#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 1.15 -0.48 5.18 1.01 -0.01 -4.99 120.40 122.27 2k32 s VAL 2 Ca 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 61.98 60.75 2k32 s VAL 2 Cb 0.00 -1.08 0.13 0.00 0.00 0.00 0.00 36.38 35.43 2k32 s VAL 2 CO 0.00 -0.12 0.29 -0.63 0.00 0.00 0.00 175.10 174.64 2k32 s ILE 3 N -1.09 3.51 0.46 2.22 1.09 -1.26 -0.55 121.20 125.59 2k32 s ILE 3 Ca 0.00 -2.27 -0.23 0.00 -1.10 0.00 0.00 60.65 57.05 2k32 s ILE 3 Cb -0.09 -3.37 -0.07 0.00 -1.06 0.00 0.00 42.46 37.87 2k32 s ILE 3 CO 0.02 -0.75 1.19 -0.51 -0.10 0.00 0.00 174.94 174.78 2k32 s ILE 4 N 0.84 3.00 0.04 2.92 -1.16 0.48 -4.93 121.20 122.40 2k32 s ILE 4 Ca 0.10 0.76 -0.07 0.00 -0.51 0.00 0.00 60.65 60.94 2k32 s ILE 4 Cb -0.22 -3.39 -0.00 0.00 0.61 0.00 0.00 42.46 39.45 2k32 s ILE 4 CO -0.04 0.00 0.14 -0.54 -2.81 0.00 0.00 174.94 171.69 2k32 s LYS 5 N -2.67 0.63 0.75 3.50 1.02 -1.26 -2.25 119.74 119.46 2k32 s LYS 5 Ca 0.63 -0.70 -0.11 0.00 0.02 0.00 0.00 55.97 55.81 2k32 s LYS 5 Cb -0.30 0.25 0.04 0.00 -0.52 0.00 0.00 37.83 37.30 2k32 s LYS 5 CO 0.37 -0.17 1.08 -1.25 -0.92 0.00 0.00 175.35 174.45 2k32 s PRO 6 N -2.58 2.51 0.00 -1.68 0.04 -1.23 -4.95 135.00 127.10 2k32 s PRO 6 Ca -0.05 0.84 0.20 0.00 0.04 0.00 0.00 61.00 62.03 2k32 s PRO 6 Cb -0.01 -1.95 0.23 0.00 0.04 0.00 0.00 34.50 32.80 2k32 s PRO 6 CO -0.04 -1.37 1.19 0.00 0.04 0.00 0.00 177.00 176.81 2k32 n GLN 7 N -3.30 1.95 -4.20 4.56 0.00 -1.26 -4.36 117.38 110.77 2k32 n GLN 7 Ca 0.07 -1.83 -0.12 0.00 0.00 0.00 0.00 57.00 55.13 2k32 n GLN 7 Cb 0.55 -1.40 -0.10 0.00 0.00 0.00 0.00 30.24 29.28 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 -1.55 0.04 0.01 -0.39 -7.23 -1.26 -4.94 120.40 105.07 2k32 s VAL 8 Ca 0.26 -1.99 -0.05 0.00 -1.81 0.00 0.00 61.98 58.40 2k32 s VAL 8 Cb 0.18 -2.43 -0.05 0.00 0.56 0.00 0.00 36.38 34.64 2k32 s VAL 8 CO 0.26 -0.07 0.24 -0.55 -0.31 0.00 0.00 175.10 174.67 2k32 s SER 9 N -3.15 6.45 0.00 4.85 0.15 -1.26 -3.03 113.70 117.71 2k32 s SER 9 Ca 0.37 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.51 2k32 s SER 9 Cb 0.07 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.32 2k32 s SER 9 CO 0.10 0.25 0.00 0.61 1.20 0.00 0.00 173.24 175.41 2k32 n GLY 10 N 1.04 -0.53 3.05 9.45 0.00 -0.39 -4.52 105.19 113.27 2k32 n GLY 10 Ca -0.11 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.00 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 -3.81 0.56 0.49 1.61 -7.23 -0.36 -0.73 120.40 110.93 2k32 s VAL 11 Ca 0.00 -0.87 -0.23 0.00 -1.81 0.00 0.00 61.98 59.07 2k32 s VAL 11 Cb 0.00 -0.59 -0.07 0.00 0.56 0.00 0.00 36.38 36.29 2k32 s VAL 11 CO 0.00 -0.23 1.34 -0.63 -0.31 0.00 0.00 175.10 175.27 2k32 s ILE 12 N -1.03 2.30 0.00 -0.62 -1.09 -0.54 -0.41 121.20 119.80 2k32 s ILE 12 Ca -0.06 0.24 0.00 0.00 -2.23 0.00 0.00 60.65 58.60 2k32 s ILE 12 Cb -0.08 -3.13 0.00 0.00 -1.58 0.00 0.00 42.46 37.67 2k32 s ILE 12 CO 0.00 0.01 0.00 0.52 -1.23 0.00 0.00 174.94 174.25 2k32 n VAL 13 N -0.56 0.00 -3.80 2.92 0.31 0.68 -0.91 118.33 116.98 2k32 n VAL 13 Ca 0.08 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.31 2k32 n VAL 13 Cb 0.44 -0.61 -0.06 0.00 -0.91 0.00 0.00 33.84 32.70 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 -3.28 0.02 -0.40 4.52 3.84 -1.22 -4.88 114.94 113.55 2k32 s ASN 14 Ca 0.00 -0.57 0.02 0.00 0.21 0.00 0.00 52.86 52.53 2k32 s ASN 14 Cb 0.00 0.38 0.12 0.00 -0.55 0.00 0.00 41.25 41.20 2k32 s ASN 14 CO 0.00 -0.76 0.17 -0.54 -2.79 0.00 0.00 177.10 173.17 2k32 s LYS 15 N -3.85 1.34 0.09 0.43 -0.14 -1.26 -2.33 119.74 114.02 2k32 s LYS 15 Ca 0.05 -1.89 -0.13 0.00 -1.36 0.00 0.00 55.97 52.63 2k32 s LYS 15 Cb 0.04 -2.65 -0.19 0.00 -1.68 0.00 0.00 37.83 33.35 2k32 s LYS 15 CO -0.11 -1.06 1.26 -0.07 -0.76 0.00 0.00 175.35 174.60 2k32 h LEU 16 N 7.18 0.94-10.82 3.17 -0.00 -1.27 -3.46 115.31 111.06 2k32 h LEU 16 Ca -0.06 -0.67 -0.44 0.00 -0.00 0.00 0.00 57.88 56.71 2k32 h LEU 16 Cb 0.96 -0.28 0.18 0.00 -0.00 0.00 0.00 40.66 41.52 2k32 h LEU 16 CO 0.53 1.48 0.39 0.72 -0.00 0.00 0.00 178.44 181.55 2k32 s PHE 17 N -3.58 1.11 -0.04 1.13 -0.71 -1.19 -4.95 117.98 109.75 2k32 s PHE 17 Ca -0.10 0.23 0.03 0.00 -1.04 0.00 0.00 56.93 56.06 2k32 s PHE 17 Cb 0.08 -4.17 0.00 0.00 -1.21 0.00 0.00 43.02 37.72 2k32 s PHE 17 CO 0.91 -3.03 -0.14 0.15 -1.34 0.00 0.00 175.22 171.78 2k32 s LYS 18 N -5.91 1.50 -0.21 1.99 -0.14 -1.26 -5.11 119.74 110.61 2k32 s LYS 18 Ca 0.76 -0.48 -0.32 0.00 -1.36 0.00 0.00 55.97 54.58 2k32 s LYS 18 Cb -0.03 -1.32 -0.09 0.00 -1.68 0.00 0.00 37.83 34.72 2k32 s LYS 18 CO 0.54 0.17 2.12 0.00 -0.76 0.00 0.00 175.35 177.42 2k32 n ALA 19 N 3.30 1.35 0.00 5.17 0.00 -1.26 -2.28 120.51 126.79 2k32 n ALA 19 Ca -0.19 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2k32 n ALA 19 Cb 0.53 -2.70 0.00 0.00 0.00 0.00 0.00 19.45 17.29 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 5.61 0.92 0.30 0.00 0.00 -0.90 -4.85 105.19 106.27 2k32 n GLY 20 Ca 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.31 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 0.04 -4.90 1.61 -0.08 -0.97 -4.63 116.55 107.63 2k32 n ASP 21 Ca 0.00 -1.06 -0.28 0.00 -1.51 0.00 0.00 54.79 51.94 2k32 n ASP 21 Cb 0.00 -0.07 -0.01 0.00 2.34 0.00 0.00 41.12 43.38 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 -3.00 3.61 -0.02 -0.67 -0.14 -1.26 -1.46 119.74 116.80 2k32 s LYS 22 Ca 0.06 0.31 0.01 0.00 -1.36 0.00 0.00 55.97 54.99 2k32 s LYS 22 Cb -0.00 -2.36 0.01 0.00 -1.68 0.00 0.00 37.83 33.80 2k32 s LYS 22 CO 0.04 -0.18 -0.02 0.14 -0.76 0.00 0.00 175.35 174.56 2k32 s VAL 23 N -2.67 0.28 0.72 3.17 -7.23 -0.29 -4.87 120.40 109.52 2k32 s VAL 23 Ca 0.49 -0.05 -0.12 0.00 -1.81 0.00 0.00 61.98 60.50 2k32 s VAL 23 Cb -0.10 -0.31 0.03 0.00 0.56 0.00 0.00 36.38 36.56 2k32 s VAL 23 CO 0.42 0.13 1.09 -0.75 -0.31 0.00 0.00 175.10 175.68 2k32 s LYS 24 N 0.55 2.54 -0.36 4.82 2.36 -1.26 -1.41 119.74 126.99 2k32 s LYS 24 Ca -0.06 1.19 -0.18 0.00 -2.55 0.00 0.00 55.97 54.37 2k32 s LYS 24 Cb -0.09 -1.93 -0.19 0.00 -1.05 0.00 0.00 37.83 34.57 2k32 s LYS 24 CO -0.01 -1.42 1.44 1.17 1.55 0.00 0.00 175.35 178.08 2k32 n LYS 25 N -3.13 0.03 0.00 4.03 3.00 -1.26 -1.74 118.16 119.10 2k32 n LYS 25 Ca 0.09 -0.84 0.00 0.00 -0.00 0.00 0.00 58.31 57.56 2k32 n LYS 25 Cb 0.53 -2.39 0.00 0.00 0.00 0.00 0.00 35.03 33.16 2k32 n LYS 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2k32 n GLY 26 N 5.00 1.31 3.67 3.14 0.00 -1.24 -4.82 105.19 112.23 2k32 n GLY 26 Ca 0.27 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.29 1.89 -2.10 1.61 10.64 -0.71 -4.30 117.38 123.12 2k32 n GLN 27 Ca 0.00 0.66 -0.41 0.00 -1.83 0.00 0.00 57.00 55.42 2k32 n GLN 27 Cb 0.00 -2.19 -0.02 0.00 -0.86 0.00 0.00 30.24 27.17 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 -1.09 2.73 0.00 -0.39 2.01 -1.26 -0.91 115.64 116.73 2k32 s THR 28 Ca 0.57 0.70 0.00 0.00 0.31 0.00 0.00 61.69 63.27 2k32 s THR 28 Cb -0.60 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 68.46 2k32 s THR 28 CO 0.61 0.15 0.00 0.18 -0.69 0.00 0.00 174.62 174.88 2k32 n LEU 29 N 1.17 1.41 -4.10 4.42 4.77 0.71 -4.09 117.00 121.30 2k32 n LEU 29 Ca 0.02 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.91 2k32 n LEU 29 Cb 0.42 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.41 2k32 n LEU 29 CO 0.59 0.22 -0.27 -0.36 -1.33 0.00 0.00 177.39 176.25 2k32 s PHE 30 N -1.97 0.70 0.02 -1.77 0.40 -1.01 -0.86 117.98 113.48 2k32 s PHE 30 Ca 0.00 -1.11 0.05 0.00 -0.60 0.00 0.00 56.93 55.27 2k32 s PHE 30 Cb 0.00 -0.39 -0.02 0.00 0.51 0.00 0.00 43.02 43.13 2k32 s PHE 30 CO 0.00 -0.52 -0.15 0.42 0.70 0.00 0.00 175.22 175.68 2k32 s ILE 31 N -4.00 1.15 0.12 0.64 1.01 -0.98 -1.09 121.20 118.05 2k32 s ILE 31 Ca 0.19 -0.85 0.07 0.00 0.00 0.00 0.00 60.65 60.06 2k32 s ILE 31 Cb 0.07 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.50 2k32 s ILE 31 CO -0.02 0.15 -0.16 -0.63 0.00 0.00 0.00 174.94 174.28 2k32 s ILE 32 N -0.63 1.45 -0.17 2.92 1.01 0.36 -0.23 121.20 125.91 2k32 s ILE 32 Ca 0.04 -1.66 -0.00 0.00 0.00 0.00 0.00 60.65 59.02 2k32 s ILE 32 Cb -0.07 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.89 2k32 s ILE 32 CO 0.01 -0.31 -0.15 -0.70 0.00 0.00 0.00 174.94 173.79 2k32 s GLU 33 N -2.42 3.17 0.00 2.79 2.12 0.45 -1.61 118.70 123.20 2k32 s GLU 33 Ca 0.08 -0.76 0.07 0.00 0.36 0.00 0.00 54.97 54.73 2k32 s GLU 33 Cb -0.07 -2.67 0.42 0.00 0.26 0.00 0.00 34.13 32.08 2k32 s GLU 33 CO 0.04 -0.08 0.99 1.04 -0.54 0.00 0.00 175.26 176.71 2k32 n GLN 34 N 4.33 0.66 -2.75 4.30 6.02 -0.57 -1.23 117.38 128.14 2k32 n GLN 34 Ca -0.19 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 56.78 2k32 n GLN 34 Cb 0.51 -1.17 -0.02 0.00 1.02 0.00 0.00 30.24 30.59 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 -0.67 -5.46 0.00 1.08 2.03 -1.26 -4.76 116.55 107.51 2k32 n ASP 35 Ca 0.05 1.29 0.00 0.00 0.52 0.00 0.00 54.79 56.65 2k32 n ASP 35 Cb 0.02 -4.76 0.00 0.00 -0.72 0.00 0.00 41.12 35.67 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 1.19 0.00 -0.31 -0.67 10.64 -1.26 -3.99 117.38 122.97 2k32 n GLN 36 Ca -0.14 0.00 0.12 0.00 -1.83 0.00 0.00 57.00 55.15 2k32 n GLN 36 Cb 0.26 -1.26 0.34 0.00 -0.86 0.00 0.00 30.24 28.72 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 1.46 1.75 -0.00 2.61 0.00 -2.03 -1.99 119.26 121.06 2k32 h ALA 37 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2k32 h ALA 37 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2k32 h ALA 37 CO 0.00 -0.04 -0.16 0.43 0.00 0.00 0.00 179.25 179.47 2k32 n SER 38 N -4.63 0.18 -0.15 0.00 7.64 -1.26 -4.46 113.62 110.95 2k32 n SER 38 Ca 0.20 0.19 -0.09 0.00 1.01 0.00 0.00 58.87 60.18 2k32 n SER 38 Cb 0.50 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 2k32 n SER 38 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2k32 h LYS 39 N 0.03 0.66 -0.74 1.43 3.64 -1.66 0.31 116.57 120.24 2k32 h LYS 39 Ca 0.00 -0.11 -0.04 0.00 -1.27 0.00 0.00 60.65 59.23 2k32 h LYS 39 Cb 0.49 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 2k32 h LYS 39 CO 0.00 0.59 0.31 0.22 -2.27 0.00 0.00 179.45 178.31 2k32 h ASP 40 N 0.57 1.00 -0.06 4.20 3.58 -1.78 -2.93 116.42 121.01 2k32 h ASP 40 Ca 0.15 -0.16 -0.25 0.00 0.42 0.00 0.00 57.03 57.19 2k32 h ASP 40 Cb 0.18 -0.26 0.02 0.00 1.72 0.00 0.00 39.33 40.98 2k32 h ASP 40 CO -0.01 0.89 -0.92 0.15 -2.88 0.00 0.00 179.24 176.46 2k32 h PHE 41 N 1.05 1.05 -0.20 0.28 3.57 -1.68 -3.29 116.94 117.73 2k32 h PHE 41 Ca 0.25 -0.52 -0.05 0.00 3.53 0.00 0.00 57.97 61.18 2k32 h PHE 41 Cb 0.19 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 2k32 h PHE 41 CO 0.01 1.36 -0.06 -0.97 -2.23 0.00 0.00 178.31 176.42 2k32 h ASN 42 N 0.46 0.40 0.17 0.41 -1.24 -1.02 -3.35 115.58 111.41 2k32 h ASN 42 Ca -0.09 -0.38 -0.03 0.00 0.71 0.00 0.00 56.30 56.51 2k32 h ASN 42 Cb 1.56 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 40.50 2k32 h ASN 42 CO 0.18 0.68 -0.14 0.03 -1.29 0.00 0.00 177.43 176.90 2k32 h ARG 43 N 0.11 0.00 -0.09 6.67 3.08 -1.58 -2.71 114.38 119.86 2k32 h ARG 43 Ca 0.05 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.13 2k32 h ARG 43 Cb 0.51 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 2k32 h ARG 43 CO 0.02 0.14 0.15 0.77 -1.07 0.00 0.00 179.97 179.99 2k32 h SER 44 N 0.00 0.00 1.00 7.04 0.02 -1.69 -1.70 113.55 118.22 2k32 h SER 44 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2k32 h SER 44 Cb 0.26 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 2k32 h SER 44 CO 0.02 0.00 -0.02 0.11 -1.14 0.00 0.00 176.83 175.80 2k32 h LYS 45 N 0.00 0.00 -4.04 3.45 1.57 -1.73 -3.41 116.57 112.41 2k32 h LYS 45 Ca 0.04 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.16 2k32 h LYS 45 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2k32 h LYS 45 CO -0.00 0.02 2.87 0.00 -0.57 0.00 0.00 179.45 181.77 2k32 n ALA 46 N -2.10 4.88 -2.54 3.86 0.00 -0.64 -4.55 120.51 119.42 2k32 n ALA 46 Ca 0.00 -3.52 -0.16 0.00 0.00 0.00 0.00 53.44 49.76 2k32 n ALA 46 Cb 0.31 -3.52 -0.11 0.00 0.00 0.00 0.00 19.45 16.13 2k32 n ALA 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k32 s LEU 47 N 1.52 2.37 0.00 0.00 1.43 -1.26 -4.59 118.68 118.15 2k32 s LEU 47 Ca 0.52 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 2k32 s LEU 47 Cb 0.14 -0.39 0.00 0.00 0.03 0.00 0.00 46.19 45.98 2k32 s LEU 47 CO -0.01 -0.20 0.00 0.49 0.23 0.00 0.00 176.35 176.86 2k32 n PHE 48 N 0.72 0.00 0.27 0.29 3.72 -1.26 -0.70 117.46 120.50 2k32 n PHE 48 Ca -0.17 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.38 2k32 n PHE 48 Cb 0.57 0.00 0.63 0.00 -0.94 0.00 0.00 39.48 39.73 2k32 n PHE 48 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2k32 h SER 49 N 0.00 0.00 0.02 4.37 4.64 -1.98 -2.91 113.55 117.68 2k32 h SER 49 Ca 0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 2k32 h SER 49 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 2k32 h SER 49 CO 0.00 0.05 -2.39 0.00 -0.87 0.00 0.00 176.83 173.62 2k32 n GLN 50 N -3.16 0.67 0.30 4.77 6.02 0.13 -4.17 117.38 121.94 2k32 n GLN 50 Ca 0.01 0.08 0.19 0.00 -0.01 0.00 0.00 57.00 57.26 2k32 n GLN 50 Cb 0.34 -1.54 0.93 0.00 1.02 0.00 0.00 30.24 30.99 2k32 n GLN 50 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2k32 h SER 51 N 0.00 0.00 0.16 1.08 4.64 -1.38 -1.78 113.55 116.28 2k32 h SER 51 Ca -0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 2k32 h SER 51 Cb 2.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.18 2k32 h SER 51 CO -0.02 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2k32 n ALA 52 N -2.12 1.47 0.00 5.18 0.00 -1.10 -4.89 120.51 119.05 2k32 n ALA 52 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2k32 n ALA 52 Cb 0.19 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.34 0.00 -3.89 0.00 5.41 -0.67 -5.13 119.36 113.74 2k32 n ILE 53 Ca 0.03 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.65 2k32 n ILE 53 Cb 0.06 0.00 -0.15 0.00 -0.71 0.00 0.00 39.64 38.85 2k32 n ILE 53 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 2k32 s SER 54 N 0.00 0.12 0.00 4.38 0.01 -1.19 -4.93 113.70 112.08 2k32 s SER 54 Ca 0.00 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.25 2k32 s SER 54 Cb 0.00 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.19 2k32 s SER 54 CO 0.00 -0.02 0.69 0.00 0.41 0.00 0.00 173.24 174.32 2k32 n GLN 55 N 3.33 0.00 0.00 12.44 6.02 -1.26 -1.13 117.38 136.78 2k32 n GLN 55 Ca -0.16 0.21 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 2k32 n GLN 55 Cb 0.57 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.32 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 -1.19 3.20 -0.06 -1.09 2.85 -1.26 -4.74 118.16 115.87 2k32 n LYS 56 Ca 0.00 -0.16 -0.07 0.00 -1.05 0.00 0.00 58.31 57.03 2k32 n LYS 56 Cb 0.01 -0.60 -0.08 0.00 -0.65 0.00 0.00 35.03 33.71 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 -0.50 1.58 0.00 -1.58 4.71 -0.40 -4.80 120.64 119.64 2k32 n GLU 57 Ca 0.00 0.02 0.05 0.00 -0.01 0.00 0.00 57.16 57.22 2k32 n GLU 57 Cb 0.02 -1.28 0.25 0.00 -1.01 0.00 0.00 31.44 29.42 2k32 n GLU 57 CO 0.00 0.00 0.00 2.48 0.09 0.00 0.00 177.13 179.70 2k32 n TYR 58 N -2.58 0.00 0.32 -0.32 4.11 -0.29 -3.45 117.16 114.95 2k32 n TYR 58 Ca -0.20 0.00 0.19 0.00 -0.00 0.00 0.00 57.90 57.88 2k32 n TYR 58 Cb 0.83 -0.16 1.05 0.00 -0.00 0.00 0.00 39.34 41.06 2k32 n TYR 58 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.86 177.24 2k32 h ASP 59 N 0.00 0.00 0.21 9.48 2.03 -1.87 -0.78 116.42 125.49 2k32 h ASP 59 Ca 0.00 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2k32 h ASP 59 Cb 0.05 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.55 2k32 h ASP 59 CO 0.00 0.00 -0.01 0.77 -1.03 0.00 0.00 179.24 178.97 2k32 h SER 60 N 0.00 0.00 0.00 4.15 4.64 -1.89 -2.78 113.55 117.67 2k32 h SER 60 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2k32 h SER 60 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2k32 h SER 60 CO 0.00 0.01 -1.87 -1.20 -0.87 0.00 0.00 176.83 172.89 2k32 n SER 61 N -3.16 0.72 0.21 4.97 7.64 -0.32 -4.51 113.62 119.18 2k32 n SER 61 Ca -0.02 0.00 0.10 0.00 1.01 0.00 0.00 58.87 59.96 2k32 n SER 61 Cb 0.12 1.81 0.29 0.00 -1.01 0.00 0.00 64.21 65.43 2k32 n SER 61 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2k32 h LEU 62 N 0.00 0.00 -8.61 -3.43 3.38 -1.30 -3.48 115.31 101.87 2k32 h LEU 62 Ca -0.02 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.67 2k32 h LEU 62 Cb 0.92 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.54 2k32 h LEU 62 CO 0.00 0.19 -0.46 0.00 0.09 0.00 0.00 178.44 178.26 2k32 s ALA 63 N -3.34 1.10 -0.01 1.53 0.00 -1.15 -5.10 121.76 114.79 2k32 s ALA 63 Ca 0.04 -1.66 -0.01 0.00 0.00 0.00 0.00 51.96 50.33 2k32 s ALA 63 Cb 0.08 1.34 0.01 0.00 0.00 0.00 0.00 23.12 24.54 2k32 s ALA 63 CO 0.66 -0.67 0.02 0.99 0.00 0.00 0.00 175.76 176.76 2k32 s THR 64 N -3.81 -0.01 -1.25 0.00 2.01 -1.26 -4.85 115.64 106.46 2k32 s THR 64 Ca 0.36 0.04 -0.14 0.00 0.31 0.00 0.00 61.69 62.26 2k32 s THR 64 Cb 0.04 -0.05 0.13 0.00 0.01 0.00 0.00 72.50 72.64 2k32 s THR 64 CO 0.17 0.02 0.44 0.18 -0.69 0.00 0.00 174.62 174.73 2k32 n LEU 65 N 3.28 -0.86 -2.29 4.42 4.77 -1.26 -0.92 117.00 124.13 2k32 n LEU 65 Ca -0.15 -0.58 -0.07 0.00 -0.03 0.00 0.00 56.01 55.18 2k32 n LEU 65 Cb 0.58 -1.61 -0.01 0.00 -2.33 0.00 0.00 43.42 40.05 2k32 n LEU 65 CO 0.25 0.10 -0.08 -0.90 -1.33 0.00 0.00 177.39 175.43 2k32 n ASP 66 N -2.19 -2.43 -4.93 -1.43 5.68 -1.26 -4.92 116.55 105.07 2k32 n ASP 66 Ca 0.05 0.31 -0.25 0.00 -0.50 0.00 0.00 54.79 54.40 2k32 n ASP 66 Cb 0.49 -2.18 -0.01 0.00 -1.14 0.00 0.00 41.12 38.28 2k32 n ASP 66 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2k32 s HIS 67 N -2.22 3.52 0.06 2.11 3.76 -0.10 -1.51 115.29 120.91 2k32 s HIS 67 Ca 0.00 0.55 0.01 0.00 -0.15 0.00 0.00 55.06 55.48 2k32 s HIS 67 Cb 0.00 -2.09 -0.03 0.00 1.11 0.00 0.00 32.58 31.57 2k32 s HIS 67 CO 0.00 -0.07 -0.06 0.99 -0.85 0.00 0.00 174.74 174.75 2k32 s THR 68 N -2.51 0.48 0.04 1.30 2.01 -0.64 -4.19 115.64 112.13 2k32 s THR 68 Ca 0.43 -1.40 0.08 0.00 0.31 0.00 0.00 61.69 61.12 2k32 s THR 68 Cb -0.10 -0.98 -0.03 0.00 0.01 0.00 0.00 72.50 71.40 2k32 s THR 68 CO 0.40 -0.62 -0.23 -1.61 -0.69 0.00 0.00 174.62 171.87 2k32 s GLU 69 N -2.52 1.59 -0.05 4.92 2.02 -1.26 -0.49 118.70 122.91 2k32 s GLU 69 Ca -0.02 -0.99 0.05 0.00 0.02 0.00 0.00 54.97 54.03 2k32 s GLU 69 Cb -0.03 -1.71 -0.02 0.00 0.10 0.00 0.00 34.13 32.47 2k32 s GLU 69 CO -0.03 0.44 -0.21 0.42 0.02 0.00 0.00 175.26 175.91 2k32 s ILE 70 N -0.77 2.47 0.05 -1.63 1.09 -0.25 -4.94 121.20 117.22 2k32 s ILE 70 Ca 0.09 -0.94 0.03 0.00 -1.10 0.00 0.00 60.65 58.74 2k32 s ILE 70 Cb -0.09 -1.92 -0.03 0.00 -1.06 0.00 0.00 42.46 39.36 2k32 s ILE 70 CO 0.02 0.58 -0.10 -0.54 -0.10 0.00 0.00 174.94 174.79 2k32 s LYS 71 N -0.46 0.64 0.79 2.79 1.02 -1.26 -0.21 119.74 123.05 2k32 s LYS 71 Ca 0.05 -0.85 -0.14 0.00 0.02 0.00 0.00 55.97 55.06 2k32 s LYS 71 Cb -0.12 -0.48 0.07 0.00 -0.52 0.00 0.00 37.83 36.78 2k32 s LYS 71 CO 0.01 0.10 1.22 0.00 -0.92 0.00 0.00 175.35 175.75 2k32 s ALA 72 N -1.41 1.89 0.14 5.17 0.00 -0.08 -4.92 121.76 122.55 2k32 s ALA 72 Ca -0.06 0.89 -0.08 0.00 0.00 0.00 0.00 51.96 52.70 2k32 s ALA 72 Cb -0.10 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.47 2k32 s ALA 72 CO 0.01 -2.22 1.37 -1.00 0.00 0.00 0.00 175.76 173.92 2k32 h PRO 73 N -0.75 0.65 -2.64 0.00 0.13 -1.92 -3.30 132.00 124.17 2k32 h PRO 73 Ca -0.47 -0.52 0.09 0.00 -0.87 0.00 0.00 66.00 64.24 2k32 h PRO 73 Cb 1.30 0.10 -0.09 0.00 0.13 0.00 0.00 31.00 32.44 2k32 h PRO 73 CO 0.47 1.14 0.36 -0.59 -0.23 0.00 0.00 178.00 179.15 2k32 s PHE 74 N -3.74 -0.27 0.20 1.56 -0.12 -1.26 -4.62 117.98 109.73 2k32 s PHE 74 Ca -0.08 -0.02 -0.31 0.00 -0.05 0.00 0.00 56.93 56.46 2k32 s PHE 74 Cb 0.09 0.62 -0.11 0.00 -0.63 0.00 0.00 43.02 43.00 2k32 s PHE 74 CO 0.88 -0.89 1.63 0.16 -0.05 0.00 0.00 175.22 176.95 2k32 s ASP 75 N -2.80 6.48 0.00 1.98 -4.77 -1.26 -4.09 116.67 112.21 2k32 s ASP 75 Ca 0.08 2.77 0.00 0.00 -3.30 0.00 0.00 52.55 52.10 2k32 s ASP 75 Cb -0.02 -2.60 0.00 0.00 -1.09 0.00 0.00 42.92 39.20 2k32 s ASP 75 CO -0.02 -0.89 0.00 0.61 0.70 0.00 0.00 175.17 175.57 2k32 n GLY 76 N 3.55 -0.58 3.45 2.12 0.00 -0.50 -4.44 105.19 108.79 2k32 n GLY 76 Ca 0.14 -0.69 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 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 -3.77 2.43 0.03 2.61 2.01 0.48 -1.14 115.64 118.28 2k32 s THR 77 Ca 0.00 -2.23 0.05 0.00 0.31 0.00 0.00 61.69 59.82 2k32 s THR 77 Cb 0.00 -2.22 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 2k32 s THR 77 CO 0.00 -0.27 -0.15 -0.51 -0.69 0.00 0.00 174.62 173.00 2k32 s ILE 78 N -2.12 1.21 0.44 1.82 2.07 -0.53 -0.46 121.20 123.63 2k32 s ILE 78 Ca 0.26 -0.96 -0.07 0.00 -1.41 0.00 0.00 60.65 58.47 2k32 s ILE 78 Cb -0.06 -1.07 0.11 0.00 0.13 0.00 0.00 42.46 41.56 2k32 s ILE 78 CO 0.13 0.10 0.43 0.61 -1.91 0.00 0.00 174.94 174.30 2k32 n GLY 79 N 2.06 -2.27 3.77 1.50 0.00 -0.32 -2.60 105.19 107.33 2k32 n GLY 79 Ca -0.17 -1.52 -0.38 0.00 0.00 0.00 0.00 46.02 43.95 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 -2.66 6.56 0.68 1.61 1.01 -1.26 -2.11 116.67 120.50 2k32 s ASP 80 Ca 0.27 2.29 -0.16 0.00 0.71 0.00 0.00 52.55 55.65 2k32 s ASP 80 Cb -0.02 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.31 2k32 s ASP 80 CO 0.20 -0.64 1.20 0.00 0.21 0.00 0.00 175.17 176.14 2k32 s ALA 81 N -1.46 2.31 0.00 5.23 0.00 -1.26 -4.60 121.76 121.98 2k32 s ALA 81 Ca 0.57 0.89 0.00 0.00 0.00 0.00 0.00 51.96 53.42 2k32 s ALA 81 Cb -0.29 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2k32 s ALA 81 CO 0.36 -1.57 0.73 1.28 0.00 0.00 0.00 175.76 176.57 2k32 n LEU 82 N -2.30 1.46 -3.87 0.00 4.77 0.18 -4.96 117.00 112.29 2k32 n LEU 82 Ca 0.13 -1.46 -0.09 0.00 -0.03 0.00 0.00 56.01 54.56 2k32 n LEU 82 Cb 0.50 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.51 2k32 n LEU 82 CO 0.47 0.36 -0.11 0.68 -1.33 0.00 0.00 177.39 177.46 2k32 s VAL 83 N -0.47 0.14 0.23 4.08 -7.23 -1.25 -4.89 120.40 111.02 2k32 s VAL 83 Ca 0.00 -1.13 0.02 0.00 -1.81 0.00 0.00 61.98 59.06 2k32 s VAL 83 Cb 0.00 -1.22 -0.05 0.00 0.56 0.00 0.00 36.38 35.67 2k32 s VAL 83 CO 0.00 -0.62 0.06 0.20 -0.31 0.00 0.00 175.10 174.43 2k32 s ASN 84 N -2.64 1.26 -0.48 4.85 0.01 -1.26 -5.05 114.94 111.63 2k32 s ASN 84 Ca 0.02 -1.32 -0.29 0.00 -0.71 0.00 0.00 52.86 50.57 2k32 s ASN 84 Cb 0.03 0.14 -0.09 0.00 0.41 0.00 0.00 41.25 41.74 2k32 s ASN 84 CO -0.09 -0.67 2.38 -0.38 -1.51 0.00 0.00 177.10 176.83 2k32 n ILE 85 N -0.41 0.05 0.00 0.60 -0.00 -1.26 -1.07 119.36 117.27 2k32 n ILE 85 Ca -0.02 -0.55 0.00 0.00 -0.00 0.00 0.00 62.75 62.18 2k32 n ILE 85 Cb 0.65 -2.28 0.00 0.00 -0.00 0.00 0.00 39.64 38.01 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 6.12 0.95 3.67 7.39 0.00 -0.08 -4.97 105.19 118.26 2k32 n GLY 86 Ca 0.40 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 -1.50 6.67 0.27 1.61 1.01 -0.24 -4.66 116.67 119.82 2k32 s ASP 87 Ca 0.00 2.30 -0.30 0.00 0.71 0.00 0.00 52.55 55.26 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 -0.90 1.43 -0.47 0.21 0.00 0.00 175.17 175.45 2k32 s TYR 88 N 3.53 2.99 0.03 4.23 5.04 -1.26 -1.47 117.35 130.44 2k32 s TYR 88 Ca 0.73 1.07 -0.05 0.00 -2.44 0.00 0.00 57.07 56.38 2k32 s TYR 88 Cb -0.35 -3.82 -0.01 0.00 0.35 0.00 0.00 41.96 38.13 2k32 s TYR 88 CO 0.30 -2.62 0.09 0.14 -1.34 0.00 0.00 175.55 172.13 2k32 s VAL 89 N -0.20 0.13 -0.02 3.14 -7.23 0.09 -4.97 120.40 111.33 2k32 s VAL 89 Ca 0.58 -1.04 0.04 0.00 -1.81 0.00 0.00 61.98 59.74 2k32 s VAL 89 Cb -0.42 -0.82 -0.01 0.00 0.56 0.00 0.00 36.38 35.69 2k32 s VAL 89 CO 0.46 -0.58 -0.13 -0.55 -0.31 0.00 0.00 175.10 173.99 2k32 s SER 90 N -2.02 1.60 0.00 4.85 0.15 -1.26 -1.27 113.70 115.75 2k32 s SER 90 Ca -0.06 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2k32 s SER 90 Cb -0.02 -0.30 0.00 0.00 -1.71 0.00 0.00 66.02 63.99 2k32 s SER 90 CO -0.04 0.14 0.69 0.00 1.20 0.00 0.00 173.24 175.23 2k32 n ALA 91 N 2.97 0.00 1.13 5.45 0.00 -1.17 -1.56 120.51 127.33 2k32 n ALA 91 Ca -0.16 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.40 2k32 n ALA 91 Cb 0.55 0.34 0.20 0.00 0.00 0.00 0.00 19.45 20.53 2k32 n ALA 91 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k32 n SER 92 N -2.47 1.64 0.01 0.00 2.88 -1.26 -3.53 113.62 110.90 2k32 n SER 92 Ca 0.00 -1.29 0.11 0.00 -1.33 0.00 0.00 58.87 56.36 2k32 n SER 92 Cb 0.00 0.28 -0.05 0.00 -0.75 0.00 0.00 64.21 63.69 2k32 n SER 92 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2k32 n THR 93 N -0.18 0.09 -3.70 2.46 -1.04 -0.60 -4.90 114.28 106.41 2k32 n THR 93 Ca 0.11 -0.22 -0.17 0.00 -2.04 0.00 0.00 64.05 61.73 2k32 n THR 93 Cb 0.42 0.38 -0.16 0.00 -1.82 0.00 0.00 70.33 69.15 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 -3.20 -0.14 -0.13 12.58 2.01 -0.76 -4.89 115.64 121.11 2k32 s THR 94 Ca 0.03 0.34 -0.05 0.00 0.31 0.00 0.00 61.69 62.31 2k32 s THR 94 Cb 0.15 -0.20 -0.04 0.00 0.01 0.00 0.00 72.50 72.42 2k32 s THR 94 CO 0.84 0.14 0.06 -1.61 -0.69 0.00 0.00 174.62 173.36 2k32 s GLU 95 N 1.90 3.45 -0.22 4.92 2.02 -1.26 -4.57 118.70 124.93 2k32 s GLU 95 Ca 0.00 -0.31 0.08 0.00 0.02 0.00 0.00 54.97 54.77 2k32 s GLU 95 Cb -0.12 -3.05 -0.21 0.00 0.10 0.00 0.00 34.13 30.86 2k32 s GLU 95 CO -0.04 0.58 -0.05 1.28 0.02 0.00 0.00 175.26 177.05 2k32 n LEU 96 N 2.56 1.72 0.00 1.80 4.77 -0.96 -4.65 117.00 122.25 2k32 n LEU 96 Ca -0.18 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 2k32 n LEU 96 Cb 0.54 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2k32 n LEU 96 CO 0.31 0.74 0.00 0.55 -1.33 0.00 0.00 177.39 177.67 2k32 n VAL 97 N -3.07 0.00 -4.08 4.08 3.14 -1.26 -0.64 118.33 116.50 2k32 n VAL 97 Ca -0.39 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 60.68 2k32 n VAL 97 Cb 1.06 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 33.77 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 2.90 -0.05 1.45 1.70 -1.26 -0.39 118.95 121.30 2k32 s ARG 98 Ca 0.00 -0.65 0.05 0.00 -0.47 0.00 0.00 55.73 54.66 2k32 s ARG 98 Cb 0.00 -2.74 -0.01 0.00 -0.57 0.00 0.00 34.95 31.63 2k32 s ARG 98 CO 0.00 0.59 -0.22 0.08 -1.08 0.00 0.00 175.30 174.67 2k32 s VAL 99 N -1.32 1.80 -0.06 4.99 1.01 0.29 -1.17 120.40 125.94 2k32 s VAL 99 Ca 0.27 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2k32 s VAL 99 Cb -0.12 -1.53 0.04 0.00 0.00 0.00 0.00 36.38 34.77 2k32 s VAL 99 CO 0.19 0.51 0.10 0.28 0.00 0.00 0.00 175.10 176.18 2k32 s THR 100 N -0.10 -0.16 0.53 3.92 -1.32 0.39 -0.83 115.64 118.07 2k32 s THR 100 Ca -0.03 0.37 -0.18 0.00 -1.21 0.00 0.00 61.69 60.64 2k32 s THR 100 Cb -0.13 -0.20 -0.07 0.00 -1.51 0.00 0.00 72.50 70.59 2k32 s THR 100 CO 0.03 0.15 1.02 0.21 -2.21 0.00 0.00 174.62 173.82 2k32 s ASN 101 N 2.06 6.32 0.14 8.08 3.84 -1.26 -0.39 114.94 133.73 2k32 s ASN 101 Ca 0.02 1.74 0.02 0.00 0.21 0.00 0.00 52.86 54.85 2k32 s ASN 101 Cb -0.12 -2.53 -0.01 0.00 -0.55 0.00 0.00 41.25 38.04 2k32 s ASN 101 CO -0.04 -0.80 0.07 0.18 -2.79 0.00 0.00 177.10 173.73 2k32 n LEU 102 N -1.50 0.00 -4.53 3.21 4.77 -1.26 -4.89 117.00 112.79 2k32 n LEU 102 Ca 0.08 -1.19 -0.35 0.00 -0.03 0.00 0.00 56.01 54.53 2k32 n LEU 102 Cb 0.53 0.48 0.10 0.00 -2.33 0.00 0.00 43.42 42.20 2k32 n LEU 102 CO 0.44 -0.19 0.27 0.59 -1.33 0.00 0.00 177.39 177.17 2k32 n ASN 103 N -2.09 -0.62 0.00 -1.43 4.13 -1.26 -4.88 115.26 109.11 2k32 n ASN 103 Ca -0.00 0.54 0.06 0.00 1.68 0.00 0.00 54.58 56.86 2k32 n ASN 103 Cb 0.23 -1.31 0.38 0.00 -1.54 0.00 0.00 39.78 37.54 2k32 n ASN 103 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2k32 n PRO 104 N -1.75 0.91 0.00 3.52 -0.04 -1.26 -3.73 135.00 132.65 2k32 n PRO 104 Ca 0.11 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.58 2k32 n PRO 104 Cb 0.51 -1.22 0.09 0.00 -0.04 0.00 0.00 33.50 32.83 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 -0.72 0.19 0.08 0.52 -5.35 -1.26 -2.07 119.36 110.75 2k32 n ILE 105 Ca 0.10 0.05 0.01 0.00 -0.27 0.00 0.00 62.75 62.63 2k32 n ILE 105 Cb 0.04 -1.00 0.01 0.00 -1.74 0.00 0.00 39.64 36.95 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 -1.05 0.00 -1.27 4.28 4.01 -1.24 -4.78 117.16 117.10 2k32 n TYR 106 Ca 0.02 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.46 2k32 n TYR 106 Cb 0.01 0.00 0.24 0.00 -0.31 0.00 0.00 39.34 39.28 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 -0.21 0.93 -0.30 -0.72 0.00 -0.88 -4.84 121.76 115.73 2k32 s ALA 107 Ca 0.02 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 50.59 2k32 s ALA 107 Cb 0.02 -2.82 -0.07 0.00 0.00 0.00 0.00 23.12 20.24 2k32 s ALA 107 CO 0.03 -3.45 2.26 -3.47 0.00 0.00 0.00 175.76 171.13 2k32 n ASP 108 N -4.62 2.81 0.00 0.00 2.03 -1.26 -4.75 116.55 110.75 2k32 n ASP 108 Ca 0.15 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.59 2k32 n ASP 108 Cb 0.60 -1.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 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 6.00 -1.11 2.80 0.27 0.00 -1.26 -5.16 105.19 106.73 2k32 n GLY 109 Ca 0.34 -1.09 -0.16 0.00 0.00 0.00 0.00 46.02 45.12 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 0.21 0.11 1.61 0.01 -1.26 -5.08 113.70 105.31 2k32 s SER 110 Ca 0.00 0.01 -0.18 0.00 1.31 0.00 0.00 55.95 57.09 2k32 s SER 110 Cb 0.00 -0.13 0.04 0.00 0.21 0.00 0.00 66.02 66.14 2k32 s SER 110 CO 0.00 -0.11 0.45 -2.28 0.41 0.00 0.00 173.24 171.71 2k32 s HIS 111 N 0.98 -0.30 -0.60 2.43 5.04 -1.26 -5.07 115.29 116.52 2k32 s HIS 111 Ca -0.09 0.07 0.24 0.00 -1.54 0.00 0.00 55.06 53.74 2k32 s HIS 111 Cb -0.13 0.32 0.34 0.00 0.04 0.00 0.00 32.58 33.15 2k32 s HIS 111 CO -0.02 -0.71 1.33 0.45 -2.34 0.00 0.00 174.74 173.45 2k32 h HIS 112 N 2.41 0.00 0.00 3.88 3.86 -1.97 -3.48 115.15 119.84 2k32 h HIS 112 Ca -0.33 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.88 2k32 h HIS 112 Cb 1.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.73 2k32 h HIS 112 CO 0.32 0.00 0.00 0.72 0.86 0.00 0.00 177.93 179.83 2k32 n HIS 113 N -2.22 0.00 -0.75 2.45 8.25 -1.26 -4.33 115.22 117.36 2k32 n HIS 113 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2k32 n HIS 113 Cb 0.45 -0.66 0.00 0.00 1.12 0.00 0.00 29.99 30.91 2k32 n HIS 113 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k32 n HIS 114 N -1.37 0.00 -3.74 4.41 8.25 -1.26 -5.09 115.22 116.41 2k32 n HIS 114 Ca 0.00 -0.08 -0.10 0.00 -0.26 0.00 0.00 57.72 57.28 2k32 n HIS 114 Cb 0.00 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.05 2k32 n HIS 114 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2k32 s HIS 115 N -0.17 -0.05 0.00 4.41 5.65 -1.26 -5.33 115.29 118.55 2k32 s HIS 115 Ca 0.00 -0.29 0.00 0.00 0.25 0.00 0.00 55.06 55.02 2k32 s HIS 115 Cb 0.00 0.25 0.00 0.00 -1.18 0.00 0.00 32.58 31.65 2k32 s HIS 115 CO 0.00 -0.79 0.00 1.58 -0.65 0.00 0.00 174.74 174.88