#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 0.68 -5.08 0.00 0.13 -2.08 -3.43 132.00 122.22 2kh2 h PRO 2 Ca 0.00 -0.25 -0.52 0.00 -0.87 0.00 0.00 66.00 64.36 2kh2 h PRO 2 Cb 0.00 -0.04 -0.31 0.00 0.13 0.00 0.00 31.00 30.78 2kh2 h PRO 2 CO 0.00 0.82 -0.82 0.54 -0.23 0.00 0.00 178.00 178.31 2kh2 s VAL 3 N -4.84 1.21 0.24 1.56 0.11 -1.26 -5.14 120.40 112.28 2kh2 s VAL 3 Ca -0.13 -0.60 0.08 0.00 -2.93 0.00 0.00 61.98 58.40 2kh2 s VAL 3 Cb 0.09 -1.05 -0.04 0.00 -1.53 0.00 0.00 36.38 33.86 2kh2 s VAL 3 CO 0.80 0.36 0.08 -0.13 -3.33 0.00 0.00 175.10 172.87 2kh2 s ARG 4 N 0.07 2.58 -0.01 1.54 0.52 -1.26 -5.02 118.95 117.36 2kh2 s ARG 4 Ca -0.03 -1.20 0.01 0.00 -0.52 0.00 0.00 55.73 53.99 2kh2 s ARG 4 Cb -0.10 -2.37 0.01 0.00 0.52 0.00 0.00 34.95 33.00 2kh2 s ARG 4 CO 0.01 0.40 -0.03 0.45 0.02 0.00 0.00 175.30 176.16 2kh2 s SER 5 N -3.58 0.45 0.12 0.23 0.15 -1.26 -2.12 113.70 107.69 2kh2 s SER 5 Ca 0.31 -0.06 0.02 0.00 0.70 0.00 0.00 55.95 56.93 2kh2 s SER 5 Cb -0.08 -0.13 -0.04 0.00 -1.71 0.00 0.00 66.02 64.07 2kh2 s SER 5 CO 0.22 -0.01 0.20 -0.76 1.20 0.00 0.00 173.24 174.09 2kh2 s LEU 6 N 0.32 4.14 -0.18 3.45 1.43 0.63 -4.88 118.68 123.58 2kh2 s LEU 6 Ca -0.03 0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2kh2 s LEU 6 Cb -0.06 -2.75 0.03 0.00 0.03 0.00 0.00 46.19 43.44 2kh2 s LEU 6 CO -0.01 0.11 -0.14 0.20 0.23 0.00 0.00 176.35 176.74 2kh2 s ASN 7 N -2.86 3.17 0.21 2.29 0.01 -1.26 0.51 114.94 117.01 2kh2 s ASN 7 Ca 0.33 -0.73 -0.09 0.00 -0.71 0.00 0.00 52.86 51.65 2kh2 s ASN 7 Cb -0.12 -1.30 -0.01 0.00 0.41 0.00 0.00 41.25 40.23 2kh2 s ASN 7 CO 0.26 -0.08 0.35 0.00 -1.51 0.00 0.00 177.10 176.11 2kh2 s THR 9 N -4.03 3.09 -0.11 0.00 2.01 0.72 -1.18 115.64 116.14 2kh2 s THR 9 Ca 0.24 -1.61 0.02 0.00 0.31 0.00 0.00 61.69 60.65 2kh2 s THR 9 Cb 0.02 -2.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.02 2kh2 s THR 9 CO 0.07 -0.05 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.01 2kh2 s LEU 10 N -2.63 2.43 -0.04 4.42 1.43 -1.26 -0.86 118.68 122.18 2kh2 s LEU 10 Ca 0.23 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.96 2kh2 s LEU 10 Cb -0.09 -1.51 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 2kh2 s LEU 10 CO 0.14 0.19 -0.18 -0.13 0.23 0.00 0.00 176.35 176.59 2kh2 s ARG 11 N 0.21 1.78 0.91 1.70 1.81 -1.03 -4.26 118.95 120.07 2kh2 s ARG 11 Ca -0.11 -0.64 -0.13 0.00 -1.72 0.00 0.00 55.73 53.12 2kh2 s ARG 11 Cb -0.16 -1.57 0.17 0.00 -0.45 0.00 0.00 34.95 32.94 2kh2 s ARG 11 CO 0.06 0.28 1.26 0.16 -0.68 0.00 0.00 175.30 176.38 2kh2 s ASP 12 N -0.07 3.47 0.33 0.23 -4.77 -1.15 -0.83 116.67 113.87 2kh2 s ASP 12 Ca -0.02 0.25 0.25 0.00 -3.30 0.00 0.00 52.55 49.73 2kh2 s ASP 12 Cb -0.11 -0.40 1.16 0.00 -1.09 0.00 0.00 42.92 42.48 2kh2 s ASP 12 CO 0.02 -2.50 1.75 0.28 0.70 0.00 0.00 175.17 175.41 2kh2 h SER 13 N -1.41 0.00 0.09 2.11 0.02 -1.94 -1.24 113.55 111.18 2kh2 h SER 13 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2kh2 h SER 13 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2kh2 h SER 13 CO 0.42 0.00 -0.19 0.00 -1.14 0.00 0.00 176.83 175.92 2kh2 n GLN 14 N -2.36 1.32 -2.07 3.45 1.13 -1.26 -4.93 117.38 112.66 2kh2 n GLN 14 Ca 0.00 -0.89 -0.05 0.00 -1.94 0.00 0.00 57.00 54.12 2kh2 n GLN 14 Cb 0.15 -1.48 -0.00 0.00 0.11 0.00 0.00 30.24 29.02 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 -0.06 -0.40 -3.25 -1.09 1.13 -0.47 -5.00 117.38 108.25 2kh2 n GLN 15 Ca 0.14 0.25 -0.30 0.00 -1.94 0.00 0.00 57.00 55.15 2kh2 n GLN 15 Cb 0.40 -4.03 -0.04 0.00 0.11 0.00 0.00 30.24 26.68 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 -4.20 3.73 0.10 -1.09 1.02 -1.26 -4.32 119.74 113.72 2kh2 s LYS 16 Ca 0.00 0.21 0.10 0.00 0.02 0.00 0.00 55.97 56.30 2kh2 s LYS 16 Cb 0.00 -2.58 -0.04 0.00 -0.52 0.00 0.00 37.83 34.69 2kh2 s LYS 16 CO 0.00 0.19 -0.25 -1.12 -0.92 0.00 0.00 175.35 173.24 2kh2 s SER 17 N -2.89 3.11 -0.17 2.83 0.01 0.12 -2.95 113.70 113.76 2kh2 s SER 17 Ca 0.47 -0.69 -0.25 0.00 1.31 0.00 0.00 55.95 56.79 2kh2 s SER 17 Cb -0.11 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 65.89 2kh2 s SER 17 CO 0.27 0.18 0.82 -0.76 0.41 0.00 0.00 173.24 174.15 2kh2 s LEU 18 N -1.80 4.18 0.19 2.44 1.43 -1.26 -1.26 118.68 122.60 2kh2 s LEU 18 Ca 0.12 1.15 0.09 0.00 -1.03 0.00 0.00 54.13 54.46 2kh2 s LEU 18 Cb -0.10 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.87 2kh2 s LEU 18 CO 0.05 -0.38 -0.19 0.68 0.23 0.00 0.00 176.35 176.74 2kh2 s VAL 19 N 2.10 1.94 -0.53 -1.59 -7.23 0.39 -2.86 120.40 112.63 2kh2 s VAL 19 Ca 0.38 -2.02 -0.29 0.00 -1.81 0.00 0.00 61.98 58.24 2kh2 s VAL 19 Cb -0.17 -1.95 0.03 0.00 0.56 0.00 0.00 36.38 34.85 2kh2 s VAL 19 CO 0.12 -0.34 1.18 -0.04 -0.31 0.00 0.00 175.10 175.72 2kh2 s MET 20 N -2.97 3.60 0.00 4.82 -1.94 -1.26 -1.88 119.30 119.67 2kh2 s MET 20 Ca 0.19 0.41 0.00 0.00 -1.71 0.00 0.00 55.69 54.58 2kh2 s MET 20 Cb -0.05 -3.97 0.00 0.00 2.01 0.00 0.00 34.83 32.81 2kh2 s MET 20 CO 0.08 -1.56 0.01 0.45 -0.01 0.00 0.00 175.02 173.98 2kh2 n SER 21 N 8.24 0.00 -1.83 3.03 2.88 -0.21 -4.98 113.62 120.76 2kh2 n SER 21 Ca 0.10 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.85 2kh2 n SER 21 Cb 0.49 -0.20 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 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 2.27 2.96 0.31 0.46 0.00 -1.15 -4.95 105.19 105.09 2kh2 n GLY 22 Ca 0.00 -2.15 0.01 0.00 0.00 0.00 0.00 46.02 43.88 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 0.70 -0.29 1.61 0.13 -2.03 -3.12 132.00 129.00 2kh2 h PRO 23 Ca 0.00 -0.07 -0.24 0.00 -0.87 0.00 0.00 66.00 64.82 2kh2 h PRO 23 Cb 0.00 -0.14 -0.30 0.00 0.13 0.00 0.00 31.00 30.68 2kh2 h PRO 23 CO 0.00 0.53 -0.87 0.66 -0.23 0.00 0.00 178.00 178.09 2kh2 n TYR 24 N -4.40 0.98 -4.38 1.56 4.01 -1.26 -5.05 117.16 108.62 2kh2 n TYR 24 Ca 0.04 -1.57 -0.21 0.00 -0.16 0.00 0.00 57.90 56.00 2kh2 n TYR 24 Cb 0.11 -0.24 -0.16 0.00 -0.31 0.00 0.00 39.34 38.74 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 -2.63 1.12 -0.07 -0.72 2.12 -1.18 -4.51 118.70 112.83 2kh2 s GLU 25 Ca 0.37 -0.28 0.04 0.00 0.36 0.00 0.00 54.97 55.47 2kh2 s GLU 25 Cb 0.37 -1.01 -0.00 0.00 0.26 0.00 0.00 34.13 33.75 2kh2 s GLU 25 CO -0.06 0.03 -0.21 -0.51 -0.54 0.00 0.00 175.26 173.97 2kh2 s LEU 26 N 0.52 1.98 0.16 2.70 1.43 -1.26 -1.04 118.68 123.18 2kh2 s LEU 26 Ca -0.09 -0.46 0.08 0.00 -1.03 0.00 0.00 54.13 52.63 2kh2 s LEU 26 Cb -0.12 -1.22 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 2kh2 s LEU 26 CO 0.01 0.16 -0.18 -0.54 0.23 0.00 0.00 176.35 176.04 2kh2 s LYS 27 N 0.19 1.25 -0.20 1.70 1.02 -0.78 -2.91 119.74 120.00 2kh2 s LYS 27 Ca -0.11 -1.40 -0.02 0.00 0.02 0.00 0.00 55.97 54.45 2kh2 s LYS 27 Cb -0.15 -1.28 -0.00 0.00 -0.52 0.00 0.00 37.83 35.88 2kh2 s LYS 27 CO 0.05 0.26 -0.09 0.00 -0.92 0.00 0.00 175.35 174.65 2kh2 s ALA 28 N -2.11 2.69 0.11 5.17 0.00 0.63 -0.46 121.76 127.79 2kh2 s ALA 28 Ca 0.15 -1.16 -0.12 0.00 0.00 0.00 0.00 51.96 50.84 2kh2 s ALA 28 Cb -0.05 -1.54 0.01 0.00 0.00 0.00 0.00 23.12 21.54 2kh2 s ALA 28 CO 0.06 -0.35 0.30 -0.48 0.00 0.00 0.00 175.76 175.28 2kh2 s LEU 29 N 1.34 0.91 0.08 0.00 0.05 -0.39 -2.59 118.68 118.09 2kh2 s LEU 29 Ca 0.04 -0.52 -0.31 0.00 0.05 0.00 0.00 54.13 53.40 2kh2 s LEU 29 Cb -0.14 1.43 -0.09 0.00 -2.05 0.00 0.00 46.19 45.33 2kh2 s LEU 29 CO -0.05 -0.80 1.79 -1.00 -0.55 0.00 0.00 176.35 175.74 2kh2 s HIS 30 N -3.84 2.06 -0.33 3.48 3.76 -1.26 0.15 115.29 119.31 2kh2 s HIS 30 Ca 0.05 0.01 0.01 0.00 -0.15 0.00 0.00 55.06 54.98 2kh2 s HIS 30 Cb 0.03 -4.11 0.10 0.00 1.11 0.00 0.00 32.58 29.71 2kh2 s HIS 30 CO -0.11 -4.64 0.10 -1.17 -0.85 0.00 0.00 174.74 168.07 2kh2 s LEU 31 N 3.09 2.90 0.00 0.89 2.96 -1.26 -4.89 118.68 122.37 2kh2 s LEU 31 Ca 0.80 -1.86 0.00 0.00 -0.22 0.00 0.00 54.13 52.84 2kh2 s LEU 31 Cb -0.43 -1.07 0.00 0.00 0.50 0.00 0.00 46.19 45.19 2kh2 s LEU 31 CO 0.36 -0.39 0.00 0.00 -1.32 0.00 0.00 176.35 174.99 2kh2 n GLN 32 N 4.57 3.31 0.00 1.98 3.00 -1.26 -4.78 117.38 124.20 2kh2 n GLN 32 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2kh2 n GLN 32 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.65 2kh2 n GLN 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2kh2 n GLY 33 N 4.93 2.56 1.38 1.08 0.00 -1.26 -2.60 105.19 111.28 2kh2 n GLY 33 Ca 0.00 -0.41 0.09 0.00 0.00 0.00 0.00 46.02 45.70 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 11.14 3.16 -0.18 1.61 -0.06 -1.26 -4.13 117.38 127.66 2kh2 n GLN 34 Ca 0.00 -2.49 0.08 0.00 -2.00 0.00 0.00 57.00 52.59 2kh2 n GLN 34 Cb 0.00 -1.73 0.23 0.00 -4.06 0.00 0.00 30.24 24.68 2kh2 n GLN 34 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 2kh2 n ASP 35 N 1.12 2.14 0.17 1.69 9.92 -1.07 -4.20 116.55 126.31 2kh2 n ASP 35 Ca 0.23 -1.93 0.17 0.00 -0.53 0.00 0.00 54.79 52.73 2kh2 n ASP 35 Cb 0.73 -0.23 0.78 0.00 -0.64 0.00 0.00 41.12 41.76 2kh2 n ASP 35 CO 0.00 0.00 0.00 -0.03 0.13 0.00 0.00 177.20 177.30 2kh2 h MET 36 N 2.48 0.00 0.00 -1.24 4.05 -1.72 -1.26 114.93 117.24 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 0.56 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.36 2kh2 h MET 36 CO 0.00 0.00 0.02 0.39 0.23 0.00 0.00 176.91 177.55 2kh2 n GLU 37 N -3.97 0.12 0.00 0.39 -0.58 -1.26 -1.12 120.64 114.22 2kh2 n GLU 37 Ca 0.03 0.62 0.15 0.00 -0.42 0.00 0.00 57.16 57.54 2kh2 n GLU 37 Cb 0.37 -1.93 0.76 0.00 -0.57 0.00 0.00 31.44 30.07 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 -2.18 0.57 -1.96 3.49 6.02 -0.47 -4.87 117.38 117.98 2kh2 n GLN 38 Ca -0.01 -0.05 -0.41 0.00 -0.01 0.00 0.00 57.00 56.52 2kh2 n GLN 38 Cb 0.05 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.79 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 -2.46 4.24 -0.02 -1.09 -2.07 -0.28 -4.58 119.66 113.39 2kh2 s GLN 39 Ca 0.32 2.37 -0.16 0.00 -1.82 0.00 0.00 55.36 56.07 2kh2 s GLN 39 Cb 0.21 -3.06 -0.05 0.00 -1.09 0.00 0.00 33.01 29.01 2kh2 s GLN 39 CO 0.45 -0.42 0.45 0.08 -1.32 0.00 0.00 175.29 174.53 2kh2 s VAL 40 N -0.48 5.03 -0.22 3.63 1.01 -1.14 -5.05 120.40 123.19 2kh2 s VAL 40 Ca 0.56 0.93 -0.10 0.00 0.00 0.00 0.00 61.98 63.37 2kh2 s VAL 40 Cb -0.43 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 2kh2 s VAL 40 CO 0.50 0.50 0.14 -0.69 0.00 0.00 0.00 175.10 175.55 2kh2 s VAL 41 N -0.58 5.29 -0.14 2.92 1.01 -1.26 -4.70 120.40 122.94 2kh2 s VAL 41 Ca 0.25 0.15 -0.06 0.00 0.00 0.00 0.00 61.98 62.33 2kh2 s VAL 41 Cb -0.17 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2kh2 s VAL 41 CO 0.13 0.39 0.05 -0.36 0.00 0.00 0.00 175.10 175.31 2kh2 s PHE 42 N 0.78 3.26 -0.22 5.22 0.08 -0.33 -1.45 117.98 125.33 2kh2 s PHE 42 Ca 0.07 0.15 -0.14 0.00 0.12 0.00 0.00 56.93 57.13 2kh2 s PHE 42 Cb -0.13 -1.97 -0.04 0.00 -0.57 0.00 0.00 43.02 40.31 2kh2 s PHE 42 CO 0.02 0.32 0.33 -1.12 -0.10 0.00 0.00 175.22 174.66 2kh2 s SER 43 N -0.19 6.33 -0.40 1.36 0.01 0.98 -1.51 113.70 120.28 2kh2 s SER 43 Ca 0.07 0.39 -0.07 0.00 1.31 0.00 0.00 55.95 57.64 2kh2 s SER 43 Cb -0.12 -2.19 0.08 0.00 0.21 0.00 0.00 66.02 64.00 2kh2 s SER 43 CO 0.01 -0.04 0.22 -0.04 0.41 0.00 0.00 173.24 173.81 2kh2 s MET 44 N 1.26 2.47 0.22 12.44 -1.94 0.18 -2.54 119.30 131.40 2kh2 s MET 44 Ca 0.15 -1.51 -0.14 0.00 -1.71 0.00 0.00 55.69 52.48 2kh2 s MET 44 Cb -0.14 -3.68 -0.08 0.00 2.01 0.00 0.00 34.83 32.94 2kh2 s MET 44 CO 0.07 -0.94 0.62 -1.12 -0.01 0.00 0.00 175.02 173.64 2kh2 s SER 45 N 1.97 6.79 -0.97 3.03 0.01 -1.24 -0.27 113.70 123.03 2kh2 s SER 45 Ca 0.03 1.13 -0.24 0.00 1.31 0.00 0.00 55.95 58.18 2kh2 s SER 45 Cb -0.23 -2.31 0.04 0.00 0.21 0.00 0.00 66.02 63.73 2kh2 s SER 45 CO 0.00 -0.03 1.47 -0.36 0.41 0.00 0.00 173.24 174.73 2kh2 s PHE 46 N -1.70 2.43 0.00 2.43 0.08 -0.90 -3.09 117.98 117.23 2kh2 s PHE 46 Ca 0.45 -0.59 0.00 0.00 0.12 0.00 0.00 56.93 56.91 2kh2 s PHE 46 Cb -0.13 -4.63 0.00 0.00 -0.57 0.00 0.00 43.02 37.69 2kh2 s PHE 46 CO 0.20 -1.95 0.00 1.33 -0.10 0.00 0.00 175.22 174.70 2kh2 n VAL 47 N 6.90 0.00 -4.60 -0.44 0.24 -1.25 -4.76 118.33 114.42 2kh2 n VAL 47 Ca 0.29 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.30 2kh2 n VAL 47 Cb 0.50 -1.91 -0.14 0.00 -1.47 0.00 0.00 33.84 30.83 2kh2 n VAL 47 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2kh2 s GLN 48 N -2.16 1.62 0.00 7.34 2.00 -0.78 -4.96 119.66 122.72 2kh2 s GLN 48 Ca 0.00 -1.22 0.00 0.00 -2.00 0.00 0.00 55.36 52.14 2kh2 s GLN 48 Cb 0.00 -1.96 0.00 0.00 0.80 0.00 0.00 33.01 31.85 2kh2 s GLN 48 CO 0.00 0.48 0.00 0.41 -0.50 0.00 0.00 175.29 175.68 2kh2 n GLY 49 N 1.28 -0.51 3.56 2.59 0.00 -1.26 -4.87 105.19 105.98 2kh2 n GLY 49 Ca -0.17 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 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 -1.89 3.82 -1.14 1.61 8.01 -1.26 -4.92 118.70 122.94 2kh2 s GLU 50 Ca 0.00 -1.67 -0.21 0.00 0.01 0.00 0.00 54.97 53.09 2kh2 s GLU 50 Cb 0.00 -5.42 0.03 0.00 -4.31 0.00 0.00 34.13 24.43 2kh2 s GLU 50 CO 0.00 -2.20 1.67 -1.21 0.01 0.00 0.00 175.26 173.54 2kh2 s GLU 51 N 4.34 3.51 0.93 1.61 2.02 -1.26 -4.40 118.70 125.44 2kh2 s GLU 51 Ca 0.50 -1.38 -0.13 0.00 0.02 0.00 0.00 54.97 53.97 2kh2 s GLU 51 Cb 0.02 -5.39 0.20 0.00 0.10 0.00 0.00 34.13 29.07 2kh2 s GLU 51 CO -0.00 -2.56 1.27 -1.12 0.02 0.00 0.00 175.26 172.87 2kh2 s SER 52 N 5.19 3.19 0.00 -0.19 0.01 -0.02 -4.97 113.70 116.91 2kh2 s SER 52 Ca 0.54 0.02 0.28 0.00 1.31 0.00 0.00 55.95 58.10 2kh2 s SER 52 Cb 0.01 -0.06 1.03 0.00 0.21 0.00 0.00 66.02 67.21 2kh2 s SER 52 CO 0.01 -2.66 1.76 -3.20 0.41 0.00 0.00 173.24 169.55 2kh2 n ASN 53 N -3.62 0.33 0.00 2.44 2.85 -1.26 -4.23 115.26 111.76 2kh2 n ASN 53 Ca 0.16 -0.14 0.00 0.00 -0.11 0.00 0.00 54.58 54.50 2kh2 n ASN 53 Cb 0.60 -0.12 0.00 0.00 1.24 0.00 0.00 39.78 41.49 2kh2 n ASN 53 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 2kh2 n ASP 54 N -1.28 2.13 -4.50 1.20 5.75 -1.26 -5.00 116.55 113.59 2kh2 n ASP 54 Ca 0.10 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.45 2kh2 n ASP 54 Cb 0.31 0.01 -0.08 0.00 -1.03 0.00 0.00 41.12 40.34 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 -1.53 3.17 -0.20 0.11 2.20 -1.26 -3.11 119.74 119.12 2kh2 s LYS 55 Ca 0.00 -0.61 -0.03 0.00 -0.36 0.00 0.00 55.97 54.97 2kh2 s LYS 55 Cb 0.00 -3.97 -0.01 0.00 -1.51 0.00 0.00 37.83 32.35 2kh2 s LYS 55 CO 0.00 -0.93 -0.07 0.42 -0.36 0.00 0.00 175.35 174.41 2kh2 s ILE 56 N 2.43 3.19 -0.12 5.43 -1.09 -0.79 -0.84 121.20 129.41 2kh2 s ILE 56 Ca 0.16 -0.56 -0.29 0.00 -2.23 0.00 0.00 60.65 57.73 2kh2 s ILE 56 Cb -0.16 -2.43 -0.03 0.00 -1.58 0.00 0.00 42.46 38.26 2kh2 s ILE 56 CO 0.16 0.45 1.36 -2.16 -1.23 0.00 0.00 174.94 173.52 2kh2 s PRO 57 N 1.31 4.23 0.20 2.79 0.04 -1.26 -0.90 135.00 141.41 2kh2 s PRO 57 Ca 0.04 1.81 0.01 0.00 0.04 0.00 0.00 61.00 62.90 2kh2 s PRO 57 Cb -0.14 -3.79 -0.05 0.00 0.04 0.00 0.00 34.50 30.56 2kh2 s PRO 57 CO -0.03 -0.72 0.06 0.14 0.04 0.00 0.00 177.00 176.49 2kh2 s VAL 58 N 3.48 0.45 0.09 -0.36 -7.23 0.06 -3.90 120.40 113.00 2kh2 s VAL 58 Ca 0.60 -1.98 0.05 0.00 -1.81 0.00 0.00 61.98 58.84 2kh2 s VAL 58 Cb -0.25 -2.36 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 2kh2 s VAL 58 CO 0.19 -0.22 -0.03 0.00 -0.31 0.00 0.00 175.10 174.74 2kh2 s ALA 59 N -3.83 3.21 -0.29 1.32 0.00 -1.18 -0.27 121.76 120.72 2kh2 s ALA 59 Ca 0.31 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 51.15 2kh2 s ALA 59 Cb 0.07 -1.12 0.08 0.00 0.00 0.00 0.00 23.12 22.16 2kh2 s ALA 59 CO 0.09 0.69 0.01 -0.51 0.00 0.00 0.00 175.76 176.03 2kh2 s LEU 60 N -2.29 3.50 0.20 0.00 1.43 -1.25 -3.61 118.68 116.66 2kh2 s LEU 60 Ca 0.25 -1.68 0.03 0.00 -1.03 0.00 0.00 54.13 51.70 2kh2 s LEU 60 Cb -0.12 -1.35 -0.05 0.00 0.03 0.00 0.00 46.19 44.70 2kh2 s LEU 60 CO 0.17 -0.32 -0.01 -0.83 0.23 0.00 0.00 176.35 175.59 2kh2 s GLY 61 N 1.20 1.40 0.27 -3.19 0.00 -1.05 -0.78 107.32 105.16 2kh2 s GLY 61 Ca 0.03 -1.68 -0.29 0.00 0.00 0.00 0.00 44.72 42.78 2kh2 s GLY 61 CO -0.10 -1.61 0.96 1.08 0.00 0.00 0.00 173.10 173.42 2kh2 s LEU 62 N -3.25 4.55 0.06 0.66 1.02 0.35 -0.01 118.68 122.06 2kh2 s LEU 62 Ca 0.26 1.95 -0.34 0.00 0.02 0.00 0.00 54.13 56.02 2kh2 s LEU 62 Cb 0.05 -3.73 -0.13 0.00 0.02 0.00 0.00 46.19 42.41 2kh2 s LEU 62 CO 0.06 0.06 1.70 1.17 0.02 0.00 0.00 176.35 179.36 2kh2 n LYS 63 N 1.19 2.16 -3.19 1.70 4.81 -0.53 -2.10 118.16 122.21 2kh2 n LYS 63 Ca -0.01 0.78 -0.20 0.00 -0.87 0.00 0.00 58.31 58.02 2kh2 n LYS 63 Cb 0.48 -2.58 -0.01 0.00 0.02 0.00 0.00 35.03 32.93 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 4.69 -3.02 -4.31 1.64 0.28 -1.26 -4.94 120.64 113.72 2kh2 n GLU 64 Ca 0.19 0.43 -0.16 0.00 -0.16 0.00 0.00 57.16 57.46 2kh2 n GLU 64 Cb 0.29 -5.09 -0.10 0.00 1.43 0.00 0.00 31.44 27.97 2kh2 n GLU 64 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2kh2 s LYS 65 N -5.81 1.35 -0.18 3.44 1.02 -0.89 -5.05 119.74 113.63 2kh2 s LYS 65 Ca 0.32 -1.72 0.16 0.00 0.02 0.00 0.00 55.97 54.75 2kh2 s LYS 65 Cb -0.17 -0.30 0.77 0.00 -0.52 0.00 0.00 37.83 37.62 2kh2 s LYS 65 CO 0.39 -0.25 1.69 0.27 -0.92 0.00 0.00 175.35 176.53 2kh2 n ASN 66 N -0.42 5.26 -4.61 2.83 6.94 -1.26 -4.62 115.26 119.38 2kh2 n ASN 66 Ca -0.02 -2.70 -0.39 0.00 -0.02 0.00 0.00 54.58 51.46 2kh2 n ASN 66 Cb 0.66 -0.63 -0.09 0.00 -2.36 0.00 0.00 39.78 37.35 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 -2.32 4.04 0.04 -4.53 1.43 -1.26 -2.30 118.68 113.78 2kh2 s LEU 67 Ca 0.53 0.30 0.08 0.00 -1.03 0.00 0.00 54.13 54.00 2kh2 s LEU 67 Cb 0.37 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 2kh2 s LEU 67 CO 0.20 -0.18 -0.22 -0.31 0.23 0.00 0.00 176.35 176.08 2kh2 s TYR 68 N 2.05 1.89 -0.23 0.29 1.51 -0.72 -0.50 117.35 121.63 2kh2 s TYR 68 Ca 0.15 -0.38 -0.29 0.00 -1.01 0.00 0.00 57.07 55.54 2kh2 s TYR 68 Cb -0.16 -1.13 -0.01 0.00 -0.11 0.00 0.00 41.96 40.55 2kh2 s TYR 68 CO 0.10 0.10 1.39 -0.51 -1.11 0.00 0.00 175.55 175.51 2kh2 s LEU 69 N -1.19 3.99 -0.11 -1.29 1.43 0.04 -1.00 118.68 120.55 2kh2 s LEU 69 Ca 0.08 1.49 0.00 0.00 -1.03 0.00 0.00 54.13 54.67 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 0.02 -1.03 -0.11 -0.55 0.23 0.00 0.00 176.35 174.91 2kh2 s SER 70 N 2.96 4.23 -0.39 2.29 0.15 0.51 -4.44 113.70 119.01 2kh2 s SER 70 Ca 0.60 -0.23 -0.14 0.00 0.70 0.00 0.00 55.95 56.89 2kh2 s SER 70 Cb -0.21 -1.42 0.01 0.00 -1.71 0.00 0.00 66.02 62.69 2kh2 s SER 70 CO 0.23 0.23 0.28 0.00 1.20 0.00 0.00 173.24 175.17 2kh2 s VAL 72 N 1.67 0.39 -0.24 0.00 -7.23 -0.51 -4.66 120.40 109.82 2kh2 s VAL 72 Ca 0.05 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.12 2kh2 s VAL 72 Cb -0.19 -2.56 -0.04 0.00 0.56 0.00 0.00 36.38 34.14 2kh2 s VAL 72 CO 0.10 0.00 0.13 -0.76 -0.31 0.00 0.00 175.10 174.26 2kh2 s LEU 73 N -3.32 3.91 -0.09 1.32 1.43 -1.26 0.30 118.68 120.96 2kh2 s LEU 73 Ca 0.37 0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.49 2kh2 s LEU 73 Cb 0.06 -2.05 0.02 0.00 0.03 0.00 0.00 46.19 44.25 2kh2 s LEU 73 CO 0.15 0.03 -0.11 -0.54 0.23 0.00 0.00 176.35 176.12 2kh2 s LYS 74 N 1.25 1.68 -1.30 1.70 1.02 0.65 -4.76 119.74 119.98 2kh2 s LYS 74 Ca 0.06 -0.36 -0.03 0.00 0.02 0.00 0.00 55.97 55.66 2kh2 s LYS 74 Cb -0.14 -1.54 0.01 0.00 -0.52 0.00 0.00 37.83 35.64 2kh2 s LYS 74 CO 0.05 -0.11 0.94 -3.47 -0.92 0.00 0.00 175.35 171.85 2kh2 n ASP 75 N 4.35 -2.91 -1.17 2.83 4.64 -1.26 -1.40 116.55 121.62 2kh2 n ASP 75 Ca -0.18 -0.68 -0.15 0.00 -1.38 0.00 0.00 54.79 52.39 2kh2 n ASP 75 Cb 0.51 -4.65 -0.07 0.00 -1.04 0.00 0.00 41.12 35.87 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 -3.05 -5.60 -3.98 1.67 9.92 -1.26 -4.97 116.55 109.28 2kh2 n ASP 76 Ca -0.20 0.38 -0.22 0.00 -0.53 0.00 0.00 54.79 54.22 2kh2 n ASP 76 Cb 0.64 -4.47 -0.16 0.00 -0.64 0.00 0.00 41.12 36.48 2kh2 n ASP 76 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2kh2 s LYS 77 N -3.28 1.23 0.11 -1.24 2.47 -0.50 -5.11 119.74 113.42 2kh2 s LYS 77 Ca 0.00 -0.29 -0.31 0.00 -1.56 0.00 0.00 55.97 53.81 2kh2 s LYS 77 Cb 0.00 -1.09 -0.09 0.00 -1.46 0.00 0.00 37.83 35.19 2kh2 s LYS 77 CO 0.00 0.02 1.56 -2.14 0.16 0.00 0.00 175.35 174.95 2kh2 s PRO 78 N 0.61 4.23 0.12 4.03 0.02 -1.26 -0.26 135.00 142.49 2kh2 s PRO 78 Ca -0.11 2.28 -0.02 0.00 0.02 0.00 0.00 61.00 63.18 2kh2 s PRO 78 Cb -0.13 -3.35 -0.04 0.00 0.02 0.00 0.00 34.50 31.00 2kh2 s PRO 78 CO 0.02 -0.62 0.06 0.95 -0.33 0.00 0.00 177.00 177.07 2kh2 s THR 79 N 1.72 0.12 -0.01 0.99 -4.23 0.15 -4.69 115.64 109.68 2kh2 s THR 79 Ca 0.70 -1.86 -0.01 0.00 -1.18 0.00 0.00 61.69 59.34 2kh2 s THR 79 Cb -0.40 -1.94 -0.04 0.00 1.34 0.00 0.00 72.50 71.46 2kh2 s THR 79 CO 0.31 -0.54 0.11 -0.22 -0.54 0.00 0.00 174.62 173.74 2kh2 s LEU 80 N -3.02 4.06 0.20 4.79 2.96 -1.26 -1.42 118.68 125.00 2kh2 s LEU 80 Ca 0.21 0.22 -0.12 0.00 -0.22 0.00 0.00 54.13 54.22 2kh2 s LEU 80 Cb 0.07 -2.36 0.00 0.00 0.50 0.00 0.00 46.19 44.40 2kh2 s LEU 80 CO -0.00 0.28 0.41 0.00 -1.32 0.00 0.00 176.35 175.71 2kh2 s GLN 81 N -1.75 1.36 -0.38 1.98 -2.07 -0.08 -4.97 119.66 113.76 2kh2 s GLN 81 Ca 0.24 -1.15 -0.13 0.00 -1.82 0.00 0.00 55.36 52.50 2kh2 s GLN 81 Cb -0.12 0.44 0.01 0.00 -1.09 0.00 0.00 33.01 32.25 2kh2 s GLN 81 CO 0.15 -0.54 0.25 -0.51 -1.32 0.00 0.00 175.29 173.31 2kh2 s LEU 82 N -2.97 4.78 -0.17 2.60 2.01 -1.26 -0.36 118.68 123.30 2kh2 s LEU 82 Ca 0.18 -0.80 -0.08 0.00 0.01 0.00 0.00 54.13 53.44 2kh2 s LEU 82 Cb 0.01 -2.10 -0.04 0.00 0.01 0.00 0.00 46.19 44.07 2kh2 s LEU 82 CO 0.03 -0.36 0.11 -0.70 1.01 0.00 0.00 176.35 176.44 2kh2 s GLU 83 N 1.64 3.91 -0.63 1.70 2.12 -0.17 -4.90 118.70 122.36 2kh2 s GLU 83 Ca 0.04 -0.24 -0.19 0.00 0.36 0.00 0.00 54.97 54.95 2kh2 s GLU 83 Cb -0.19 -3.29 0.11 0.00 0.26 0.00 0.00 34.13 31.03 2kh2 s GLU 83 CO 0.09 0.42 0.75 -1.12 -0.54 0.00 0.00 175.26 174.86 2kh2 s SER 84 N -0.01 6.25 0.44 -1.70 0.01 -1.26 -1.76 113.70 115.66 2kh2 s SER 84 Ca 0.09 -1.54 0.07 0.00 1.31 0.00 0.00 55.95 55.88 2kh2 s SER 84 Cb -0.12 -2.31 0.01 0.00 0.21 0.00 0.00 66.02 63.82 2kh2 s SER 84 CO 0.00 -1.09 0.60 0.68 0.41 0.00 0.00 173.24 173.83 2kh2 s VAL 85 N 2.58 2.95 0.03 3.43 -7.23 -0.97 -5.04 120.40 116.16 2kh2 s VAL 85 Ca 0.14 -0.96 -0.32 0.00 -1.81 0.00 0.00 61.98 59.03 2kh2 s VAL 85 Cb -0.22 -2.99 -0.11 0.00 0.56 0.00 0.00 36.38 33.62 2kh2 s VAL 85 CO 0.04 0.00 1.89 -0.67 -0.31 0.00 0.00 175.10 176.05 2kh2 n ASP 86 N -1.91 3.84 0.12 4.85 4.64 -1.26 -4.84 116.55 121.98 2kh2 n ASP 86 Ca 0.08 0.96 0.12 0.00 -1.38 0.00 0.00 54.79 54.57 2kh2 n ASP 86 Cb 0.59 -1.48 0.46 0.00 -1.04 0.00 0.00 41.12 39.66 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 6.50 0.20 -0.03 -0.67 -0.04 -1.26 -2.30 135.00 137.39 2kh2 n PRO 87 Ca 0.20 0.35 0.02 0.00 -0.04 0.00 0.00 63.50 64.03 2kh2 n PRO 87 Cb 0.36 -1.83 -0.13 0.00 -0.04 0.00 0.00 33.50 31.85 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 -2.21 0.86 0.00 0.54 2.85 -1.26 -4.28 118.16 114.66 2kh2 n LYS 88 Ca 0.03 -0.10 0.14 0.00 -1.05 0.00 0.00 58.31 57.33 2kh2 n LYS 88 Cb 0.29 -1.41 0.48 0.00 -0.65 0.00 0.00 35.03 33.74 2kh2 n LYS 88 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2kh2 n ASN 89 N -2.28 1.14 -4.20 -5.58 5.15 -1.18 -4.86 115.26 103.45 2kh2 n ASN 89 Ca -0.12 -1.12 -0.16 0.00 -0.60 0.00 0.00 54.58 52.58 2kh2 n ASN 89 Cb 0.66 0.06 -0.11 0.00 -0.53 0.00 0.00 39.78 39.86 2kh2 n ASN 89 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 2kh2 s TYR 90 N -2.28 1.20 0.82 1.20 1.51 -0.97 -4.60 117.35 114.23 2kh2 s TYR 90 Ca 0.31 -0.60 -0.07 0.00 -1.01 0.00 0.00 57.07 55.70 2kh2 s TYR 90 Cb 0.20 -0.64 0.15 0.00 -0.11 0.00 0.00 41.96 41.56 2kh2 s TYR 90 CO 0.43 0.06 1.13 -1.25 -1.11 0.00 0.00 175.55 174.81 2kh2 s PRO 91 N -2.65 1.31 0.13 -1.71 0.04 -1.26 -4.79 135.00 126.07 2kh2 s PRO 91 Ca 0.06 -0.75 -0.09 0.00 0.04 0.00 0.00 61.00 60.27 2kh2 s PRO 91 Cb -0.04 -2.12 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 2kh2 s PRO 91 CO 0.01 -1.82 0.24 -1.59 0.04 0.00 0.00 177.00 173.89 2kh2 s LYS 92 N -5.45 1.00 -0.03 4.56 -2.85 -1.26 -5.08 119.74 110.63 2kh2 s LYS 92 Ca 0.69 -1.07 -0.26 0.00 -1.00 0.00 0.00 55.97 54.33 2kh2 s LYS 92 Cb -0.05 0.36 -0.20 0.00 -2.06 0.00 0.00 37.83 35.87 2kh2 s LYS 92 CO 0.48 -0.35 1.22 -0.22 0.10 0.00 0.00 175.35 176.58 2kh2 h LYS 93 N 2.64 -0.02 -4.64 1.78 3.64 -1.96 -3.37 116.57 114.64 2kh2 h LYS 93 Ca -0.33 0.00 -0.73 0.00 -1.27 0.00 0.00 60.65 58.32 2kh2 h LYS 93 Cb 1.21 0.00 -0.20 0.00 -0.41 0.00 0.00 32.23 32.84 2kh2 h LYS 93 CO 0.52 0.49 0.84 0.21 -2.27 0.00 0.00 179.45 179.25 2kh2 s LYS 94 N -4.11 3.80 0.62 1.90 2.47 -1.26 -1.87 119.74 121.29 2kh2 s LYS 94 Ca -0.16 -2.23 -0.04 0.00 -1.56 0.00 0.00 55.97 51.97 2kh2 s LYS 94 Cb 0.01 -4.86 0.03 0.00 -1.46 0.00 0.00 37.83 31.56 2kh2 s LYS 94 CO 0.66 -1.65 0.91 -1.64 0.16 0.00 0.00 175.35 173.79 2kh2 s MET 95 N 1.64 2.55 0.48 4.03 -1.94 -1.26 -5.04 119.30 119.76 2kh2 s MET 95 Ca 0.33 -0.29 -0.23 0.00 -1.71 0.00 0.00 55.69 53.80 2kh2 s MET 95 Cb -0.05 -2.29 -0.07 0.00 2.01 0.00 0.00 34.83 34.43 2kh2 s MET 95 CO -0.07 -0.90 1.25 -1.21 -0.01 0.00 0.00 175.02 174.08 2kh2 s GLU 96 N -5.03 3.60 0.63 2.03 8.01 -1.26 -4.86 118.70 121.81 2kh2 s GLU 96 Ca 0.57 1.97 0.33 0.00 0.01 0.00 0.00 54.97 57.85 2kh2 s GLU 96 Cb -0.11 -2.41 1.84 0.00 -4.31 0.00 0.00 34.13 29.14 2kh2 s GLU 96 CO 0.43 -0.74 2.11 -0.22 0.01 0.00 0.00 175.26 176.85 2kh2 h LYS 97 N 1.96 0.00 0.00 1.61 3.64 -1.96 0.18 116.57 121.99 2kh2 h LYS 97 Ca -0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2kh2 h LYS 97 Cb 1.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 2kh2 h LYS 97 CO 0.60 0.00 0.00 2.89 -2.27 0.00 0.00 179.45 180.67 2kh2 n ARG 98 N -3.37 0.17 0.00 1.90 1.85 -1.26 -2.79 116.66 113.15 2kh2 n ARG 98 Ca -0.00 0.27 0.05 0.00 -1.00 0.00 0.00 57.85 57.17 2kh2 n ARG 98 Cb 0.29 -1.75 0.02 0.00 -1.05 0.00 0.00 32.46 29.96 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 -2.06 0.00 -3.28 2.89 3.72 0.60 -0.50 117.46 118.82 2kh2 n PHE 99 Ca 0.04 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.04 2kh2 n PHE 99 Cb 0.31 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.77 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 -1.18 5.07 0.02 -4.37 1.01 -1.04 -3.95 120.40 115.97 2kh2 s VAL 100 Ca 0.10 0.44 0.02 0.00 0.00 0.00 0.00 61.98 62.54 2kh2 s VAL 100 Cb 0.08 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2kh2 s VAL 100 CO 0.21 -0.09 0.04 -0.36 0.00 0.00 0.00 175.10 174.89 2kh2 s PHE 101 N 2.29 3.14 -0.56 5.22 0.40 0.63 -2.76 117.98 126.34 2kh2 s PHE 101 Ca 0.18 0.10 -0.16 0.00 -0.60 0.00 0.00 56.93 56.45 2kh2 s PHE 101 Cb -0.16 -1.66 0.13 0.00 0.51 0.00 0.00 43.02 41.84 2kh2 s PHE 101 CO 0.12 0.50 0.53 -0.80 0.70 0.00 0.00 175.22 176.27 2kh2 s ASN 102 N -1.85 6.22 -0.72 1.36 0.02 0.21 -0.76 114.94 119.41 2kh2 s ASN 102 Ca 0.23 -1.82 -0.26 0.00 -1.02 0.00 0.00 52.86 49.99 2kh2 s ASN 102 Cb -0.12 -2.22 -0.00 0.00 0.02 0.00 0.00 41.25 38.93 2kh2 s ASN 102 CO 0.14 -0.86 1.66 -0.75 0.02 0.00 0.00 177.10 177.31 2kh2 s LYS 103 N 1.60 2.87 0.09 -0.60 2.20 -0.08 -1.74 119.74 124.09 2kh2 s LYS 103 Ca 0.04 0.08 -0.21 0.00 -0.36 0.00 0.00 55.97 55.53 2kh2 s LYS 103 Cb -0.28 -4.49 -0.07 0.00 -1.51 0.00 0.00 37.83 31.47 2kh2 s LYS 103 CO 0.03 -2.59 0.63 0.42 -0.36 0.00 0.00 175.35 173.47 2kh2 s ILE 104 N 7.82 4.65 -0.53 5.43 1.01 0.49 -1.89 121.20 138.18 2kh2 s ILE 104 Ca 0.56 1.35 0.04 0.00 0.00 0.00 0.00 60.65 62.59 2kh2 s ILE 104 Cb -0.09 -3.97 0.15 0.00 0.01 0.00 0.00 42.46 38.57 2kh2 s ILE 104 CO 0.14 0.54 0.35 -0.70 0.00 0.00 0.00 174.94 175.26 2kh2 s GLU 105 N -1.08 1.65 0.15 2.79 2.12 -1.18 -0.13 118.70 123.02 2kh2 s GLU 105 Ca 0.31 -2.52 -0.17 0.00 0.36 0.00 0.00 54.97 52.95 2kh2 s GLU 105 Cb -0.20 -2.58 0.02 0.00 0.26 0.00 0.00 34.13 31.62 2kh2 s GLU 105 CO 0.21 -1.25 1.79 -0.84 -0.54 0.00 0.00 175.26 174.63 2kh2 h ILE 106 N 4.85 1.02 0.00 -3.70 3.07 -1.92 -3.48 117.51 117.36 2kh2 h ILE 106 Ca 0.10 -0.14 0.00 0.00 1.55 0.00 0.00 64.86 66.37 2kh2 h ILE 106 Cb 0.86 0.59 0.00 0.00 -0.27 0.00 0.00 36.82 38.00 2kh2 h ILE 106 CO 0.55 0.07 0.00 -0.46 -1.05 0.00 0.00 178.15 177.27 2kh2 n ASN 107 N -4.90 0.00 0.04 2.16 0.23 -1.26 -4.99 115.26 106.53 2kh2 n ASN 107 Ca 0.00 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 54.15 2kh2 n ASN 107 Cb 0.06 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 37.66 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 0.38 -4.78 0.53 5.03 -1.26 -4.89 115.26 110.26 2kh2 n ASN 108 Ca 0.00 0.15 -0.33 0.00 0.87 0.00 0.00 54.58 55.27 2kh2 n ASN 108 Cb 0.00 1.27 -0.07 0.00 -1.02 0.00 0.00 39.78 39.96 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 -3.40 3.08 0.01 3.52 -0.14 -1.26 -4.93 119.74 116.62 2kh2 s LYS 109 Ca -0.05 -0.46 0.01 0.00 -1.36 0.00 0.00 55.97 54.11 2kh2 s LYS 109 Cb 0.12 -2.87 -0.04 0.00 -1.68 0.00 0.00 37.83 33.36 2kh2 s LYS 109 CO 0.86 0.66 0.03 -0.51 -0.76 0.00 0.00 175.35 175.62 2kh2 s LEU 110 N -1.67 3.63 0.13 3.17 1.02 0.34 -3.58 118.68 121.72 2kh2 s LEU 110 Ca 0.22 0.02 0.09 0.00 0.02 0.00 0.00 54.13 54.49 2kh2 s LEU 110 Cb -0.12 -2.12 -0.04 0.00 0.02 0.00 0.00 46.19 43.93 2kh2 s LEU 110 CO 0.13 0.27 -0.19 -1.61 0.02 0.00 0.00 176.35 174.97 2kh2 s GLU 111 N -1.69 1.73 -0.39 1.70 2.02 0.81 -0.19 118.70 122.69 2kh2 s GLU 111 Ca 0.21 -1.24 0.03 0.00 0.02 0.00 0.00 54.97 53.99 2kh2 s GLU 111 Cb -0.12 -2.06 0.11 0.00 0.10 0.00 0.00 34.13 32.16 2kh2 s GLU 111 CO 0.12 0.46 0.14 -0.06 0.02 0.00 0.00 175.26 175.94 2kh2 s PHE 112 N -1.22 2.84 0.07 1.61 0.08 -1.26 -0.38 117.98 119.72 2kh2 s PHE 112 Ca 0.18 -2.63 -0.10 0.00 0.12 0.00 0.00 56.93 54.50 2kh2 s PHE 112 Cb -0.10 -2.43 -0.06 0.00 -0.57 0.00 0.00 43.02 39.86 2kh2 s PHE 112 CO 0.10 -0.86 0.39 -2.00 -0.10 0.00 0.00 175.22 172.75 2kh2 s GLU 113 N 0.74 3.75 -0.06 0.44 2.12 -0.71 -1.77 118.70 123.21 2kh2 s GLU 113 Ca 0.13 0.17 -0.27 0.00 0.36 0.00 0.00 54.97 55.36 2kh2 s GLU 113 Cb -0.21 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.13 2kh2 s GLU 113 CO -0.09 0.58 0.86 0.45 -0.54 0.00 0.00 175.26 176.51 2kh2 s SER 114 N -1.71 7.15 0.28 -1.70 0.15 0.13 0.64 113.70 118.64 2kh2 s SER 114 Ca 0.32 1.40 0.01 0.00 0.70 0.00 0.00 55.95 58.38 2kh2 s SER 114 Cb -0.14 -2.49 0.40 0.00 -1.71 0.00 0.00 66.02 62.08 2kh2 s SER 114 CO 0.17 -0.25 1.75 0.00 1.20 0.00 0.00 173.24 176.11 2kh2 h ALA 115 N 6.90 1.12 -0.39 5.45 0.00 -1.77 -2.74 119.26 127.84 2kh2 h ALA 115 Ca -0.38 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.11 2kh2 h ALA 115 Cb 1.19 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2kh2 h ALA 115 CO 0.78 0.55 -0.21 0.37 0.00 0.00 0.00 179.25 180.73 2kh2 h GLN 116 N 0.54 0.77 -3.62 0.00 4.15 -1.78 -3.38 115.11 111.78 2kh2 h GLN 116 Ca 0.09 -0.30 -0.63 0.00 0.77 0.00 0.00 58.65 58.58 2kh2 h GLN 116 Cb 0.57 -0.04 -0.40 0.00 0.21 0.00 0.00 27.48 27.81 2kh2 h GLN 116 CO 0.04 0.91 -0.69 -0.06 -1.93 0.00 0.00 178.83 177.10 2kh2 s PHE 117 N -4.63 2.85 0.42 3.99 0.08 -1.04 -5.11 117.98 114.54 2kh2 s PHE 117 Ca -0.09 -2.78 -0.27 0.00 0.12 0.00 0.00 56.93 53.91 2kh2 s PHE 117 Cb 0.13 -2.48 -0.10 0.00 -0.57 0.00 0.00 43.02 40.00 2kh2 s PHE 117 CO 0.83 -0.82 1.46 -2.14 -0.10 0.00 0.00 175.22 174.46 2kh2 s PRO 118 N 0.39 3.88 0.00 0.24 0.02 -1.21 -2.21 135.00 136.11 2kh2 s PRO 118 Ca 0.15 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.67 2kh2 s PRO 118 Cb -0.23 -2.80 0.00 0.00 0.02 0.00 0.00 34.50 31.49 2kh2 s PRO 118 CO -0.05 -0.69 0.00 0.09 -0.33 0.00 0.00 177.00 176.02 2kh2 n ASN 119 N 0.11 -0.99 -4.36 2.53 4.13 -1.26 -4.99 115.26 110.42 2kh2 n ASN 119 Ca 0.03 0.00 -0.38 0.00 1.68 0.00 0.00 54.58 55.91 2kh2 n ASN 119 Cb 0.40 -0.48 -0.12 0.00 -1.54 0.00 0.00 39.78 38.05 2kh2 n ASN 119 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2kh2 s TRP 120 N -3.11 3.18 0.31 3.10 0.52 -0.94 -4.51 118.94 117.49 2kh2 s TRP 120 Ca 0.00 -0.93 0.09 0.00 0.02 0.00 0.00 56.10 55.27 2kh2 s TRP 120 Cb 0.00 -2.31 -0.04 0.00 -1.15 0.00 0.00 33.47 29.97 2kh2 s TRP 120 CO 0.00 -0.58 0.08 0.71 0.02 0.00 0.00 176.95 177.18 2kh2 s TYR 121 N 1.52 2.72 0.01 -1.98 1.51 -0.05 -0.69 117.35 120.38 2kh2 s TYR 121 Ca 0.02 -0.31 -0.30 0.00 -1.01 0.00 0.00 57.07 55.47 2kh2 s TYR 121 Cb -0.18 -1.45 -0.06 0.00 -0.11 0.00 0.00 41.96 40.17 2kh2 s TYR 121 CO 0.04 0.47 1.40 0.42 -1.11 0.00 0.00 175.55 176.77 2kh2 s ILE 122 N -2.38 3.69 0.18 2.71 1.01 -0.73 -0.32 121.20 125.36 2kh2 s ILE 122 Ca 0.35 1.08 0.10 0.00 0.00 0.00 0.00 60.65 62.18 2kh2 s ILE 122 Cb -0.04 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 2kh2 s ILE 122 CO 0.21 0.00 -0.21 -0.44 0.00 0.00 0.00 174.94 174.51 2kh2 s SER 123 N 1.84 3.01 -0.18 3.58 0.01 0.55 -4.35 113.70 118.16 2kh2 s SER 123 Ca 0.64 -0.86 -0.09 0.00 1.31 0.00 0.00 55.95 56.95 2kh2 s SER 123 Cb -0.32 -0.20 0.07 0.00 0.21 0.00 0.00 66.02 65.78 2kh2 s SER 123 CO 0.27 0.03 0.42 -0.89 0.41 0.00 0.00 173.24 173.48 2kh2 s THR 124 N -1.87 -0.24 1.02 1.44 2.01 -0.83 -2.77 115.64 114.40 2kh2 s THR 124 Ca 0.18 0.12 -0.12 0.00 0.31 0.00 0.00 61.69 62.18 2kh2 s THR 124 Cb -0.07 -0.64 0.20 0.00 0.01 0.00 0.00 72.50 72.01 2kh2 s THR 124 CO 0.08 0.05 1.07 -0.44 -0.69 0.00 0.00 174.62 174.69 2kh2 s SER 125 N 1.84 2.25 0.27 3.53 0.01 -1.26 -1.01 113.70 119.33 2kh2 s SER 125 Ca -0.07 1.54 0.25 0.00 1.31 0.00 0.00 55.95 58.99 2kh2 s SER 125 Cb -0.10 -2.22 0.94 0.00 0.21 0.00 0.00 66.02 64.85 2kh2 s SER 125 CO -0.13 -3.41 1.75 1.56 0.41 0.00 0.00 173.24 173.42 2kh2 h GLN 126 N -2.08 0.00 -7.16 12.44 1.08 -1.98 -3.45 115.11 113.96 2kh2 h GLN 126 Ca -0.54 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.13 2kh2 h GLN 126 Cb 1.31 0.00 0.14 0.00 -0.05 0.00 0.00 27.48 28.88 2kh2 h GLN 126 CO 0.52 0.00 0.41 0.00 -0.95 0.00 0.00 178.83 178.81 2kh2 s ALA 127 N -3.27 2.28 0.20 3.87 0.00 -1.26 -5.01 121.76 118.56 2kh2 s ALA 127 Ca 0.06 0.87 -0.19 0.00 0.00 0.00 0.00 51.96 52.70 2kh2 s ALA 127 Cb 0.10 -3.45 -0.08 0.00 0.00 0.00 0.00 23.12 19.70 2kh2 s ALA 127 CO 0.48 -1.62 0.68 -2.00 0.00 0.00 0.00 175.76 173.30 2kh2 s GLU 128 N -3.79 4.20 -1.00 0.00 2.56 -1.26 -4.11 118.70 115.31 2kh2 s GLU 128 Ca 0.74 0.79 -0.03 0.00 0.00 0.00 0.00 54.97 56.48 2kh2 s GLU 128 Cb -0.28 -2.93 0.00 0.00 2.00 0.00 0.00 34.13 32.92 2kh2 s GLU 128 CO 0.42 0.43 0.34 -1.71 -0.56 0.00 0.00 175.26 174.18 2kh2 n ASN 129 N 0.83 -4.40 -4.86 -1.70 5.15 -1.15 -5.01 115.26 104.12 2kh2 n ASN 129 Ca -0.04 -0.16 -0.35 0.00 -0.60 0.00 0.00 54.58 53.44 2kh2 n ASN 129 Cb 0.51 -3.31 -0.06 0.00 -0.53 0.00 0.00 39.78 36.39 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 -5.18 3.82 0.89 1.20 -1.94 -1.07 -4.83 119.30 112.19 2kh2 s MET 130 Ca 0.17 0.26 -0.12 0.00 -1.71 0.00 0.00 55.69 54.29 2kh2 s MET 130 Cb -0.07 -2.99 0.12 0.00 2.01 0.00 0.00 34.83 33.90 2kh2 s MET 130 CO 0.21 0.54 1.12 -2.14 -0.01 0.00 0.00 175.02 174.74 2kh2 s PRO 131 N -1.90 1.33 -0.15 2.03 0.02 -1.26 -0.27 135.00 134.80 2kh2 s PRO 131 Ca 0.34 0.43 -0.16 0.00 0.02 0.00 0.00 61.00 61.63 2kh2 s PRO 131 Cb -0.14 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 2kh2 s PRO 131 CO 0.18 -2.10 0.38 0.08 -0.33 0.00 0.00 177.00 175.21 2kh2 s VAL 132 N -3.20 5.25 0.29 3.83 1.01 -1.15 -4.74 120.40 121.69 2kh2 s VAL 132 Ca 0.63 0.72 0.01 0.00 0.00 0.00 0.00 61.98 63.34 2kh2 s VAL 132 Cb -0.15 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 2kh2 s VAL 132 CO 0.54 0.35 0.30 0.72 0.00 0.00 0.00 175.10 177.01 2kh2 s PHE 133 N 0.61 1.30 -0.18 5.22 -0.12 -1.12 -4.80 117.98 118.90 2kh2 s PHE 133 Ca 0.20 -1.41 -0.08 0.00 -0.05 0.00 0.00 56.93 55.60 2kh2 s PHE 133 Cb -0.14 -0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 41.77 2kh2 s PHE 133 CO 0.07 -0.88 0.08 -1.17 -0.05 0.00 0.00 175.22 173.27 2kh2 s LEU 134 N -3.25 3.97 0.11 -1.99 2.96 -1.26 -0.33 118.68 118.88 2kh2 s LEU 134 Ca 0.36 0.16 0.08 0.00 -0.22 0.00 0.00 54.13 54.51 2kh2 s LEU 134 Cb 0.03 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 2kh2 s LEU 134 CO 0.20 0.21 -0.19 -0.83 -1.32 0.00 0.00 176.35 174.42 2kh2 s GLY 135 N 0.15 1.20 0.00 7.98 0.00 0.56 -4.82 107.32 112.39 2kh2 s GLY 135 Ca 0.06 -1.25 0.12 0.00 0.00 0.00 0.00 44.72 43.65 2kh2 s GLY 135 CO -0.00 -1.27 1.08 0.61 0.00 0.00 0.00 173.10 173.52 2kh2 n GLY 136 N 0.95 1.22 3.34 0.20 0.00 -1.26 -0.87 105.19 108.76 2kh2 n GLY 136 Ca -0.18 -0.39 -0.45 0.00 0.00 0.00 0.00 46.02 44.99 2kh2 n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kh2 s THR 137 N -1.02 5.88 -0.20 2.61 2.01 -1.26 -4.89 115.64 118.76 2kh2 s THR 137 Ca 0.20 -3.16 -0.29 0.00 0.31 0.00 0.00 61.69 58.75 2kh2 s THR 137 Cb 0.12 -4.58 -0.01 0.00 0.01 0.00 0.00 72.50 68.04 2kh2 s THR 137 CO 0.17 -1.16 1.24 -0.75 -0.69 0.00 0.00 174.62 173.42 2kh2 s LYS 138 N -0.81 4.17 0.00 4.92 2.20 -1.26 -3.06 119.74 125.89 2kh2 s LYS 138 Ca 0.28 1.53 0.00 0.00 -0.36 0.00 0.00 55.97 57.41 2kh2 s LYS 138 Cb -0.10 -3.77 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 2kh2 s LYS 138 CO -0.08 -0.79 0.00 0.41 -0.36 0.00 0.00 175.35 174.53 2kh2 n GLY 139 N 3.72 0.78 0.00 5.54 0.00 -1.26 -5.07 105.19 108.91 2kh2 n GLY 139 Ca 0.14 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.14 1.65 0.11 -0.02 0.00 -1.17 -5.01 105.19 98.62 2kh2 n GLY 140 Ca 0.00 -1.26 -0.18 0.00 0.00 0.00 0.00 46.02 44.58 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 0.30 -6.76 1.61 7.50 -1.98 -3.46 115.11 112.33 2kh2 h GLN 141 Ca 0.00 -0.52 -0.49 0.00 0.50 0.00 0.00 58.65 58.14 2kh2 h GLN 141 Cb 0.00 0.19 -0.02 0.00 0.05 0.00 0.00 27.48 27.71 2kh2 h GLN 141 CO 0.00 1.22 0.36 -0.51 -1.50 0.00 0.00 178.83 178.40 2kh2 s ASP 142 N -7.15 7.60 -0.01 1.46 1.01 -1.26 -4.51 116.67 113.81 2kh2 s ASP 142 Ca -0.07 1.99 -0.30 0.00 0.71 0.00 0.00 52.55 54.88 2kh2 s ASP 142 Cb 0.07 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.34 2kh2 s ASP 142 CO 0.88 0.12 1.23 -0.63 0.21 0.00 0.00 175.17 176.98 2kh2 s ILE 143 N -1.19 4.09 -0.63 0.77 1.01 -0.18 -4.63 121.20 120.45 2kh2 s ILE 143 Ca 0.42 1.46 0.05 0.00 0.00 0.00 0.00 60.65 62.58 2kh2 s ILE 143 Cb -0.27 -3.94 0.07 0.00 0.01 0.00 0.00 42.46 38.34 2kh2 s ILE 143 CO 0.33 0.04 0.78 0.35 0.00 0.00 0.00 174.94 176.44 2kh2 n THR 144 N 4.39 0.24 -4.51 2.92 -2.24 -1.26 -1.96 114.28 111.85 2kh2 n THR 144 Ca 0.11 -0.62 -0.31 0.00 -2.27 0.00 0.00 64.05 60.96 2kh2 n THR 144 Cb 0.46 0.97 -0.12 0.00 -2.10 0.00 0.00 70.33 69.54 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 -0.58 4.03 0.33 3.42 -4.77 -1.26 -4.42 116.67 113.41 2kh2 s ASP 145 Ca 0.08 -0.39 0.06 0.00 -3.30 0.00 0.00 52.55 49.00 2kh2 s ASP 145 Cb 0.05 -0.71 -0.03 0.00 -1.09 0.00 0.00 42.92 41.14 2kh2 s ASP 145 CO 0.07 0.24 0.26 -0.36 0.70 0.00 0.00 175.17 176.07 2kh2 s PHE 146 N -1.01 1.72 -0.00 2.11 0.08 0.73 -3.90 117.98 117.71 2kh2 s PHE 146 Ca 0.16 -1.62 0.04 0.00 0.12 0.00 0.00 56.93 55.64 2kh2 s PHE 146 Cb -0.11 -0.74 -0.01 0.00 -0.57 0.00 0.00 43.02 41.59 2kh2 s PHE 146 CO 0.08 -0.82 -0.14 0.95 -0.10 0.00 0.00 175.22 175.19 2kh2 s THR 147 N -3.48 1.09 -0.30 0.64 -4.23 -0.01 -0.50 115.64 108.84 2kh2 s THR 147 Ca 0.39 -0.64 -0.13 0.00 -1.18 0.00 0.00 61.69 60.13 2kh2 s THR 147 Cb 0.03 -0.92 -0.03 0.00 1.34 0.00 0.00 72.50 72.92 2kh2 s THR 147 CO 0.26 0.27 0.29 -0.32 -0.54 0.00 0.00 174.62 174.58 2kh2 s MET 148 N -0.43 3.79 -0.30 3.99 1.75 -1.26 -2.45 119.30 124.38 2kh2 s MET 148 Ca 0.05 -0.31 -0.01 0.00 -1.25 0.00 0.00 55.69 54.17 2kh2 s MET 148 Cb -0.06 -3.72 0.06 0.00 2.84 0.00 0.00 34.83 33.95 2kh2 s MET 148 CO -0.00 -0.34 -0.00 -0.65 -0.65 0.00 0.00 175.02 173.38 2kh2 s GLN 149 N 1.90 2.29 0.17 4.11 1.11 -0.04 -4.96 119.66 124.23 2kh2 s GLN 149 Ca 0.10 -1.37 -0.30 0.00 0.01 0.00 0.00 55.36 53.79 2kh2 s GLN 149 Cb -0.16 -3.16 -0.08 0.00 -1.01 0.00 0.00 33.01 28.60 2kh2 s GLN 149 CO 0.11 -0.67 1.27 -0.06 0.01 0.00 0.00 175.29 175.94 2kh2 s PHE 150 N 1.19 3.34 0.52 0.91 0.08 -1.26 -0.20 117.98 122.55 2kh2 s PHE 150 Ca -0.04 1.27 0.03 0.00 0.12 0.00 0.00 56.93 58.31 2kh2 s PHE 150 Cb -0.20 -3.53 0.00 0.00 -0.57 0.00 0.00 43.02 38.72 2kh2 s PHE 150 CO -0.03 -1.64 0.13 0.14 -0.10 0.00 0.00 175.22 173.73 2kh2 s VAL 151 N 0.31 1.36 -0.76 -0.44 -7.23 -1.11 -4.93 120.40 107.59 2kh2 s VAL 151 Ca 0.57 -1.83 -0.04 0.00 -1.81 0.00 0.00 61.98 58.87 2kh2 s VAL 151 Cb -0.34 -2.19 0.12 0.00 0.56 0.00 0.00 36.38 34.53 2kh2 s VAL 151 CO 0.35 0.00 2.54 -1.54 -0.31 0.00 0.00 175.10 176.14 2kh2 n SER 152 N -1.42 7.05 0.00 4.85 3.41 -1.26 -4.86 113.62 121.39 2kh2 n SER 152 Ca -0.13 -3.29 0.00 0.00 -0.26 0.00 0.00 58.87 55.19 2kh2 n SER 152 Cb 0.66 -1.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68