#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 -0.00 -0.73 2.12 1.01 -0.15 -5.01 120.40 117.64 2k32 s VAL 2 Ca 0.00 0.03 -0.17 0.00 0.00 0.00 0.00 61.98 61.84 2k32 s VAL 2 Cb 0.00 -0.02 0.16 0.00 0.00 0.00 0.00 36.38 36.52 2k32 s VAL 2 CO 0.00 0.01 0.77 -0.63 0.00 0.00 0.00 175.10 175.25 2k32 s ILE 3 N 0.14 5.17 0.57 2.22 1.09 -1.26 -0.34 121.20 128.79 2k32 s ILE 3 Ca -0.01 -1.74 -0.20 0.00 -1.10 0.00 0.00 60.65 57.59 2k32 s ILE 3 Cb -0.02 -4.51 -0.05 0.00 -1.06 0.00 0.00 42.46 36.83 2k32 s ILE 3 CO -0.00 -1.11 1.20 0.00 -0.10 0.00 0.00 174.94 174.93 2k32 n ILE 4 N 4.89 3.85 -3.92 2.92 0.00 0.28 -4.89 119.36 122.49 2k32 n ILE 4 Ca 0.04 -0.50 -0.09 0.00 0.00 0.00 0.00 62.75 62.20 2k32 n ILE 4 Cb 0.45 -1.44 -0.09 0.00 0.00 0.00 0.00 39.64 38.55 2k32 n ILE 4 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2k32 s LYS 5 N -2.84 0.61 0.29 9.51 1.02 -1.26 -2.55 119.74 124.52 2k32 s LYS 5 Ca 0.74 -0.75 -0.26 0.00 0.02 0.00 0.00 55.97 55.72 2k32 s LYS 5 Cb -0.42 0.24 -0.09 0.00 -0.52 0.00 0.00 37.83 37.03 2k32 s LYS 5 CO 0.48 -0.16 0.91 -1.25 -0.92 0.00 0.00 175.35 174.41 2k32 s PRO 6 N -2.66 4.59 0.06 -1.68 0.04 -1.26 -4.94 135.00 129.15 2k32 s PRO 6 Ca -0.04 1.30 0.23 0.00 0.04 0.00 0.00 61.00 62.52 2k32 s PRO 6 Cb -0.01 -2.90 0.94 0.00 0.04 0.00 0.00 34.50 32.57 2k32 s PRO 6 CO -0.05 0.34 1.72 0.00 0.04 0.00 0.00 177.00 179.06 2k32 n GLN 7 N 0.76 0.06 -3.97 4.56 10.64 -1.26 -4.38 117.38 123.79 2k32 n GLN 7 Ca 0.01 0.17 -0.08 0.00 -1.83 0.00 0.00 57.00 55.26 2k32 n GLN 7 Cb 0.50 -1.59 -0.09 0.00 -0.86 0.00 0.00 30.24 28.19 2k32 n GLN 7 CO 0.00 0.00 0.00 0.14 -1.83 0.00 0.00 177.06 175.37 2k32 s VAL 8 N -3.06 0.17 0.52 -0.39 -7.23 -1.26 -4.98 120.40 104.17 2k32 s VAL 8 Ca 0.10 -1.38 -0.16 0.00 -1.81 0.00 0.00 61.98 58.73 2k32 s VAL 8 Cb 0.14 -1.23 -0.08 0.00 0.56 0.00 0.00 36.38 35.77 2k32 s VAL 8 CO 0.43 -0.76 0.98 -0.94 -0.31 0.00 0.00 175.10 174.50 2k32 s SER 9 N -2.60 6.60 0.00 4.85 1.04 -1.26 -4.37 113.70 117.95 2k32 s SER 9 Ca 0.02 1.54 0.00 0.00 0.48 0.00 0.00 55.95 57.99 2k32 s SER 9 Cb 0.04 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.66 2k32 s SER 9 CO -0.08 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.15 2k32 n GLY 10 N -1.63 -0.23 3.12 7.32 0.00 -0.56 -4.32 105.19 108.89 2k32 n GLY 10 Ca 0.06 -1.07 -0.19 0.00 0.00 0.00 0.00 46.02 44.81 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 -3.59 1.02 0.48 1.61 -7.23 -0.77 -0.43 120.40 111.50 2k32 s VAL 11 Ca 0.00 -0.92 -0.24 0.00 -1.81 0.00 0.00 61.98 59.01 2k32 s VAL 11 Cb 0.00 -0.93 -0.07 0.00 0.56 0.00 0.00 36.38 35.94 2k32 s VAL 11 CO 0.00 0.01 1.34 -0.63 -0.31 0.00 0.00 175.10 175.51 2k32 s ILE 12 N -0.80 2.32 0.00 -0.62 -1.09 -0.58 -0.26 121.20 120.17 2k32 s ILE 12 Ca 0.01 0.26 0.00 0.00 -2.23 0.00 0.00 60.65 58.69 2k32 s ILE 12 Cb -0.07 -3.14 0.00 0.00 -1.58 0.00 0.00 42.46 37.66 2k32 s ILE 12 CO 0.01 0.02 0.00 0.52 -1.23 0.00 0.00 174.94 174.26 2k32 n VAL 13 N -0.47 0.00 -3.84 2.92 0.31 0.66 -1.11 118.33 116.79 2k32 n VAL 13 Ca 0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.31 2k32 n VAL 13 Cb 0.44 -0.53 -0.07 0.00 -0.91 0.00 0.00 33.84 32.77 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 -3.20 0.09 -0.42 4.52 3.84 -1.22 -4.88 114.94 113.67 2k32 s ASN 14 Ca 0.00 -0.59 0.03 0.00 0.21 0.00 0.00 52.86 52.51 2k32 s ASN 14 Cb 0.00 0.34 0.12 0.00 -0.55 0.00 0.00 41.25 41.16 2k32 s ASN 14 CO 0.00 -0.71 0.18 -0.54 -2.79 0.00 0.00 177.10 173.25 2k32 s LYS 15 N -3.64 1.42 0.10 0.43 -0.14 -1.26 -2.29 119.74 114.36 2k32 s LYS 15 Ca 0.03 -1.99 -0.13 0.00 -1.36 0.00 0.00 55.97 52.52 2k32 s LYS 15 Cb 0.04 -2.73 -0.15 0.00 -1.68 0.00 0.00 37.83 33.31 2k32 s LYS 15 CO -0.10 -1.07 1.31 -0.07 -0.76 0.00 0.00 175.35 174.66 2k32 h LEU 16 N 7.07 0.96 0.00 3.17 -0.00 -1.30 -3.47 115.31 121.75 2k32 h LEU 16 Ca -0.06 -0.62 -0.37 0.00 -0.00 0.00 0.00 57.88 56.83 2k32 h LEU 16 Cb 0.95 -0.28 0.14 0.00 -0.00 0.00 0.00 40.66 41.47 2k32 h LEU 16 CO 0.55 1.42 0.33 2.22 -0.00 0.00 0.00 178.44 182.96 2k32 n PHE 17 N -3.94 -3.90 -4.96 1.13 -1.74 -1.20 -4.95 117.46 97.89 2k32 n PHE 17 Ca -0.07 -1.05 -0.29 0.00 -0.56 0.00 0.00 57.45 55.47 2k32 n PHE 17 Cb 0.74 -0.85 -0.17 0.00 1.52 0.00 0.00 39.48 40.72 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 -5.41 2.52 -0.22 3.97 -0.14 -1.26 -5.10 119.74 114.09 2k32 s LYS 18 Ca 0.64 -0.70 -0.30 0.00 -1.36 0.00 0.00 55.97 54.25 2k32 s LYS 18 Cb -0.02 -1.95 -0.07 0.00 -1.68 0.00 0.00 37.83 34.11 2k32 s LYS 18 CO 0.44 0.12 2.19 0.00 -0.76 0.00 0.00 175.35 177.34 2k32 n ALA 19 N 3.65 1.58 -0.05 5.17 0.00 -1.26 -2.34 120.51 127.26 2k32 n ALA 19 Ca -0.21 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2k32 n ALA 19 Cb 0.52 -2.81 0.00 0.00 0.00 0.00 0.00 19.45 17.17 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 5.79 0.42 0.00 0.00 0.00 -0.58 -4.82 105.19 106.01 2k32 n GLY 20 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 0.00 -4.81 1.61 2.03 -0.99 -4.65 116.55 109.74 2k32 n ASP 21 Ca 0.00 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.09 2k32 n ASP 21 Cb 0.00 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.36 2k32 n ASP 21 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2k32 s LYS 22 N 2.38 2.75 -0.00 -0.67 -0.14 -1.26 -1.56 119.74 121.23 2k32 s LYS 22 Ca 0.00 -1.22 0.01 0.00 -1.36 0.00 0.00 55.97 53.39 2k32 s LYS 22 Cb 0.00 -2.46 -0.00 0.00 -1.68 0.00 0.00 37.83 33.68 2k32 s LYS 22 CO 0.00 0.25 -0.02 0.14 -0.76 0.00 0.00 175.35 174.95 2k32 s VAL 23 N -2.24 0.20 1.22 3.17 -7.23 -0.50 -4.85 120.40 110.17 2k32 s VAL 23 Ca 0.37 -0.10 -0.20 0.00 -1.81 0.00 0.00 61.98 60.23 2k32 s VAL 23 Cb -0.06 -0.18 0.30 0.00 0.56 0.00 0.00 36.38 36.99 2k32 s VAL 23 CO 0.25 0.06 1.11 -0.54 -0.31 0.00 0.00 175.10 175.67 2k32 s LYS 24 N -0.03 -1.39 0.00 4.82 -0.14 -1.26 -2.25 119.74 119.48 2k32 s LYS 24 Ca 0.01 -0.12 -0.00 0.00 -1.36 0.00 0.00 55.97 54.50 2k32 s LYS 24 Cb -0.01 -1.58 -0.01 0.00 -1.68 0.00 0.00 37.83 34.54 2k32 s LYS 24 CO -0.00 -3.82 0.57 1.63 -0.76 0.00 0.00 175.35 172.98 2k32 n LYS 25 N -4.82 0.25 0.00 1.68 4.76 -1.26 -2.93 118.16 115.84 2k32 n LYS 25 Ca 0.14 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 2k32 n LYS 25 Cb 0.60 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 32.34 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 2.13 1.70 3.55 0.72 0.00 -1.26 -4.52 105.19 107.50 2k32 n GLY 26 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 0.94 -2.21 1.61 10.64 -1.15 -3.92 117.38 123.29 2k32 n GLN 27 Ca 0.00 0.34 -0.41 0.00 -1.83 0.00 0.00 57.00 55.11 2k32 n GLN 27 Cb 0.00 -1.85 -0.03 0.00 -0.86 0.00 0.00 30.24 27.50 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 -1.42 3.00 0.00 -0.39 2.01 -1.26 -1.00 115.64 116.58 2k32 s THR 28 Ca 0.66 0.95 0.00 0.00 0.31 0.00 0.00 61.69 63.60 2k32 s THR 28 Cb -0.54 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 68.37 2k32 s THR 28 CO 0.55 0.20 0.00 0.18 -0.69 0.00 0.00 174.62 174.87 2k32 n LEU 29 N 1.43 1.63 -4.12 4.42 4.77 0.44 -4.08 117.00 121.51 2k32 n LEU 29 Ca 0.02 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.90 2k32 n LEU 29 Cb 0.43 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.42 2k32 n LEU 29 CO 0.58 0.26 -0.26 -0.36 -1.33 0.00 0.00 177.39 176.28 2k32 s PHE 30 N -1.97 0.78 -0.00 -1.77 0.40 -0.99 -0.93 117.98 113.49 2k32 s PHE 30 Ca 0.00 -1.16 0.04 0.00 -0.60 0.00 0.00 56.93 55.21 2k32 s PHE 30 Cb 0.00 -0.41 -0.01 0.00 0.51 0.00 0.00 43.02 43.10 2k32 s PHE 30 CO 0.00 -0.54 -0.13 0.42 0.70 0.00 0.00 175.22 175.66 2k32 s ILE 31 N -4.03 1.05 0.09 0.64 1.01 -0.97 -1.11 121.20 117.88 2k32 s ILE 31 Ca 0.22 -0.63 0.08 0.00 0.00 0.00 0.00 60.65 60.32 2k32 s ILE 31 Cb 0.07 -0.89 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 2k32 s ILE 31 CO 0.01 0.25 -0.20 -0.63 0.00 0.00 0.00 174.94 174.36 2k32 s ILE 32 N -0.40 1.67 -0.23 2.92 1.01 0.29 -0.25 121.20 126.21 2k32 s ILE 32 Ca 0.04 -1.46 -0.10 0.00 0.00 0.00 0.00 60.65 59.13 2k32 s ILE 32 Cb -0.06 -1.51 -0.05 0.00 0.01 0.00 0.00 42.46 40.86 2k32 s ILE 32 CO -0.00 -0.02 0.15 -0.70 0.00 0.00 0.00 174.94 174.36 2k32 s GLU 33 N -1.76 4.08 -0.23 2.79 2.12 0.65 -1.32 118.70 125.03 2k32 s GLU 33 Ca 0.06 -0.27 -0.04 0.00 0.36 0.00 0.00 54.97 55.08 2k32 s GLU 33 Cb -0.10 -3.49 -0.13 0.00 0.26 0.00 0.00 34.13 30.67 2k32 s GLU 33 CO 0.04 0.12 2.23 1.04 -0.54 0.00 0.00 175.26 178.15 2k32 n GLN 34 N 4.11 1.37 -0.28 4.30 6.02 0.03 -1.84 117.38 131.09 2k32 n GLN 34 Ca -0.15 -0.79 0.11 0.00 -0.01 0.00 0.00 57.00 56.16 2k32 n GLN 34 Cb 0.52 -1.95 0.22 0.00 1.02 0.00 0.00 30.24 30.06 2k32 n GLN 34 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2k32 n ASP 35 N 3.08 -0.11 -0.50 1.08 2.03 -1.26 -3.70 116.55 117.16 2k32 n ASP 35 Ca 0.29 1.37 -0.00 0.00 0.52 0.00 0.00 54.79 56.98 2k32 n ASP 35 Cb 0.42 -0.49 -0.00 0.00 -0.72 0.00 0.00 41.12 40.33 2k32 n ASP 35 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k32 n GLN 36 N -5.16 0.00 -0.16 -0.67 10.64 -1.26 -4.92 117.38 115.84 2k32 n GLN 36 Ca 0.18 -0.46 -0.04 0.00 -1.83 0.00 0.00 57.00 54.86 2k32 n GLN 36 Cb 0.60 -0.23 0.06 0.00 -0.86 0.00 0.00 30.24 29.81 2k32 n GLN 36 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k32 h ALA 37 N 0.00 0.60 0.00 2.61 0.00 -1.75 -2.22 119.26 118.51 2k32 h ALA 37 Ca -0.00 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2k32 h ALA 37 Cb 1.18 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2k32 h ALA 37 CO -0.00 -0.19 -0.08 0.77 0.00 0.00 0.00 179.25 179.75 2k32 h SER 38 N 0.38 0.00 0.39 0.00 0.02 -1.92 -1.36 113.55 111.06 2k32 h SER 38 Ca 0.23 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.16 2k32 h SER 38 Cb 0.22 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 2k32 h SER 38 CO -0.22 0.08 -0.08 0.50 -1.14 0.00 0.00 176.83 175.98 2k32 h LYS 39 N 0.00 0.00 0.03 3.45 3.64 -1.76 -1.03 116.57 120.91 2k32 h LYS 39 Ca -0.00 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.03 2k32 h LYS 39 Cb 0.16 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 2k32 h LYS 39 CO 0.01 0.08 -1.94 -3.47 -2.27 0.00 0.00 179.45 171.85 2k32 n ASP 40 N -3.48 1.97 0.08 4.20 2.03 -0.90 -4.65 116.55 115.79 2k32 n ASP 40 Ca -0.02 0.27 0.00 0.00 0.52 0.00 0.00 54.79 55.56 2k32 n ASP 40 Cb 0.21 -0.82 0.31 0.00 -0.72 0.00 0.00 41.12 40.10 2k32 n ASP 40 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2k32 h PHE 41 N -0.60 0.34 0.00 -0.67 3.04 -0.99 -2.49 116.94 115.57 2k32 h PHE 41 Ca -0.49 -0.05 -0.05 0.00 3.98 0.00 0.00 57.97 61.35 2k32 h PHE 41 Cb 1.65 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 40.06 2k32 h PHE 41 CO 0.04 0.50 -0.26 -2.95 -2.02 0.00 0.00 178.31 173.62 2k32 h ASN 42 N 0.29 0.00 -0.03 0.41 -1.07 -1.46 -3.31 115.58 110.41 2k32 h ASN 42 Ca 0.05 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 56.42 2k32 h ASN 42 Cb 0.51 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.76 2k32 h ASN 42 CO 0.03 0.26 0.00 0.03 0.07 0.00 0.00 177.43 177.82 2k32 h ARG 43 N 0.00 0.06 0.15 4.14 3.08 -1.69 -3.04 114.38 117.08 2k32 h ARG 43 Ca -0.00 -0.02 -0.29 0.00 0.07 0.00 0.00 59.98 59.74 2k32 h ARG 43 Cb 0.55 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.61 2k32 h ARG 43 CO 0.03 0.31 -1.28 0.66 -1.07 0.00 0.00 179.97 178.62 2k32 h SER 44 N -0.21 0.55 -0.70 7.04 4.64 -1.73 -3.36 113.55 119.79 2k32 h SER 44 Ca 0.01 -0.58 -0.02 0.00 -0.47 0.00 0.00 61.79 60.73 2k32 h SER 44 Cb 0.28 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 2k32 h SER 44 CO 0.00 1.44 0.37 0.07 -0.87 0.00 0.00 176.83 177.85 2k32 h LYS 45 N 0.11 1.00 -0.00 4.77 2.10 -1.64 -3.04 116.57 119.87 2k32 h LYS 45 Ca -0.16 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 2k32 h LYS 45 Cb 2.00 -0.20 0.00 0.00 -0.90 0.00 0.00 32.23 33.13 2k32 h LYS 45 CO 0.22 0.75 -0.06 0.00 -2.00 0.00 0.00 179.45 178.36 2k32 n ALA 46 N -2.43 2.50 -0.04 0.07 0.00 -1.15 -1.58 120.51 117.88 2k32 n ALA 46 Ca 0.07 -0.14 -0.09 0.00 0.00 0.00 0.00 53.44 53.28 2k32 n ALA 46 Cb 0.11 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.10 2k32 n ALA 46 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2k32 h LEU 47 N 0.03 0.11 0.00 0.00 3.38 -1.69 -3.43 115.31 113.70 2k32 h LEU 47 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2k32 h LEU 47 Cb 0.46 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2k32 h LEU 47 CO 0.00 0.09 0.00 2.22 0.09 0.00 0.00 178.44 180.84 2k32 n PHE 48 N -5.03 0.00 0.02 1.13 -1.74 -1.26 -5.04 117.46 105.54 2k32 n PHE 48 Ca -0.03 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.86 2k32 n PHE 48 Cb 0.06 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.06 2k32 n PHE 48 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 2k32 n SER 49 N 0.00 0.11 -1.64 5.98 3.41 -1.25 -4.85 113.62 115.38 2k32 n SER 49 Ca 0.00 0.07 0.09 0.00 -0.26 0.00 0.00 58.87 58.77 2k32 n SER 49 Cb 0.00 0.00 0.36 0.00 -0.26 0.00 0.00 64.21 64.32 2k32 n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2k32 n GLN 50 N -2.93 3.90 0.16 4.33 7.27 -0.61 -4.29 117.38 125.21 2k32 n GLN 50 Ca 0.00 -2.88 0.12 0.00 0.07 0.00 0.00 57.00 54.31 2k32 n GLN 50 Cb 0.21 -1.96 0.57 0.00 2.41 0.00 0.00 30.24 31.48 2k32 n GLN 50 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2k32 h SER 51 N 4.05 0.00 0.00 1.69 4.64 -1.79 -3.09 113.55 119.04 2k32 h SER 51 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2k32 h SER 51 Cb 1.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.62 2k32 h SER 51 CO 0.28 0.00 0.04 0.00 -0.87 0.00 0.00 176.83 176.28 2k32 h ALA 52 N 2.11 1.03 -3.30 5.18 0.00 -1.92 -3.41 119.26 118.95 2k32 h ALA 52 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 2k32 h ALA 52 Cb 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 17.79 17.59 2k32 h ALA 52 CO 0.00 -0.03 -0.78 -1.50 0.00 0.00 0.00 179.25 176.93 2k32 s ILE 53 N -3.85 0.68 0.37 0.00 1.10 -1.17 -5.13 121.20 113.21 2k32 s ILE 53 Ca -0.04 -0.12 -0.27 0.00 -0.51 0.00 0.00 60.65 59.72 2k32 s ILE 53 Cb 0.09 -0.74 -0.11 0.00 0.15 0.00 0.00 42.46 41.85 2k32 s ILE 53 CO 0.29 0.29 1.29 -1.20 -2.11 0.00 0.00 174.94 173.50 2k32 n SER 54 N 4.67 2.72 0.00 4.50 7.64 -1.26 -4.72 113.62 127.18 2k32 n SER 54 Ca -0.15 1.17 0.00 0.00 1.01 0.00 0.00 58.87 60.91 2k32 n SER 54 Cb 0.50 -1.49 0.02 0.00 -1.01 0.00 0.00 64.21 62.23 2k32 n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k32 n GLN 55 N 0.38 0.01 0.00 1.43 6.02 -1.26 -1.53 117.38 122.42 2k32 n GLN 55 Ca 0.05 0.32 0.00 0.00 -0.01 0.00 0.00 57.00 57.36 2k32 n GLN 55 Cb 0.37 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.13 2k32 n GLN 55 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2k32 n LYS 56 N -1.32 0.78 -0.08 -1.09 5.02 -1.26 -4.73 118.16 115.47 2k32 n LYS 56 Ca 0.00 -0.80 -0.13 0.00 -2.02 0.00 0.00 58.31 55.36 2k32 n LYS 56 Cb 0.01 -0.85 -0.07 0.00 -0.02 0.00 0.00 35.03 34.10 2k32 n LYS 56 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2k32 n GLU 57 N -0.19 0.38 0.27 1.97 1.02 -0.58 -4.80 120.64 118.71 2k32 n GLU 57 Ca 0.00 0.11 0.12 0.00 -0.02 0.00 0.00 57.16 57.38 2k32 n GLU 57 Cb 0.20 -1.23 0.79 0.00 -0.02 0.00 0.00 31.44 31.19 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 -0.22 0.00 0.00 -0.32 -0.00 -1.57 -2.48 116.97 112.37 2k32 h TYR 58 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.35 2k32 h TYR 58 Cb 1.48 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.21 2k32 h TYR 58 CO -0.01 0.00 0.00 0.38 -0.00 0.00 0.00 178.16 178.53 2k32 h ASP 59 N 0.00 0.00 0.07 0.10 2.03 -1.86 -1.98 116.42 114.78 2k32 h ASP 59 Ca 0.01 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 2k32 h ASP 59 Cb 0.03 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 2k32 h ASP 59 CO -0.00 0.00 0.00 0.28 -1.03 0.00 0.00 179.24 178.49 2k32 h SER 60 N 0.00 0.00 0.65 4.15 0.02 -1.70 -0.61 113.55 116.06 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 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 2k32 h SER 60 CO 0.00 0.00 -0.59 -1.20 -1.14 0.00 0.00 176.83 173.90 2k32 n SER 61 N -3.07 0.58 -0.02 3.07 7.64 -0.74 -4.34 113.62 116.74 2k32 n SER 61 Ca -0.03 -0.08 0.06 0.00 1.01 0.00 0.00 58.87 59.84 2k32 n SER 61 Cb 0.09 0.25 -0.15 0.00 -1.01 0.00 0.00 64.21 63.39 2k32 n SER 61 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k32 n LEU 62 N -1.79 0.00 -3.71 -3.43 4.77 -0.31 -5.06 117.00 107.47 2k32 n LEU 62 Ca 0.04 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 2k32 n LEU 62 Cb 0.39 0.08 -0.07 0.00 -2.33 0.00 0.00 43.42 41.49 2k32 n LEU 62 CO 0.36 0.08 0.09 0.00 -1.33 0.00 0.00 177.39 176.59 2k32 s ALA 63 N -3.19 -0.85 0.27 -1.18 0.00 -0.76 -4.87 121.76 111.19 2k32 s ALA 63 Ca -0.07 0.16 -0.00 0.00 0.00 0.00 0.00 51.96 52.04 2k32 s ALA 63 Cb 0.11 0.34 0.38 0.00 0.00 0.00 0.00 23.12 23.94 2k32 s ALA 63 CO 0.80 -0.44 1.75 1.15 0.00 0.00 0.00 175.76 179.02 2k32 h THR 64 N 3.11 1.25 0.00 0.00 2.02 -1.84 -3.43 112.91 114.02 2k32 h THR 64 Ca -0.31 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 65.77 2k32 h THR 64 Cb 1.20 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 2k32 h THR 64 CO 0.45 0.37 0.00 0.18 0.37 0.00 0.00 175.52 176.89 2k32 n LEU 65 N -4.18 -2.17 -0.92 2.58 4.77 -1.26 -4.94 117.00 110.88 2k32 n LEU 65 Ca 0.01 0.70 -0.05 0.00 -0.03 0.00 0.00 56.01 56.64 2k32 n LEU 65 Cb 0.34 2.14 -0.05 0.00 -2.33 0.00 0.00 43.42 43.52 2k32 n LEU 65 CO 0.42 -0.26 0.32 -0.90 -1.33 0.00 0.00 177.39 175.64 2k32 n ASP 66 N -3.46 -0.72 -4.46 -1.43 5.75 -1.26 -4.93 116.55 106.04 2k32 n ASP 66 Ca 0.00 -1.81 -0.23 0.00 -0.01 0.00 0.00 54.79 52.74 2k32 n ASP 66 Cb 0.00 0.21 -0.10 0.00 -1.03 0.00 0.00 41.12 40.20 2k32 n ASP 66 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2k32 s HIS 67 N 0.00 2.21 0.02 2.11 3.76 -1.26 -0.79 115.29 121.34 2k32 s HIS 67 Ca 0.01 -0.39 0.01 0.00 -0.15 0.00 0.00 55.06 54.55 2k32 s HIS 67 Cb 0.02 -1.00 -0.01 0.00 1.11 0.00 0.00 32.58 32.69 2k32 s HIS 67 CO -0.01 0.65 -0.05 0.99 -0.85 0.00 0.00 174.74 175.47 2k32 s THR 68 N -2.60 0.33 0.19 1.30 2.01 -0.44 -2.81 115.64 113.62 2k32 s THR 68 Ca 0.29 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 61.71 2k32 s THR 68 Cb -0.04 -0.36 -0.03 0.00 0.01 0.00 0.00 72.50 72.08 2k32 s THR 68 CO 0.14 -0.20 0.31 -1.61 -0.69 0.00 0.00 174.62 172.57 2k32 s GLU 69 N -0.87 3.41 -0.03 4.92 2.02 -1.26 -0.55 118.70 126.35 2k32 s GLU 69 Ca -0.06 -0.68 0.04 0.00 0.02 0.00 0.00 54.97 54.29 2k32 s GLU 69 Cb -0.06 -2.92 -0.01 0.00 0.10 0.00 0.00 34.13 31.25 2k32 s GLU 69 CO -0.00 0.48 -0.15 0.42 0.02 0.00 0.00 175.26 176.03 2k32 s ILE 70 N -1.84 1.21 0.04 -1.63 1.09 -0.27 -4.77 121.20 115.03 2k32 s ILE 70 Ca 0.34 -0.62 0.03 0.00 -1.10 0.00 0.00 60.65 59.30 2k32 s ILE 70 Cb -0.10 -1.03 -0.02 0.00 -1.06 0.00 0.00 42.46 40.25 2k32 s ILE 70 CO 0.28 0.35 -0.09 -0.54 -0.10 0.00 0.00 174.94 174.84 2k32 s LYS 71 N -0.10 0.60 1.00 2.79 1.02 -1.26 -0.42 119.74 123.38 2k32 s LYS 71 Ca 0.00 -0.69 -0.11 0.00 0.02 0.00 0.00 55.97 55.19 2k32 s LYS 71 Cb -0.09 -0.47 0.19 0.00 -0.52 0.00 0.00 37.83 36.95 2k32 s LYS 71 CO 0.01 0.10 1.10 0.00 -0.92 0.00 0.00 175.35 175.64 2k32 s ALA 72 N -1.09 0.79 0.02 5.17 0.00 -0.17 -4.92 121.76 121.56 2k32 s ALA 72 Ca -0.05 0.29 -0.18 0.00 0.00 0.00 0.00 51.96 52.02 2k32 s ALA 72 Cb -0.08 -3.36 -0.27 0.00 0.00 0.00 0.00 23.12 19.41 2k32 s ALA 72 CO 0.01 -3.11 1.08 -1.00 0.00 0.00 0.00 175.76 172.73 2k32 h PRO 73 N -2.11 0.50 -2.95 0.00 0.13 -1.91 -3.37 132.00 122.29 2k32 h PRO 73 Ca -0.50 -0.62 0.01 0.00 -0.87 0.00 0.00 66.00 64.02 2k32 h PRO 73 Cb 1.29 0.20 -0.01 0.00 0.13 0.00 0.00 31.00 32.61 2k32 h PRO 73 CO 0.46 1.24 0.30 -0.59 -0.23 0.00 0.00 178.00 179.18 2k32 s PHE 74 N -3.02 0.06 0.13 1.56 -0.12 -1.26 -4.35 117.98 110.97 2k32 s PHE 74 Ca -0.12 -0.68 -0.30 0.00 -0.05 0.00 0.00 56.93 55.79 2k32 s PHE 74 Cb 0.04 0.81 -0.07 0.00 -0.63 0.00 0.00 43.02 43.17 2k32 s PHE 74 CO 0.87 -1.46 1.18 0.34 -0.05 0.00 0.00 175.22 176.10 2k32 s ASP 75 N -3.07 7.12 0.00 1.98 -1.08 -1.24 -4.05 116.67 116.33 2k32 s ASP 75 Ca 0.15 2.10 0.00 0.00 -0.52 0.00 0.00 52.55 54.29 2k32 s ASP 75 Cb -0.05 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.82 2k32 s ASP 75 CO 0.10 -0.38 0.00 0.61 0.52 0.00 0.00 175.17 176.02 2k32 n GLY 76 N 2.62 -0.55 3.62 2.66 0.00 -0.96 -4.41 105.19 108.18 2k32 n GLY 76 Ca 0.06 -0.73 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 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 -3.00 3.53 0.07 2.61 2.01 0.37 -1.40 115.64 119.81 2k32 s THR 77 Ca 0.00 -1.45 0.06 0.00 0.31 0.00 0.00 61.69 60.61 2k32 s THR 77 Cb 0.00 -2.74 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 2k32 s THR 77 CO 0.00 -0.07 -0.16 -0.51 -0.69 0.00 0.00 174.62 173.19 2k32 s ILE 78 N -1.63 1.28 0.27 1.82 2.07 -0.60 -0.53 121.20 123.88 2k32 s ILE 78 Ca 0.26 -1.25 -0.04 0.00 -1.41 0.00 0.00 60.65 58.20 2k32 s ILE 78 Cb -0.10 -1.18 0.06 0.00 0.13 0.00 0.00 42.46 41.37 2k32 s ILE 78 CO 0.17 -0.09 0.36 0.61 -1.91 0.00 0.00 174.94 174.09 2k32 n GLY 79 N 1.47 -0.99 3.77 1.50 0.00 -0.07 -3.06 105.19 107.81 2k32 n GLY 79 Ca -0.20 -1.72 -0.40 0.00 0.00 0.00 0.00 46.02 43.71 2k32 n GLY 79 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k32 s ASP 80 N -2.35 6.83 0.30 1.61 -4.77 -1.26 -1.52 116.67 115.51 2k32 s ASP 80 Ca 0.21 2.43 -0.30 0.00 -3.30 0.00 0.00 52.55 51.59 2k32 s ASP 80 Cb -0.01 -2.63 -0.12 0.00 -1.09 0.00 0.00 42.92 39.07 2k32 s ASP 80 CO 0.15 -0.47 1.49 0.00 0.70 0.00 0.00 175.17 177.04 2k32 n ALA 81 N 0.64 1.98 1.18 2.11 0.00 -1.26 -4.60 120.51 120.56 2k32 n ALA 81 Ca 0.01 0.38 0.13 0.00 0.00 0.00 0.00 53.44 53.96 2k32 n ALA 81 Cb 0.44 -2.38 0.25 0.00 0.00 0.00 0.00 19.45 17.76 2k32 n ALA 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k32 n LEU 82 N 1.77 1.95 -3.94 0.00 4.77 0.25 -4.97 117.00 116.83 2k32 n LEU 82 Ca 0.08 -0.65 -0.08 0.00 -0.03 0.00 0.00 56.01 55.33 2k32 n LEU 82 Cb 0.35 -0.03 -0.08 0.00 -2.33 0.00 0.00 43.42 41.33 2k32 n LEU 82 CO 0.63 0.34 -0.20 0.68 -1.33 0.00 0.00 177.39 177.52 2k32 s VAL 83 N -2.22 0.17 0.18 4.08 -7.23 -1.25 -4.94 120.40 109.19 2k32 s VAL 83 Ca 0.28 -1.39 -0.00 0.00 -1.81 0.00 0.00 61.98 59.05 2k32 s VAL 83 Cb 0.20 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.73 2k32 s VAL 83 CO 0.42 -0.77 0.07 0.20 -0.31 0.00 0.00 175.10 174.72 2k32 s ASN 84 N -2.82 0.58 -0.52 4.85 0.01 -1.26 -5.06 114.94 110.72 2k32 s ASN 84 Ca 0.05 -1.28 -0.28 0.00 -0.71 0.00 0.00 52.86 50.64 2k32 s ASN 84 Cb 0.06 0.26 -0.09 0.00 0.41 0.00 0.00 41.25 41.89 2k32 s ASN 84 CO -0.10 -0.73 2.42 -0.38 -1.51 0.00 0.00 177.10 176.80 2k32 n ILE 85 N -0.23 -0.01 0.00 0.60 -0.00 -1.26 -1.06 119.36 117.40 2k32 n ILE 85 Ca -0.03 -0.62 0.00 0.00 -0.00 0.00 0.00 62.75 62.10 2k32 n ILE 85 Cb 0.65 -2.39 0.00 0.00 -0.00 0.00 0.00 39.64 37.90 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 6.09 1.32 3.67 7.39 0.00 -0.27 -4.97 105.19 118.42 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 -1.83 6.71 0.26 1.61 1.01 -0.22 -4.68 116.67 119.53 2k32 s ASP 87 Ca 0.00 2.21 -0.30 0.00 0.71 0.00 0.00 52.55 55.17 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 -0.87 1.46 -0.47 0.21 0.00 0.00 175.17 175.50 2k32 s TYR 88 N 3.49 2.98 0.05 4.23 5.04 -1.26 -1.52 117.35 130.36 2k32 s TYR 88 Ca 0.70 1.00 -0.00 0.00 -2.44 0.00 0.00 57.07 56.34 2k32 s TYR 88 Cb -0.33 -3.85 -0.04 0.00 0.35 0.00 0.00 41.96 38.09 2k32 s TYR 88 CO 0.28 -2.77 -0.04 0.14 -1.34 0.00 0.00 175.55 171.82 2k32 s VAL 89 N -0.04 0.30 0.06 3.14 -7.23 0.43 -4.97 120.40 112.08 2k32 s VAL 89 Ca 0.60 -1.63 0.05 0.00 -1.81 0.00 0.00 61.98 59.19 2k32 s VAL 89 Cb -0.43 -1.27 -0.03 0.00 0.56 0.00 0.00 36.38 35.22 2k32 s VAL 89 CO 0.44 -0.86 -0.15 -0.55 -0.31 0.00 0.00 175.10 173.68 2k32 s SER 90 N -2.60 1.79 0.65 4.85 0.15 -1.26 -1.50 113.70 115.77 2k32 s SER 90 Ca 0.03 -0.56 0.35 0.00 0.70 0.00 0.00 55.95 56.47 2k32 s SER 90 Cb 0.03 -0.09 1.92 0.00 -1.71 0.00 0.00 66.02 66.18 2k32 s SER 90 CO -0.07 -0.01 2.12 0.00 1.20 0.00 0.00 173.24 176.48 2k32 h ALA 91 N 4.53 1.34 0.00 5.45 0.00 -1.76 -2.44 119.26 126.38 2k32 h ALA 91 Ca -0.40 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2k32 h ALA 91 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2k32 h ALA 91 CO 0.42 -0.21 0.00 -1.13 0.00 0.00 0.00 179.25 178.32 2k32 n SER 92 N -3.19 0.23 0.00 0.00 3.41 -1.26 -4.23 113.62 108.59 2k32 n SER 92 Ca -0.01 -1.03 0.11 0.00 -0.26 0.00 0.00 58.87 57.67 2k32 n SER 92 Cb 0.26 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.10 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 -0.02 0.04 0.00 6.66 -1.04 -0.92 -4.71 114.28 114.29 2k32 n THR 93 Ca 0.00 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 2k32 n THR 93 Cb 0.24 0.42 0.00 0.00 -1.82 0.00 0.00 70.33 69.17 2k32 n THR 93 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2k32 n THR 94 N -1.92 0.00 -1.92 12.58 -1.04 -1.23 -4.93 114.28 115.82 2k32 n THR 94 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2k32 n THR 94 Cb 0.45 -0.55 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 2k32 n THR 94 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2k32 n GLU 95 N -1.73 -5.34 -0.11 -2.82 1.02 -1.26 -5.02 120.64 105.39 2k32 n GLU 95 Ca 0.00 3.84 -0.14 0.00 -0.02 0.00 0.00 57.16 60.84 2k32 n GLU 95 Cb 0.33 -4.20 -0.14 0.00 -0.02 0.00 0.00 31.44 27.42 2k32 n GLU 95 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2k32 n LEU 96 N 0.89 1.41 0.00 -4.62 4.77 -1.06 -4.65 117.00 113.74 2k32 n LEU 96 Ca 0.00 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 2k32 n LEU 96 Cb 0.00 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2k32 n LEU 96 CO 0.00 0.70 0.00 0.55 -1.33 0.00 0.00 177.39 177.31 2k32 n VAL 97 N -3.00 0.00 -5.10 4.08 3.14 -1.26 -0.59 118.33 115.60 2k32 n VAL 97 Ca -0.38 0.00 -0.32 0.00 -2.96 0.00 0.00 64.34 60.68 2k32 n VAL 97 Cb 1.08 0.00 -0.15 0.00 -1.06 0.00 0.00 33.84 33.71 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 2.33 -0.13 1.45 1.04 -1.26 -0.55 118.95 119.82 2k32 s ARG 98 Ca 0.00 -0.81 0.02 0.00 -1.04 0.00 0.00 55.73 53.90 2k32 s ARG 98 Cb 0.00 -2.21 0.00 0.00 -2.04 0.00 0.00 34.95 30.70 2k32 s ARG 98 CO 0.00 0.58 -0.19 0.08 -0.04 0.00 0.00 175.30 175.73 2k32 s VAL 99 N -0.65 2.37 -0.06 4.99 1.01 0.54 -0.89 120.40 127.71 2k32 s VAL 99 Ca 0.10 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.17 2k32 s VAL 99 Cb -0.10 -1.96 0.04 0.00 0.00 0.00 0.00 36.38 34.35 2k32 s VAL 99 CO -0.00 0.54 0.12 0.28 0.00 0.00 0.00 175.10 176.04 2k32 s THR 100 N 0.63 -0.06 -0.05 3.92 -1.32 0.31 -0.98 115.64 118.08 2k32 s THR 100 Ca -0.10 0.20 -0.30 0.00 -1.21 0.00 0.00 61.69 60.28 2k32 s THR 100 Cb -0.16 -0.21 -0.03 0.00 -1.51 0.00 0.00 72.50 70.59 2k32 s THR 100 CO 0.03 0.08 1.14 0.21 -2.21 0.00 0.00 174.62 173.87 2k32 s ASN 101 N 1.23 7.12 -0.03 8.08 3.84 -1.26 -0.48 114.94 133.44 2k32 s ASN 101 Ca -0.08 1.76 -0.14 0.00 0.21 0.00 0.00 52.86 54.60 2k32 s ASN 101 Cb -0.12 -2.56 -0.08 0.00 -0.55 0.00 0.00 41.25 37.94 2k32 s ASN 101 CO -0.05 -0.52 0.65 -0.07 -2.79 0.00 0.00 177.10 174.32 2k32 h LEU 102 N 7.91 -0.43 -8.21 3.21 3.38 -1.94 -3.48 115.31 115.75 2k32 h LEU 102 Ca -0.35 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.52 2k32 h LEU 102 Cb 1.17 0.11 -0.15 0.00 0.09 0.00 0.00 40.66 41.88 2k32 h LEU 102 CO 0.86 -0.07 -0.68 0.20 0.09 0.00 0.00 178.44 178.84 2k32 s ASN 103 N -4.52 0.46 0.00 -0.43 -0.87 -1.26 -5.08 114.94 103.24 2k32 s ASN 103 Ca -0.07 -0.96 0.28 0.00 -1.57 0.00 0.00 52.86 50.54 2k32 s ASN 103 Cb 0.01 0.20 1.01 0.00 -0.02 0.00 0.00 41.25 42.44 2k32 s ASN 103 CO 0.22 -0.58 1.73 -0.81 -2.57 0.00 0.00 177.10 175.10 2k32 n PRO 104 N 0.22 0.51 0.20 -0.60 -0.04 -1.26 -3.47 135.00 130.56 2k32 n PRO 104 Ca -0.15 -0.21 0.05 0.00 -0.04 0.00 0.00 63.50 63.16 2k32 n PRO 104 Cb 0.61 -1.50 0.43 0.00 -0.04 0.00 0.00 33.50 33.00 2k32 n PRO 104 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 2k32 h ILE 105 N 0.52 1.02 0.00 0.52 3.07 -1.93 -1.57 117.51 119.14 2k32 h ILE 105 Ca 0.00 -1.17 0.00 0.00 1.55 0.00 0.00 64.86 65.24 2k32 h ILE 105 Cb 0.43 1.67 0.00 0.00 -0.27 0.00 0.00 36.82 38.65 2k32 h ILE 105 CO 0.00 0.31 0.00 -1.22 -1.05 0.00 0.00 178.15 176.19 2k32 n TYR 106 N -3.86 0.69 -1.28 0.16 4.01 -1.23 -3.99 117.16 111.67 2k32 n TYR 106 Ca -0.01 0.23 0.08 0.00 -0.16 0.00 0.00 57.90 58.04 2k32 n TYR 106 Cb 0.39 -0.87 0.16 0.00 -0.31 0.00 0.00 39.34 38.71 2k32 n TYR 106 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2k32 n ALA 107 N -1.72 2.69 0.00 -0.72 0.00 -0.71 -4.97 120.51 115.09 2k32 n ALA 107 Ca 0.05 -2.79 0.00 0.00 0.00 0.00 0.00 53.44 50.69 2k32 n ALA 107 Cb 0.33 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.40 2k32 n ALA 107 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2k32 n ASP 108 N -1.27 0.00 -0.21 0.00 2.03 -1.16 -4.99 116.55 110.95 2k32 n ASP 108 Ca 0.16 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.39 2k32 n ASP 108 Cb 0.66 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 41.09 2k32 n ASP 108 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2k32 h GLY 109 N 0.00 1.00 0.00 0.27 0.00 -1.53 -3.47 103.07 99.34 2k32 h GLY 109 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 46.72 2k32 h GLY 109 CO 0.00 0.57 0.00 -1.26 0.00 0.00 0.00 176.54 175.85 2k32 n SER 110 N -4.39 0.00 -3.66 0.19 2.88 -1.26 -4.71 113.62 102.67 2k32 n SER 110 Ca 0.03 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.48 2k32 n SER 110 Cb 0.22 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.66 2k32 n SER 110 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2k32 s HIS 111 N 0.00 -0.31 0.22 0.66 -3.43 -1.26 -4.90 115.29 106.27 2k32 s HIS 111 Ca 0.00 -0.03 -0.01 0.00 -0.80 0.00 0.00 55.06 54.22 2k32 s HIS 111 Cb 0.00 0.58 0.20 0.00 -1.43 0.00 0.00 32.58 31.93 2k32 s HIS 111 CO 0.00 -1.01 1.57 1.12 -2.00 0.00 0.00 174.74 174.42 2k32 h HIS 112 N 2.04 0.65 -3.09 0.38 2.07 -2.04 -3.47 115.15 111.69 2k32 h HIS 112 Ca -0.27 -0.20 -0.02 0.00 -2.85 0.00 0.00 60.37 57.02 2k32 h HIS 112 Cb 1.28 -0.13 -0.12 0.00 2.57 0.00 0.00 27.41 31.00 2k32 h HIS 112 CO 0.33 0.89 0.15 -1.58 -3.07 0.00 0.00 177.93 174.65 2k32 s HIS 113 N -4.16 -0.45 0.89 6.12 2.46 -1.26 -5.18 115.29 113.72 2k32 s HIS 113 Ca -0.07 0.20 -0.10 0.00 0.47 0.00 0.00 55.06 55.56 2k32 s HIS 113 Cb 0.12 0.49 0.13 0.00 -0.13 0.00 0.00 32.58 33.20 2k32 s HIS 113 CO 0.83 -0.83 1.13 -1.58 -2.47 0.00 0.00 174.74 171.82 2k32 s HIS 114 N -3.77 1.82 0.19 3.88 2.46 -1.26 -5.07 115.29 113.54 2k32 s HIS 114 Ca 0.02 1.72 -0.09 0.00 0.47 0.00 0.00 55.06 57.19 2k32 s HIS 114 Cb -0.01 -3.27 -0.01 0.00 -0.13 0.00 0.00 32.58 29.16 2k32 s HIS 114 CO -0.12 -2.62 0.31 -3.38 -2.47 0.00 0.00 174.74 166.46 2k32 s HIS 115 N -2.70 0.49 0.00 3.88 -3.43 -1.26 -5.20 115.29 107.06 2k32 s HIS 115 Ca 0.66 -0.83 0.00 0.00 -0.80 0.00 0.00 55.06 54.08 2k32 s HIS 115 Cb -0.22 -0.07 0.00 0.00 -1.43 0.00 0.00 32.58 30.87 2k32 s HIS 115 CO 0.58 -0.77 0.00 0.72 -2.00 0.00 0.00 174.74 173.27