 N 0.05 1.10 -2.89 0.00 0.00 -1.02 -3.35 119.26 113.14 2b01 h ALA 12 Ca -0.05 -0.26 -0.61 0.00 0.00 0.00 0.00 54.91 53.99 2b01 h ALA 12 Cb 1.21 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 18.55 2b01 h ALA 12 CO 0.05 0.36 -0.71 0.42 0.00 0.00 0.00 179.25 179.37 2b01 s ILE 13 N -3.80 1.99 0.34 0.00 1.01 -0.09 -4.88 121.20 115.78 2b01 s ILE 13 Ca -0.01 -3.56 0.20 0.00 0.00 0.00 0.00 60.65 57.28 2b01 s ILE 13 Cb 0.12 -2.33 0.33 0.00 0.01 0.00 0.00 42.46 40.58 2b01 s ILE 13 CO 0.66 -1.04 1.47 -2.65 0.00 0.00 0.00 174.94 173.37 2b01 n PRO 14 N 2.48 -0.06 -0.21 2.79 -0.02 -1.15 -4.52 135.00 134.31 2b01 n PRO 14 Ca 0.20 1.28 0.03 0.00 -2.02 0.00 0.00 63.50 62.99 2b01 n PRO 14 Cb 0.38 -2.31 -0.01 0.00 -0.02 0.00 0.00 33.50 31.55 2b01 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b01 n GLY 15 N -1.24 -0.45 0.14 -1.23 0.00 -1.26 -4.64 105.19 96.51 2b01 n GLY 15 Ca 0.35 -0.35 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2b01 n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b01 n SER 16 N -3.99 1.66 -3.46 1.61 3.41 -1.26 -4.96 113.62 106.63 2b01 n SER 16 Ca 0.00 -2.55 -0.19 0.00 -0.26 0.00 0.00 58.87 55.87 2b01 n SER 16 Cb 0.10 -0.28 -0.12 0.00 -0.26 0.00 0.00 64.21 63.64 2b01 n SER 16 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2b01 s HIS 17 N -1.79 -0.27 0.00 7.33 3.76 -1.26 -5.10 115.29 117.95 2b01 s HIS 17 Ca 0.18 -0.08 0.00 0.00 -0.15 0.00 0.00 55.06 55.01 2b01 s HIS 17 Cb 0.16 -0.47 0.00 0.00 1.11 0.00 0.00 32.58 33.38 2b01 s HIS 17 CO 0.02 -0.76 0.00 -2.30 -0.85 0.00 0.00 174.74 170.85 2b01 n PRO 18 N 5.31 0.00 -1.36 8.40 -0.02 -1.26 -4.05 135.00 142.01 2b01 n PRO 18 Ca -0.04 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.05 2b01 n PRO 18 Cb 0.47 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.93 2b01 n PRO 18 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2b01 n LEU 19 N 0.00 8.59 0.00 2.45 4.77 -1.26 -4.55 117.00 127.00 2b01 n LEU 19 Ca 0.00 -4.35 0.08 0.00 -0.03 0.00 0.00 56.01 51.71 2b01 n LEU 19 Cb 0.00 -1.57 0.37 0.00 -2.33 0.00 0.00 43.42 39.90 2b01 n LEU 19 CO 0.00 1.98 0.74 1.15 -1.33 0.00 0.00 177.39 179.93 2b01 n MET 20 N 3.82 0.13 -1.87 3.23 0.00 -1.26 -4.96 117.12 116.21 2b01 n MET 20 Ca 0.76 0.18 0.00 0.00 0.00 0.00 0.00 57.70 58.64 2b01 n MET 20 Cb 0.25 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.97 2b01 n MET 20 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2b01 n ASP 21 N -1.38 -6.97 -4.75 3.17 10.43 -1.26 -4.95 116.55 110.83 2b01 n ASP 21 Ca 0.06 1.21 -0.40 0.00 2.57 0.00 0.00 54.79 58.23 2b01 n ASP 21 Cb 0.15 -3.77 -0.06 0.00 1.84 0.00 0.00 41.12 39.29 2b01 n ASP 21 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2b01 s PHE 22 N -0.39 3.94 0.30 1.24 0.08 -1.26 -5.06 117.98 116.83 2b01 s PHE 22 Ca 0.00 1.86 0.08 0.00 0.12 0.00 0.00 56.93 58.99 2b01 s PHE 22 Cb 0.00 -2.97 -0.04 0.00 -0.57 0.00 0.00 43.02 39.44 2b01 s PHE 22 CO 0.00 0.41 0.18 -0.80 -0.10 0.00 0.00 175.22 174.90 2b01 s ASN 23 N -0.90 5.05 0.78 1.36 0.01 -1.26 -5.10 114.94 114.88 2b01 s ASN 23 Ca 0.42 -0.54 -0.14 0.00 -0.71 0.00 0.00 52.86 51.89 2b01 s ASN 23 Cb -0.25 -0.99 0.07 0.00 0.41 0.00 0.00 41.25 40.49 2b01 s ASN 23 CO 0.31 -0.20 1.22 0.20 -1.51 0.00 0.00 177.10 177.12 2b01 s ASN 24 N -3.86 3.76 -0.13 -1.22 0.02 -1.26 -4.88 114.94 107.36 2b01 s ASN 24 Ca 0.36 2.41 -0.09 0.00 -1.02 0.00 0.00 52.86 54.53 2b01 s ASN 24 Cb -0.05 -2.59 0.05 0.00 0.02 0.00 0.00 41.25 38.67 2b01 s ASN 24 CO 0.24 -2.56 0.32 -0.47 0.02 0.00 0.00 177.10 174.66 2b01 s TYR 25 N -2.01 -0.42 0.00 2.20 6.14 -0.68 -1.36 117.35 121.22 2b01 s TYR 25 Ca 0.75 0.97 0.00 0.00 0.64 0.00 0.00 57.07 59.43 2b01 s TYR 25 Cb -0.30 0.14 0.00 0.00 0.42 0.00 0.00 41.96 42.22 2b01 s TYR 25 CO 0.49 -0.25 0.00 0.41 0.64 0.00 0.00 175.55 176.84 2b01 n GLY 26 N 3.79 1.02 0.06 8.97 0.00 -0.03 -2.14 105.19 116.87 2b01 n GLY 26 Ca -0.21 -0.60 0.11 0.00 0.00 0.00 0.00 46.02 45.33 2b01 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b01 n TYR 28 N -2.29 0.00 -2.38 0.00 4.01 -1.25 -2.97 117.16 112.28 2b01 n TYR 28 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.34 2b01 n TYR 28 Cb 0.50 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.50 2b01 n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2b01 n GLY 30 N 5.47 1.60 3.68 0.00 0.00 -1.26 -1.68 105.19 113.00 2b01 n GLY 30 Ca 0.09 -1.70 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 2b01 n GLY 30 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b01 s LEU 31 N 0.00 4.41 0.00 0.99 2.96 -1.26 -4.65 118.68 121.12 2b01 s LEU 31 Ca 0.00 2.71 0.00 0.00 -0.22 0.00 0.00 54.13 56.62 2b01 s LEU 31 Cb 0.00 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.14 2b01 s LEU 31 CO 0.00 -1.02 0.00 0.61 -1.32 0.00 0.00 176.35 174.62 2b01 n GLY 32 N 4.34 -1.01 0.00 7.98 0.00 -1.26 -5.05 105.19 110.18 2b01 n GLY 32 Ca 0.18 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.99 2b01 n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b01 n GLY 33 N 0.00 2.33 3.43 -0.02 0.00 -1.26 -4.70 105.19 104.97 2b01 n GLY 33 Ca 0.00 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 2b01 n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b01 s SER 34 N 0.00 -0.57 0.86 1.61 1.04 -1.16 -5.03 113.70 110.45 2b01 s SER 34 Ca 0.00 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.46 2b01 s SER 34 Cb 0.00 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2b01 s SER 34 CO 0.00 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 173.88 2b01 n GLY 35 N -0.33 1.48 3.60 7.32 0.00 -1.23 -4.76 105.19 111.27 2b01 n GLY 35 Ca -0.17 -0.59 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 2b01 n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b01 s THR 36 N 0.00 3.81 0.47 2.61 2.01 -1.26 -5.08 115.64 118.19 2b01 s THR 36 Ca 0.00 -0.45 -0.24 0.00 0.31 0.00 0.00 61.69 61.31 2b01 s THR 36 Cb 0.00 -2.57 -0.08 0.00 0.01 0.00 0.00 72.50 69.86 2b01 s THR 36 CO 0.00 0.59 1.20 -2.65 -0.69 0.00 0.00 174.62 173.07 2b01 n PRO 37 N 2.17 1.66 0.09 4.92 -0.02 -1.26 -4.81 135.00 137.74 2b01 n PRO 37 Ca -0.18 0.60 0.06 0.00 -2.02 0.00 0.00 63.50 61.96 2b01 n PRO 37 Cb 0.53 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2b01 n PRO 37 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2b01 h VAL 38 N 1.67 0.25 -2.09 -1.45 -1.51 -1.95 -3.47 116.25 107.70 2b01 h VAL 38 Ca -0.48 -1.47 -0.00 0.00 -1.23 0.00 0.00 66.70 63.52 2b01 h VAL 38 Cb 1.31 1.81 0.00 0.00 -2.13 0.00 0.00 31.29 32.28 2b01 h VAL 38 CO 0.58 0.14 0.02 -0.90 -1.23 0.00 0.00 177.57 176.18 2b01 n ASP 39 N -2.83 -0.19 0.10 4.19 5.68 -1.26 -5.02 116.55 117.22 2b01 n ASP 39 Ca -0.03 -1.14 -0.13 0.00 -0.50 0.00 0.00 54.79 52.99 2b01 n ASP 39 Cb 0.67 0.32 -0.06 0.00 -1.14 0.00 0.00 41.12 40.91 2b01 n ASP 39 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2b01 h GLU 40 N 0.00 -0.53 -0.52 0.11 4.57 -1.95 0.16 114.58 116.42 2b01 h GLU 40 Ca -0.03 0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2b01 h GLU 40 Cb 0.10 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.78 2b01 h GLU 40 CO 0.04 -0.35 0.33 1.25 -1.18 0.00 0.00 179.01 179.09 2b01 h LEU 41 N -0.55 0.55 -1.13 1.64 5.85 -1.90 -1.50 115.31 118.26 2b01 h LEU 41 Ca 0.04 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2b01 h LEU 41 Cb 0.60 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 2b01 h LEU 41 CO -0.22 0.39 0.45 -0.78 -0.34 0.00 0.00 178.44 177.94 2b01 h ASP 42 N 0.66 0.92 -0.78 1.25 3.58 -1.83 -1.37 116.42 118.85 2b01 h ASP 42 Ca 0.20 -0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.55 2b01 h ASP 42 Cb -0.03 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.76 2b01 h ASP 42 CO -0.07 0.72 0.34 0.03 -2.88 0.00 0.00 179.24 177.38 2b01 h ARG 43 N 1.06 1.15 -0.67 0.28 3.08 0.18 -0.40 114.38 119.06 2b01 h ARG 43 Ca 0.27 -0.19 0.08 0.00 0.07 0.00 0.00 59.98 60.22 2b01 h ARG 43 Cb -0.02 -0.20 -0.07 0.00 0.08 0.00 0.00 29.97 29.76 2b01 h ARG 43 CO -0.05 0.91 0.34 0.00 -1.07 0.00 0.00 179.97 180.10 2b01 h GLU 46 N 0.45 0.65 -0.71 0.00 4.81 -0.38 0.14 114.58 119.53 2b01 h GLU 46 Ca 0.04 -0.23 0.04 0.00 -0.13 0.00 0.00 59.36 59.08 2b01 h GLU 46 Cb 0.89 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.18 2b01 h GLU 46 CO 0.08 0.79 0.44 1.15 -0.73 0.00 0.00 179.01 180.73 2b01 h THR 47 N 0.45 1.08 -0.24 0.32 2.02 -0.97 0.94 112.91 116.51 2b01 h THR 47 Ca 0.10 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 2b01 h THR 47 Cb 0.52 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2b01 h THR 47 CO 0.03 0.16 0.13 -0.74 0.37 0.00 0.00 175.52 175.47 2b01 h HIS 48 N 0.85 0.33 -0.62 3.16 -0.00 -1.10 0.45 115.15 118.22 2b01 h HIS 48 Ca 0.29 -0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.69 2b01 h HIS 48 Cb 0.05 -0.10 -0.04 0.00 -0.00 0.00 0.00 27.41 27.31 2b01 h HIS 48 CO -0.04 0.28 0.37 -0.44 -0.00 0.00 0.00 177.93 178.09 2b01 h ASP 49 N 0.28 0.59 0.04 3.26 3.45 -0.26 -0.89 116.42 122.89 2b01 h ASP 49 Ca 0.08 0.01 -0.06 0.00 0.43 0.00 0.00 57.03 57.49 2b01 h ASP 49 Cb 0.05 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 2b01 h ASP 49 CO -0.01 0.41 -0.17 0.78 -1.57 0.00 0.00 179.24 178.67 2b01 h ASN 50 N 0.72 0.26 -0.41 6.45 2.35 -0.40 0.11 115.58 124.65 2b01 h ASN 50 Ca 0.25 -0.06 -0.14 0.00 -0.55 0.00 0.00 56.30 55.80 2b01 h ASN 50 Cb 0.05 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 2b01 h ASN 50 CO -0.12 0.45 -0.30 0.00 -1.65 0.00 0.00 177.43 175.82 2b01 h TYR 52 N 0.80 0.00 -0.41 0.00 -1.99 -0.68 -1.09 116.97 113.61 2b01 h TYR 52 Ca 0.09 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.75 2b01 h TYR 52 Cb 0.88 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.59 2b01 h TYR 52 CO 0.06 0.52 -0.02 -0.09 -0.00 0.00 0.00 178.16 178.62 2b01 h ARG 53 N 0.00 0.73 -0.66 4.88 2.43 -0.31 -2.11 114.38 119.34 2b01 h ARG 53 Ca -0.01 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 58.90 2b01 h ARG 53 Cb 0.95 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.41 2b01 h ARG 53 CO 0.07 0.83 0.35 -0.44 -1.51 0.00 0.00 179.97 179.27 2b01 h ASP 54 N 0.56 0.83 -0.55 -3.80 3.45 -0.74 -2.60 116.42 113.57 2b01 h ASP 54 Ca 0.11 -0.10 0.10 0.00 0.43 0.00 0.00 57.03 57.57 2b01 h ASP 54 Cb 0.51 -0.21 -0.08 0.00 -0.56 0.00 0.00 39.33 39.00 2b01 h ASP 54 CO 0.03 0.70 0.12 0.00 -1.57 0.00 0.00 179.24 178.51 2b01 h ALA 55 N 1.17 0.63 0.00 3.45 0.00 -0.87 0.19 119.26 123.83 2b01 h ALA 55 Ca 0.23 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2b01 h ALA 55 Cb 0.06 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2b01 h ALA 55 CO -0.04 -0.30 0.00 0.87 0.00 0.00 0.00 179.25 179.78 2b01 h LYS 56 N 0.25 0.00 -0.23 0.00 1.57 -1.00 -1.60 116.57 115.56 2b01 h LYS 56 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2b01 h LYS 56 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2b01 h LYS 56 CO -0.36 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.61 2b01 n ASN 57 N -2.99 2.76 -4.69 0.86 5.03 0.65 -4.91 115.26 111.97 2b01 n ASN 57 Ca -0.02 -1.88 -0.42 0.00 0.87 0.00 0.00 54.58 53.12 2b01 n ASN 57 Cb 0.12 -0.14 -0.03 0.00 -1.02 0.00 0.00 39.78 38.71 2b01 n ASN 57 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2b01 s LEU 58 N -1.65 4.33 0.50 3.41 1.43 -0.61 -4.87 118.68 121.22 2b01 s LEU 58 Ca 0.35 2.26 0.26 0.00 -1.03 0.00 0.00 54.13 55.97 2b01 s LEU 58 Cb 0.21 -3.56 1.31 0.00 0.03 0.00 0.00 46.19 44.17 2b01 s LEU 58 CO 0.30 -0.80 2.01 -2.24 0.23 0.00 0.00 176.35 175.85 2b01 h ASP 59 N 8.13 0.00 0.31 2.29 2.03 -1.91 -2.81 116.42 124.47 2b01 h ASP 59 Ca -0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.90 2b01 h ASP 59 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.69 2b01 h ASP 59 CO 0.92 0.15 -0.80 -1.54 -1.03 0.00 0.00 179.24 176.94 2b01 n SER 60 N -3.59 0.69 -4.38 4.15 3.41 -1.26 -4.92 113.62 107.72 2b01 n SER 60 Ca -0.01 -0.49 -0.32 0.00 -0.26 0.00 0.00 58.87 57.79 2b01 n SER 60 Cb 0.29 0.64 -0.15 0.00 -0.26 0.00 0.00 64.21 64.73 2b01 n SER 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b01 s LYS 62 N -0.54 0.16 0.36 0.00 2.47 -1.26 -4.56 119.74 116.38 2b01 s LYS 62 Ca 0.07 0.27 0.00 0.00 -1.56 0.00 0.00 55.97 54.76 2b01 s LYS 62 Cb -0.11 -1.04 -0.03 0.00 -1.46 0.00 0.00 37.83 35.19 2b01 s LYS 62 CO 0.01 -0.58 0.57 -0.06 0.16 0.00 0.00 175.35 175.44 2b01 s PHE 63 N 2.32 3.46 0.19 4.03 0.40 -1.26 -4.98 117.98 122.14 2b01 s PHE 63 Ca 0.06 0.34 -0.33 0.00 -0.60 0.00 0.00 56.93 56.40 2b01 s PHE 63 Cb -0.15 -1.96 -0.15 0.00 0.51 0.00 0.00 43.02 41.27 2b01 s PHE 63 CO -0.11 0.05 1.29 -0.11 0.70 0.00 0.00 175.22 177.04 2b01 n LEU 64 N -1.84 2.19 -3.62 -0.37 7.94 -1.26 0.12 117.00 120.16 2b01 n LEU 64 Ca -0.04 1.14 -0.24 0.00 -1.11 0.00 0.00 56.01 55.76 2b01 n LEU 64 Cb 0.56 -1.30 -0.04 0.00 0.53 0.00 0.00 43.42 43.17 2b01 n LEU 64 CO 0.49 -0.93 -0.09 1.33 -1.11 0.00 0.00 177.39 177.08 2b01 n VAL 65 N 1.85 0.00 -2.68 1.96 0.24 -1.26 -0.70 118.33 117.75 2b01 n VAL 65 Ca 0.14 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.32 2b01 n VAL 65 Cb 0.27 -0.28 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 2b01 n VAL 65 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2b01 n ASP 66 N -2.02 -3.23 -4.13 -1.34 9.92 0.12 -4.94 116.55 110.93 2b01 n ASP 66 Ca 0.07 0.12 -0.34 0.00 -0.53 0.00 0.00 54.79 54.10 2b01 n ASP 66 Cb 0.47 -2.76 -0.14 0.00 -0.64 0.00 0.00 41.12 38.05 2b01 n ASP 66 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2b01 s ASN 67 N -2.18 4.81 0.58 -2.24 2.47 0.12 -4.90 114.94 113.60 2b01 s ASN 67 Ca 0.09 -1.44 0.28 0.00 0.42 0.00 0.00 52.86 52.21 2b01 s ASN 67 Cb -0.05 -1.68 1.53 0.00 -1.45 0.00 0.00 41.25 39.60 2b01 s ASN 67 CO 0.12 -0.28 1.99 -0.65 -3.72 0.00 0.00 177.10 174.56 2b01 h PRO 68 N 7.92 0.00 0.00 0.43 0.11 -1.91 -0.50 132.00 138.04 2b01 h PRO 68 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.93 2b01 h PRO 68 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2b01 h PRO 68 CO 0.53 0.00 0.00 1.88 -0.21 0.00 0.00 178.00 180.20 2b01 h TYR 69 N 0.00 0.00 0.00 0.65 0.05 -1.94 -1.64 116.97 114.09 2b01 h TYR 69 Ca 0.17 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.95 2b01 h TYR 69 Cb 0.89 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.63 2b01 h TYR 69 CO 0.00 0.00 -0.11 1.79 -1.05 0.00 0.00 178.16 178.79 2b01 h THR 70 N 0.00 0.00 -2.96 -2.88 1.35 -1.41 -0.53 112.91 106.48 2b01 h THR 70 Ca 0.00 -1.00 -0.55 0.00 -0.55 0.00 0.00 66.41 64.31 2b01 h THR 70 Cb 0.18 1.94 -0.05 0.00 -1.73 0.00 0.00 68.15 68.49 2b01 h THR 70 CO 0.00 0.00 1.12 -0.70 -0.25 0.00 0.00 175.52 175.69 2b01 s GLU 71 N -3.23 3.38 0.22 4.72 2.56 -0.62 -4.79 118.70 120.95 2b01 s GLU 71 Ca 0.06 0.75 -0.26 0.00 0.00 0.00 0.00 54.97 55.52 2b01 s GLU 71 Cb 0.06 -4.10 -0.09 0.00 2.00 0.00 0.00 34.13 31.99 2b01 s GLU 71 CO 0.68 -1.82 0.85 -1.12 -0.56 0.00 0.00 175.26 173.29 2b01 s SER 72 N 4.58 7.41 0.17 -1.70 0.01 -1.26 0.18 113.70 123.09 2b01 s SER 72 Ca 0.59 1.74 0.02 0.00 1.31 0.00 0.00 55.95 59.61 2b01 s SER 72 Cb -0.13 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.56 2b01 s SER 72 CO 0.29 0.12 0.08 0.00 0.41 0.00 0.00 173.24 174.14 2b01 n TYR 73 N 1.25 -0.04 -4.89 2.43 0.18 -1.26 -4.81 117.16 110.03 2b01 n TYR 73 Ca -0.03 -1.15 -0.28 0.00 1.88 0.00 0.00 57.90 58.32 2b01 n TYR 73 Cb 0.49 0.03 -0.17 0.00 -0.38 0.00 0.00 39.34 39.31 2b01 n TYR 73 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2b01 s SER 74 N -2.06 2.39 0.13 9.48 0.15 -1.26 -4.92 113.70 117.61 2b01 s SER 74 Ca 0.11 -0.42 -0.11 0.00 0.70 0.00 0.00 55.95 56.23 2b01 s SER 74 Cb 0.01 -1.07 0.00 0.00 -1.71 0.00 0.00 66.02 63.25 2b01 s SER 74 CO 0.08 0.10 0.28 -0.72 1.20 0.00 0.00 173.24 174.18 2b01 s TYR 75 N 0.47 0.17 0.14 3.44 -0.85 -1.26 -0.51 117.35 118.94 2b01 s TYR 75 Ca -0.16 -0.55 0.06 0.00 -0.52 0.00 0.00 57.07 55.90 2b01 s TYR 75 Cb -0.16 0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.16 2b01 s TYR 75 CO 0.06 -0.66 -0.13 -1.54 -1.52 0.00 0.00 175.55 171.75 2b01 s SER 76 N -2.89 2.07 -0.03 -0.18 1.04 -0.27 -4.93 113.70 108.51 2b01 s SER 76 Ca 0.09 -0.88 0.03 0.00 0.48 0.00 0.00 55.95 55.67 2b01 s SER 76 Cb 0.03 -0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.08 2b01 s SER 76 CO -0.06 -0.18 -0.12 0.00 0.98 0.00 0.00 173.24 173.85 2b01 n SER 78 N 3.22 0.00 -4.22 0.00 3.41 -0.57 -4.93 113.62 110.53 2b01 n SER 78 Ca -0.18 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.00 2b01 n SER 78 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 2b01 n SER 78 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2b01 n ASN 79 N 0.00 4.49 0.00 4.04 3.02 -1.26 -4.19 115.26 121.36 2b01 n ASN 79 Ca 0.00 -2.89 0.00 0.00 -0.03 0.00 0.00 54.58 51.66 2b01 n ASN 79 Cb 0.00 -1.71 0.00 0.00 -0.61 0.00 0.00 39.78 37.46 2b01 n ASN 79 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2b01 n THR 80 N 5.83 0.00 -3.04 3.41 -2.24 -1.26 -4.95 114.28 112.03 2b01 n THR 80 Ca 0.50 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.89 2b01 n THR 80 Cb 0.43 -0.45 -0.05 0.00 -2.10 0.00 0.00 70.33 68.16 2b01 n THR 80 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2b01 s GLU 81 N -0.90 4.44 -0.14 -0.78 2.56 -1.26 -4.30 118.70 118.33 2b01 s GLU 81 Ca 0.00 0.93 -0.03 0.00 0.00 0.00 0.00 54.97 55.87 2b01 s GLU 81 Cb 0.00 -3.40 -0.03 0.00 2.00 0.00 0.00 34.13 32.70 2b01 s GLU 81 CO 0.00 0.19 -0.04 0.42 -0.56 0.00 0.00 175.26 175.27 2b01 s ILE 82 N 0.34 3.88 -0.10 -3.70 1.01 -1.26 -1.51 121.20 119.87 2b01 s ILE 82 Ca 0.37 -0.37 -0.01 0.00 0.00 0.00 0.00 60.65 60.64 2b01 s ILE 82 Cb -0.19 -2.68 0.03 0.00 0.01 0.00 0.00 42.46 39.63 2b01 s ILE 82 CO 0.20 0.52 -0.03 -0.89 0.00 0.00 0.00 174.94 174.74 2b01 s THR 83 N 0.12 0.66 0.06 2.92 2.01 -0.66 -5.00 115.64 115.76 2b01 s THR 83 Ca -0.01 -0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 2b01 s THR 83 Cb -0.14 -0.80 -0.05 0.00 0.01 0.00 0.00 72.50 71.53 2b01 s THR 83 CO 0.03 0.25 1.01 0.00 -0.69 0.00 0.00 174.62 175.22 2b01 s ASN 85 N 0.54 6.55 0.36 0.00 3.84 0.33 -4.87 114.94 121.69 2b01 s ASN 85 Ca 0.51 2.67 0.26 0.00 0.21 0.00 0.00 52.86 56.51 2b01 s ASN 85 Cb -0.23 -2.60 1.24 0.00 -0.55 0.00 0.00 41.25 39.11 2b01 s ASN 85 CO 0.29 -0.84 1.80 0.77 -2.79 0.00 0.00 177.10 176.33 2b01 h SER 86 N 6.59 0.00 0.39 -4.21 4.64 -1.94 -1.86 113.55 117.16 2b01 h SER 86 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2b01 h SER 86 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2b01 h SER 86 CO 0.91 0.00 -0.06 0.29 -0.87 0.00 0.00 176.83 177.10 2b01 n LYS 87 N -2.44 0.65 -1.91 4.77 4.76 -1.26 -4.84 118.16 117.88 2b01 n LYS 87 Ca 0.00 -0.13 -0.40 0.00 -2.87 0.00 0.00 58.31 54.91 2b01 n LYS 87 Cb 0.16 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 2b01 n LYS 87 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2b01 s ASN 88 N -2.44 6.25 0.90 4.39 0.01 -0.70 -4.97 114.94 118.37 2b01 s ASN 88 Ca 0.31 2.85 -0.12 0.00 -0.71 0.00 0.00 52.86 55.19 2b01 s ASN 88 Cb 0.20 -2.65 0.13 0.00 0.41 0.00 0.00 41.25 39.34 2b01 s ASN 88 CO 0.45 -0.91 1.11 0.54 -1.51 0.00 0.00 177.10 176.78 2b01 s ASN 89 N -0.47 3.52 0.24 -1.22 6.03 -1.26 -4.59 114.94 117.20 2b01 s ASN 89 Ca 0.56 1.19 -0.07 0.00 -1.03 0.00 0.00 52.86 53.51 2b01 s ASN 89 Cb -0.42 -1.85 0.43 0.00 -3.03 0.00 0.00 41.25 36.38 2b01 s ASN 89 CO 0.56 -2.57 1.65 0.00 -2.03 0.00 0.00 177.10 174.71 2b01 h ALA 90 N -1.51 0.82 -0.58 3.54 0.00 -1.96 0.27 119.26 119.85 2b01 h ALA 90 Ca -0.50 0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 2b01 h ALA 90 Cb 1.31 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 19.42 2b01 h ALA 90 CO 0.59 -0.40 0.11 0.00 0.00 0.00 0.00 179.25 179.54 2b01 h GLU 92 N 0.85 1.04 -0.75 0.00 5.08 -1.58 -2.62 114.58 116.60 2b01 h GLU 92 Ca 0.18 -0.39 -0.04 0.00 -1.00 0.00 0.00 59.36 58.10 2b01 h GLU 92 Cb 0.40 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2b01 h GLU 92 CO 0.01 1.08 0.30 0.00 -1.00 0.00 0.00 179.01 179.40 2b01 h ALA 93 N 0.93 0.97 -0.50 3.43 0.00 -0.35 0.26 119.26 123.99 2b01 h ALA 93 Ca 0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2b01 h ALA 93 Cb 0.69 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2b01 h ALA 93 CO 0.05 0.59 0.23 0.35 0.00 0.00 0.00 179.25 180.47 2b01 h PHE 94 N 1.07 0.72 -0.29 0.00 3.04 -1.24 -0.36 116.94 119.88 2b01 h PHE 94 Ca 0.25 -0.04 -0.06 0.00 3.98 0.00 0.00 57.97 62.10 2b01 h PHE 94 Cb 0.21 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 38.49 2b01 h PHE 94 CO 0.02 0.58 -0.06 0.82 -2.02 0.00 0.00 178.31 177.65 2b01 h ILE 95 N 0.66 1.28 -0.82 1.41 1.08 -1.07 -2.13 117.51 117.92 2b01 h ILE 95 Ca 0.17 -1.07 0.05 0.00 -0.39 0.00 0.00 64.86 63.62 2b01 h ILE 95 Cb 0.13 1.37 -0.05 0.00 -3.07 0.00 0.00 36.82 35.20 2b01 h ILE 95 CO -0.02 0.34 0.51 0.00 -0.69 0.00 0.00 178.15 178.29 2b01 h ASN 97 N 0.97 1.06 -0.23 0.00 2.35 -0.95 0.74 115.58 119.52 2b01 h ASN 97 Ca 0.34 -0.23 0.02 0.00 -0.55 0.00 0.00 56.30 55.87 2b01 h ASN 97 Cb 0.09 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 2b01 h ASN 97 CO -0.14 1.02 0.10 0.00 -1.65 0.00 0.00 177.43 176.76 2b01 h ASP 99 N 0.22 0.76 -0.30 0.00 5.19 -0.94 -2.29 116.42 119.07 2b01 h ASP 99 Ca 0.09 -0.13 -0.02 0.00 -0.62 0.00 0.00 57.03 56.36 2b01 h ASP 99 Cb 0.04 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 2b01 h ASP 99 CO -0.07 0.68 0.13 -0.09 -3.12 0.00 0.00 179.24 176.76 2b01 h ARG 100 N 0.79 0.44 -0.90 3.56 2.43 -0.58 -0.33 114.38 119.79 2b01 h ARG 100 Ca 0.20 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 2b01 h ARG 100 Cb 0.12 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.55 2b01 h ARG 100 CO -0.02 0.44 0.59 -0.91 -1.51 0.00 0.00 179.97 178.56 2b01 h ASN 101 N 0.33 0.96 -0.21 -3.80 2.35 -1.03 -1.80 115.58 112.39 2b01 h ASN 101 Ca 0.10 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.77 2b01 h ASN 101 Cb 0.16 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 2b01 h ASN 101 CO -0.01 0.66 -0.16 0.00 -1.65 0.00 0.00 177.43 176.26 2b01 h ALA 102 N 1.48 0.30 -0.51 -0.83 0.00 -1.10 -0.78 119.26 117.82 2b01 h ALA 102 Ca 0.36 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2b01 h ALA 102 Cb 0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2b01 h ALA 102 CO -0.11 0.20 0.27 0.00 0.00 0.00 0.00 179.25 179.61 2b01 h ALA 103 N 0.67 0.66 -0.24 0.00 0.00 -0.68 0.37 119.26 120.04 2b01 h ALA 103 Ca 0.04 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2b01 h ALA 103 Cb 0.69 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2b01 h ALA 103 CO 0.04 -0.06 0.06 0.82 0.00 0.00 0.00 179.25 180.11 2b01 h ILE 104 N 0.53 1.21 -0.44 0.00 2.04 -1.31 -1.91 117.51 117.63 2b01 h ILE 104 Ca 0.22 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.44 2b01 h ILE 104 Cb 0.10 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 2b01 h ILE 104 CO -0.14 0.22 0.15 0.00 0.00 0.00 0.00 178.15 178.39 2b01 h PHE 106 N 0.32 0.72 0.00 0.00 0.04 -0.10 -2.27 116.94 115.65 2b01 h PHE 106 Ca 0.20 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.00 2b01 h PHE 106 Cb 0.20 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.12 2b01 h PHE 106 CO -0.15 0.39 0.00 -1.13 -0.60 0.00 0.00 178.31 176.81 2b01 n SER 107 N -4.74 0.00 -0.00 2.17 3.41 -0.73 -2.11 113.62 111.62 2b01 n SER 107 Ca 0.07 0.30 0.04 0.00 -0.26 0.00 0.00 58.87 59.02 2b01 n SER 107 Cb 0.11 -0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 63.64 2b01 n SER 107 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2b01 n LYS 108 N -1.36 2.63 -3.43 4.33 5.02 -0.87 -5.02 118.16 119.46 2b01 n LYS 108 Ca 0.03 -0.03 -0.38 0.00 -2.02 0.00 0.00 58.31 55.90 2b01 n LYS 108 Cb 0.06 -1.04 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 2b01 n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b01 s ALA 109 N -2.15 3.67 0.79 7.82 0.00 -0.90 -5.07 121.76 125.91 2b01 s ALA 109 Ca 0.01 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.71 2b01 s ALA 109 Cb 0.07 -2.46 0.07 0.00 0.00 0.00 0.00 23.12 20.79 2b01 s ALA 109 CO 0.38 0.46 1.13 -2.14 0.00 0.00 0.00 175.76 175.58 2b01 s PRO 110 N -1.11 2.00 -0.42 0.00 0.02 -1.26 -4.88 135.00 129.36 2b01 s PRO 110 Ca 0.26 1.39 -0.03 0.00 0.02 0.00 0.00 61.00 62.64 2b01 s PRO 110 Cb -0.17 -1.85 0.11 0.00 0.02 0.00 0.00 34.50 32.61 2b01 s PRO 110 CO 0.15 -1.87 0.22 -0.47 -0.33 0.00 0.00 177.00 174.70 2b01 s TYR 111 N -2.61 3.58 -0.65 6.54 6.14 -1.26 -4.49 117.35 124.59 2b01 s TYR 111 Ca 0.65 -2.42 -0.25 0.00 0.64 0.00 0.00 57.07 55.69 2b01 s TYR 111 Cb -0.21 -3.23 0.05 0.00 0.42 0.00 0.00 41.96 38.99 2b01 s TYR 111 CO 0.53 -0.97 1.08 -0.80 0.64 0.00 0.00 175.55 176.03 2b01 s ASN 112 N 1.79 6.24 0.54 4.32 0.01 -1.26 -4.89 114.94 121.69 2b01 s ASN 112 Ca 0.09 -0.56 0.24 0.00 -0.71 0.00 0.00 52.86 51.92 2b01 s ASN 112 Cb -0.23 -2.48 1.33 0.00 0.41 0.00 0.00 41.25 40.28 2b01 s ASN 112 CO -0.04 -1.52 1.72 0.11 -1.51 0.00 0.00 177.10 175.85 2b01 h LYS 113 N 9.65 0.00 0.00 -0.60 1.57 -1.99 0.13 116.57 125.33 2b01 h LYS 113 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2b01 h LYS 113 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.37 2b01 h LYS 113 CO 1.19 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 179.22 2b01 n GLU 114 N -2.59 0.08 0.00 3.15 0.00 -1.26 -3.10 120.64 116.92 2b01 n GLU 114 Ca -0.02 0.06 0.09 0.00 0.00 0.00 0.00 57.16 57.29 2b01 n GLU 114 Cb 0.34 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.30 2b01 n GLU 114 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2b01 n HIS 115 N -1.46 0.00 -2.12 -1.84 8.25 0.44 -4.84 115.22 113.65 2b01 n HIS 115 Ca 0.07 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.11 2b01 n HIS 115 Cb 0.28 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 2b01 n HIS 115 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2b01 s LYS 116 N -1.83 4.28 -1.37 -0.41 2.20 -1.18 -0.85 119.74 120.58 2b01 s LYS 116 Ca 0.17 2.12 -0.05 0.00 -0.36 0.00 0.00 55.97 57.86 2b01 s LYS 116 Cb 0.14 -3.36 0.03 0.00 -1.51 0.00 0.00 37.83 33.13 2b01 s LYS 116 CO 0.36 -0.53 0.83 0.09 -0.36 0.00 0.00 175.35 175.74 2b01 n ASN 117 N 4.51 -2.62 -4.76 1.43 5.03 -0.46 -4.92 115.26 113.46 2b01 n ASN 117 Ca 0.13 -0.78 -0.39 0.00 0.87 0.00 0.00 54.58 54.41 2b01 n ASN 117 Cb 0.42 -4.13 0.01 0.00 -1.02 0.00 0.00 39.78 35.07 2b01 n ASN 117 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2b01 s LEU 118 N -6.88 4.02 -1.05 3.41 2.96 -1.12 -4.89 118.68 115.13 2b01 s LEU 118 Ca 0.24 2.65 -0.23 0.00 -0.22 0.00 0.00 54.13 56.57 2b01 s LEU 118 Cb -0.12 -4.12 0.01 0.00 0.50 0.00 0.00 46.19 42.46 2b01 s LEU 118 CO 0.81 -1.17 1.71 -0.62 -1.32 0.00 0.00 176.35 175.77 2b01 s ASP 119 N -0.93 5.95 0.58 3.68 3.68 -1.26 -4.78 116.67 123.59 2b01 s ASP 119 Ca 0.64 -1.41 0.28 0.00 2.13 0.00 0.00 52.55 54.18 2b01 s ASP 119 Cb -0.37 -2.57 1.72 0.00 -1.45 0.00 0.00 42.92 40.25 2b01 s ASP 119 CO 0.46 -2.03 2.22 0.71 0.13 0.00 0.00 175.17 176.65 2b01 h THR 120 N 6.65 0.58 0.00 1.71 1.35 -1.90 -1.87 112.91 119.43 2b01 h THR 120 Ca 0.21 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 66.05 2b01 h THR 120 Cb 0.98 0.97 -0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2b01 h THR 120 CO 1.34 0.00 -0.11 0.50 -0.25 0.00 0.00 175.52 177.00 2b01 h LYS 121 N 0.00 0.00 0.00 4.72 1.63 -1.89 -2.57 116.57 118.46 2b01 h LYS 121 Ca 0.02 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.65 2b01 h LYS 121 Cb 0.09 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.69 2b01 h LYS 121 CO -0.00 0.11 -1.61 1.63 -3.45 0.00 0.00 179.45 176.13 2b01 n LYS 122 N -3.40 2.01 -0.12 1.90 5.02 -0.77 -4.74 118.16 118.07 2b01 n LYS 122 Ca -0.01 0.01 0.08 0.00 -2.02 0.00 0.00 58.31 56.37 2b01 n LYS 122 Cb 0.29 -1.22 0.14 0.00 -0.02 0.00 0.00 35.03 34.21 2b01 n LYS 122 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2b01 n TYR 123 N -2.45 0.32 -0.11 2.13 4.01 -0.80 -5.13 117.16 115.13 2b01 n TYR 123 Ca -0.16 -0.25 0.00 0.00 -0.16 0.00 0.00 57.90 57.33 2b01 n TYR 123 Cb 0.77 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.79 2b01 n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40