#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k32 s VAL 2 N 0.00 0.91 -0.33 2.53 1.01 -0.64 -5.02 120.40 118.87 2k32 s VAL 2 Ca 0.00 -1.21 0.01 0.00 0.00 0.00 0.00 61.98 60.78 2k32 s VAL 2 Cb 0.00 -0.90 0.10 0.00 0.00 0.00 0.00 36.38 35.58 2k32 s VAL 2 CO 0.00 -0.27 0.09 -0.63 0.00 0.00 0.00 175.10 174.29 2k32 s ILE 3 N -1.29 1.40 0.54 2.22 -1.09 -1.26 -1.36 121.20 120.36 2k32 s ILE 3 Ca -0.05 -1.80 -0.20 0.00 -2.23 0.00 0.00 60.65 56.38 2k32 s ILE 3 Cb -0.10 -2.05 -0.06 0.00 -1.58 0.00 0.00 42.46 38.68 2k32 s ILE 3 CO 0.02 -0.66 1.17 -0.51 -1.23 0.00 0.00 174.94 173.73 2k32 s ILE 4 N 1.30 2.94 0.05 2.92 -1.16 0.86 -4.92 121.20 123.18 2k32 s ILE 4 Ca 0.11 0.62 -0.06 0.00 -0.51 0.00 0.00 60.65 60.80 2k32 s ILE 4 Cb -0.18 -3.27 -0.01 0.00 0.61 0.00 0.00 42.46 39.61 2k32 s ILE 4 CO -0.18 -0.09 0.11 -0.54 -2.81 0.00 0.00 174.94 171.43 2k32 s LYS 5 N -3.14 0.64 0.62 3.50 1.02 -1.26 -2.03 119.74 119.08 2k32 s LYS 5 Ca 0.72 -0.82 -0.12 0.00 0.02 0.00 0.00 55.97 55.77 2k32 s LYS 5 Cb -0.28 0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.25 2k32 s LYS 5 CO 0.31 -0.17 1.03 -1.25 -0.92 0.00 0.00 175.35 174.35 2k32 s PRO 6 N -2.94 3.56 0.00 -1.68 0.04 -1.26 -4.94 135.00 127.77 2k32 s PRO 6 Ca -0.02 0.81 0.25 0.00 0.04 0.00 0.00 61.00 62.08 2k32 s PRO 6 Cb 0.01 -2.07 0.44 0.00 0.04 0.00 0.00 34.50 32.91 2k32 s PRO 6 CO -0.06 -0.60 1.37 0.00 0.04 0.00 0.00 177.00 177.74 2k32 n GLN 7 N -2.63 0.64 -4.09 4.56 0.00 -1.26 -4.41 117.38 110.18 2k32 n GLN 7 Ca 0.06 -0.44 -0.11 0.00 0.00 0.00 0.00 57.00 56.52 2k32 n GLN 7 Cb 0.54 -1.49 -0.11 0.00 0.00 0.00 0.00 30.24 29.18 2k32 n GLN 7 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 2k32 s VAL 8 N -2.66 0.47 0.51 -0.39 -7.23 -1.26 -4.92 120.40 104.92 2k32 s VAL 8 Ca 0.19 -1.46 -0.14 0.00 -1.81 0.00 0.00 61.98 58.76 2k32 s VAL 8 Cb 0.18 -1.06 -0.07 0.00 0.56 0.00 0.00 36.38 35.99 2k32 s VAL 8 CO 0.61 -0.67 0.93 -0.94 -0.31 0.00 0.00 175.10 174.72 2k32 s SER 9 N -2.27 6.51 0.00 4.85 1.04 -1.26 -4.21 113.70 118.36 2k32 s SER 9 Ca -0.01 1.41 0.00 0.00 0.48 0.00 0.00 55.95 57.83 2k32 s SER 9 Cb -0.02 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.65 2k32 s SER 9 CO -0.03 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.20 2k32 n GLY 10 N -1.77 -0.29 3.09 7.32 0.00 -0.43 -4.46 105.19 108.66 2k32 n GLY 10 Ca 0.05 -0.97 -0.18 0.00 0.00 0.00 0.00 46.02 44.93 2k32 n GLY 10 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k32 s VAL 11 N -3.83 0.86 0.53 1.61 -7.23 -0.43 -0.54 120.40 111.37 2k32 s VAL 11 Ca 0.00 -0.88 -0.22 0.00 -1.81 0.00 0.00 61.98 59.07 2k32 s VAL 11 Cb 0.00 -0.80 -0.05 0.00 0.56 0.00 0.00 36.38 36.09 2k32 s VAL 11 CO 0.00 -0.07 1.34 -0.63 -0.31 0.00 0.00 175.10 175.43 2k32 s ILE 12 N -0.85 2.21 0.00 -0.62 -1.09 -0.67 -0.24 121.20 119.94 2k32 s ILE 12 Ca -0.01 0.16 0.00 0.00 -2.23 0.00 0.00 60.65 58.57 2k32 s ILE 12 Cb -0.07 -3.08 0.00 0.00 -1.58 0.00 0.00 42.46 37.73 2k32 s ILE 12 CO 0.01 -0.00 0.00 0.52 -1.23 0.00 0.00 174.94 174.24 2k32 n VAL 13 N -0.90 0.00 -3.80 2.92 0.31 0.72 -0.99 118.33 116.59 2k32 n VAL 13 Ca 0.10 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.33 2k32 n VAL 13 Cb 0.45 -0.51 -0.07 0.00 -0.91 0.00 0.00 33.84 32.81 2k32 n VAL 13 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2k32 s ASN 14 N -3.19 0.01 -0.42 4.52 3.84 -1.22 -4.89 114.94 113.60 2k32 s ASN 14 Ca 0.00 -0.50 0.02 0.00 0.21 0.00 0.00 52.86 52.60 2k32 s ASN 14 Cb 0.00 0.36 0.12 0.00 -0.55 0.00 0.00 41.25 41.18 2k32 s ASN 14 CO 0.00 -0.72 0.18 -0.54 -2.79 0.00 0.00 177.10 173.23 2k32 s LYS 15 N -3.53 1.40 0.02 0.43 -0.14 -1.26 -2.28 119.74 114.39 2k32 s LYS 15 Ca 0.02 -1.97 -0.21 0.00 -1.36 0.00 0.00 55.97 52.45 2k32 s LYS 15 Cb 0.03 -2.71 -0.17 0.00 -1.68 0.00 0.00 37.83 33.29 2k32 s LYS 15 CO -0.09 -1.07 1.25 -0.07 -0.76 0.00 0.00 175.35 174.60 2k32 h LEU 16 N 7.10 0.40 0.00 3.17 -0.00 -1.29 -3.46 115.31 121.23 2k32 h LEU 16 Ca -0.06 -0.58 -0.22 0.00 -0.00 0.00 0.00 57.88 57.02 2k32 h LEU 16 Cb 0.95 -0.11 0.10 0.00 -0.00 0.00 0.00 40.66 41.60 2k32 h LEU 16 CO 0.54 0.91 0.11 2.22 -0.00 0.00 0.00 178.44 182.22 2k32 n PHE 17 N -4.47 -3.64 -4.19 1.13 -1.74 -1.19 -4.96 117.46 98.39 2k32 n PHE 17 Ca -0.07 -0.57 -0.18 0.00 -0.56 0.00 0.00 57.45 56.07 2k32 n PHE 17 Cb 0.45 -0.60 -0.15 0.00 1.52 0.00 0.00 39.48 40.69 2k32 n PHE 17 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 2k32 s LYS 18 N -4.42 0.67 -0.34 3.97 -0.14 -1.26 -5.10 119.74 113.12 2k32 s LYS 18 Ca 0.39 -0.16 -0.31 0.00 -1.36 0.00 0.00 55.97 54.53 2k32 s LYS 18 Cb -0.03 -0.67 -0.09 0.00 -1.68 0.00 0.00 37.83 35.37 2k32 s LYS 18 CO 0.29 0.03 2.25 0.00 -0.76 0.00 0.00 175.35 177.16 2k32 n ALA 19 N 3.50 1.31 -0.00 5.17 0.00 -1.26 -2.20 120.51 127.02 2k32 n ALA 19 Ca -0.20 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2k32 n ALA 19 Cb 0.54 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 17.21 2k32 n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k32 n GLY 20 N 6.17 0.26 1.25 0.00 0.00 -0.62 -4.80 105.19 107.46 2k32 n GLY 20 Ca 0.37 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.30 2k32 n GLY 20 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2k32 n ASP 21 N 0.00 0.15 -4.88 1.61 -0.08 -0.94 -4.59 116.55 107.83 2k32 n ASP 21 Ca 0.00 -1.22 -0.30 0.00 -1.51 0.00 0.00 54.79 51.76 2k32 n ASP 21 Cb 0.00 -0.30 0.03 0.00 2.34 0.00 0.00 41.12 43.19 2k32 n ASP 21 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2k32 s LYS 22 N -3.75 3.25 0.00 -0.67 -0.14 -1.26 -1.24 119.74 115.93 2k32 s LYS 22 Ca 0.24 0.59 -0.00 0.00 -1.36 0.00 0.00 55.97 55.44 2k32 s LYS 22 Cb -0.01 -2.06 -0.00 0.00 -1.68 0.00 0.00 37.83 34.08 2k32 s LYS 22 CO 0.16 -0.78 -0.00 0.14 -0.76 0.00 0.00 175.35 174.11 2k32 s VAL 23 N -3.25 0.02 1.03 3.17 -7.23 -0.63 -4.85 120.40 108.65 2k32 s VAL 23 Ca 0.56 -0.13 -0.17 0.00 -1.81 0.00 0.00 61.98 60.43 2k32 s VAL 23 Cb -0.11 -0.05 0.25 0.00 0.56 0.00 0.00 36.38 37.04 2k32 s VAL 23 CO 0.53 -0.07 0.93 0.29 -0.31 0.00 0.00 175.10 176.46 2k32 n LYS 24 N 2.87 -2.74 -0.06 4.82 4.76 -1.26 -2.07 118.16 124.48 2k32 n LYS 24 Ca -0.14 -1.48 0.00 0.00 -2.87 0.00 0.00 58.31 53.82 2k32 n LYS 24 Cb 0.59 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 32.41 2k32 n LYS 24 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2k32 n LYS 25 N -4.28 0.22 0.00 1.97 4.76 -1.26 -3.30 118.16 116.27 2k32 n LYS 25 Ca 0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2k32 n LYS 25 Cb 0.49 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.29 2k32 n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k32 n GLY 26 N 1.42 1.63 3.64 0.72 0.00 -1.26 -4.51 105.19 106.85 2k32 n GLY 26 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2k32 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k32 n GLN 27 N 0.00 1.11 -2.05 1.61 10.64 -1.21 -4.19 117.38 123.29 2k32 n GLN 27 Ca 0.00 0.42 -0.41 0.00 -1.83 0.00 0.00 57.00 55.18 2k32 n GLN 27 Cb 0.00 -2.24 -0.02 0.00 -0.86 0.00 0.00 30.24 27.12 2k32 n GLN 27 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 2k32 s THR 28 N -1.44 2.66 0.00 -0.39 2.01 -1.26 -0.94 115.64 116.29 2k32 s THR 28 Ca 0.74 0.60 0.00 0.00 0.31 0.00 0.00 61.69 63.34 2k32 s THR 28 Cb -0.43 -3.39 0.00 0.00 0.01 0.00 0.00 72.50 68.69 2k32 s THR 28 CO 0.48 0.12 0.00 0.18 -0.69 0.00 0.00 174.62 174.71 2k32 n LEU 29 N 1.60 1.38 -4.13 4.42 4.77 0.72 -4.04 117.00 121.71 2k32 n LEU 29 Ca 0.04 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.92 2k32 n LEU 29 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 2k32 n LEU 29 CO 0.60 0.20 -0.24 -0.36 -1.33 0.00 0.00 177.39 176.26 2k32 s PHE 30 N -1.94 0.85 0.00 -1.77 0.40 -0.99 -0.89 117.98 113.65 2k32 s PHE 30 Ca 0.00 -1.19 0.03 0.00 -0.60 0.00 0.00 56.93 55.17 2k32 s PHE 30 Cb 0.00 -0.43 -0.01 0.00 0.51 0.00 0.00 43.02 43.09 2k32 s PHE 30 CO 0.00 -0.57 -0.11 0.42 0.70 0.00 0.00 175.22 175.66 2k32 s ILE 31 N -4.06 0.85 0.11 0.64 1.01 -0.96 -0.99 121.20 117.79 2k32 s ILE 31 Ca 0.26 -0.54 0.08 0.00 0.00 0.00 0.00 60.65 60.44 2k32 s ILE 31 Cb 0.07 -0.72 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 2k32 s ILE 31 CO 0.03 0.18 -0.19 -0.63 0.00 0.00 0.00 174.94 174.33 2k32 s ILE 32 N -0.37 1.62 -0.26 2.92 1.01 0.22 -0.20 121.20 126.14 2k32 s ILE 32 Ca 0.03 -1.60 -0.03 0.00 0.00 0.00 0.00 60.65 59.05 2k32 s ILE 32 Cb -0.05 -1.55 0.02 0.00 0.01 0.00 0.00 42.46 40.90 2k32 s ILE 32 CO -0.00 -0.16 -0.03 -0.70 0.00 0.00 0.00 174.94 174.05 2k32 s GLU 33 N -2.12 2.89 0.57 2.79 2.12 0.66 -1.34 118.70 124.28 2k32 s GLU 33 Ca 0.07 -0.95 0.27 0.00 0.36 0.00 0.00 54.97 54.72 2k32 s GLU 33 Cb -0.09 -3.08 1.65 0.00 0.26 0.00 0.00 34.13 32.87 2k32 s GLU 33 CO 0.04 -0.41 2.17 1.96 -0.54 0.00 0.00 175.26 178.48 2k32 h GLN 34 N 8.06 0.00 0.00 4.30 4.20 -1.41 -1.15 115.11 129.12 2k32 h GLN 34 Ca -0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.39 2k32 h GLN 34 Cb 1.11 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.89 2k32 h GLN 34 CO 0.58 0.00 0.00 -3.47 -0.67 0.00 0.00 178.83 175.27 2k32 n ASP 35 N -3.99 0.00 -4.77 1.46 2.03 -1.26 -4.50 116.55 105.52 2k32 n ASP 35 Ca -0.01 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.92 2k32 n ASP 35 Cb 0.19 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.59 2k32 n ASP 35 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2k32 s GLN 36 N -1.16 3.76 0.00 -0.67 1.11 -1.26 -4.74 119.66 116.70 2k32 s GLN 36 Ca 0.00 1.92 -0.02 0.00 0.01 0.00 0.00 55.36 57.26 2k32 s GLN 36 Cb 0.00 -2.50 -0.01 0.00 -1.01 0.00 0.00 33.01 29.50 2k32 s GLN 36 CO 0.00 -0.59 -0.04 0.00 0.01 0.00 0.00 175.29 174.67 2k32 n ALA 37 N -0.35 2.12 0.27 6.09 0.00 -1.26 -4.74 120.51 122.64 2k32 n ALA 37 Ca 0.07 -0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.47 2k32 n ALA 37 Cb 0.47 0.07 0.76 0.00 0.00 0.00 0.00 19.45 20.74 2k32 n ALA 37 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2k32 h SER 38 N -0.12 0.00 0.52 0.00 0.02 -1.92 -0.77 113.55 111.28 2k32 h SER 38 Ca 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2k32 h SER 38 Cb 0.12 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 2k32 h SER 38 CO 0.00 0.06 -0.16 0.11 -1.14 0.00 0.00 176.83 175.70 2k32 h LYS 39 N 0.00 0.00 0.01 3.45 6.56 -2.00 -0.61 116.57 123.99 2k32 h LYS 39 Ca -0.00 0.00 -0.22 0.00 -1.06 0.00 0.00 60.65 59.37 2k32 h LYS 39 Cb 0.14 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 31.77 2k32 h LYS 39 CO 0.01 0.16 -1.20 -0.44 -2.06 0.00 0.00 179.45 175.93 2k32 h ASP 40 N 0.00 0.04 -0.12 0.86 3.32 -1.64 -3.42 116.42 115.45 2k32 h ASP 40 Ca -0.00 -0.59 -0.10 0.00 0.02 0.00 0.00 57.03 56.36 2k32 h ASP 40 Cb 0.47 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 2k32 h ASP 40 CO 0.02 1.47 -0.23 0.15 -1.72 0.00 0.00 179.24 178.94 2k32 h PHE 41 N -0.92 0.63 -0.89 4.55 3.57 -0.90 -2.59 116.94 120.39 2k32 h PHE 41 Ca -0.32 -0.13 0.06 0.00 3.53 0.00 0.00 57.97 61.11 2k32 h PHE 41 Cb 1.33 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 39.86 2k32 h PHE 41 CO 0.11 0.75 0.58 -2.95 -2.23 0.00 0.00 178.31 174.57 2k32 h ASN 42 N 0.50 0.90 0.55 0.41 7.08 -1.38 -2.96 115.58 120.67 2k32 h ASN 42 Ca 0.07 0.00 -0.17 0.00 -3.08 0.00 0.00 56.30 53.13 2k32 h ASN 42 Cb 0.67 -0.19 -0.01 0.00 -2.08 0.00 0.00 38.32 36.70 2k32 h ASN 42 CO 0.05 0.58 -0.75 0.03 -2.08 0.00 0.00 177.43 175.26 2k32 h ARG 43 N 1.02 0.16 -0.25 4.14 3.08 -1.70 -3.11 114.38 117.73 2k32 h ARG 43 Ca 0.38 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 60.26 2k32 h ARG 43 Cb 0.18 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 2k32 h ARG 43 CO -0.14 0.84 0.05 0.77 -1.07 0.00 0.00 179.97 180.42 2k32 h SER 44 N 0.10 0.32 -0.16 7.04 0.02 -1.48 -3.18 113.55 116.21 2k32 h SER 44 Ca -0.02 -0.03 0.05 0.00 -0.84 0.00 0.00 61.79 60.94 2k32 h SER 44 Cb 1.32 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 2k32 h SER 44 CO 0.11 0.33 0.20 0.11 -1.14 0.00 0.00 176.83 176.45 2k32 h LYS 45 N 0.35 0.00 0.00 3.45 1.57 -1.57 0.44 116.57 120.81 2k32 h LYS 45 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2k32 h LYS 45 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2k32 h LYS 45 CO -0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 2k32 n ALA 46 N -2.27 1.63 0.00 3.86 0.00 -1.20 -4.42 120.51 118.11 2k32 n ALA 46 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2k32 n ALA 46 Cb 0.32 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.52 2k32 n ALA 46 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k32 n LEU 47 N -1.61 0.04 -3.43 0.00 4.77 -0.01 -5.17 117.00 111.59 2k32 n LEU 47 Ca 0.03 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.89 2k32 n LEU 47 Cb 0.17 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2k32 n LEU 47 CO 0.14 -0.37 0.43 -0.36 -1.33 0.00 0.00 177.39 175.90 2k32 s PHE 48 N -1.95 -0.52 -0.89 -1.77 0.08 -0.27 -5.06 117.98 107.60 2k32 s PHE 48 Ca 0.00 0.34 0.13 0.00 0.12 0.00 0.00 56.93 57.52 2k32 s PHE 48 Cb 0.00 0.55 -0.07 0.00 -0.57 0.00 0.00 43.02 42.93 2k32 s PHE 48 CO 0.00 -0.81 0.64 0.43 -0.10 0.00 0.00 175.22 175.38 2k32 n SER 49 N -0.32 0.99 0.31 1.36 7.64 -1.26 -3.94 113.62 118.40 2k32 n SER 49 Ca -0.16 -1.00 0.18 0.00 1.01 0.00 0.00 58.87 58.90 2k32 n SER 49 Cb 0.64 0.74 1.04 0.00 -1.01 0.00 0.00 64.21 65.63 2k32 n SER 49 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2k32 h GLN 50 N 0.71 0.00 0.00 1.43 4.20 -1.97 -1.99 115.11 117.50 2k32 h GLN 50 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2k32 h GLN 50 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2k32 h GLN 50 CO 0.00 0.00 0.14 0.77 -0.67 0.00 0.00 178.83 179.07 2k32 h SER 51 N 0.00 0.00 0.06 1.46 0.02 -1.98 -2.63 113.55 110.48 2k32 h SER 51 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k32 h SER 51 Cb 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2k32 h SER 51 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 2k32 n ALA 52 N -1.81 1.09 0.40 3.77 0.00 -0.75 -1.74 120.51 121.47 2k32 n ALA 52 Ca -0.02 0.15 0.11 0.00 0.00 0.00 0.00 53.44 53.69 2k32 n ALA 52 Cb 0.18 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 2k32 n ALA 52 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2k32 n ILE 53 N -2.11 0.21 -1.90 0.00 2.08 -0.99 -3.53 119.36 113.11 2k32 n ILE 53 Ca -0.01 -0.33 -0.41 0.00 0.56 0.00 0.00 62.75 62.56 2k32 n ILE 53 Cb 0.04 0.11 -0.01 0.00 -0.75 0.00 0.00 39.64 39.04 2k32 n ILE 53 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 2k32 s SER 54 N -4.24 6.42 0.00 4.38 0.01 -0.71 -4.67 113.70 114.89 2k32 s SER 54 Ca 0.01 2.92 0.00 0.00 1.31 0.00 0.00 55.95 60.19 2k32 s SER 54 Cb 0.14 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2k32 s SER 54 CO 0.82 -0.80 0.72 0.00 0.41 0.00 0.00 173.24 174.39 2k32 n GLN 55 N 0.48 0.00 0.00 12.44 6.02 -1.26 -1.12 117.38 133.94 2k32 n GLN 55 Ca 0.01 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.25 2k32 n GLN 55 Cb 0.40 -1.55 0.00 0.00 1.02 0.00 0.00 30.24 30.11 2k32 n GLN 55 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2k32 n LYS 56 N -1.22 -0.20 -0.05 -1.09 2.85 -1.26 -4.79 118.16 112.40 2k32 n LYS 56 Ca 0.00 -0.34 -0.06 0.00 -1.05 0.00 0.00 58.31 56.86 2k32 n LYS 56 Cb 0.05 -0.73 -0.05 0.00 -0.65 0.00 0.00 35.03 33.64 2k32 n LYS 56 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2k32 n GLU 57 N -0.03 0.89 0.25 -1.58 1.02 -0.28 -4.43 120.64 116.48 2k32 n GLU 57 Ca 0.00 0.04 0.17 0.00 -0.02 0.00 0.00 57.16 57.36 2k32 n GLU 57 Cb 0.17 -1.21 0.87 0.00 -0.02 0.00 0.00 31.44 31.25 2k32 n GLU 57 CO 0.00 0.00 0.00 0.10 1.18 0.00 0.00 177.13 178.41 2k32 h TYR 58 N 0.00 0.00 -0.42 -0.32 -0.00 -1.20 -3.06 116.97 111.96 2k32 h TYR 58 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.50 2k32 h TYR 58 Cb 1.40 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.13 2k32 h TYR 58 CO 0.01 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 177.77 2k32 n ASP 59 N -2.73 3.24 0.18 0.10 5.75 -1.26 -4.45 116.55 117.38 2k32 n ASP 59 Ca -0.01 -1.94 0.16 0.00 -0.01 0.00 0.00 54.79 52.99 2k32 n ASP 59 Cb 0.11 -0.28 0.78 0.00 -1.03 0.00 0.00 41.12 40.70 2k32 n ASP 59 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2k32 h SER 60 N 3.33 0.00 1.32 -1.12 0.02 -1.78 0.02 113.55 115.34 2k32 h SER 60 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k32 h SER 60 Cb 0.84 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.38 2k32 h SER 60 CO 0.00 0.00 -0.01 0.77 -1.14 0.00 0.00 176.83 176.45 2k32 h SER 61 N 0.00 0.00 0.00 3.07 4.64 -1.86 -2.52 113.55 116.88 2k32 h SER 61 Ca 0.10 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.09 2k32 h SER 61 Cb 0.49 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.52 2k32 h SER 61 CO -0.00 0.01 -2.23 0.18 -0.87 0.00 0.00 176.83 173.92 2k32 n LEU 62 N -3.10 0.18 0.00 5.97 4.77 -0.14 -4.78 117.00 119.89 2k32 n LEU 62 Ca 0.02 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2k32 n LEU 62 Cb 0.38 0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 2k32 n LEU 62 CO 0.30 0.47 0.19 0.00 -1.33 0.00 0.00 177.39 177.02 2k32 n ALA 63 N -2.69 0.81 -0.12 -1.18 0.00 -0.40 -5.08 120.51 111.84 2k32 n ALA 63 Ca -0.30 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 52.76 2k32 n ALA 63 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.52 2k32 n ALA 63 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2k32 n THR 64 N -0.03 0.00 -1.22 0.00 -1.04 -0.95 -1.13 114.28 109.91 2k32 n THR 64 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2k32 n THR 64 Cb 0.40 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 2k32 n THR 64 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2k32 n LEU 65 N 0.00 0.00 -3.55 -4.42 4.77 -1.26 -4.57 117.00 107.97 2k32 n LEU 65 Ca 0.00 -0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.67 2k32 n LEU 65 Cb 0.00 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2k32 n LEU 65 CO 0.00 0.10 0.16 -0.67 -1.33 0.00 0.00 177.39 175.66 2k32 n ASP 66 N 0.00 -4.14 -4.82 -1.43 2.03 -0.28 -4.44 116.55 103.47 2k32 n ASP 66 Ca 0.00 -0.61 -0.33 0.00 0.52 0.00 0.00 54.79 54.37 2k32 n ASP 66 Cb 0.46 -4.94 -0.04 0.00 -0.72 0.00 0.00 41.12 35.88 2k32 n ASP 66 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2k32 s HIS 67 N -3.36 3.22 0.01 -0.67 3.76 -1.26 -1.29 115.29 115.71 2k32 s HIS 67 Ca 0.31 1.56 -0.01 0.00 -0.15 0.00 0.00 55.06 56.76 2k32 s HIS 67 Cb -0.14 -2.91 -0.01 0.00 1.11 0.00 0.00 32.58 30.62 2k32 s HIS 67 CO 0.74 -0.49 -0.00 0.99 -0.85 0.00 0.00 174.74 175.13 2k32 s THR 68 N -2.26 0.09 0.08 1.30 2.01 -0.45 -4.96 115.64 111.46 2k32 s THR 68 Ca 0.63 -0.75 0.06 0.00 0.31 0.00 0.00 61.69 61.94 2k32 s THR 68 Cb -0.12 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 2k32 s THR 68 CO 0.22 -0.41 -0.07 -1.61 -0.69 0.00 0.00 174.62 172.06 2k32 s GLU 69 N -1.23 2.29 -0.01 4.92 2.02 -1.26 -0.61 118.70 124.81 2k32 s GLU 69 Ca -0.13 -0.93 0.05 0.00 0.02 0.00 0.00 54.97 53.97 2k32 s GLU 69 Cb -0.08 -2.39 -0.01 0.00 0.10 0.00 0.00 34.13 31.75 2k32 s GLU 69 CO -0.01 0.53 -0.17 0.42 0.02 0.00 0.00 175.26 176.06 2k32 s ILE 70 N -1.20 1.32 0.05 -1.63 1.09 -0.16 -4.92 121.20 115.75 2k32 s ILE 70 Ca 0.22 -0.71 0.01 0.00 -1.10 0.00 0.00 60.65 59.06 2k32 s ILE 70 Cb -0.11 -1.10 -0.03 0.00 -1.06 0.00 0.00 42.46 40.16 2k32 s ILE 70 CO 0.14 0.37 -0.05 -1.59 -0.10 0.00 0.00 174.94 173.71 2k32 s LYS 71 N -0.37 0.55 0.99 2.79 -2.85 -1.26 -0.20 119.74 119.40 2k32 s LYS 71 Ca 0.06 -0.95 -0.11 0.00 -1.00 0.00 0.00 55.97 53.96 2k32 s LYS 71 Cb -0.07 -0.03 0.16 0.00 -2.06 0.00 0.00 37.83 35.83 2k32 s LYS 71 CO -0.00 -0.03 0.95 0.00 0.10 0.00 0.00 175.35 176.37 2k32 n ALA 72 N 0.85 -1.72 0.08 0.59 0.00 -0.11 -4.91 120.51 115.29 2k32 n ALA 72 Ca -0.19 -0.74 -0.21 0.00 0.00 0.00 0.00 53.44 52.29 2k32 n ALA 72 Cb 0.58 -2.06 -0.14 0.00 0.00 0.00 0.00 19.45 17.82 2k32 n ALA 72 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2k32 h PRO 73 N -2.05 0.45 -2.69 0.00 0.13 -1.90 -3.35 132.00 122.60 2k32 h PRO 73 Ca -0.48 -0.68 0.11 0.00 -0.87 0.00 0.00 66.00 64.08 2k32 h PRO 73 Cb 1.29 0.24 -0.07 0.00 0.13 0.00 0.00 31.00 32.59 2k32 h PRO 73 CO 0.42 1.31 0.35 -0.59 -0.23 0.00 0.00 178.00 179.25 2k32 s PHE 74 N -2.71 -0.19 -0.08 1.56 -0.12 -1.26 -4.50 117.98 110.68 2k32 s PHE 74 Ca -0.11 -0.18 -0.30 0.00 -0.05 0.00 0.00 56.93 56.29 2k32 s PHE 74 Cb 0.03 0.66 -0.03 0.00 -0.63 0.00 0.00 43.02 43.05 2k32 s PHE 74 CO 0.88 -1.02 1.31 0.34 -0.05 0.00 0.00 175.22 176.69 2k32 s ASP 75 N -2.90 6.93 0.00 1.98 -1.08 -1.23 -4.37 116.67 116.00 2k32 s ASP 75 Ca 0.11 1.88 0.00 0.00 -0.52 0.00 0.00 52.55 54.02 2k32 s ASP 75 Cb -0.04 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.88 2k32 s ASP 75 CO 0.03 -0.71 0.00 0.61 0.52 0.00 0.00 175.17 175.62 2k32 n GLY 76 N 3.60 1.00 3.01 2.66 0.00 -0.88 -0.78 105.19 113.79 2k32 n GLY 76 Ca 0.13 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 2k32 n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k32 s THR 77 N -1.83 1.12 0.13 2.61 2.01 0.32 -1.60 115.64 118.39 2k32 s THR 77 Ca 0.00 -0.45 0.03 0.00 0.31 0.00 0.00 61.69 61.58 2k32 s THR 77 Cb 0.00 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 71.43 2k32 s THR 77 CO 0.00 0.36 0.19 -0.51 -0.69 0.00 0.00 174.62 173.96 2k32 s ILE 78 N 0.82 4.92 0.04 1.82 2.07 -0.37 -1.18 121.20 129.31 2k32 s ILE 78 Ca -0.12 -0.79 -0.01 0.00 -1.41 0.00 0.00 60.65 58.33 2k32 s ILE 78 Cb -0.15 -3.48 0.01 0.00 0.13 0.00 0.00 42.46 38.97 2k32 s ILE 78 CO 0.02 -0.03 0.05 0.61 -1.91 0.00 0.00 174.94 173.68 2k32 n GLY 79 N -0.19 -0.79 3.77 1.50 0.00 0.54 -3.13 105.19 106.88 2k32 n GLY 79 Ca -0.07 -1.73 -0.38 0.00 0.00 0.00 0.00 46.02 43.84 2k32 n GLY 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k32 s ASP 80 N -1.18 6.41 0.67 1.61 1.01 -1.26 -1.59 116.67 122.34 2k32 s ASP 80 Ca 0.03 2.42 -0.17 0.00 0.71 0.00 0.00 52.55 55.54 2k32 s ASP 80 Cb -0.00 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.32 2k32 s ASP 80 CO 0.02 -0.76 1.22 0.00 0.21 0.00 0.00 175.17 175.86 2k32 s ALA 81 N -1.39 2.31 -0.13 5.23 0.00 -1.26 -4.58 121.76 121.93 2k32 s ALA 81 Ca 0.58 0.97 0.01 0.00 0.00 0.00 0.00 51.96 53.53 2k32 s ALA 81 Cb -0.32 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.35 2k32 s ALA 81 CO 0.40 -1.59 0.87 1.28 0.00 0.00 0.00 175.76 176.72 2k32 n LEU 82 N -2.22 1.78 -3.83 0.00 4.77 0.07 -4.97 117.00 112.60 2k32 n LEU 82 Ca 0.14 -1.67 -0.10 0.00 -0.03 0.00 0.00 56.01 54.36 2k32 n LEU 82 Cb 0.50 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.49 2k32 n LEU 82 CO 0.47 0.44 -0.07 0.68 -1.33 0.00 0.00 177.39 177.58 2k32 s VAL 83 N -0.70 0.12 0.21 4.08 -7.23 -1.25 -4.90 120.40 110.73 2k32 s VAL 83 Ca 0.02 -1.00 0.01 0.00 -1.81 0.00 0.00 61.98 59.21 2k32 s VAL 83 Cb 0.01 -1.14 -0.05 0.00 0.56 0.00 0.00 36.38 35.77 2k32 s VAL 83 CO 0.02 -0.55 0.05 0.20 -0.31 0.00 0.00 175.10 174.51 2k32 s ASN 84 N -2.51 1.13 -0.48 4.85 0.01 -1.26 -5.05 114.94 111.63 2k32 s ASN 84 Ca 0.00 -1.28 -0.29 0.00 -0.71 0.00 0.00 52.86 50.58 2k32 s ASN 84 Cb 0.02 0.16 -0.10 0.00 0.41 0.00 0.00 41.25 41.74 2k32 s ASN 84 CO -0.08 -0.66 2.37 -0.38 -1.51 0.00 0.00 177.10 176.85 2k32 n ILE 85 N -0.34 0.06 0.00 0.60 -0.00 -1.26 -1.05 119.36 117.37 2k32 n ILE 85 Ca -0.03 -0.52 0.00 0.00 -0.00 0.00 0.00 62.75 62.20 2k32 n ILE 85 Cb 0.65 -2.20 0.00 0.00 -0.00 0.00 0.00 39.64 38.09 2k32 n ILE 85 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2k32 n GLY 86 N 6.15 1.12 3.67 7.39 0.00 -0.16 -4.97 105.19 118.39 2k32 n GLY 86 Ca 0.41 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.00 2k32 n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k32 s ASP 87 N -1.65 6.73 0.28 1.61 1.01 -0.22 -4.66 116.67 119.77 2k32 s ASP 87 Ca 0.00 2.19 -0.30 0.00 0.71 0.00 0.00 52.55 55.15 2k32 s ASP 87 Cb 0.00 -2.54 -0.10 0.00 1.01 0.00 0.00 42.92 41.28 2k32 s ASP 87 CO 0.00 -0.86 1.43 -0.47 0.21 0.00 0.00 175.17 175.48 2k32 s TYR 88 N 3.44 2.96 0.04 4.23 5.04 -1.26 -1.66 117.35 130.14 2k32 s TYR 88 Ca 0.70 1.09 -0.03 0.00 -2.44 0.00 0.00 57.07 56.38 2k32 s TYR 88 Cb -0.33 -3.83 -0.02 0.00 0.35 0.00 0.00 41.96 38.13 2k32 s TYR 88 CO 0.28 -2.62 0.04 0.14 -1.34 0.00 0.00 175.55 172.05 2k32 s VAL 89 N -0.32 0.16 0.03 3.14 -7.23 0.30 -4.98 120.40 111.51 2k32 s VAL 89 Ca 0.57 -1.33 0.03 0.00 -1.81 0.00 0.00 61.98 59.44 2k32 s VAL 89 Cb -0.42 -1.07 -0.02 0.00 0.56 0.00 0.00 36.38 35.43 2k32 s VAL 89 CO 0.47 -0.73 -0.09 -0.55 -0.31 0.00 0.00 175.10 173.88 2k32 s SER 90 N -2.39 1.08 0.64 4.85 0.15 -1.26 -1.31 113.70 115.46 2k32 s SER 90 Ca -0.01 -0.40 0.34 0.00 0.70 0.00 0.00 55.95 56.58 2k32 s SER 90 Cb 0.01 -0.04 1.89 0.00 -1.71 0.00 0.00 66.02 66.17 2k32 s SER 90 CO -0.07 -0.05 2.11 0.00 1.20 0.00 0.00 173.24 176.44 2k32 h ALA 91 N 5.05 1.38 0.00 5.45 0.00 -1.77 -2.10 119.26 127.27 2k32 h ALA 91 Ca -0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2k32 h ALA 91 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2k32 h ALA 91 CO 0.44 -0.23 0.00 -1.13 0.00 0.00 0.00 179.25 178.33 2k32 n SER 92 N -3.22 0.28 0.01 0.00 3.41 -1.26 -4.35 113.62 108.49 2k32 n SER 92 Ca -0.01 -0.82 0.11 0.00 -0.26 0.00 0.00 58.87 57.89 2k32 n SER 92 Cb 0.28 0.08 -0.05 0.00 -0.26 0.00 0.00 64.21 64.26 2k32 n SER 92 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2k32 n THR 93 N -0.08 0.10 -3.68 6.66 -1.04 -0.81 -4.88 114.28 110.54 2k32 n THR 93 Ca 0.00 -0.24 -0.19 0.00 -2.04 0.00 0.00 64.05 61.58 2k32 n THR 93 Cb 0.12 0.35 -0.17 0.00 -1.82 0.00 0.00 70.33 68.81 2k32 n THR 93 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2k32 s THR 94 N -3.22 -0.14 -0.20 12.58 2.01 -1.09 -4.89 115.64 120.70 2k32 s THR 94 Ca 0.02 0.38 -0.08 0.00 0.31 0.00 0.00 61.69 62.33 2k32 s THR 94 Cb 0.15 -0.18 -0.04 0.00 0.01 0.00 0.00 72.50 72.44 2k32 s THR 94 CO 0.84 0.16 0.07 -1.61 -0.69 0.00 0.00 174.62 173.39 2k32 s GLU 95 N 2.05 3.92 -0.10 4.92 2.02 -1.26 -4.59 118.70 125.67 2k32 s GLU 95 Ca 0.03 -0.36 -0.02 0.00 0.02 0.00 0.00 54.97 54.64 2k32 s GLU 95 Cb -0.12 -3.25 -0.25 0.00 0.10 0.00 0.00 34.13 30.60 2k32 s GLU 95 CO -0.04 0.18 0.44 1.28 0.02 0.00 0.00 175.26 177.14 2k32 n LEU 96 N 3.82 2.19 0.00 1.80 4.77 -0.86 -4.68 117.00 124.05 2k32 n LEU 96 Ca -0.16 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2k32 n LEU 96 Cb 0.52 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 2k32 n LEU 96 CO 0.34 0.74 0.00 0.55 -1.33 0.00 0.00 177.39 177.69 2k32 n VAL 97 N -3.37 0.00 -3.76 4.08 3.14 -1.26 -0.75 118.33 116.41 2k32 n VAL 97 Ca -0.28 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 60.79 2k32 n VAL 97 Cb 1.05 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.79 2k32 n VAL 97 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2k32 s ARG 98 N -2.00 3.54 0.04 1.45 1.04 -1.26 -0.10 118.95 121.66 2k32 s ARG 98 Ca 0.00 -0.25 0.02 0.00 -1.04 0.00 0.00 55.73 54.46 2k32 s ARG 98 Cb 0.00 -2.91 -0.02 0.00 -2.04 0.00 0.00 34.95 29.97 2k32 s ARG 98 CO 0.00 0.51 -0.08 0.54 -0.04 0.00 0.00 175.30 176.23 2k32 s VAL 99 N -1.64 0.53 0.00 4.99 0.11 -0.47 -0.34 120.40 123.59 2k32 s VAL 99 Ca 0.39 -1.11 -0.01 0.00 -2.93 0.00 0.00 61.98 58.31 2k32 s VAL 99 Cb -0.12 -0.65 -0.01 0.00 -1.53 0.00 0.00 36.38 34.07 2k32 s VAL 99 CO 0.26 -0.41 0.02 0.28 -3.33 0.00 0.00 175.10 171.92 2k32 s THR 100 N -1.49 0.06 -0.39 5.04 -1.32 -0.33 -1.61 115.64 115.61 2k32 s THR 100 Ca -0.09 -0.54 -0.13 0.00 -1.21 0.00 0.00 61.69 59.72 2k32 s THR 100 Cb -0.09 -0.21 0.02 0.00 -1.51 0.00 0.00 72.50 70.71 2k32 s THR 100 CO 0.00 -0.29 0.26 0.21 -2.21 0.00 0.00 174.62 172.58 2k32 s ASN 101 N -0.89 5.96 1.26 8.08 3.84 -1.26 -0.52 114.94 131.41 2k32 s ASN 101 Ca -0.10 -0.86 -0.18 0.00 0.21 0.00 0.00 52.86 51.93 2k32 s ASN 101 Cb -0.06 -2.11 0.31 0.00 -0.55 0.00 0.00 41.25 38.84 2k32 s ASN 101 CO -0.00 -0.40 1.01 -0.76 -2.79 0.00 0.00 177.10 174.16 2k32 s LEU 102 N 1.64 0.07 0.89 3.21 1.43 -1.26 -5.03 118.68 119.63 2k32 s LEU 102 Ca 0.04 1.06 -0.13 0.00 -1.03 0.00 0.00 54.13 54.08 2k32 s LEU 102 Cb -0.19 -2.76 0.06 0.00 0.03 0.00 0.00 46.19 43.33 2k32 s LEU 102 CO 0.09 -4.58 0.73 0.59 0.23 0.00 0.00 176.35 173.40 2k32 n ASN 103 N -5.13 -0.90 0.00 2.29 3.02 -1.26 -4.37 115.26 108.91 2k32 n ASN 103 Ca 0.08 0.42 0.05 0.00 -0.03 0.00 0.00 54.58 55.11 2k32 n ASN 103 Cb 0.58 -1.32 0.32 0.00 -0.61 0.00 0.00 39.78 38.75 2k32 n ASN 103 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2k32 n PRO 104 N -2.45 0.74 0.00 3.52 -0.04 -1.26 -1.06 135.00 134.45 2k32 n PRO 104 Ca 0.09 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.66 2k32 n PRO 104 Cb 0.52 -1.23 0.04 0.00 -0.04 0.00 0.00 33.50 32.80 2k32 n PRO 104 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2k32 n ILE 105 N -0.73 0.00 0.00 0.52 -5.35 -1.26 -4.64 119.36 107.91 2k32 n ILE 105 Ca 0.08 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.18 2k32 n ILE 105 Cb 0.04 1.34 0.00 0.00 -1.74 0.00 0.00 39.64 39.28 2k32 n ILE 105 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2k32 n TYR 106 N 0.57 0.00 -3.83 4.28 4.01 -0.23 -5.11 117.16 116.85 2k32 n TYR 106 Ca 0.11 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.75 2k32 n TYR 106 Cb 0.49 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.47 2k32 n TYR 106 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2k32 s ALA 107 N -0.66 -0.68 -0.09 -0.72 0.00 -0.70 -4.93 121.76 113.98 2k32 s ALA 107 Ca 0.00 -0.45 0.10 0.00 0.00 0.00 0.00 51.96 51.61 2k32 s ALA 107 Cb 0.00 0.89 -0.15 0.00 0.00 0.00 0.00 23.12 23.86 2k32 s ALA 107 CO 0.00 -0.80 0.09 -3.47 0.00 0.00 0.00 175.76 171.58 2k32 n ASP 108 N -0.33 2.29 -0.56 0.00 2.03 -1.23 -4.06 116.55 114.69 2k32 n ASP 108 Ca -0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.23 2k32 n ASP 108 Cb 0.62 0.95 0.00 0.00 -0.72 0.00 0.00 41.12 41.97 2k32 n ASP 108 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k32 n GLY 109 N 2.21 -0.63 3.77 0.27 0.00 0.04 -4.72 105.19 106.13 2k32 n GLY 109 Ca -0.14 -1.02 -0.37 0.00 0.00 0.00 0.00 46.02 44.49 2k32 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k32 s SER 110 N -4.00 6.06 0.36 1.61 0.01 -1.26 -4.35 113.70 112.13 2k32 s SER 110 Ca 0.00 2.30 0.05 0.00 1.31 0.00 0.00 55.95 59.61 2k32 s SER 110 Cb 0.00 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 2k32 s SER 110 CO 0.00 -0.99 0.21 -1.38 0.41 0.00 0.00 173.24 171.48 2k32 s HIS 111 N -1.57 1.75 0.15 2.43 -0.00 -1.26 -5.13 115.29 111.65 2k32 s HIS 111 Ca 0.65 -1.49 -0.02 0.00 -0.00 0.00 0.00 55.06 54.20 2k32 s HIS 111 Cb -0.28 -0.91 -0.04 0.00 -0.00 0.00 0.00 32.58 31.36 2k32 s HIS 111 CO 0.34 -0.61 0.10 -1.58 -0.00 0.00 0.00 174.74 172.99 2k32 s HIS 112 N -3.37 0.85 0.62 0.38 5.65 -1.26 -5.07 115.29 113.10 2k32 s HIS 112 Ca 0.33 -1.20 0.35 0.00 0.25 0.00 0.00 55.06 54.79 2k32 s HIS 112 Cb 0.02 -0.43 1.99 0.00 -1.18 0.00 0.00 32.58 32.98 2k32 s HIS 112 CO 0.21 -0.57 2.25 0.45 -0.65 0.00 0.00 174.74 176.43 2k32 h HIS 113 N 2.78 0.00 -0.49 3.88 3.86 -2.06 -1.66 115.15 121.47 2k32 h HIS 113 Ca -0.35 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.86 2k32 h HIS 113 Cb 1.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.68 2k32 h HIS 113 CO 0.42 0.00 0.00 0.72 0.86 0.00 0.00 177.93 179.93 2k32 n HIS 114 N -3.52 0.65 -1.22 2.45 8.25 -1.26 -4.74 115.22 115.82 2k32 n HIS 114 Ca -0.02 -0.32 -0.37 0.00 -0.26 0.00 0.00 57.72 56.75 2k32 n HIS 114 Cb 0.14 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 2k32 n HIS 114 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k32 n HIS 115 N 1.12 2.26 -1.06 4.41 -0.00 -0.62 -5.27 115.22 116.06 2k32 n HIS 115 Ca 0.19 -2.35 0.00 0.00 -0.00 0.00 0.00 57.72 55.55 2k32 n HIS 115 Cb 0.48 -2.04 0.00 0.00 -0.00 0.00 0.00 29.99 28.43 2k32 n HIS 115 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92