#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kh2 h PRO 2 N 0.00 0.77 -5.08 0.00 0.11 -2.02 -3.41 132.00 122.37 2kh2 h PRO 2 Ca 0.00 -0.26 -0.67 0.00 0.11 0.00 0.00 66.00 65.18 2kh2 h PRO 2 Cb 0.00 -0.06 -0.33 0.00 0.11 0.00 0.00 31.00 30.72 2kh2 h PRO 2 CO 0.00 0.86 -0.82 0.54 -0.21 0.00 0.00 178.00 178.37 2kh2 s VAL 3 N -4.76 2.43 0.22 3.15 0.11 -1.26 -4.86 120.40 115.43 2kh2 s VAL 3 Ca -0.09 -0.82 -0.30 0.00 -2.93 0.00 0.00 61.98 57.84 2kh2 s VAL 3 Cb 0.14 -2.04 -0.09 0.00 -1.53 0.00 0.00 36.38 32.86 2kh2 s VAL 3 CO 0.82 0.51 1.19 -0.13 -3.33 0.00 0.00 175.10 174.17 2kh2 s ARG 4 N 1.22 4.51 -0.10 1.54 0.52 -1.26 -4.84 118.95 120.53 2kh2 s ARG 4 Ca 0.03 1.91 -0.01 0.00 -0.52 0.00 0.00 55.73 57.13 2kh2 s ARG 4 Cb -0.14 -3.21 0.03 0.00 0.52 0.00 0.00 34.95 32.16 2kh2 s ARG 4 CO -0.08 -0.03 -0.01 -1.12 0.02 0.00 0.00 175.30 174.07 2kh2 s SER 5 N -0.17 1.97 -0.13 0.23 0.01 -1.25 -0.30 113.70 114.05 2kh2 s SER 5 Ca 0.51 -0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.52 2kh2 s SER 5 Cb -0.33 -0.57 0.01 0.00 0.21 0.00 0.00 66.02 65.33 2kh2 s SER 5 CO 0.39 -0.19 -0.21 -0.76 0.41 0.00 0.00 173.24 172.88 2kh2 s LEU 6 N 1.88 2.18 -0.20 2.44 1.43 -0.49 -4.88 118.68 121.04 2kh2 s LEU 6 Ca 0.04 -0.57 -0.24 0.00 -1.03 0.00 0.00 54.13 52.33 2kh2 s LEU 6 Cb -0.13 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 2kh2 s LEU 6 CO -0.06 0.10 0.79 0.20 0.23 0.00 0.00 176.35 177.61 2kh2 s ASN 7 N 0.70 6.85 0.09 2.29 0.01 -1.26 0.42 114.94 124.04 2kh2 s ASN 7 Ca -0.09 1.05 -0.07 0.00 -0.71 0.00 0.00 52.86 53.03 2kh2 s ASN 7 Cb -0.16 -2.43 -0.01 0.00 0.41 0.00 0.00 41.25 39.07 2kh2 s ASN 7 CO 0.01 -0.42 0.17 0.00 -1.51 0.00 0.00 177.10 175.34 2kh2 s THR 9 N -3.88 3.66 -0.09 0.00 -4.23 0.33 0.14 115.64 111.57 2kh2 s THR 9 Ca 0.07 -1.32 0.04 0.00 -1.18 0.00 0.00 61.69 59.30 2kh2 s THR 9 Cb 0.05 -2.79 -0.01 0.00 1.34 0.00 0.00 72.50 71.09 2kh2 s THR 9 CO -0.10 -0.01 -0.21 -0.76 -0.54 0.00 0.00 174.62 173.00 2kh2 s LEU 10 N -2.64 2.30 -0.01 4.79 1.43 -1.26 -2.32 118.68 120.97 2kh2 s LEU 10 Ca 0.25 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 2kh2 s LEU 10 Cb -0.10 -1.46 -0.00 0.00 0.03 0.00 0.00 46.19 44.65 2kh2 s LEU 10 CO 0.17 0.21 -0.08 -0.13 0.23 0.00 0.00 176.35 176.75 2kh2 s ARG 11 N 0.05 0.67 0.98 1.70 0.52 -1.25 -3.49 118.95 118.12 2kh2 s ARG 11 Ca -0.08 -0.28 -0.16 0.00 -0.52 0.00 0.00 55.73 54.69 2kh2 s ARG 11 Cb -0.15 -0.65 0.22 0.00 0.52 0.00 0.00 34.95 34.90 2kh2 s ARG 11 CO 0.05 0.16 1.34 0.16 0.02 0.00 0.00 175.30 177.03 2kh2 s ASP 12 N -0.14 2.89 0.22 0.23 1.47 -0.67 -0.35 116.67 120.32 2kh2 s ASP 12 Ca 0.02 0.10 0.20 0.00 1.18 0.00 0.00 52.55 54.06 2kh2 s ASP 12 Cb -0.04 -0.06 0.91 0.00 -0.34 0.00 0.00 42.92 43.39 2kh2 s ASP 12 CO -0.00 -2.86 1.62 -1.54 0.68 0.00 0.00 175.17 173.06 2kh2 n SER 13 N -3.81 0.50 -0.95 2.11 3.41 -1.25 -1.42 113.62 112.22 2kh2 n SER 13 Ca 0.17 0.65 0.10 0.00 -0.26 0.00 0.00 58.87 59.53 2kh2 n SER 13 Cb 0.59 -0.75 0.27 0.00 -0.26 0.00 0.00 64.21 64.06 2kh2 n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kh2 n GLN 14 N -2.09 2.22 -1.61 4.33 1.13 -1.26 -4.91 117.38 115.20 2kh2 n GLN 14 Ca 0.01 -1.87 -0.11 0.00 -1.94 0.00 0.00 57.00 53.10 2kh2 n GLN 14 Cb 0.16 -1.45 -0.03 0.00 0.11 0.00 0.00 30.24 29.03 2kh2 n GLN 14 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2kh2 n GLN 15 N 1.05 -0.81 -3.20 -1.09 1.13 -0.50 -4.96 117.38 109.00 2kh2 n GLN 15 Ca 0.18 0.78 -0.36 0.00 -1.94 0.00 0.00 57.00 55.66 2kh2 n GLN 15 Cb 0.48 -4.80 -0.06 0.00 0.11 0.00 0.00 30.24 25.98 2kh2 n GLN 15 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2kh2 s LYS 16 N -3.45 4.15 0.15 -1.09 1.02 -1.26 -4.25 119.74 115.00 2kh2 s LYS 16 Ca 0.00 0.72 0.07 0.00 0.02 0.00 0.00 55.97 56.78 2kh2 s LYS 16 Cb 0.00 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 2kh2 s LYS 16 CO 0.00 0.44 -0.03 -1.12 -0.92 0.00 0.00 175.35 173.72 2kh2 s SER 17 N -1.65 4.68 -0.14 2.83 0.01 0.11 -1.66 113.70 117.88 2kh2 s SER 17 Ca 0.40 -0.39 -0.23 0.00 1.31 0.00 0.00 55.95 57.05 2kh2 s SER 17 Cb -0.16 -0.98 -0.03 0.00 0.21 0.00 0.00 66.02 65.07 2kh2 s SER 17 CO 0.20 0.12 0.70 -0.76 0.41 0.00 0.00 173.24 173.91 2kh2 s LEU 18 N -2.72 4.22 0.10 2.44 1.43 -1.23 -1.69 118.68 121.23 2kh2 s LEU 18 Ca 0.26 1.06 0.09 0.00 -1.03 0.00 0.00 54.13 54.50 2kh2 s LEU 18 Cb -0.10 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 43.04 2kh2 s LEU 18 CO 0.17 -0.23 -0.22 0.68 0.23 0.00 0.00 176.35 176.98 2kh2 s VAL 19 N 1.49 1.85 -0.56 -1.59 -7.23 0.13 -2.65 120.40 111.83 2kh2 s VAL 19 Ca 0.34 -1.57 -0.28 0.00 -1.81 0.00 0.00 61.98 58.67 2kh2 s VAL 19 Cb -0.17 -1.66 0.01 0.00 0.56 0.00 0.00 36.38 35.13 2kh2 s VAL 19 CO 0.14 0.00 1.40 -0.04 -0.31 0.00 0.00 175.10 176.29 2kh2 s MET 20 N -1.87 3.32 0.00 4.82 -1.94 -1.26 -0.52 119.30 121.85 2kh2 s MET 20 Ca 0.08 0.44 0.00 0.00 -1.71 0.00 0.00 55.69 54.51 2kh2 s MET 20 Cb -0.10 -4.11 0.00 0.00 2.01 0.00 0.00 34.83 32.63 2kh2 s MET 20 CO 0.04 -1.91 0.03 0.45 -0.01 0.00 0.00 175.02 173.62 2kh2 n SER 21 N 9.47 0.00 -1.79 3.03 2.88 0.30 -4.93 113.62 122.57 2kh2 n SER 21 Ca 0.12 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2kh2 n SER 21 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2kh2 n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kh2 n GLY 22 N 1.87 1.19 0.24 0.46 0.00 -1.17 -4.91 105.19 102.87 2kh2 n GLY 22 Ca 0.00 -2.00 0.08 0.00 0.00 0.00 0.00 46.02 44.10 2kh2 n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kh2 h PRO 23 N 0.00 0.00 -0.21 1.61 0.13 -2.02 -3.13 132.00 128.38 2kh2 h PRO 23 Ca 0.00 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.92 2kh2 h PRO 23 Cb 0.00 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 30.81 2kh2 h PRO 23 CO 0.00 0.16 -0.93 0.66 -0.23 0.00 0.00 178.00 177.65 2kh2 n TYR 24 N -4.04 0.70 -4.11 1.56 4.01 -1.26 -4.96 117.16 109.05 2kh2 n TYR 24 Ca -0.02 -1.36 -0.14 0.00 -0.16 0.00 0.00 57.90 56.21 2kh2 n TYR 24 Cb 0.24 -0.21 -0.13 0.00 -0.31 0.00 0.00 39.34 38.92 2kh2 n TYR 24 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2kh2 s GLU 25 N -2.12 0.46 -0.00 -0.72 2.12 -1.18 -3.93 118.70 113.33 2kh2 s GLU 25 Ca 0.35 -0.43 0.06 0.00 0.36 0.00 0.00 54.97 55.31 2kh2 s GLU 25 Cb 0.37 -0.35 -0.02 0.00 0.26 0.00 0.00 34.13 34.40 2kh2 s GLU 25 CO -0.09 0.08 -0.18 -0.51 -0.54 0.00 0.00 175.26 174.02 2kh2 s LEU 26 N -0.74 2.07 0.13 2.70 1.43 -1.26 -0.54 118.68 122.46 2kh2 s LEU 26 Ca -0.03 -0.37 0.07 0.00 -1.03 0.00 0.00 54.13 52.77 2kh2 s LEU 26 Cb -0.05 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 45.21 2kh2 s LEU 26 CO 0.00 0.20 -0.17 -0.54 0.23 0.00 0.00 176.35 176.07 2kh2 s LYS 27 N -0.59 1.13 -0.14 1.70 1.02 0.32 -1.27 119.74 121.91 2kh2 s LYS 27 Ca 0.07 -1.27 0.01 0.00 0.02 0.00 0.00 55.97 54.80 2kh2 s LYS 27 Cb -0.07 -1.16 -0.00 0.00 -0.52 0.00 0.00 37.83 36.08 2kh2 s LYS 27 CO -0.00 0.24 -0.18 0.00 -0.92 0.00 0.00 175.35 174.49 2kh2 s ALA 28 N -1.85 2.40 0.19 5.17 0.00 0.52 0.20 121.76 128.39 2kh2 s ALA 28 Ca 0.10 -1.03 -0.13 0.00 0.00 0.00 0.00 51.96 50.90 2kh2 s ALA 28 Cb -0.07 -1.10 0.01 0.00 0.00 0.00 0.00 23.12 21.96 2kh2 s ALA 28 CO 0.05 0.05 0.41 -0.48 0.00 0.00 0.00 175.76 175.79 2kh2 s LEU 29 N 0.69 0.49 -0.10 0.00 0.05 -0.68 -2.10 118.68 117.02 2kh2 s LEU 29 Ca -0.09 -0.69 -0.29 0.00 0.05 0.00 0.00 54.13 53.11 2kh2 s LEU 29 Cb -0.16 1.69 -0.04 0.00 -2.05 0.00 0.00 46.19 45.63 2kh2 s LEU 29 CO 0.02 -0.99 1.50 -1.00 -0.55 0.00 0.00 176.35 175.32 2kh2 s HIS 30 N -3.93 2.33 -0.16 3.48 3.76 -1.26 0.07 115.29 119.58 2kh2 s HIS 30 Ca 0.14 0.52 0.01 0.00 -0.15 0.00 0.00 55.06 55.58 2kh2 s HIS 30 Cb 0.01 -3.75 0.02 0.00 1.11 0.00 0.00 32.58 29.97 2kh2 s HIS 30 CO -0.01 -3.00 -0.18 -1.17 -0.85 0.00 0.00 174.74 169.53 2kh2 s LEU 31 N 3.80 1.98 -0.29 0.89 2.96 -1.26 -4.93 118.68 121.84 2kh2 s LEU 31 Ca 0.66 -0.59 -0.07 0.00 -0.22 0.00 0.00 54.13 53.92 2kh2 s LEU 31 Cb -0.29 -1.37 0.15 0.00 0.50 0.00 0.00 46.19 45.18 2kh2 s LEU 31 CO 0.24 -0.00 0.60 -1.58 -1.32 0.00 0.00 176.35 174.28 2kh2 s GLN 32 N 1.25 0.54 0.00 1.98 0.74 -1.26 -4.84 119.66 118.07 2kh2 s GLN 32 Ca 0.02 1.23 0.00 0.00 0.05 0.00 0.00 55.36 56.67 2kh2 s GLN 32 Cb -0.13 0.66 0.00 0.00 1.10 0.00 0.00 33.01 34.64 2kh2 s GLN 32 CO -0.10 -0.36 0.00 0.41 -0.55 0.00 0.00 175.29 174.69 2kh2 n GLY 33 N 5.43 0.48 0.00 2.59 0.00 -1.26 -4.70 105.19 107.73 2kh2 n GLY 33 Ca -0.08 -1.89 0.12 0.00 0.00 0.00 0.00 46.02 44.17 2kh2 n GLY 33 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2kh2 n GLN 34 N 0.00 0.78 0.00 1.61 -0.06 -1.26 -2.03 117.38 116.43 2kh2 n GLN 34 Ca 0.00 0.00 0.08 0.00 -2.00 0.00 0.00 57.00 55.08 2kh2 n GLN 34 Cb 0.00 -1.47 0.00 0.00 -4.06 0.00 0.00 30.24 24.71 2kh2 n GLN 34 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 2kh2 n ASP 35 N -0.97 1.66 0.26 1.69 5.68 -1.26 -4.36 116.55 119.25 2kh2 n ASP 35 Ca 0.18 -1.33 0.13 0.00 -0.50 0.00 0.00 54.79 53.27 2kh2 n ASP 35 Cb 0.08 0.43 0.66 0.00 -1.14 0.00 0.00 41.12 41.15 2kh2 n ASP 35 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 2kh2 h MET 36 N 1.87 0.00 0.00 0.11 4.05 -1.70 -2.43 114.93 116.83 2kh2 h MET 36 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2kh2 h MET 36 Cb 0.55 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 2kh2 h MET 36 CO 0.00 0.13 0.00 0.39 0.23 0.00 0.00 176.91 177.66 2kh2 n GLU 37 N -3.43 0.59 -0.08 0.39 -0.58 -1.26 -2.05 120.64 114.21 2kh2 n GLU 37 Ca -0.01 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.80 2kh2 n GLU 37 Cb 0.30 -1.50 0.24 0.00 -0.57 0.00 0.00 31.44 29.92 2kh2 n GLU 37 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2kh2 n GLN 38 N -1.01 1.48 -1.76 3.49 6.02 -0.92 -4.89 117.38 119.79 2kh2 n GLN 38 Ca 0.14 -0.73 -0.42 0.00 -0.01 0.00 0.00 57.00 55.98 2kh2 n GLN 38 Cb 0.07 -1.25 -0.03 0.00 1.02 0.00 0.00 30.24 30.06 2kh2 n GLN 38 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2kh2 s GLN 39 N -1.78 4.13 0.03 -1.09 -2.07 -0.87 -4.78 119.66 113.23 2kh2 s GLN 39 Ca 0.21 2.58 -0.29 0.00 -1.82 0.00 0.00 55.36 56.04 2kh2 s GLN 39 Cb 0.11 -3.06 -0.04 0.00 -1.09 0.00 0.00 33.01 28.93 2kh2 s GLN 39 CO 0.16 -0.70 0.94 0.08 -1.32 0.00 0.00 175.29 174.45 2kh2 s VAL 40 N 0.79 4.76 -0.21 3.63 1.01 -1.09 -5.03 120.40 124.27 2kh2 s VAL 40 Ca 0.71 1.99 -0.10 0.00 0.00 0.00 0.00 61.98 64.58 2kh2 s VAL 40 Cb -0.49 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.56 2kh2 s VAL 40 CO 0.37 0.23 0.12 -0.69 0.00 0.00 0.00 175.10 175.13 2kh2 s VAL 41 N 0.62 5.25 -0.16 2.92 1.01 -1.26 -4.53 120.40 124.24 2kh2 s VAL 41 Ca 0.48 0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.53 2kh2 s VAL 41 Cb -0.21 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 2kh2 s VAL 41 CO 0.27 0.42 0.06 -0.36 0.00 0.00 0.00 175.10 175.49 2kh2 s PHE 42 N 0.56 3.27 -0.31 5.22 0.08 0.12 -0.80 117.98 126.13 2kh2 s PHE 42 Ca 0.07 0.14 -0.25 0.00 0.12 0.00 0.00 56.93 57.01 2kh2 s PHE 42 Cb -0.12 -2.01 0.00 0.00 -0.57 0.00 0.00 43.02 40.32 2kh2 s PHE 42 CO 0.00 0.27 0.85 -1.12 -0.10 0.00 0.00 175.22 175.12 2kh2 s SER 43 N -0.01 6.72 -0.61 1.36 0.01 0.16 -1.00 113.70 120.34 2kh2 s SER 43 Ca 0.06 0.75 -0.22 0.00 1.31 0.00 0.00 55.95 57.85 2kh2 s SER 43 Cb -0.12 -2.43 0.06 0.00 0.21 0.00 0.00 66.02 63.74 2kh2 s SER 43 CO 0.01 -0.66 0.90 -0.32 0.41 0.00 0.00 173.24 173.58 2kh2 s MET 44 N 3.08 3.17 -0.12 12.44 1.75 0.17 -2.63 119.30 137.15 2kh2 s MET 44 Ca 0.35 -0.72 -0.20 0.00 -1.25 0.00 0.00 55.69 53.87 2kh2 s MET 44 Cb -0.14 -4.17 -0.04 0.00 2.84 0.00 0.00 34.83 33.32 2kh2 s MET 44 CO 0.13 -1.64 0.55 -1.12 -0.65 0.00 0.00 175.02 172.28 2kh2 s SER 45 N 3.34 6.75 -0.65 1.11 0.01 -0.80 -1.39 113.70 122.07 2kh2 s SER 45 Ca 0.23 0.90 -0.25 0.00 1.31 0.00 0.00 55.95 58.14 2kh2 s SER 45 Cb -0.16 -2.32 0.05 0.00 0.21 0.00 0.00 66.02 63.79 2kh2 s SER 45 CO 0.13 -0.06 1.06 -0.36 0.41 0.00 0.00 173.24 174.42 2kh2 s PHE 46 N 0.85 2.59 0.60 2.43 0.40 0.59 -0.06 117.98 125.37 2kh2 s PHE 46 Ca 0.29 -0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.47 2kh2 s PHE 46 Cb -0.16 -4.35 0.09 0.00 0.51 0.00 0.00 43.02 39.11 2kh2 s PHE 46 CO 0.12 -1.69 0.83 0.14 0.70 0.00 0.00 175.22 175.32 2kh2 s VAL 47 N 4.57 2.25 -0.28 -0.44 -7.23 -1.10 -4.33 120.40 113.84 2kh2 s VAL 47 Ca 0.29 -0.86 -0.08 0.00 -1.81 0.00 0.00 61.98 59.53 2kh2 s VAL 47 Cb -0.13 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.42 2kh2 s VAL 47 CO 0.15 0.00 0.09 -1.58 -0.31 0.00 0.00 175.10 173.45 2kh2 s GLN 48 N -4.79 3.37 0.00 4.82 2.00 -0.98 -4.75 119.66 119.34 2kh2 s GLN 48 Ca 0.62 -0.67 0.00 0.00 -2.00 0.00 0.00 55.36 53.31 2kh2 s GLN 48 Cb -0.06 -3.39 0.00 0.00 0.80 0.00 0.00 33.01 30.36 2kh2 s GLN 48 CO 0.40 -0.33 0.00 0.41 -0.50 0.00 0.00 175.29 175.27 2kh2 n GLY 49 N 4.91 2.07 3.57 2.59 0.00 -1.26 -4.88 105.19 112.20 2kh2 n GLY 49 Ca -0.15 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2kh2 n GLY 49 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kh2 s GLU 50 N 4.03 3.03 -0.02 1.61 8.01 -1.26 -4.95 118.70 129.15 2kh2 s GLU 50 Ca 0.00 -1.12 -0.22 0.00 0.01 0.00 0.00 54.97 53.63 2kh2 s GLU 50 Cb 0.00 -5.28 -0.05 0.00 -4.31 0.00 0.00 34.13 24.49 2kh2 s GLU 50 CO 0.00 -3.15 0.66 -2.00 0.01 0.00 0.00 175.26 170.79 2kh2 s GLU 51 N 5.85 4.40 0.36 1.61 2.12 -1.26 -3.82 118.70 127.96 2kh2 s GLU 51 Ca 0.62 0.85 -0.10 0.00 0.36 0.00 0.00 54.97 56.69 2kh2 s GLU 51 Cb -0.01 -3.39 0.03 0.00 0.26 0.00 0.00 34.13 31.02 2kh2 s GLU 51 CO 0.05 0.24 0.64 -1.12 -0.54 0.00 0.00 175.26 174.52 2kh2 s SER 52 N 0.20 0.38 0.05 -1.70 0.01 0.09 -5.01 113.70 107.72 2kh2 s SER 52 Ca 0.35 -1.26 -0.02 0.00 1.31 0.00 0.00 55.95 56.33 2kh2 s SER 52 Cb -0.18 0.75 -0.27 0.00 0.21 0.00 0.00 66.02 66.53 2kh2 s SER 52 CO 0.19 -1.48 1.03 -1.13 0.41 0.00 0.00 173.24 172.25 2kh2 h ASN 53 N 2.06 0.34 -0.36 2.44 -1.24 -1.99 -3.32 115.58 113.51 2kh2 h ASN 53 Ca -0.30 -0.41 0.00 0.00 0.71 0.00 0.00 56.30 56.30 2kh2 h ASN 53 Cb 1.25 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 40.18 2kh2 h ASN 53 CO 0.39 1.33 0.00 -0.90 -1.29 0.00 0.00 177.43 176.96 2kh2 n ASP 54 N -3.46 3.74 -3.41 1.15 5.75 -1.26 -4.87 116.55 114.20 2kh2 n ASP 54 Ca -0.11 -2.57 -0.08 0.00 -0.01 0.00 0.00 54.79 52.03 2kh2 n ASP 54 Cb 1.02 -0.44 -0.08 0.00 -1.03 0.00 0.00 41.12 40.59 2kh2 n ASP 54 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2kh2 s LYS 55 N -2.03 0.37 -0.21 0.11 2.20 -1.25 -1.36 119.74 117.57 2kh2 s LYS 55 Ca 0.37 0.71 -0.05 0.00 -0.36 0.00 0.00 55.97 56.64 2kh2 s LYS 55 Cb 0.26 -0.17 -0.02 0.00 -1.51 0.00 0.00 37.83 36.39 2kh2 s LYS 55 CO 0.14 -0.54 -0.00 0.42 -0.36 0.00 0.00 175.35 175.00 2kh2 s ILE 56 N 2.60 3.84 -0.47 5.43 -1.09 0.73 -0.73 121.20 131.50 2kh2 s ILE 56 Ca 0.10 -0.35 -0.29 0.00 -2.23 0.00 0.00 60.65 57.88 2kh2 s ILE 56 Cb -0.15 -2.75 0.03 0.00 -1.58 0.00 0.00 42.46 38.02 2kh2 s ILE 56 CO -0.16 0.42 1.14 -2.16 -1.23 0.00 0.00 174.94 172.95 2kh2 s PRO 57 N 1.19 3.74 0.16 2.79 0.04 -1.25 0.14 135.00 141.81 2kh2 s PRO 57 Ca 0.03 0.60 -0.01 0.00 0.04 0.00 0.00 61.00 61.66 2kh2 s PRO 57 Cb -0.15 -3.90 -0.04 0.00 0.04 0.00 0.00 34.50 30.45 2kh2 s PRO 57 CO 0.01 -1.36 0.08 0.14 0.04 0.00 0.00 177.00 175.91 2kh2 s VAL 58 N 4.42 0.13 0.23 -0.36 -7.23 0.00 -2.69 120.40 114.90 2kh2 s VAL 58 Ca 0.48 -1.95 0.08 0.00 -1.81 0.00 0.00 61.98 58.79 2kh2 s VAL 58 Cb -0.07 -2.22 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 2kh2 s VAL 58 CO 0.31 -0.30 0.03 0.00 -0.31 0.00 0.00 175.10 174.83 2kh2 s ALA 59 N -4.05 3.24 -0.19 1.32 0.00 0.91 0.12 121.76 123.11 2kh2 s ALA 59 Ca 0.29 -1.51 -0.01 0.00 0.00 0.00 0.00 51.96 50.73 2kh2 s ALA 59 Cb 0.07 -0.93 0.05 0.00 0.00 0.00 0.00 23.12 22.31 2kh2 s ALA 59 CO 0.06 0.34 -0.02 -0.51 0.00 0.00 0.00 175.76 175.62 2kh2 s LEU 60 N -3.43 1.69 0.26 0.00 1.43 -1.26 -1.91 118.68 115.47 2kh2 s LEU 60 Ca 0.30 -0.82 0.03 0.00 -1.03 0.00 0.00 54.13 52.61 2kh2 s LEU 60 Cb -0.08 -0.87 -0.05 0.00 0.03 0.00 0.00 46.19 45.22 2kh2 s LEU 60 CO 0.20 -0.23 0.04 -0.83 0.23 0.00 0.00 176.35 175.76 2kh2 s GLY 61 N 1.65 1.73 0.21 -3.19 0.00 -1.08 -0.77 107.32 105.87 2kh2 s GLY 61 Ca -0.01 -1.86 -0.30 0.00 0.00 0.00 0.00 44.72 42.54 2kh2 s GLY 61 CO -0.07 -1.68 0.97 1.08 0.00 0.00 0.00 173.10 173.40 2kh2 s LEU 62 N -3.35 4.60 -0.28 0.66 1.02 0.30 0.39 118.68 122.02 2kh2 s LEU 62 Ca 0.33 1.95 -0.39 0.00 0.02 0.00 0.00 54.13 56.05 2kh2 s LEU 62 Cb 0.07 -3.61 -0.15 0.00 0.02 0.00 0.00 46.19 42.53 2kh2 s LEU 62 CO 0.12 0.06 1.86 1.17 0.02 0.00 0.00 176.35 179.58 2kh2 n LYS 63 N 1.79 1.21 -3.43 1.70 4.81 0.02 -1.43 118.16 122.84 2kh2 n LYS 63 Ca -0.01 0.42 -0.24 0.00 -0.87 0.00 0.00 58.31 57.61 2kh2 n LYS 63 Cb 0.47 -2.21 0.00 0.00 0.02 0.00 0.00 35.03 33.32 2kh2 n LYS 63 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 2kh2 n GLU 64 N 6.16 -3.70 -4.37 1.64 0.00 -1.26 -4.97 120.64 114.15 2kh2 n GLU 64 Ca 0.30 0.52 -0.18 0.00 0.00 0.00 0.00 57.16 57.80 2kh2 n GLU 64 Cb 0.16 -5.26 -0.10 0.00 0.00 0.00 0.00 31.44 26.23 2kh2 n GLU 64 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2kh2 s LYS 65 N -6.09 1.46 -0.29 3.44 1.02 -0.51 -5.05 119.74 113.73 2kh2 s LYS 65 Ca 0.43 -1.78 0.12 0.00 0.02 0.00 0.00 55.97 54.76 2kh2 s LYS 65 Cb -0.23 -0.62 0.74 0.00 -0.52 0.00 0.00 37.83 37.20 2kh2 s LYS 65 CO 0.53 -0.17 1.75 0.27 -0.92 0.00 0.00 175.35 176.81 2kh2 n ASN 66 N -0.52 4.89 -4.49 2.83 6.94 -1.26 -4.60 115.26 119.05 2kh2 n ASN 66 Ca -0.03 -3.16 -0.37 0.00 -0.02 0.00 0.00 54.58 51.00 2kh2 n ASN 66 Cb 0.65 -0.71 -0.12 0.00 -2.36 0.00 0.00 39.78 37.24 2kh2 n ASN 66 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2kh2 s LEU 67 N -2.94 3.60 0.12 -4.53 1.43 -1.26 -1.57 118.68 113.53 2kh2 s LEU 67 Ca 0.54 -0.14 0.09 0.00 -1.03 0.00 0.00 54.13 53.58 2kh2 s LEU 67 Cb 0.43 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.64 2kh2 s LEU 67 CO 0.13 -0.03 -0.22 -0.31 0.23 0.00 0.00 176.35 176.16 2kh2 s TYR 68 N 1.58 1.92 -0.20 0.29 1.51 -0.88 -0.54 117.35 121.03 2kh2 s TYR 68 Ca 0.06 -0.41 -0.29 0.00 -1.01 0.00 0.00 57.07 55.42 2kh2 s TYR 68 Cb -0.15 -1.03 -0.02 0.00 -0.11 0.00 0.00 41.96 40.65 2kh2 s TYR 68 CO 0.05 0.26 1.40 -0.51 -1.11 0.00 0.00 175.55 175.64 2kh2 s LEU 69 N -2.07 4.06 -0.08 -1.29 1.43 0.05 -0.59 118.68 120.19 2kh2 s LEU 69 Ca 0.10 1.63 0.02 0.00 -1.03 0.00 0.00 54.13 54.85 2kh2 s LEU 69 Cb -0.09 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 2kh2 s LEU 69 CO 0.05 -0.97 -0.14 -0.55 0.23 0.00 0.00 176.35 174.97 2kh2 s SER 70 N 2.84 4.01 -0.38 2.29 0.15 0.34 -4.51 113.70 118.44 2kh2 s SER 70 Ca 0.61 -0.25 -0.12 0.00 0.70 0.00 0.00 55.95 56.90 2kh2 s SER 70 Cb -0.23 -1.13 0.03 0.00 -1.71 0.00 0.00 66.02 62.98 2kh2 s SER 70 CO 0.22 0.28 0.23 0.00 1.20 0.00 0.00 173.24 175.16 2kh2 s VAL 72 N 1.57 0.79 -0.27 0.00 -7.23 -0.87 -4.74 120.40 109.65 2kh2 s VAL 72 Ca 0.02 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.06 2kh2 s VAL 72 Cb -0.19 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2kh2 s VAL 72 CO 0.07 -0.29 0.29 -0.76 -0.31 0.00 0.00 175.10 174.10 2kh2 s LEU 73 N -3.26 4.03 -0.22 1.32 1.43 -1.26 -0.05 118.68 120.66 2kh2 s LEU 73 Ca 0.29 0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.57 2kh2 s LEU 73 Cb 0.06 -2.29 0.05 0.00 0.03 0.00 0.00 46.19 44.04 2kh2 s LEU 73 CO 0.08 -0.12 -0.11 -0.54 0.23 0.00 0.00 176.35 175.89 2kh2 s LYS 74 N 1.90 2.19 -1.11 1.70 1.02 0.13 -4.75 119.74 120.83 2kh2 s LYS 74 Ca 0.11 -1.04 -0.04 0.00 0.02 0.00 0.00 55.97 55.02 2kh2 s LYS 74 Cb -0.16 -2.63 -0.04 0.00 -0.52 0.00 0.00 37.83 34.47 2kh2 s LYS 74 CO 0.10 -0.47 0.94 -3.47 -0.92 0.00 0.00 175.35 171.53 2kh2 n ASP 75 N 4.58 -5.02 -1.05 2.83 4.64 -1.26 -2.52 116.55 118.75 2kh2 n ASP 75 Ca -0.15 -0.69 -0.14 0.00 -1.38 0.00 0.00 54.79 52.43 2kh2 n ASP 75 Cb 0.45 -5.13 -0.06 0.00 -1.04 0.00 0.00 41.12 35.34 2kh2 n ASP 75 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 2kh2 n ASP 76 N -3.18 -5.60 -3.79 1.67 10.43 -1.26 -4.96 116.55 109.85 2kh2 n ASP 76 Ca -0.15 0.34 -0.17 0.00 2.57 0.00 0.00 54.79 57.39 2kh2 n ASP 76 Cb 0.64 -4.31 -0.16 0.00 1.84 0.00 0.00 41.12 39.12 2kh2 n ASP 76 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 2kh2 s LYS 77 N -3.15 0.16 0.20 -1.24 2.47 -1.05 -5.12 119.74 112.03 2kh2 s LYS 77 Ca 0.00 0.13 -0.30 0.00 -1.56 0.00 0.00 55.97 54.24 2kh2 s LYS 77 Cb 0.00 -0.41 -0.09 0.00 -1.46 0.00 0.00 37.83 35.87 2kh2 s LYS 77 CO 0.00 -0.16 1.28 -2.14 0.16 0.00 0.00 175.35 174.48 2kh2 s PRO 78 N 1.13 4.42 0.05 4.03 0.02 -1.26 0.20 135.00 143.58 2kh2 s PRO 78 Ca -0.08 2.01 -0.05 0.00 0.02 0.00 0.00 61.00 62.90 2kh2 s PRO 78 Cb -0.13 -3.20 -0.02 0.00 0.02 0.00 0.00 34.50 31.17 2kh2 s PRO 78 CO -0.02 -0.20 0.08 0.99 -0.33 0.00 0.00 177.00 177.51 2kh2 s THR 79 N 0.00 0.15 0.15 0.99 2.01 0.93 -4.68 115.64 115.18 2kh2 s THR 79 Ca 0.55 -1.24 -0.06 0.00 0.31 0.00 0.00 61.69 61.25 2kh2 s THR 79 Cb -0.36 -1.05 -0.06 0.00 0.01 0.00 0.00 72.50 71.04 2kh2 s THR 79 CO 0.38 -0.68 0.41 -0.22 -0.69 0.00 0.00 174.62 173.82 2kh2 s LEU 80 N -2.36 4.26 0.32 4.42 2.96 -1.26 -2.04 118.68 124.98 2kh2 s LEU 80 Ca -0.02 0.68 -0.18 0.00 -0.22 0.00 0.00 54.13 54.39 2kh2 s LEU 80 Cb 0.01 -3.32 0.06 0.00 0.50 0.00 0.00 46.19 43.44 2kh2 s LEU 80 CO -0.06 0.05 0.85 0.00 -1.32 0.00 0.00 176.35 175.87 2kh2 s GLN 81 N -2.55 1.92 -0.28 1.98 -2.07 -0.70 -4.90 119.66 113.06 2kh2 s GLN 81 Ca 0.41 -1.22 -0.07 0.00 -1.82 0.00 0.00 55.36 52.66 2kh2 s GLN 81 Cb -0.12 0.55 -0.01 0.00 -1.09 0.00 0.00 33.01 32.34 2kh2 s GLN 81 CO 0.23 -0.90 0.09 -0.51 -1.32 0.00 0.00 175.29 172.88 2kh2 s LEU 82 N -3.13 3.76 -0.18 2.60 2.01 -1.25 -0.50 118.68 121.98 2kh2 s LEU 82 Ca 0.16 -0.52 -0.07 0.00 0.01 0.00 0.00 54.13 53.72 2kh2 s LEU 82 Cb -0.04 -1.91 -0.04 0.00 0.01 0.00 0.00 46.19 44.21 2kh2 s LEU 82 CO 0.09 -0.14 0.04 -0.70 1.01 0.00 0.00 176.35 176.65 2kh2 s GLU 83 N 1.56 3.87 -0.25 1.70 2.12 0.24 -4.86 118.70 123.09 2kh2 s GLU 83 Ca 0.04 -0.40 -0.29 0.00 0.36 0.00 0.00 54.97 54.69 2kh2 s GLU 83 Cb -0.16 -3.16 0.01 0.00 0.26 0.00 0.00 34.13 31.07 2kh2 s GLU 83 CO 0.03 0.22 1.03 -1.12 -0.54 0.00 0.00 175.26 174.88 2kh2 s SER 84 N 0.51 7.05 0.29 -1.70 0.01 -1.26 -2.08 113.70 116.51 2kh2 s SER 84 Ca 0.02 1.30 0.11 0.00 1.31 0.00 0.00 55.95 58.68 2kh2 s SER 84 Cb -0.13 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 2kh2 s SER 84 CO 0.01 -0.69 -0.17 0.68 0.41 0.00 0.00 173.24 173.48 2kh2 s VAL 85 N 3.24 2.35 -0.21 3.43 -7.23 -0.61 -5.04 120.40 116.34 2kh2 s VAL 85 Ca 0.43 -2.35 -0.31 0.00 -1.81 0.00 0.00 61.98 57.94 2kh2 s VAL 85 Cb -0.15 -2.34 -0.08 0.00 0.56 0.00 0.00 36.38 34.37 2kh2 s VAL 85 CO 0.08 -0.38 2.14 -0.67 -0.31 0.00 0.00 175.10 175.96 2kh2 n ASP 86 N -0.63 3.08 0.13 4.85 4.64 -1.26 -4.81 116.55 122.55 2kh2 n ASP 86 Ca -0.05 0.44 0.11 0.00 -1.38 0.00 0.00 54.79 53.90 2kh2 n ASP 86 Cb 0.61 -1.45 0.51 0.00 -1.04 0.00 0.00 41.12 39.75 2kh2 n ASP 86 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2kh2 n PRO 87 N 8.18 0.15 0.02 -0.67 -0.04 -1.26 -1.98 135.00 139.41 2kh2 n PRO 87 Ca 0.31 0.52 0.11 0.00 -0.04 0.00 0.00 63.50 64.40 2kh2 n PRO 87 Cb 0.36 -1.88 0.01 0.00 -0.04 0.00 0.00 33.50 31.95 2kh2 n PRO 87 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2kh2 n LYS 88 N -2.19 0.27 -0.11 0.54 2.85 -1.26 -4.09 118.16 114.17 2kh2 n LYS 88 Ca 0.00 -0.01 0.05 0.00 -1.05 0.00 0.00 58.31 57.30 2kh2 n LYS 88 Cb 0.13 -1.58 0.11 0.00 -0.65 0.00 0.00 35.03 33.04 2kh2 n LYS 88 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2kh2 n ASN 89 N -1.92 2.55 -4.11 -5.58 3.02 -0.84 -4.99 115.26 103.40 2kh2 n ASN 89 Ca 0.02 -1.85 -0.19 0.00 -0.03 0.00 0.00 54.58 52.52 2kh2 n ASN 89 Cb 0.43 -0.15 -0.14 0.00 -0.61 0.00 0.00 39.78 39.31 2kh2 n ASN 89 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2kh2 s TYR 90 N -0.95 1.09 0.41 3.10 1.51 -1.02 -4.47 117.35 117.02 2kh2 s TYR 90 Ca 0.18 -0.31 -0.04 0.00 -1.01 0.00 0.00 57.07 55.89 2kh2 s TYR 90 Cb 0.10 -0.66 0.09 0.00 -0.11 0.00 0.00 41.96 41.38 2kh2 s TYR 90 CO 0.13 0.01 0.56 -0.35 -1.11 0.00 0.00 175.55 174.79 2kh2 n PRO 91 N 2.16 -0.17 -3.93 -1.71 -0.04 -1.26 -4.85 135.00 125.19 2kh2 n PRO 91 Ca -0.17 -1.16 -0.10 0.00 -0.04 0.00 0.00 63.50 62.04 2kh2 n PRO 91 Cb 0.55 -0.49 -0.07 0.00 -0.04 0.00 0.00 33.50 33.46 2kh2 n PRO 91 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2kh2 s LYS 92 N -4.05 1.19 0.02 0.54 -2.85 -1.26 -5.04 119.74 108.29 2kh2 s LYS 92 Ca 0.34 -1.14 -0.25 0.00 -1.00 0.00 0.00 55.97 53.92 2kh2 s LYS 92 Cb -0.01 0.40 -0.18 0.00 -2.06 0.00 0.00 37.83 35.97 2kh2 s LYS 92 CO 0.23 -0.45 1.38 -0.22 0.10 0.00 0.00 175.35 176.39 2kh2 h LYS 93 N 2.49 -0.14 -3.86 1.78 1.63 -1.89 -3.36 116.57 113.23 2kh2 h LYS 93 Ca -0.31 0.01 -0.79 0.00 -0.85 0.00 0.00 60.65 58.71 2kh2 h LYS 93 Cb 1.23 0.03 -0.26 0.00 -0.60 0.00 0.00 32.23 32.64 2kh2 h LYS 93 CO 0.47 0.17 0.19 0.21 -3.45 0.00 0.00 179.45 177.03 2kh2 s LYS 94 N -4.89 3.69 0.75 1.90 2.47 -1.26 -2.32 119.74 120.08 2kh2 s LYS 94 Ca -0.15 -2.53 -0.08 0.00 -1.56 0.00 0.00 55.97 51.65 2kh2 s LYS 94 Cb 0.03 -4.47 0.08 0.00 -1.46 0.00 0.00 37.83 32.01 2kh2 s LYS 94 CO 0.63 -1.31 1.07 -1.64 0.16 0.00 0.00 175.35 174.26 2kh2 s MET 95 N 0.09 1.99 0.51 4.03 -1.94 -1.26 -5.03 119.30 117.70 2kh2 s MET 95 Ca 0.20 -0.25 -0.22 0.00 -1.71 0.00 0.00 55.69 53.71 2kh2 s MET 95 Cb -0.10 -2.11 -0.06 0.00 2.01 0.00 0.00 34.83 34.57 2kh2 s MET 95 CO -0.09 -1.42 1.26 -1.21 -0.01 0.00 0.00 175.02 173.55 2kh2 s GLU 96 N -5.36 3.39 0.57 2.03 8.01 -1.26 -4.88 118.70 121.21 2kh2 s GLU 96 Ca 0.62 2.00 0.26 0.00 0.01 0.00 0.00 54.97 57.86 2kh2 s GLU 96 Cb -0.10 -2.29 1.66 0.00 -4.31 0.00 0.00 34.13 29.09 2kh2 s GLU 96 CO 0.46 -0.91 2.19 -0.22 0.01 0.00 0.00 175.26 176.79 2kh2 h LYS 97 N 1.66 0.00 0.00 1.61 1.63 -1.96 0.13 116.57 119.64 2kh2 h LYS 97 Ca -0.50 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 2kh2 h LYS 97 Cb 1.28 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 2kh2 h LYS 97 CO 0.58 0.00 0.00 2.89 -3.45 0.00 0.00 179.45 179.47 2kh2 n ARG 98 N -4.00 0.11 -0.02 1.90 1.85 -1.26 -2.59 116.66 112.64 2kh2 n ARG 98 Ca -0.02 0.08 0.05 0.00 -1.00 0.00 0.00 57.85 56.96 2kh2 n ARG 98 Cb 0.15 -1.50 0.05 0.00 -1.05 0.00 0.00 32.46 30.11 2kh2 n ARG 98 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2kh2 n PHE 99 N -1.43 0.06 -3.48 2.89 3.72 0.41 -1.03 117.46 118.59 2kh2 n PHE 99 Ca 0.08 -0.07 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 2kh2 n PHE 99 Cb 0.25 -0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.70 2kh2 n PHE 99 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2kh2 s VAL 100 N -0.81 5.24 0.13 -4.37 1.01 -1.04 -4.14 120.40 116.41 2kh2 s VAL 100 Ca 0.12 0.44 0.08 0.00 0.00 0.00 0.00 61.98 62.62 2kh2 s VAL 100 Cb 0.08 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 2kh2 s VAL 100 CO 0.12 0.23 -0.12 -0.36 0.00 0.00 0.00 175.10 174.96 2kh2 s PHE 101 N 1.69 2.66 -0.41 5.22 0.08 0.12 -2.39 117.98 124.94 2kh2 s PHE 101 Ca 0.13 -0.20 -0.10 0.00 0.12 0.00 0.00 56.93 56.88 2kh2 s PHE 101 Cb -0.15 -1.37 0.07 0.00 -0.57 0.00 0.00 43.02 40.99 2kh2 s PHE 101 CO 0.09 0.44 0.25 -0.80 -0.10 0.00 0.00 175.22 175.09 2kh2 s ASN 102 N -2.34 5.66 -0.57 1.36 0.02 0.24 -0.82 114.94 118.48 2kh2 s ASN 102 Ca 0.21 -1.41 -0.28 0.00 -1.02 0.00 0.00 52.86 50.36 2kh2 s ASN 102 Cb -0.10 -1.99 0.03 0.00 0.02 0.00 0.00 41.25 39.20 2kh2 s ASN 102 CO 0.13 -0.51 1.18 -0.75 0.02 0.00 0.00 177.10 177.17 2kh2 s LYS 103 N 1.45 3.52 0.07 -0.60 2.20 0.12 -0.81 119.74 125.68 2kh2 s LYS 103 Ca 0.03 0.24 -0.22 0.00 -0.36 0.00 0.00 55.97 55.66 2kh2 s LYS 103 Cb -0.22 -4.01 -0.06 0.00 -1.51 0.00 0.00 37.83 32.02 2kh2 s LYS 103 CO 0.03 -1.66 0.66 0.42 -0.36 0.00 0.00 175.35 174.44 2kh2 s ILE 104 N 4.89 4.69 -0.81 5.43 1.01 0.98 -0.19 121.20 137.20 2kh2 s ILE 104 Ca 0.43 1.42 0.02 0.00 0.00 0.00 0.00 60.65 62.52 2kh2 s ILE 104 Cb -0.08 -4.01 0.28 0.00 0.01 0.00 0.00 42.46 38.67 2kh2 s ILE 104 CO 0.25 0.47 1.07 -0.62 0.00 0.00 0.00 174.94 176.12 2kh2 n GLU 105 N 2.17 3.41 0.10 2.79 -0.58 -0.46 -2.10 120.64 125.97 2kh2 n GLU 105 Ca -0.07 -4.65 -0.04 0.00 -0.42 0.00 0.00 57.16 51.99 2kh2 n GLU 105 Cb 0.50 -2.36 -0.02 0.00 -0.57 0.00 0.00 31.44 28.99 2kh2 n GLU 105 CO 0.00 0.00 0.00 -0.84 -0.48 0.00 0.00 177.13 175.81 2kh2 h ILE 106 N 3.22 0.00 0.00 -3.67 3.07 -1.84 -3.47 117.51 114.81 2kh2 h ILE 106 Ca 0.21 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.62 2kh2 h ILE 106 Cb 0.62 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.17 2kh2 h ILE 106 CO 1.04 0.00 0.00 -0.46 -1.05 0.00 0.00 178.15 177.68 2kh2 n ASN 107 N -2.74 0.00 -0.81 2.16 0.23 -1.26 -4.98 115.26 107.86 2kh2 n ASN 107 Ca -0.03 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.13 2kh2 n ASN 107 Cb 0.11 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 37.88 2kh2 n ASN 107 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2kh2 n ASN 108 N 0.00 2.68 -4.39 0.53 5.03 -1.26 -4.92 115.26 112.93 2kh2 n ASN 108 Ca 0.00 -1.84 -0.27 0.00 0.87 0.00 0.00 54.58 53.34 2kh2 n ASN 108 Cb 0.00 0.11 -0.12 0.00 -1.02 0.00 0.00 39.78 38.75 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2kh2 s LYS 109 N -2.00 1.41 0.00 3.52 -0.14 -1.26 -4.96 119.74 116.32 2kh2 s LYS 109 Ca 0.24 -1.42 0.05 0.00 -1.36 0.00 0.00 55.97 53.48 2kh2 s LYS 109 Cb 0.18 -1.75 -0.03 0.00 -1.68 0.00 0.00 37.83 34.55 2kh2 s LYS 109 CO 0.34 0.39 -0.13 -0.51 -0.76 0.00 0.00 175.35 174.68 2kh2 s LEU 110 N -2.41 2.85 0.03 3.17 1.43 -0.28 -3.81 118.68 119.66 2kh2 s LEU 110 Ca 0.17 -0.26 0.08 0.00 -1.03 0.00 0.00 54.13 53.09 2kh2 s LEU 110 Cb -0.08 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2kh2 s LEU 110 CO 0.08 0.29 -0.25 -1.61 0.23 0.00 0.00 176.35 175.09 2kh2 s GLU 111 N -1.24 1.76 -0.32 1.70 2.02 -0.89 -0.27 118.70 121.46 2kh2 s GLU 111 Ca 0.15 -1.02 -0.06 0.00 0.02 0.00 0.00 54.97 54.06 2kh2 s GLU 111 Cb -0.11 -1.87 0.03 0.00 0.10 0.00 0.00 34.13 32.29 2kh2 s GLU 111 CO 0.05 0.49 0.07 -0.06 0.02 0.00 0.00 175.26 175.83 2kh2 s PHE 112 N -0.75 3.22 0.05 1.61 0.08 -1.26 -0.01 117.98 120.91 2kh2 s PHE 112 Ca 0.10 -1.38 -0.04 0.00 0.12 0.00 0.00 56.93 55.73 2kh2 s PHE 112 Cb -0.10 -2.23 -0.05 0.00 -0.57 0.00 0.00 43.02 40.07 2kh2 s PHE 112 CO 0.01 -0.70 0.26 -2.00 -0.10 0.00 0.00 175.22 172.69 2kh2 s GLU 113 N 1.40 3.53 -0.16 0.44 2.12 0.01 -1.62 118.70 124.42 2kh2 s GLU 113 Ca -0.01 -0.21 -0.23 0.00 0.36 0.00 0.00 54.97 54.88 2kh2 s GLU 113 Cb -0.19 -3.02 -0.02 0.00 0.26 0.00 0.00 34.13 31.16 2kh2 s GLU 113 CO 0.02 0.61 0.73 0.45 -0.54 0.00 0.00 175.26 176.52 2kh2 s SER 114 N -2.10 6.86 0.23 -1.70 0.15 0.20 0.79 113.70 118.13 2kh2 s SER 114 Ca 0.32 1.04 0.01 0.00 0.70 0.00 0.00 55.95 58.03 2kh2 s SER 114 Cb -0.13 -2.40 0.24 0.00 -1.71 0.00 0.00 66.02 62.01 2kh2 s SER 114 CO 0.21 -0.29 1.57 0.00 1.20 0.00 0.00 173.24 175.93 2kh2 h ALA 115 N 7.27 0.85 -0.67 5.45 0.00 -1.73 -2.97 119.26 127.47 2kh2 h ALA 115 Ca -0.32 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.06 2kh2 h ALA 115 Cb 1.15 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 2kh2 h ALA 115 CO 0.80 0.68 0.28 0.37 0.00 0.00 0.00 179.25 181.37 2kh2 h GLN 116 N 0.30 0.99 -3.64 0.00 5.75 -1.73 -3.38 115.11 113.40 2kh2 h GLN 116 Ca 0.01 -0.17 -0.61 0.00 -0.15 0.00 0.00 58.65 57.73 2kh2 h GLN 116 Cb 1.02 -0.16 -0.40 0.00 1.07 0.00 0.00 27.48 29.01 2kh2 h GLN 116 CO 0.09 0.82 -0.74 -0.06 -2.65 0.00 0.00 178.83 176.29 2kh2 s PHE 117 N -5.58 2.27 0.53 3.99 0.08 -1.13 -5.06 117.98 113.08 2kh2 s PHE 117 Ca -0.13 -2.23 -0.22 0.00 0.12 0.00 0.00 56.93 54.47 2kh2 s PHE 117 Cb 0.14 -2.06 -0.06 0.00 -0.57 0.00 0.00 43.02 40.47 2kh2 s PHE 117 CO 0.81 -0.86 1.36 -2.30 -0.10 0.00 0.00 175.22 174.12 2kh2 n PRO 118 N 4.33 1.76 -0.83 0.24 -0.02 -1.19 -2.37 135.00 136.93 2kh2 n PRO 118 Ca 0.02 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 2kh2 n PRO 118 Cb 0.40 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 2kh2 n PRO 118 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2kh2 n ASN 119 N -0.84 0.00 -4.43 2.55 5.03 -1.26 -4.99 115.26 111.32 2kh2 n ASN 119 Ca 0.10 0.00 -0.36 0.00 0.87 0.00 0.00 54.58 55.18 2kh2 n ASN 119 Cb 0.44 -0.26 -0.13 0.00 -1.02 0.00 0.00 39.78 38.81 2kh2 n ASN 119 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 2kh2 s TRP 120 N -3.56 3.07 0.22 3.10 0.52 -1.00 -4.35 118.94 116.94 2kh2 s TRP 120 Ca 0.00 -0.49 0.11 0.00 0.02 0.00 0.00 56.10 55.74 2kh2 s TRP 120 Cb 0.00 -2.22 -0.05 0.00 -1.15 0.00 0.00 33.47 30.06 2kh2 s TRP 120 CO 0.00 -0.38 -0.22 0.71 0.02 0.00 0.00 176.95 177.08 2kh2 s TYR 121 N 1.58 2.31 -0.19 -1.98 1.51 0.54 -0.62 117.35 120.50 2kh2 s TYR 121 Ca 0.06 -0.35 -0.29 0.00 -1.01 0.00 0.00 57.07 55.49 2kh2 s TYR 121 Cb -0.15 -1.10 -0.04 0.00 -0.11 0.00 0.00 41.96 40.56 2kh2 s TYR 121 CO 0.03 0.56 1.75 0.42 -1.11 0.00 0.00 175.55 177.20 2kh2 s ILE 122 N -1.91 3.51 0.16 2.71 1.01 -0.64 -0.91 121.20 125.13 2kh2 s ILE 122 Ca 0.24 0.57 0.08 0.00 0.00 0.00 0.00 60.65 61.53 2kh2 s ILE 122 Cb -0.07 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 2kh2 s ILE 122 CO 0.11 -0.22 -0.09 -0.44 0.00 0.00 0.00 174.94 174.31 2kh2 s SER 123 N 4.88 4.35 0.05 3.58 0.01 0.61 -4.48 113.70 122.70 2kh2 s SER 123 Ca 0.78 -0.50 0.06 0.00 1.31 0.00 0.00 55.95 57.60 2kh2 s SER 123 Cb -0.28 -0.79 -0.03 0.00 0.21 0.00 0.00 66.02 65.14 2kh2 s SER 123 CO 0.32 0.12 -0.17 0.42 0.41 0.00 0.00 173.24 174.34 2kh2 s THR 124 N -1.55 1.38 0.51 1.44 -4.23 0.52 -1.94 115.64 111.77 2kh2 s THR 124 Ca 0.24 -1.17 -0.15 0.00 -1.18 0.00 0.00 61.69 59.43 2kh2 s THR 124 Cb -0.10 -1.24 -0.07 0.00 1.34 0.00 0.00 72.50 72.43 2kh2 s THR 124 CO 0.15 0.05 0.96 -0.44 -0.54 0.00 0.00 174.62 174.80 2kh2 s SER 125 N -1.31 6.59 0.38 3.99 0.01 -1.26 -0.05 113.70 122.05 2kh2 s SER 125 Ca 0.04 1.50 0.17 0.00 1.31 0.00 0.00 55.95 58.98 2kh2 s SER 125 Cb -0.09 -2.48 0.75 0.00 0.21 0.00 0.00 66.02 64.41 2kh2 s SER 125 CO 0.02 -0.58 1.78 1.56 0.41 0.00 0.00 173.24 176.43 2kh2 h GLN 126 N 0.89 0.00 -7.18 12.44 1.08 -1.96 -3.45 115.11 116.94 2kh2 h GLN 126 Ca -0.47 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.22 2kh2 h GLN 126 Cb 1.19 0.00 0.10 0.00 -0.05 0.00 0.00 27.48 28.72 2kh2 h GLN 126 CO 0.62 0.37 0.39 0.00 -0.95 0.00 0.00 178.83 179.26 2kh2 s ALA 127 N -3.82 2.46 0.32 3.87 0.00 -1.26 -5.02 121.76 118.31 2kh2 s ALA 127 Ca -0.01 0.64 -0.19 0.00 0.00 0.00 0.00 51.96 52.40 2kh2 s ALA 127 Cb 0.12 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.80 2kh2 s ALA 127 CO 0.69 -1.27 0.80 -2.00 0.00 0.00 0.00 175.76 173.99 2kh2 s GLU 128 N -3.93 4.19 -1.38 0.00 2.56 -1.26 -3.99 118.70 114.90 2kh2 s GLU 128 Ca 0.69 0.90 -0.03 0.00 0.00 0.00 0.00 54.97 56.53 2kh2 s GLU 128 Cb -0.22 -2.55 0.00 0.00 2.00 0.00 0.00 34.13 33.36 2kh2 s GLU 128 CO 0.39 0.20 0.46 -1.71 -0.56 0.00 0.00 175.26 174.04 2kh2 n ASN 129 N -0.01 -5.51 -4.75 -1.70 5.15 -0.89 -5.00 115.26 102.55 2kh2 n ASN 129 Ca 0.02 -0.22 -0.34 0.00 -0.60 0.00 0.00 54.58 53.45 2kh2 n ASN 129 Cb 0.52 -4.37 -0.08 0.00 -0.53 0.00 0.00 39.78 35.32 2kh2 n ASN 129 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2kh2 s MET 130 N -5.46 3.04 1.06 1.20 -1.94 -1.18 -4.84 119.30 111.18 2kh2 s MET 130 Ca 0.23 -0.44 -0.13 0.00 -1.71 0.00 0.00 55.69 53.64 2kh2 s MET 130 Cb -0.10 -2.84 0.22 0.00 2.01 0.00 0.00 34.83 34.12 2kh2 s MET 130 CO 0.28 0.67 1.07 -2.14 -0.01 0.00 0.00 175.02 174.90 2kh2 s PRO 131 N -1.38 -0.07 -0.13 2.03 0.02 -1.26 -0.35 135.00 133.86 2kh2 s PRO 131 Ca 0.19 0.62 -0.09 0.00 0.02 0.00 0.00 61.00 61.73 2kh2 s PRO 131 Cb -0.12 -1.67 -0.04 0.00 0.02 0.00 0.00 34.50 32.69 2kh2 s PRO 131 CO 0.09 -3.09 0.17 0.08 -0.33 0.00 0.00 177.00 173.91 2kh2 s VAL 132 N -2.80 5.44 0.30 3.83 1.01 -0.39 -4.39 120.40 123.39 2kh2 s VAL 132 Ca 0.66 0.27 0.05 0.00 0.00 0.00 0.00 61.98 62.96 2kh2 s VAL 132 Cb -0.21 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 2kh2 s VAL 132 CO 0.60 0.56 0.27 0.72 0.00 0.00 0.00 175.10 177.24 2kh2 s PHE 133 N -0.59 1.56 -0.24 5.22 -0.71 -0.82 -4.83 117.98 117.58 2kh2 s PHE 133 Ca 0.14 -1.57 -0.11 0.00 -1.04 0.00 0.00 56.93 54.35 2kh2 s PHE 133 Cb -0.12 -0.62 -0.05 0.00 -1.21 0.00 0.00 43.02 41.02 2kh2 s PHE 133 CO 0.03 -0.85 0.20 -1.17 -1.34 0.00 0.00 175.22 172.09 2kh2 s LEU 134 N -3.31 4.12 0.14 -1.99 2.96 -1.26 -0.28 118.68 119.05 2kh2 s LEU 134 Ca 0.39 0.17 0.07 0.00 -0.22 0.00 0.00 54.13 54.55 2kh2 s LEU 134 Cb 0.03 -2.17 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 2kh2 s LEU 134 CO 0.24 0.04 -0.17 -0.83 -1.32 0.00 0.00 176.35 174.31 2kh2 s GLY 135 N 1.10 1.25 0.00 7.98 0.00 -0.08 -4.88 107.32 112.68 2kh2 s GLY 135 Ca 0.09 -1.39 0.11 0.00 0.00 0.00 0.00 44.72 43.53 2kh2 s GLY 135 CO 0.05 -1.44 1.20 0.61 0.00 0.00 0.00 173.10 173.52 2kh2 n GLY 136 N 0.45 2.37 2.73 0.20 0.00 -1.26 -0.34 105.19 109.33 2kh2 n GLY 136 Ca -0.15 -0.37 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 2kh2 n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2kh2 n THR 137 N 0.52 5.37 -1.83 2.61 -2.24 -1.26 -4.91 114.28 112.55 2kh2 n THR 137 Ca 0.11 -5.89 -0.42 0.00 -2.27 0.00 0.00 64.05 55.58 2kh2 n THR 137 Cb 0.41 -1.60 -0.03 0.00 -2.10 0.00 0.00 70.33 67.01 2kh2 n THR 137 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2kh2 s LYS 138 N -3.95 4.17 -0.38 -0.78 2.20 -1.26 -1.45 119.74 118.29 2kh2 s LYS 138 Ca 0.40 2.48 0.00 0.00 -0.36 0.00 0.00 55.97 58.49 2kh2 s LYS 138 Cb 0.19 -3.27 0.00 0.00 -1.51 0.00 0.00 37.83 33.24 2kh2 s LYS 138 CO -0.10 -0.72 0.00 0.41 -0.36 0.00 0.00 175.35 174.58 2kh2 n GLY 139 N 3.95 0.66 0.00 5.54 0.00 -1.26 -5.01 105.19 109.07 2kh2 n GLY 139 Ca 0.15 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2kh2 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kh2 n GLY 140 N -2.52 0.61 0.14 -0.02 0.00 -0.53 -5.02 105.19 97.85 2kh2 n GLY 140 Ca -0.04 -0.09 -0.07 0.00 0.00 0.00 0.00 46.02 45.82 2kh2 n GLY 140 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2kh2 h GLN 141 N 0.00 -0.22 -7.21 1.61 7.50 -1.95 -3.46 115.11 111.38 2kh2 h GLN 141 Ca 0.00 0.02 -0.51 0.00 0.50 0.00 0.00 58.65 58.65 2kh2 h GLN 141 Cb 0.00 0.05 0.12 0.00 0.05 0.00 0.00 27.48 27.70 2kh2 h GLN 141 CO 0.00 0.07 0.37 -0.51 -1.50 0.00 0.00 178.83 177.26 2kh2 s ASP 142 N -5.41 4.77 -0.08 1.46 1.01 -1.26 -4.75 116.67 112.40 2kh2 s ASP 142 Ca -0.08 2.06 -0.25 0.00 0.71 0.00 0.00 52.55 54.99 2kh2 s ASP 142 Cb 0.00 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.35 2kh2 s ASP 142 CO 0.30 -1.86 0.78 -0.63 0.21 0.00 0.00 175.17 173.97 2kh2 s ILE 143 N -2.34 4.97 -0.54 0.77 1.01 0.93 -4.55 121.20 121.45 2kh2 s ILE 143 Ca 0.68 1.59 0.05 0.00 0.00 0.00 0.00 60.65 62.97 2kh2 s ILE 143 Cb -0.22 -4.11 0.02 0.00 0.01 0.00 0.00 42.46 38.16 2kh2 s ILE 143 CO 0.44 0.18 0.55 0.35 0.00 0.00 0.00 174.94 176.46 2kh2 n THR 144 N 4.06 0.00 -4.28 2.92 -2.24 -1.26 -0.35 114.28 113.13 2kh2 n THR 144 Ca 0.01 -0.47 -0.32 0.00 -2.27 0.00 0.00 64.05 61.00 2kh2 n THR 144 Cb 0.51 1.08 -0.09 0.00 -2.10 0.00 0.00 70.33 69.73 2kh2 n THR 144 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2kh2 s ASP 145 N -0.69 5.08 0.29 3.42 -4.77 -1.26 -4.29 116.67 114.45 2kh2 s ASP 145 Ca 0.05 -0.03 0.04 0.00 -3.30 0.00 0.00 52.55 49.31 2kh2 s ASP 145 Cb 0.04 -1.31 -0.03 0.00 -1.09 0.00 0.00 42.92 40.53 2kh2 s ASP 145 CO 0.10 0.27 0.20 -0.36 0.70 0.00 0.00 175.17 176.08 2kh2 s PHE 146 N -1.10 1.55 0.36 2.11 0.08 0.62 -3.93 117.98 117.67 2kh2 s PHE 146 Ca 0.20 -1.49 0.08 0.00 0.12 0.00 0.00 56.93 55.84 2kh2 s PHE 146 Cb -0.11 -0.73 -0.04 0.00 -0.57 0.00 0.00 43.02 41.57 2kh2 s PHE 146 CO 0.11 -0.69 0.17 0.95 -0.10 0.00 0.00 175.22 175.65 2kh2 s THR 147 N -3.68 2.87 -0.14 0.64 -4.23 0.53 -1.13 115.64 110.50 2kh2 s THR 147 Ca 0.38 -1.67 -0.01 0.00 -1.18 0.00 0.00 61.69 59.22 2kh2 s THR 147 Cb 0.04 -2.98 0.03 0.00 1.34 0.00 0.00 72.50 70.94 2kh2 s THR 147 CO 0.20 -0.14 -0.06 -0.32 -0.54 0.00 0.00 174.62 173.76 2kh2 s MET 148 N -3.88 1.43 -0.22 3.99 1.75 -1.26 -3.85 119.30 117.27 2kh2 s MET 148 Ca 0.39 -0.39 0.01 0.00 -1.25 0.00 0.00 55.69 54.44 2kh2 s MET 148 Cb -0.01 -1.82 0.05 0.00 2.84 0.00 0.00 34.83 35.89 2kh2 s MET 148 CO 0.23 -0.37 -0.07 -0.65 -0.65 0.00 0.00 175.02 173.52 2kh2 s GLN 149 N 1.68 1.70 0.22 4.11 1.11 -0.98 -4.96 119.66 122.53 2kh2 s GLN 149 Ca 0.02 -0.91 -0.30 0.00 0.01 0.00 0.00 55.36 54.19 2kh2 s GLN 149 Cb -0.14 -2.49 -0.08 0.00 -1.01 0.00 0.00 33.01 29.28 2kh2 s GLN 149 CO -0.08 -0.54 0.93 -0.06 0.01 0.00 0.00 175.29 175.55 2kh2 s PHE 150 N 1.42 3.96 0.50 0.91 0.08 -1.26 -0.51 117.98 123.07 2kh2 s PHE 150 Ca -0.04 1.87 0.06 0.00 0.12 0.00 0.00 56.93 58.95 2kh2 s PHE 150 Cb -0.18 -2.97 0.02 0.00 -0.57 0.00 0.00 43.02 39.32 2kh2 s PHE 150 CO -0.07 0.43 0.40 0.14 -0.10 0.00 0.00 175.22 176.03 2kh2 s VAL 151 N -1.03 1.98 -1.20 -0.44 -7.23 -0.71 -4.97 120.40 106.80 2kh2 s VAL 151 Ca 0.41 -1.44 -0.14 0.00 -1.81 0.00 0.00 61.98 59.00 2kh2 s VAL 151 Cb -0.25 -2.42 0.17 0.00 0.56 0.00 0.00 36.38 34.43 2kh2 s VAL 151 CO 0.31 0.00 1.43 -0.44 -0.31 0.00 0.00 175.10 176.09 2kh2 s SER 152 N -4.24 7.07 0.00 4.85 0.01 -1.26 -4.84 113.70 115.29 2kh2 s SER 152 Ca 0.40 -2.99 0.00 0.00 1.31 0.00 0.00 55.95 54.67 2kh2 s SER 152 Cb -0.02 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.81 2kh2 s SER 152 CO 0.24 -0.75 0.00 -1.20 0.41 0.00 0.00 173.24 171.94