#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 0.74 -5.19 0.00 0.13 -2.07 -3.44 132.00 122.18 2kh2 h PRO 2 Ca 0.00 -0.62 -0.64 0.00 -0.87 0.00 0.00 66.00 63.87 2kh2 h PRO 2 Cb 0.00 0.14 -0.22 0.00 0.13 0.00 0.00 31.00 31.05 2kh2 h PRO 2 CO 0.00 1.23 -0.65 0.54 -0.23 0.00 0.00 178.00 178.89 2kh2 s VAL 3 N -3.69 4.06 0.11 1.56 0.11 -1.26 -5.09 120.40 116.21 2kh2 s VAL 3 Ca -0.11 -0.28 -0.30 0.00 -2.93 0.00 0.00 61.98 58.36 2kh2 s VAL 3 Cb 0.08 -2.82 -0.06 0.00 -1.53 0.00 0.00 36.38 32.05 2kh2 s VAL 3 CO 0.89 0.45 1.01 -0.13 -3.33 0.00 0.00 175.10 173.99 2kh2 s ARG 4 N 0.74 4.64 -0.08 1.54 0.52 -1.26 -4.94 118.95 120.10 2kh2 s ARG 4 Ca 0.00 1.53 -0.06 0.00 -0.52 0.00 0.00 55.73 56.68 2kh2 s ARG 4 Cb -0.14 -3.36 0.03 0.00 0.52 0.00 0.00 34.95 32.00 2kh2 s ARG 4 CO 0.02 0.12 0.21 -1.12 0.02 0.00 0.00 175.30 174.55 2kh2 s SER 5 N 0.15 -0.21 0.20 0.23 0.01 -1.26 -1.69 113.70 111.14 2kh2 s SER 5 Ca 0.49 0.42 -0.01 0.00 1.31 0.00 0.00 55.95 58.17 2kh2 s SER 5 Cb -0.25 0.39 -0.04 0.00 0.21 0.00 0.00 66.02 66.33 2kh2 s SER 5 CO 0.31 -0.10 0.11 -1.48 0.41 0.00 0.00 173.24 172.49 2kh2 s LEU 6 N 0.46 1.33 -0.13 2.44 0.05 -0.57 -4.95 118.68 117.31 2kh2 s LEU 6 Ca -0.03 -1.37 0.01 0.00 0.05 0.00 0.00 54.13 52.79 2kh2 s LEU 6 Cb -0.04 0.29 -0.01 0.00 -2.05 0.00 0.00 46.19 44.38 2kh2 s LEU 6 CO -0.02 -0.80 -0.16 0.20 -0.55 0.00 0.00 176.35 175.02 2kh2 s ASN 7 N -3.18 3.74 0.17 1.48 0.01 -1.26 0.19 114.94 116.09 2kh2 s ASN 7 Ca 0.37 -0.41 -0.08 0.00 -0.71 0.00 0.00 52.86 52.03 2kh2 s ASN 7 Cb 0.07 -1.56 -0.01 0.00 0.41 0.00 0.00 41.25 40.16 2kh2 s ASN 7 CO 0.11 0.15 0.27 0.00 -1.51 0.00 0.00 177.10 176.12 2kh2 s THR 9 N -3.98 2.87 -0.03 0.00 -4.23 -0.04 -0.95 115.64 109.27 2kh2 s THR 9 Ca 0.19 -2.01 0.06 0.00 -1.18 0.00 0.00 61.69 58.75 2kh2 s THR 9 Cb 0.04 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 71.40 2kh2 s THR 9 CO 0.01 -0.25 -0.20 -0.76 -0.54 0.00 0.00 174.62 172.88 2kh2 s LEU 10 N -3.18 2.00 -0.05 4.79 1.43 -1.26 -2.28 118.68 120.13 2kh2 s LEU 10 Ca 0.27 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2kh2 s LEU 10 Cb -0.07 -1.09 0.00 0.00 0.03 0.00 0.00 46.19 45.06 2kh2 s LEU 10 CO 0.15 0.22 -0.14 -0.13 0.23 0.00 0.00 176.35 176.68 2kh2 s ARG 11 N -0.25 1.67 0.87 1.70 0.52 -1.23 -4.18 118.95 118.05 2kh2 s ARG 11 Ca 0.02 -0.50 -0.15 0.00 -0.52 0.00 0.00 55.73 54.58 2kh2 s ARG 11 Cb -0.10 -1.42 0.21 0.00 0.52 0.00 0.00 34.95 34.15 2kh2 s ARG 11 CO 0.01 0.14 0.99 -0.40 0.02 0.00 0.00 175.30 176.05 2kh2 n ASP 12 N 3.43 -0.76 0.00 0.23 5.75 -1.21 -0.72 116.55 123.28 2kh2 n ASP 12 Ca -0.20 -1.24 0.04 0.00 -0.01 0.00 0.00 54.79 53.38 2kh2 n ASP 12 Cb 0.53 -0.81 0.16 0.00 -1.03 0.00 0.00 41.12 39.97 2kh2 n ASP 12 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2kh2 n SER 13 N -4.04 0.00 -0.93 -1.12 7.64 -1.24 -0.62 113.62 113.31 2kh2 n SER 13 Ca 0.13 0.42 0.11 0.00 1.01 0.00 0.00 58.87 60.54 2kh2 n SER 13 Cb 0.47 -0.45 0.12 0.00 -1.01 0.00 0.00 64.21 63.34 2kh2 n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kh2 n GLN 14 N -1.45 2.13 -2.48 1.43 6.02 -1.26 -4.95 117.38 116.82 2kh2 n GLN 14 Ca 0.02 -1.91 -0.14 0.00 -0.01 0.00 0.00 57.00 54.96 2kh2 n GLN 14 Cb 0.08 -1.43 0.01 0.00 1.02 0.00 0.00 30.24 29.91 2kh2 n GLN 14 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2kh2 n GLN 15 N 1.26 -2.03 -2.25 -1.09 1.13 0.21 -5.00 117.38 109.62 2kh2 n GLN 15 Ca 0.14 0.62 -0.25 0.00 -1.94 0.00 0.00 57.00 55.57 2kh2 n GLN 15 Cb 0.55 -4.83 0.07 0.00 0.11 0.00 0.00 30.24 26.14 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 -4.95 2.15 0.24 -1.09 1.02 -1.26 -4.61 119.74 111.24 2kh2 s LYS 16 Ca 0.09 -0.35 0.11 0.00 0.02 0.00 0.00 55.97 55.84 2kh2 s LYS 16 Cb -0.04 -2.19 -0.05 0.00 -0.52 0.00 0.00 37.83 35.03 2kh2 s LYS 16 CO 0.11 -1.24 -0.19 -1.12 -0.92 0.00 0.00 175.35 171.98 2kh2 s SER 17 N -4.53 3.29 -0.20 2.83 0.01 0.85 -3.33 113.70 112.62 2kh2 s SER 17 Ca 0.61 -0.99 -0.09 0.00 1.31 0.00 0.00 55.95 56.79 2kh2 s SER 17 Cb -0.10 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 2kh2 s SER 17 CO 0.44 0.00 0.09 -0.76 0.41 0.00 0.00 173.24 173.43 2kh2 s LEU 18 N -3.29 3.94 0.14 2.44 1.43 -1.26 -1.24 118.68 120.84 2kh2 s LEU 18 Ca 0.26 0.11 0.06 0.00 -1.03 0.00 0.00 54.13 53.53 2kh2 s LEU 18 Cb -0.05 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 2kh2 s LEU 18 CO 0.12 0.15 -0.13 0.68 0.23 0.00 0.00 176.35 177.40 2kh2 s VAL 19 N 0.53 1.36 -0.44 -1.59 -7.23 0.27 -2.21 120.40 111.09 2kh2 s VAL 19 Ca 0.05 -1.87 -0.28 0.00 -1.81 0.00 0.00 61.98 58.08 2kh2 s VAL 19 Cb -0.12 -1.68 0.03 0.00 0.56 0.00 0.00 36.38 35.17 2kh2 s VAL 19 CO 0.00 -0.51 1.06 -0.04 -0.31 0.00 0.00 175.10 175.30 2kh2 s MET 20 N -3.04 3.73 0.00 4.82 -1.94 -1.26 -0.32 119.30 121.29 2kh2 s MET 20 Ca 0.13 0.53 0.00 0.00 -1.71 0.00 0.00 55.69 54.64 2kh2 s MET 20 Cb -0.03 -3.88 0.00 0.00 2.01 0.00 0.00 34.83 32.93 2kh2 s MET 20 CO 0.03 -1.24 0.25 0.45 -0.01 0.00 0.00 175.02 174.50 2kh2 n SER 21 N 7.45 0.00 -1.01 3.03 2.88 1.00 -4.92 113.62 122.05 2kh2 n SER 21 Ca 0.10 0.34 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 2kh2 n SER 21 Cb 0.49 -0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.80 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 1.19 3.09 0.23 0.46 0.00 -1.16 -4.93 105.19 104.07 2kh2 n GLY 22 Ca 0.00 -2.10 0.06 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.20 1.61 0.13 -2.04 -3.18 132.00 128.32 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 -0.33 0.00 0.13 0.00 0.00 31.00 30.80 2kh2 h PRO 23 CO 0.00 0.17 -0.95 0.66 -0.23 0.00 0.00 178.00 177.66 2kh2 n TYR 24 N -4.22 0.64 -4.31 1.56 4.01 -1.26 -5.05 117.16 108.52 2kh2 n TYR 24 Ca -0.02 -1.31 -0.18 0.00 -0.16 0.00 0.00 57.90 56.23 2kh2 n TYR 24 Cb 0.24 -0.21 -0.14 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 -1.99 0.68 0.03 -0.72 2.12 -1.21 -4.14 118.70 113.48 2kh2 s GLU 25 Ca 0.35 -0.35 0.09 0.00 0.36 0.00 0.00 54.97 55.42 2kh2 s GLU 25 Cb 0.37 -0.65 -0.03 0.00 0.26 0.00 0.00 34.13 34.09 2kh2 s GLU 25 CO -0.09 0.17 -0.26 -0.51 -0.54 0.00 0.00 175.26 174.03 2kh2 s LEU 26 N -0.32 2.14 0.08 2.70 1.43 -1.26 -0.00 118.68 123.45 2kh2 s LEU 26 Ca 0.02 -0.56 0.07 0.00 -1.03 0.00 0.00 54.13 52.63 2kh2 s LEU 26 Cb -0.04 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.86 2kh2 s LEU 26 CO -0.00 0.27 -0.19 -0.54 0.23 0.00 0.00 176.35 176.12 2kh2 s LYS 27 N -1.11 1.08 -0.20 1.70 1.02 0.57 -2.15 119.74 120.66 2kh2 s LYS 27 Ca 0.11 -1.05 0.00 0.00 0.02 0.00 0.00 55.97 55.05 2kh2 s LYS 27 Cb -0.10 -1.25 0.02 0.00 -0.52 0.00 0.00 37.83 35.98 2kh2 s LYS 27 CO 0.01 0.30 -0.16 0.00 -0.92 0.00 0.00 175.35 174.58 2kh2 s ALA 28 N -1.10 2.44 0.11 5.17 0.00 0.13 -0.57 121.76 127.93 2kh2 s ALA 28 Ca 0.04 -1.28 -0.15 0.00 0.00 0.00 0.00 51.96 50.57 2kh2 s ALA 28 Cb -0.10 -1.32 0.03 0.00 0.00 0.00 0.00 23.12 21.74 2kh2 s ALA 28 CO 0.03 -0.47 0.37 -0.48 0.00 0.00 0.00 175.76 175.21 2kh2 s LEU 29 N 1.30 0.54 0.27 0.00 2.34 -0.37 -2.67 118.68 120.08 2kh2 s LEU 29 Ca 0.03 -0.31 -0.30 0.00 0.06 0.00 0.00 54.13 53.62 2kh2 s LEU 29 Cb -0.14 1.72 -0.11 0.00 -0.56 0.00 0.00 46.19 47.09 2kh2 s LEU 29 CO -0.11 -0.80 1.56 -1.00 -1.06 0.00 0.00 176.35 174.94 2kh2 s HIS 30 N -3.58 2.85 -0.05 3.48 3.76 -1.26 -0.11 115.29 120.38 2kh2 s HIS 30 Ca 0.02 0.82 0.03 0.00 -0.15 0.00 0.00 55.06 55.77 2kh2 s HIS 30 Cb 0.02 -4.00 0.01 0.00 1.11 0.00 0.00 32.58 29.71 2kh2 s HIS 30 CO -0.10 -3.38 -0.13 -1.17 -0.85 0.00 0.00 174.74 169.11 2kh2 s LEU 31 N -0.30 1.74 0.00 0.89 2.96 -1.26 -4.84 118.68 117.86 2kh2 s LEU 31 Ca 0.63 -0.29 0.00 0.00 -0.22 0.00 0.00 54.13 54.26 2kh2 s LEU 31 Cb -0.46 -0.80 0.00 0.00 0.50 0.00 0.00 46.19 45.43 2kh2 s LEU 31 CO 0.45 0.07 0.00 0.00 -1.32 0.00 0.00 176.35 175.55 2kh2 n GLN 32 N 3.52 0.00 0.00 1.98 6.02 -1.26 -4.93 117.38 122.71 2kh2 n GLN 32 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.78 2kh2 n GLN 32 Cb 0.53 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.79 2kh2 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kh2 n GLY 33 N 0.00 2.00 1.44 1.08 0.00 -1.26 -2.86 105.19 105.59 2kh2 n GLY 33 Ca 0.00 -0.48 0.09 0.00 0.00 0.00 0.00 46.02 45.63 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 7.06 3.71 -0.07 1.61 -0.06 -1.26 -4.15 117.38 124.22 2kh2 n GLN 34 Ca 0.00 -2.84 0.12 0.00 -2.00 0.00 0.00 57.00 52.28 2kh2 n GLN 34 Cb 0.00 -1.88 0.19 0.00 -4.06 0.00 0.00 30.24 24.50 2kh2 n GLN 34 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39 2kh2 n ASP 35 N 0.77 2.93 0.30 1.69 4.64 -1.13 -4.22 116.55 121.53 2kh2 n ASP 35 Ca 0.24 -1.93 0.19 0.00 -1.38 0.00 0.00 54.79 51.90 2kh2 n ASP 35 Cb 0.89 -0.09 0.90 0.00 -1.04 0.00 0.00 41.12 41.78 2kh2 n ASP 35 CO 0.00 0.00 0.00 -0.03 -0.82 0.00 0.00 177.20 176.35 2kh2 h MET 36 N 4.27 0.00 0.00 -0.67 4.05 -1.72 -2.56 114.93 118.30 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 0.92 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.72 2kh2 h MET 36 CO 0.00 0.02 0.00 0.39 0.23 0.00 0.00 176.91 177.55 2kh2 n GLU 37 N -3.17 0.23 -0.06 0.39 -0.58 -1.26 -1.86 120.64 114.33 2kh2 n GLU 37 Ca -0.01 0.13 0.10 0.00 -0.42 0.00 0.00 57.16 56.97 2kh2 n GLU 37 Cb 0.21 -1.50 0.42 0.00 -0.57 0.00 0.00 31.44 30.00 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 -1.23 1.59 -1.52 3.49 6.02 -0.96 -4.92 117.38 119.85 2kh2 n GLN 38 Ca 0.07 -0.88 -0.33 0.00 -0.01 0.00 0.00 57.00 55.85 2kh2 n GLN 38 Cb 0.09 -1.38 0.08 0.00 1.02 0.00 0.00 30.24 30.05 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 -1.84 2.40 -0.06 -1.09 -2.07 -0.78 -4.78 119.66 111.43 2kh2 s GLN 39 Ca 0.32 1.48 -0.12 0.00 -1.82 0.00 0.00 55.36 55.22 2kh2 s GLN 39 Cb 0.17 -1.89 -0.05 0.00 -1.09 0.00 0.00 33.01 30.15 2kh2 s GLN 39 CO 0.26 -1.58 0.30 0.08 -1.32 0.00 0.00 175.29 173.03 2kh2 s VAL 40 N -2.33 5.23 -0.19 3.63 1.01 -0.94 -5.03 120.40 121.78 2kh2 s VAL 40 Ca 0.68 0.59 -0.07 0.00 0.00 0.00 0.00 61.98 63.18 2kh2 s VAL 40 Cb -0.23 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2kh2 s VAL 40 CO 0.46 0.56 0.05 -0.69 0.00 0.00 0.00 175.10 175.48 2kh2 s VAL 41 N -0.82 4.63 -0.18 2.92 1.01 -1.26 -4.75 120.40 121.95 2kh2 s VAL 41 Ca 0.20 -0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 2kh2 s VAL 41 Cb -0.15 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 2kh2 s VAL 41 CO 0.09 0.45 0.08 -0.36 0.00 0.00 0.00 175.10 175.36 2kh2 s PHE 42 N 0.53 3.31 -0.25 5.22 0.08 -0.12 -1.34 117.98 125.40 2kh2 s PHE 42 Ca 0.02 0.17 -0.24 0.00 0.12 0.00 0.00 56.93 57.01 2kh2 s PHE 42 Cb -0.13 -2.08 -0.00 0.00 -0.57 0.00 0.00 43.02 40.24 2kh2 s PHE 42 CO 0.01 0.24 0.82 -1.12 -0.10 0.00 0.00 175.22 175.07 2kh2 s SER 43 N 0.23 6.80 -0.40 1.36 0.01 0.64 -1.42 113.70 120.91 2kh2 s SER 43 Ca 0.05 0.98 -0.15 0.00 1.31 0.00 0.00 55.95 58.14 2kh2 s SER 43 Cb -0.12 -2.43 0.02 0.00 0.21 0.00 0.00 66.02 63.70 2kh2 s SER 43 CO -0.00 -0.53 0.29 -0.32 0.41 0.00 0.00 173.24 173.09 2kh2 s MET 44 N 2.85 3.03 -0.09 12.44 1.75 0.13 -2.89 119.30 136.51 2kh2 s MET 44 Ca 0.34 -0.98 -0.03 0.00 -1.25 0.00 0.00 55.69 53.78 2kh2 s MET 44 Cb -0.15 -3.96 -0.03 0.00 2.84 0.00 0.00 34.83 33.53 2kh2 s MET 44 CO 0.08 -0.71 0.03 -1.12 -0.65 0.00 0.00 175.02 172.64 2kh2 s SER 45 N 1.68 5.45 -0.26 1.11 0.01 -1.14 -1.51 113.70 119.05 2kh2 s SER 45 Ca 0.05 0.21 -0.24 0.00 1.31 0.00 0.00 55.95 57.27 2kh2 s SER 45 Cb -0.19 -1.59 -0.00 0.00 0.21 0.00 0.00 66.02 64.45 2kh2 s SER 45 CO 0.10 0.38 0.83 -0.36 0.41 0.00 0.00 173.24 174.60 2kh2 s PHE 46 N -0.91 3.28 0.43 2.43 0.40 -0.68 -0.57 117.98 122.36 2kh2 s PHE 46 Ca 0.14 1.05 0.08 0.00 -0.60 0.00 0.00 56.93 57.60 2kh2 s PHE 46 Cb -0.11 -3.12 0.00 0.00 0.51 0.00 0.00 43.02 40.30 2kh2 s PHE 46 CO 0.03 -0.46 0.50 0.14 0.70 0.00 0.00 175.22 176.13 2kh2 s VAL 47 N 2.90 2.75 -0.91 -0.44 -7.23 -0.98 -4.71 120.40 111.78 2kh2 s VAL 47 Ca 0.35 -1.16 -0.17 0.00 -1.81 0.00 0.00 61.98 59.18 2kh2 s VAL 47 Cb -0.15 -2.91 0.16 0.00 0.56 0.00 0.00 36.38 34.04 2kh2 s VAL 47 CO 0.09 0.00 1.04 -1.58 -0.31 0.00 0.00 175.10 174.33 2kh2 s GLN 48 N -4.27 3.62 0.00 4.82 2.00 -1.19 -4.78 119.66 119.86 2kh2 s GLN 48 Ca 0.52 -2.00 0.00 0.00 -2.00 0.00 0.00 55.36 51.88 2kh2 s GLN 48 Cb -0.06 -4.78 0.00 0.00 0.80 0.00 0.00 33.01 28.96 2kh2 s GLN 48 CO 0.31 -1.63 0.00 0.41 -0.50 0.00 0.00 175.29 173.88 2kh2 n GLY 49 N 5.00 3.70 3.29 2.59 0.00 -1.26 -5.02 105.19 113.49 2kh2 n GLY 49 Ca 0.22 -0.42 -0.45 0.00 0.00 0.00 0.00 46.02 45.37 2kh2 n GLY 49 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kh2 s GLU 50 N 3.08 3.52 -1.13 1.61 2.56 -1.26 -4.99 118.70 122.08 2kh2 s GLU 50 Ca 0.00 -2.57 -0.17 0.00 0.00 0.00 0.00 54.97 52.23 2kh2 s GLU 50 Cb 0.00 -4.34 0.12 0.00 2.00 0.00 0.00 34.13 31.91 2kh2 s GLU 50 CO 0.00 -1.27 1.43 -2.00 -0.56 0.00 0.00 175.26 172.86 2kh2 s GLU 51 N -0.04 3.88 0.00 4.30 2.12 -1.26 -4.11 118.70 123.59 2kh2 s GLU 51 Ca 0.19 -2.04 0.00 0.00 0.36 0.00 0.00 54.97 53.48 2kh2 s GLU 51 Cb -0.11 -5.18 0.00 0.00 0.26 0.00 0.00 34.13 29.10 2kh2 s GLU 51 CO -0.08 -1.94 0.00 0.43 -0.54 0.00 0.00 175.26 173.12 2kh2 n SER 52 N 6.96 0.22 -0.01 -1.70 7.64 -0.31 -5.04 113.62 121.37 2kh2 n SER 52 Ca 0.36 -0.24 -0.16 0.00 1.01 0.00 0.00 58.87 59.83 2kh2 n SER 52 Cb 0.46 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.52 2kh2 n SER 52 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2kh2 n ASN 53 N -0.68 1.58 -0.74 6.43 2.85 -1.26 -4.27 115.26 119.17 2kh2 n ASN 53 Ca 0.00 0.27 0.08 0.00 -0.11 0.00 0.00 54.58 54.82 2kh2 n ASN 53 Cb 0.00 -0.49 0.13 0.00 1.24 0.00 0.00 39.78 40.66 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 -3.29 2.72 -3.65 1.20 5.75 -1.26 -4.89 116.55 113.13 2kh2 n ASP 54 Ca -0.27 -1.80 -0.20 0.00 -0.01 0.00 0.00 54.79 52.51 2kh2 n ASP 54 Cb 1.05 -0.14 -0.17 0.00 -1.03 0.00 0.00 41.12 40.83 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 -1.18 -0.03 -0.16 0.11 2.20 -1.25 -0.50 119.74 118.93 2kh2 s LYS 55 Ca 0.24 0.32 0.00 0.00 -0.36 0.00 0.00 55.97 56.18 2kh2 s LYS 55 Cb 0.15 -0.72 0.03 0.00 -1.51 0.00 0.00 37.83 35.77 2kh2 s LYS 55 CO 0.21 -0.39 -0.13 0.42 -0.36 0.00 0.00 175.35 175.09 2kh2 s ILE 56 N 2.19 1.58 -0.21 5.43 -1.09 -0.40 -1.16 121.20 127.54 2kh2 s ILE 56 Ca 0.04 -0.73 -0.29 0.00 -2.23 0.00 0.00 60.65 57.44 2kh2 s ILE 56 Cb -0.13 -1.54 0.00 0.00 -1.58 0.00 0.00 42.46 39.22 2kh2 s ILE 56 CO -0.05 0.38 1.10 -2.16 -1.23 0.00 0.00 174.94 172.98 2kh2 s PRO 57 N 1.47 4.26 0.10 2.79 0.04 -1.26 0.17 135.00 142.56 2kh2 s PRO 57 Ca 0.03 1.44 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 2kh2 s PRO 57 Cb -0.14 -3.67 -0.03 0.00 0.04 0.00 0.00 34.50 30.70 2kh2 s PRO 57 CO -0.10 -0.64 0.07 0.14 0.04 0.00 0.00 177.00 176.51 2kh2 s VAL 58 N 3.25 0.14 0.12 -0.36 -7.23 0.28 -2.32 120.40 114.28 2kh2 s VAL 58 Ca 0.47 -1.73 0.02 0.00 -1.81 0.00 0.00 61.98 58.93 2kh2 s VAL 58 Cb -0.17 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.98 2kh2 s VAL 58 CO 0.09 -0.65 0.25 0.00 -0.31 0.00 0.00 175.10 174.47 2kh2 s ALA 59 N -3.97 3.96 -0.20 1.32 0.00 0.26 -0.90 121.76 122.23 2kh2 s ALA 59 Ca 0.15 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.12 2kh2 s ALA 59 Cb 0.07 -1.77 0.05 0.00 0.00 0.00 0.00 23.12 21.47 2kh2 s ALA 59 CO -0.04 0.63 -0.02 -0.51 0.00 0.00 0.00 175.76 175.82 2kh2 s LEU 60 N -2.98 1.74 0.17 0.00 1.43 -1.26 -2.87 118.68 114.91 2kh2 s LEU 60 Ca 0.34 -0.87 0.02 0.00 -1.03 0.00 0.00 54.13 52.59 2kh2 s LEU 60 Cb -0.12 -0.87 -0.05 0.00 0.03 0.00 0.00 46.19 45.19 2kh2 s LEU 60 CO 0.28 -0.24 0.01 -0.83 0.23 0.00 0.00 176.35 175.79 2kh2 s GLY 61 N 1.65 1.20 0.24 -3.19 0.00 -1.14 -0.82 107.32 105.25 2kh2 s GLY 61 Ca -0.02 -1.58 -0.30 0.00 0.00 0.00 0.00 44.72 42.83 2kh2 s GLY 61 CO -0.07 -1.51 1.06 1.08 0.00 0.00 0.00 173.10 173.66 2kh2 s LEU 62 N -3.16 4.55 0.14 0.66 1.02 0.23 -0.26 118.68 121.85 2kh2 s LEU 62 Ca 0.24 2.14 -0.34 0.00 0.02 0.00 0.00 54.13 56.18 2kh2 s LEU 62 Cb 0.06 -3.62 -0.14 0.00 0.02 0.00 0.00 46.19 42.51 2kh2 s LEU 62 CO 0.04 -0.10 1.54 1.17 0.02 0.00 0.00 176.35 179.02 2kh2 n LYS 63 N 1.65 1.97 -1.76 1.70 4.81 -0.45 -1.76 118.16 124.31 2kh2 n LYS 63 Ca -0.00 0.71 -0.15 0.00 -0.87 0.00 0.00 58.31 58.00 2kh2 n LYS 63 Cb 0.46 -2.46 -0.05 0.00 0.02 0.00 0.00 35.03 33.00 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 3.35 -1.57 -4.22 1.64 0.28 -1.26 -4.94 120.64 113.91 2kh2 n GLU 64 Ca 0.17 0.84 -0.13 0.00 -0.16 0.00 0.00 57.16 57.88 2kh2 n GLU 64 Cb 0.27 -5.23 -0.10 0.00 1.43 0.00 0.00 31.44 27.81 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 -3.85 0.98 -0.19 3.44 1.02 -0.72 -5.04 119.74 115.38 2kh2 s LYS 65 Ca 0.00 -1.38 0.11 0.00 0.02 0.00 0.00 55.97 54.71 2kh2 s LYS 65 Cb 0.00 -0.52 0.63 0.00 -0.52 0.00 0.00 37.83 37.42 2kh2 s LYS 65 CO 0.00 0.06 1.46 0.27 -0.92 0.00 0.00 175.35 176.22 2kh2 n ASN 66 N -0.05 4.63 -4.57 2.83 6.94 -1.26 -4.45 115.26 119.33 2kh2 n ASN 66 Ca -0.12 -2.72 -0.41 0.00 -0.02 0.00 0.00 54.58 51.31 2kh2 n ASN 66 Cb 0.60 -0.65 -0.08 0.00 -2.36 0.00 0.00 39.78 37.30 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 -2.12 4.27 0.14 -4.53 1.43 -1.26 -2.07 118.68 114.52 2kh2 s LEU 67 Ca 0.42 0.10 0.11 0.00 -1.03 0.00 0.00 54.13 53.72 2kh2 s LEU 67 Cb 0.32 -2.58 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 2kh2 s LEU 67 CO 0.12 -0.42 -0.26 -0.31 0.23 0.00 0.00 176.35 175.72 2kh2 s TYR 68 N 2.34 2.23 -0.12 0.29 1.51 -0.31 -0.61 117.35 122.69 2kh2 s TYR 68 Ca 0.19 -0.38 -0.30 0.00 -1.01 0.00 0.00 57.07 55.57 2kh2 s TYR 68 Cb -0.16 -1.19 -0.02 0.00 -0.11 0.00 0.00 41.96 40.48 2kh2 s TYR 68 CO 0.12 0.34 1.27 -0.51 -1.11 0.00 0.00 175.55 175.66 2kh2 s LEU 69 N -2.13 4.23 -0.04 -1.29 1.43 0.00 -0.68 118.68 120.19 2kh2 s LEU 69 Ca 0.14 1.78 0.06 0.00 -1.03 0.00 0.00 54.13 55.08 2kh2 s LEU 69 Cb -0.10 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.57 2kh2 s LEU 69 CO 0.06 -0.71 -0.24 -0.55 0.23 0.00 0.00 176.35 175.15 2kh2 s SER 70 N 1.86 2.86 -0.27 2.29 0.15 0.80 -4.39 113.70 117.00 2kh2 s SER 70 Ca 0.56 -0.46 -0.04 0.00 0.70 0.00 0.00 55.95 56.71 2kh2 s SER 70 Cb -0.24 -0.63 0.02 0.00 -1.71 0.00 0.00 66.02 63.46 2kh2 s SER 70 CO 0.18 0.25 0.01 0.00 1.20 0.00 0.00 173.24 174.88 2kh2 s VAL 72 N 1.41 0.14 -0.30 0.00 -7.23 -0.80 -4.71 120.40 108.90 2kh2 s VAL 72 Ca 0.01 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.01 2kh2 s VAL 72 Cb -0.17 -2.52 -0.02 0.00 0.56 0.00 0.00 36.38 34.23 2kh2 s VAL 72 CO -0.01 0.00 0.50 -0.76 -0.31 0.00 0.00 175.10 174.52 2kh2 s LEU 73 N -3.26 4.16 -0.23 1.32 1.43 -1.26 -0.03 118.68 120.81 2kh2 s LEU 73 Ca 0.38 0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.79 2kh2 s LEU 73 Cb 0.06 -2.61 0.05 0.00 0.03 0.00 0.00 46.19 43.71 2kh2 s LEU 73 CO 0.16 -0.36 -0.13 -0.54 0.23 0.00 0.00 176.35 175.71 2kh2 s LYS 74 N 2.33 2.43 -1.14 1.70 1.02 0.12 -4.72 119.74 121.48 2kh2 s LYS 74 Ca 0.20 -1.16 -0.05 0.00 0.02 0.00 0.00 55.97 54.97 2kh2 s LYS 74 Cb -0.15 -2.76 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 2kh2 s LYS 74 CO 0.11 -0.46 0.89 -3.47 -0.92 0.00 0.00 175.35 171.50 2kh2 n ASP 75 N 4.51 -4.37 -1.76 2.83 4.64 -1.26 -2.25 116.55 118.88 2kh2 n ASP 75 Ca -0.16 -0.74 -0.19 0.00 -1.38 0.00 0.00 54.79 52.32 2kh2 n ASP 75 Cb 0.45 -4.78 -0.06 0.00 -1.04 0.00 0.00 41.12 35.69 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 -3.10 -5.09 -3.73 1.67 10.43 -1.26 -4.96 116.55 110.51 2kh2 n ASP 76 Ca -0.17 0.36 -0.16 0.00 2.57 0.00 0.00 54.79 57.39 2kh2 n ASP 76 Cb 0.64 -4.47 -0.16 0.00 1.84 0.00 0.00 41.12 38.97 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 -3.96 -0.01 0.06 -1.24 2.47 -0.95 -5.12 119.74 110.99 2kh2 s LYS 77 Ca 0.00 0.33 -0.31 0.00 -1.56 0.00 0.00 55.97 54.43 2kh2 s LYS 77 Cb 0.00 -0.29 -0.08 0.00 -1.46 0.00 0.00 37.83 36.00 2kh2 s LYS 77 CO 0.00 -0.22 1.65 -2.14 0.16 0.00 0.00 175.35 174.80 2kh2 s PRO 78 N 1.51 4.20 0.08 4.03 0.02 -1.26 0.12 135.00 143.71 2kh2 s PRO 78 Ca -0.04 2.31 0.02 0.00 0.02 0.00 0.00 61.00 63.31 2kh2 s PRO 78 Cb -0.12 -3.64 -0.04 0.00 0.02 0.00 0.00 34.50 30.72 2kh2 s PRO 78 CO -0.04 -0.74 -0.08 0.99 -0.33 0.00 0.00 177.00 176.80 2kh2 s THR 79 N 2.79 0.71 0.08 0.99 2.01 0.96 -4.66 115.64 118.52 2kh2 s THR 79 Ca 0.74 -1.62 -0.12 0.00 0.31 0.00 0.00 61.69 61.00 2kh2 s THR 79 Cb -0.39 -1.29 -0.06 0.00 0.01 0.00 0.00 72.50 70.77 2kh2 s THR 79 CO 0.32 -0.66 0.44 -0.22 -0.69 0.00 0.00 174.62 173.81 2kh2 s LEU 80 N -2.48 4.37 0.21 4.42 2.96 -1.26 -1.91 118.68 124.99 2kh2 s LEU 80 Ca 0.04 0.89 -0.13 0.00 -0.22 0.00 0.00 54.13 54.71 2kh2 s LEU 80 Cb -0.01 -2.98 0.00 0.00 0.50 0.00 0.00 46.19 43.70 2kh2 s LEU 80 CO -0.02 0.18 0.43 0.00 -1.32 0.00 0.00 176.35 175.62 2kh2 s GLN 81 N -1.78 1.38 -0.28 1.98 -2.07 0.38 -4.92 119.66 114.35 2kh2 s GLN 81 Ca 0.33 -1.13 -0.08 0.00 -1.82 0.00 0.00 55.36 52.66 2kh2 s GLN 81 Cb -0.15 0.45 -0.01 0.00 -1.09 0.00 0.00 33.01 32.21 2kh2 s GLN 81 CO 0.18 -0.56 0.10 -0.51 -1.32 0.00 0.00 175.29 173.18 2kh2 s LEU 82 N -2.97 3.77 -0.13 2.60 2.01 -1.26 -0.14 118.68 122.56 2kh2 s LEU 82 Ca 0.17 -0.43 -0.05 0.00 0.01 0.00 0.00 54.13 53.84 2kh2 s LEU 82 Cb 0.01 -1.94 -0.04 0.00 0.01 0.00 0.00 46.19 44.23 2kh2 s LEU 82 CO 0.03 -0.13 0.05 -1.61 1.01 0.00 0.00 176.35 175.71 2kh2 s GLU 83 N 1.59 3.44 -0.73 1.70 2.02 0.14 -4.89 118.70 121.97 2kh2 s GLU 83 Ca 0.05 -0.32 -0.17 0.00 0.02 0.00 0.00 54.97 54.55 2kh2 s GLU 83 Cb -0.16 -3.03 0.15 0.00 0.10 0.00 0.00 34.13 31.19 2kh2 s GLU 83 CO 0.04 0.57 0.78 -1.12 0.02 0.00 0.00 175.26 175.55 2kh2 s SER 84 N -0.48 6.48 0.53 -0.19 0.01 -1.26 -1.16 113.70 117.63 2kh2 s SER 84 Ca 0.10 -2.05 0.04 0.00 1.31 0.00 0.00 55.95 55.34 2kh2 s SER 84 Cb -0.12 -2.27 0.04 0.00 0.21 0.00 0.00 66.02 63.87 2kh2 s SER 84 CO 0.02 -0.88 0.73 0.68 0.41 0.00 0.00 173.24 174.21 2kh2 s VAL 85 N 1.63 2.69 -0.23 3.43 -7.23 -0.88 -5.00 120.40 114.80 2kh2 s VAL 85 Ca 0.17 -0.79 -0.33 0.00 -1.81 0.00 0.00 61.98 59.22 2kh2 s VAL 85 Cb -0.16 -2.90 -0.10 0.00 0.56 0.00 0.00 36.38 33.78 2kh2 s VAL 85 CO -0.03 0.00 2.10 -0.67 -0.31 0.00 0.00 175.10 176.20 2kh2 n ASP 86 N -2.23 2.89 0.26 4.85 2.03 -1.26 -4.84 116.55 118.25 2kh2 n ASP 86 Ca 0.09 0.52 0.09 0.00 0.52 0.00 0.00 54.79 56.02 2kh2 n ASP 86 Cb 0.60 -1.39 0.67 0.00 -0.72 0.00 0.00 41.12 40.28 2kh2 n ASP 86 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2kh2 h PRO 87 N 12.23 0.00 0.00 -0.67 0.13 -1.91 -1.51 132.00 140.26 2kh2 h PRO 87 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2kh2 h PRO 87 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2kh2 h PRO 87 CO 0.98 0.08 -0.88 0.36 -0.23 0.00 0.00 178.00 178.31 2kh2 n LYS 88 N -4.18 0.23 -0.09 0.86 2.85 -1.26 -3.90 118.16 112.66 2kh2 n LYS 88 Ca -0.03 0.01 0.09 0.00 -1.05 0.00 0.00 58.31 57.34 2kh2 n LYS 88 Cb 0.16 -1.59 0.13 0.00 -0.65 0.00 0.00 35.03 33.08 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 -1.89 2.85 -4.02 -5.58 3.02 -0.82 -4.95 115.26 103.87 2kh2 n ASN 89 Ca 0.03 -1.84 -0.13 0.00 -0.03 0.00 0.00 54.58 52.61 2kh2 n ASN 89 Cb 0.42 -0.12 -0.12 0.00 -0.61 0.00 0.00 39.78 39.35 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 -1.37 0.50 0.56 3.10 1.51 -0.63 -4.55 117.35 116.47 2kh2 s TYR 90 Ca 0.27 -0.41 -0.07 0.00 -1.01 0.00 0.00 57.07 55.85 2kh2 s TYR 90 Cb 0.17 -0.31 0.12 0.00 -0.11 0.00 0.00 41.96 41.83 2kh2 s TYR 90 CO 0.24 -0.09 0.77 -0.35 -1.11 0.00 0.00 175.55 175.01 2kh2 n PRO 91 N 1.83 -0.49 -3.94 -1.71 -0.04 -1.26 -4.78 135.00 124.62 2kh2 n PRO 91 Ca -0.21 -1.45 -0.09 0.00 -0.04 0.00 0.00 63.50 61.71 2kh2 n PRO 91 Cb 0.56 -0.71 -0.05 0.00 -0.04 0.00 0.00 33.50 33.25 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 -4.59 1.44 -0.03 0.54 -2.85 -1.26 -5.08 119.74 107.91 2kh2 s LYS 92 Ca 0.46 -1.17 -0.25 0.00 -1.00 0.00 0.00 55.97 54.01 2kh2 s LYS 92 Cb -0.02 0.46 -0.20 0.00 -2.06 0.00 0.00 37.83 36.01 2kh2 s LYS 92 CO 0.31 -0.59 1.17 -0.22 0.10 0.00 0.00 175.35 176.13 2kh2 h LYS 93 N 2.30 -0.05 -4.26 1.78 3.64 -1.98 -3.36 116.57 114.63 2kh2 h LYS 93 Ca -0.28 0.00 -0.76 0.00 -1.27 0.00 0.00 60.65 58.35 2kh2 h LYS 93 Cb 1.25 0.01 -0.22 0.00 -0.41 0.00 0.00 32.23 32.86 2kh2 h LYS 93 CO 0.38 0.46 0.72 0.21 -2.27 0.00 0.00 179.45 178.96 2kh2 s LYS 94 N -4.01 3.93 0.83 1.90 2.47 -1.26 -3.14 119.74 120.47 2kh2 s LYS 94 Ca -0.16 -2.59 -0.12 0.00 -1.56 0.00 0.00 55.97 51.55 2kh2 s LYS 94 Cb 0.01 -4.75 0.12 0.00 -1.46 0.00 0.00 37.83 31.75 2kh2 s LYS 94 CO 0.64 -1.51 1.19 -1.64 0.16 0.00 0.00 175.35 174.19 2kh2 s MET 95 N 0.65 1.57 0.46 4.03 -1.94 -1.26 -5.03 119.30 117.77 2kh2 s MET 95 Ca 0.32 -0.19 -0.22 0.00 -1.71 0.00 0.00 55.69 53.89 2kh2 s MET 95 Cb -0.07 -1.98 -0.08 0.00 2.01 0.00 0.00 34.83 34.72 2kh2 s MET 95 CO -0.06 -1.79 1.11 -1.21 -0.01 0.00 0.00 175.02 173.06 2kh2 s GLU 96 N -5.60 3.81 0.60 2.03 8.01 -1.26 -4.92 118.70 121.38 2kh2 s GLU 96 Ca 0.66 1.61 0.31 0.00 0.01 0.00 0.00 54.97 57.56 2kh2 s GLU 96 Cb -0.08 -2.33 1.82 0.00 -4.31 0.00 0.00 34.13 29.23 2kh2 s GLU 96 CO 0.49 -0.47 2.20 -0.22 0.01 0.00 0.00 175.26 177.28 2kh2 h LYS 97 N 1.96 0.00 0.00 1.61 1.63 -1.96 0.13 116.57 119.94 2kh2 h LYS 97 Ca -0.49 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 2kh2 h LYS 97 Cb 1.24 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 2kh2 h LYS 97 CO 0.60 0.00 0.00 2.89 -3.45 0.00 0.00 179.45 179.49 2kh2 n ARG 98 N -3.72 0.12 -0.07 1.90 1.85 -1.26 -2.84 116.66 112.64 2kh2 n ARG 98 Ca -0.01 0.05 0.03 0.00 -1.00 0.00 0.00 57.85 56.92 2kh2 n ARG 98 Cb 0.18 -1.50 0.07 0.00 -1.05 0.00 0.00 32.46 30.16 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 0.19 -3.71 2.89 3.72 0.02 -0.92 117.46 118.21 2kh2 n PHE 99 Ca 0.08 -0.35 -0.37 0.00 -0.05 0.00 0.00 57.45 56.76 2kh2 n PHE 99 Cb 0.27 -0.03 -0.11 0.00 -0.94 0.00 0.00 39.48 38.68 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 -0.86 4.97 0.10 -4.37 1.01 -1.13 -3.97 120.40 116.14 2kh2 s VAL 100 Ca 0.12 0.05 0.10 0.00 0.00 0.00 0.00 61.98 62.24 2kh2 s VAL 100 Cb 0.06 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 2kh2 s VAL 100 CO 0.09 0.32 -0.23 -0.36 0.00 0.00 0.00 175.10 174.92 2kh2 s PHE 101 N 1.38 2.41 -0.39 5.22 0.08 -0.08 -1.78 117.98 124.82 2kh2 s PHE 101 Ca 0.06 -0.33 -0.13 0.00 0.12 0.00 0.00 56.93 56.65 2kh2 s PHE 101 Cb -0.15 -1.33 0.03 0.00 -0.57 0.00 0.00 43.02 41.00 2kh2 s PHE 101 CO 0.06 0.31 0.25 -0.80 -0.10 0.00 0.00 175.22 174.94 2kh2 s ASN 102 N -1.86 5.92 -0.75 1.36 0.01 0.24 -0.55 114.94 119.31 2kh2 s ASN 102 Ca 0.15 -0.96 -0.27 0.00 -0.71 0.00 0.00 52.86 51.07 2kh2 s ASN 102 Cb -0.10 -2.09 0.03 0.00 0.41 0.00 0.00 41.25 39.49 2kh2 s ASN 102 CO 0.06 -0.42 1.35 -0.75 -1.51 0.00 0.00 177.10 175.83 2kh2 s LYS 103 N 1.61 3.16 0.11 -0.60 2.20 0.13 -0.99 119.74 125.35 2kh2 s LYS 103 Ca 0.03 -0.22 -0.22 0.00 -0.36 0.00 0.00 55.97 55.21 2kh2 s LYS 103 Cb -0.19 -4.28 -0.07 0.00 -1.51 0.00 0.00 37.83 31.78 2kh2 s LYS 103 CO 0.08 -2.22 0.67 0.42 -0.36 0.00 0.00 175.35 173.95 2kh2 s ILE 104 N 6.03 4.59 -0.61 5.43 1.01 0.11 -1.28 121.20 136.48 2kh2 s ILE 104 Ca 0.39 1.45 0.04 0.00 0.00 0.00 0.00 60.65 62.54 2kh2 s ILE 104 Cb -0.08 -4.02 0.17 0.00 0.01 0.00 0.00 42.46 38.54 2kh2 s ILE 104 CO 0.14 0.52 0.43 -1.61 0.00 0.00 0.00 174.94 174.42 2kh2 s GLU 105 N -1.02 1.98 0.11 2.79 2.02 0.35 -0.53 118.70 124.39 2kh2 s GLU 105 Ca 0.33 -2.92 -0.16 0.00 0.02 0.00 0.00 54.97 52.24 2kh2 s GLU 105 Cb -0.21 -2.84 -0.05 0.00 0.10 0.00 0.00 34.13 31.12 2kh2 s GLU 105 CO 0.22 -1.30 1.52 -0.84 0.02 0.00 0.00 175.26 174.88 2kh2 h ILE 106 N 4.56 1.27 0.00 -1.63 3.07 -1.84 -3.46 117.51 119.48 2kh2 h ILE 106 Ca 0.16 -1.09 0.00 0.00 1.55 0.00 0.00 64.86 65.48 2kh2 h ILE 106 Cb 0.81 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 38.66 2kh2 h ILE 106 CO 0.61 0.35 0.00 -0.46 -1.05 0.00 0.00 178.15 177.61 2kh2 n ASN 107 N -4.46 0.00 0.00 2.16 0.23 -1.26 -4.99 115.26 106.94 2kh2 n ASN 107 Ca -0.02 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.14 2kh2 n ASN 107 Cb 0.31 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 38.14 2kh2 n ASN 107 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2kh2 n ASN 108 N 0.00 0.65 -4.53 0.53 4.05 -1.26 -4.86 115.26 109.83 2kh2 n ASN 108 Ca 0.00 -0.44 -0.30 0.00 0.45 0.00 0.00 54.58 54.28 2kh2 n ASN 108 Cb 0.00 0.50 -0.11 0.00 1.23 0.00 0.00 39.78 41.40 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 2kh2 s LYS 109 N -3.02 2.15 0.12 1.20 -0.14 -1.26 -4.86 119.74 113.93 2kh2 s LYS 109 Ca 0.09 -0.97 0.11 0.00 -1.36 0.00 0.00 55.97 53.84 2kh2 s LYS 109 Cb 0.17 -2.29 -0.04 0.00 -1.68 0.00 0.00 37.83 33.99 2kh2 s LYS 109 CO 0.76 0.53 -0.26 -0.48 -0.76 0.00 0.00 175.35 175.14 2kh2 s LEU 110 N -1.82 2.31 0.26 3.17 0.05 0.32 -3.56 118.68 119.41 2kh2 s LEU 110 Ca 0.18 -0.73 0.11 0.00 0.05 0.00 0.00 54.13 53.74 2kh2 s LEU 110 Cb -0.11 -1.19 -0.05 0.00 -2.05 0.00 0.00 46.19 42.80 2kh2 s LEU 110 CO 0.10 0.17 -0.16 -1.61 -0.55 0.00 0.00 176.35 174.30 2kh2 s GLU 111 N -1.98 1.80 -0.33 1.48 2.02 0.31 0.35 118.70 122.34 2kh2 s GLU 111 Ca 0.13 -1.63 0.04 0.00 0.02 0.00 0.00 54.97 53.52 2kh2 s GLU 111 Cb -0.10 -1.88 0.10 0.00 0.10 0.00 0.00 34.13 32.35 2kh2 s GLU 111 CO 0.06 0.35 0.04 -0.06 0.02 0.00 0.00 175.26 175.67 2kh2 s PHE 112 N -2.30 3.59 -0.09 1.61 0.08 -1.26 0.03 117.98 119.64 2kh2 s PHE 112 Ca 0.29 -2.86 -0.17 0.00 0.12 0.00 0.00 56.93 54.30 2kh2 s PHE 112 Cb -0.06 -2.76 -0.05 0.00 -0.57 0.00 0.00 43.02 39.58 2kh2 s PHE 112 CO 0.15 -0.94 0.45 -2.00 -0.10 0.00 0.00 175.22 172.79 2kh2 s GLU 113 N 0.97 4.26 0.12 0.44 2.12 -0.17 -2.33 118.70 124.11 2kh2 s GLU 113 Ca 0.09 0.42 -0.31 0.00 0.36 0.00 0.00 54.97 55.53 2kh2 s GLU 113 Cb -0.19 -3.39 -0.08 0.00 0.26 0.00 0.00 34.13 30.73 2kh2 s GLU 113 CO -0.09 0.27 1.41 0.45 -0.54 0.00 0.00 175.26 176.76 2kh2 s SER 114 N 0.26 6.80 0.19 -1.70 0.15 0.19 0.81 113.70 120.41 2kh2 s SER 114 Ca 0.25 2.36 -0.06 0.00 0.70 0.00 0.00 55.95 59.20 2kh2 s SER 114 Cb -0.15 -2.59 0.12 0.00 -1.71 0.00 0.00 66.02 61.69 2kh2 s SER 114 CO 0.11 -0.67 1.58 0.00 1.20 0.00 0.00 173.24 175.45 2kh2 h ALA 115 N 6.80 0.78 -0.54 5.45 0.00 -1.59 -3.03 119.26 127.13 2kh2 h ALA 115 Ca -0.42 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 53.97 2kh2 h ALA 115 Cb 1.21 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2kh2 h ALA 115 CO 0.87 0.65 -0.08 0.37 0.00 0.00 0.00 179.25 181.06 2kh2 h GLN 116 N 0.68 1.00 -3.88 0.00 4.15 -1.77 -3.38 115.11 111.90 2kh2 h GLN 116 Ca 0.08 -0.36 -0.64 0.00 0.77 0.00 0.00 58.65 58.49 2kh2 h GLN 116 Cb 0.84 -0.07 -0.40 0.00 0.21 0.00 0.00 27.48 28.05 2kh2 h GLN 116 CO 0.07 1.04 -0.68 -0.06 -1.93 0.00 0.00 178.83 177.27 2kh2 s PHE 117 N -4.88 3.26 0.46 3.99 0.08 -1.15 -5.10 117.98 114.63 2kh2 s PHE 117 Ca -0.12 -3.00 -0.25 0.00 0.12 0.00 0.00 56.93 53.69 2kh2 s PHE 117 Cb 0.13 -2.75 -0.08 0.00 -0.57 0.00 0.00 43.02 39.74 2kh2 s PHE 117 CO 0.85 -0.83 1.42 -2.14 -0.10 0.00 0.00 175.22 174.43 2kh2 s PRO 118 N 0.31 3.66 0.00 0.24 0.02 -1.20 -2.25 135.00 135.78 2kh2 s PRO 118 Ca 0.14 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.57 2kh2 s PRO 118 Cb -0.23 -2.64 0.00 0.00 0.02 0.00 0.00 34.50 31.66 2kh2 s PRO 118 CO -0.04 -0.84 0.00 -1.71 -0.33 0.00 0.00 177.00 174.08 2kh2 n ASN 119 N -0.24 -3.59 -4.27 2.53 4.05 -1.26 -4.99 115.26 107.49 2kh2 n ASN 119 Ca 0.05 0.00 -0.37 0.00 0.45 0.00 0.00 54.58 54.72 2kh2 n ASN 119 Cb 0.42 -1.43 -0.13 0.00 1.23 0.00 0.00 39.78 39.87 2kh2 n ASN 119 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2kh2 s TRP 120 N -1.80 3.18 0.20 1.20 0.52 -0.95 -4.42 118.94 116.86 2kh2 s TRP 120 Ca 0.00 -1.35 0.09 0.00 0.02 0.00 0.00 56.10 54.86 2kh2 s TRP 120 Cb 0.00 -2.20 -0.04 0.00 -1.15 0.00 0.00 33.47 30.08 2kh2 s TRP 120 CO 0.00 -0.68 -0.06 0.71 0.02 0.00 0.00 176.95 176.94 2kh2 s TYR 121 N 1.40 2.68 -0.19 -1.98 1.51 0.00 -0.63 117.35 120.14 2kh2 s TYR 121 Ca -0.00 -0.21 -0.29 0.00 -1.01 0.00 0.00 57.07 55.56 2kh2 s TYR 121 Cb -0.18 -1.28 -0.04 0.00 -0.11 0.00 0.00 41.96 40.35 2kh2 s TYR 121 CO 0.01 0.54 1.86 0.42 -1.11 0.00 0.00 175.55 177.27 2kh2 s ILE 122 N -1.86 3.37 0.13 2.71 1.01 -0.98 -1.07 121.20 124.51 2kh2 s ILE 122 Ca 0.27 0.41 0.06 0.00 0.00 0.00 0.00 60.65 61.38 2kh2 s ILE 122 Cb -0.08 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 2kh2 s ILE 122 CO 0.17 -0.18 0.03 -0.44 0.00 0.00 0.00 174.94 174.51 2kh2 s SER 123 N 5.58 5.03 0.07 3.58 0.01 0.69 -4.35 113.70 124.30 2kh2 s SER 123 Ca 0.83 -0.24 0.05 0.00 1.31 0.00 0.00 55.95 57.90 2kh2 s SER 123 Cb -0.30 -1.18 -0.03 0.00 0.21 0.00 0.00 66.02 64.72 2kh2 s SER 123 CO 0.34 0.12 -0.15 0.42 0.41 0.00 0.00 173.24 174.38 2kh2 s THR 124 N -1.54 1.14 0.50 1.44 -4.23 -0.40 -2.59 115.64 109.97 2kh2 s THR 124 Ca 0.27 -1.26 -0.09 0.00 -1.18 0.00 0.00 61.69 59.43 2kh2 s THR 124 Cb -0.11 -1.08 -0.05 0.00 1.34 0.00 0.00 72.50 72.60 2kh2 s THR 124 CO 0.19 -0.17 0.86 -0.44 -0.54 0.00 0.00 174.62 174.52 2kh2 s SER 125 N -1.63 6.35 0.31 3.99 0.01 -1.26 -1.11 113.70 120.35 2kh2 s SER 125 Ca -0.01 1.16 0.15 0.00 1.31 0.00 0.00 55.95 58.56 2kh2 s SER 125 Cb -0.10 -2.35 0.40 0.00 0.21 0.00 0.00 66.02 64.19 2kh2 s SER 125 CO 0.02 -0.61 1.60 1.56 0.41 0.00 0.00 173.24 176.23 2kh2 h GLN 126 N 0.41 0.00 -7.24 12.44 1.08 -2.00 -3.45 115.11 116.35 2kh2 h GLN 126 Ca -0.46 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.22 2kh2 h GLN 126 Cb 1.19 0.00 0.13 0.00 -0.05 0.00 0.00 27.48 28.76 2kh2 h GLN 126 CO 0.62 0.52 0.34 0.00 -0.95 0.00 0.00 178.83 179.36 2kh2 s ALA 127 N -3.39 2.23 0.21 3.87 0.00 -1.26 -5.01 121.76 118.41 2kh2 s ALA 127 Ca 0.01 0.51 -0.22 0.00 0.00 0.00 0.00 51.96 52.25 2kh2 s ALA 127 Cb 0.11 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 19.80 2kh2 s ALA 127 CO 0.73 -1.71 0.76 -2.00 0.00 0.00 0.00 175.76 173.54 2kh2 s GLU 128 N -4.41 4.39 -1.21 0.00 2.56 -1.26 -4.08 118.70 114.69 2kh2 s GLU 128 Ca 0.66 1.01 -0.05 0.00 0.00 0.00 0.00 54.97 56.59 2kh2 s GLU 128 Cb -0.21 -2.99 0.01 0.00 2.00 0.00 0.00 34.13 32.93 2kh2 s GLU 128 CO 0.49 0.44 0.71 -1.71 -0.56 0.00 0.00 175.26 174.63 2kh2 n ASN 129 N 0.99 -5.46 -4.91 -1.70 5.15 -1.14 -5.01 115.26 103.18 2kh2 n ASN 129 Ca -0.03 -0.33 -0.32 0.00 -0.60 0.00 0.00 54.58 53.30 2kh2 n ASN 129 Cb 0.50 -4.19 -0.04 0.00 -0.53 0.00 0.00 39.78 35.51 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 -5.75 3.52 0.94 1.20 -1.94 -1.09 -4.82 119.30 111.35 2kh2 s MET 130 Ca 0.35 -0.27 -0.12 0.00 -1.71 0.00 0.00 55.69 53.95 2kh2 s MET 130 Cb -0.16 -2.99 0.15 0.00 2.01 0.00 0.00 34.83 33.85 2kh2 s MET 130 CO 0.44 0.58 1.10 -2.14 -0.01 0.00 0.00 175.02 174.98 2kh2 s PRO 131 N -2.40 0.92 -0.18 2.03 0.02 -1.26 0.18 135.00 134.32 2kh2 s PRO 131 Ca 0.35 0.57 -0.09 0.00 0.02 0.00 0.00 61.00 61.85 2kh2 s PRO 131 Cb -0.13 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 2kh2 s PRO 131 CO 0.24 -2.41 0.13 0.08 -0.33 0.00 0.00 177.00 174.71 2kh2 s VAL 132 N -3.03 5.38 0.29 3.83 1.01 -0.91 -4.54 120.40 122.43 2kh2 s VAL 132 Ca 0.64 0.18 0.04 0.00 0.00 0.00 0.00 61.98 62.84 2kh2 s VAL 132 Cb -0.17 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 2kh2 s VAL 132 CO 0.56 0.48 0.25 0.72 0.00 0.00 0.00 175.10 177.11 2kh2 s PHE 133 N 0.04 1.55 -0.18 5.22 -0.12 -1.07 -4.83 117.98 118.59 2kh2 s PHE 133 Ca 0.09 -1.56 -0.09 0.00 -0.05 0.00 0.00 56.93 55.32 2kh2 s PHE 133 Cb -0.11 -0.64 -0.05 0.00 -0.63 0.00 0.00 43.02 41.59 2kh2 s PHE 133 CO -0.00 -0.82 0.12 -1.17 -0.05 0.00 0.00 175.22 173.29 2kh2 s LEU 134 N -3.30 4.16 0.13 -1.99 2.96 -1.26 -0.22 118.68 119.15 2kh2 s LEU 134 Ca 0.40 0.23 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 2kh2 s LEU 134 Cb 0.04 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 2kh2 s LEU 134 CO 0.23 0.21 -0.01 -0.83 -1.32 0.00 0.00 176.35 174.63 2kh2 s GLY 135 N 0.16 0.99 0.00 7.98 0.00 -0.24 -4.85 107.32 111.36 2kh2 s GLY 135 Ca 0.08 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 43.33 2kh2 s GLY 135 CO -0.01 -1.46 0.97 0.61 0.00 0.00 0.00 173.10 173.21 2kh2 n GLY 136 N -0.13 2.67 2.47 0.20 0.00 -1.26 -0.82 105.19 108.32 2kh2 n GLY 136 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.47 4.45 -1.88 2.61 -2.24 -1.26 -4.96 114.28 110.53 2kh2 n THR 137 Ca 0.00 -3.74 -0.42 0.00 -2.27 0.00 0.00 64.05 57.61 2kh2 n THR 137 Cb 0.24 -1.88 -0.03 0.00 -2.10 0.00 0.00 70.33 66.56 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 -1.33 4.18 0.00 -0.78 2.20 -1.26 -1.45 119.74 121.29 2kh2 s LYS 138 Ca 0.56 2.37 0.00 0.00 -0.36 0.00 0.00 55.97 58.54 2kh2 s LYS 138 Cb 0.27 -3.79 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 2kh2 s LYS 138 CO -0.14 -0.81 0.00 0.41 -0.36 0.00 0.00 175.35 174.45 2kh2 n GLY 139 N 4.15 0.73 0.00 5.54 0.00 -1.26 -5.04 105.19 109.31 2kh2 n GLY 139 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.50 2.42 0.11 -0.02 0.00 -0.53 -5.02 105.19 99.65 2kh2 n GLY 140 Ca 0.00 -0.93 -0.18 0.00 0.00 0.00 0.00 46.02 44.91 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 0.33 -6.68 1.61 7.50 -1.97 -3.45 115.11 112.45 2kh2 h GLN 141 Ca 0.00 -0.57 -0.52 0.00 0.50 0.00 0.00 58.65 58.06 2kh2 h GLN 141 Cb 0.00 0.21 0.02 0.00 0.05 0.00 0.00 27.48 27.76 2kh2 h GLN 141 CO 0.00 1.27 0.53 -0.51 -1.50 0.00 0.00 178.83 178.62 2kh2 s ASP 142 N -7.24 7.14 -0.24 1.46 1.01 -1.26 -4.59 116.67 112.95 2kh2 s ASP 142 Ca -0.05 2.21 -0.25 0.00 0.71 0.00 0.00 52.55 55.17 2kh2 s ASP 142 Cb 0.06 -2.61 -0.00 0.00 1.01 0.00 0.00 42.92 41.38 2kh2 s ASP 142 CO 0.90 -0.31 0.84 -0.63 0.21 0.00 0.00 175.17 176.17 2kh2 s ILE 143 N -0.25 4.83 -0.04 0.77 1.01 -0.27 -4.53 121.20 122.72 2kh2 s ILE 143 Ca 0.51 1.60 0.15 0.00 0.00 0.00 0.00 60.65 62.91 2kh2 s ILE 143 Cb -0.32 -4.13 -0.23 0.00 0.01 0.00 0.00 42.46 37.80 2kh2 s ILE 143 CO 0.37 -0.07 0.28 0.35 0.00 0.00 0.00 174.94 175.87 2kh2 n THR 144 N 5.23 0.18 -3.65 2.92 -2.24 -1.26 -1.27 114.28 114.19 2kh2 n THR 144 Ca 0.06 -0.40 -0.32 0.00 -2.27 0.00 0.00 64.05 61.12 2kh2 n THR 144 Cb 0.47 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.66 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 -3.96 6.52 0.27 3.42 -4.77 -1.26 -4.20 116.67 112.69 2kh2 s ASP 145 Ca -0.06 0.63 0.05 0.00 -3.30 0.00 0.00 52.55 49.88 2kh2 s ASP 145 Cb 0.09 -2.11 -0.02 0.00 -1.09 0.00 0.00 42.92 39.79 2kh2 s ASP 145 CO 0.63 0.08 0.24 0.49 0.70 0.00 0.00 175.17 177.31 2kh2 n PHE 146 N 0.28 -0.71 -4.50 2.11 3.72 0.15 -3.70 117.46 114.81 2kh2 n PHE 146 Ca -0.04 -2.19 -0.26 0.00 -0.05 0.00 0.00 57.45 54.92 2kh2 n PHE 146 Cb 0.52 0.26 -0.10 0.00 -0.94 0.00 0.00 39.48 39.22 2kh2 n PHE 146 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2kh2 s THR 147 N -3.04 2.30 -0.11 4.37 -4.23 0.11 -0.52 115.64 114.52 2kh2 s THR 147 Ca 0.31 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 2kh2 s THR 147 Cb 0.01 -2.70 0.02 0.00 1.34 0.00 0.00 72.50 71.17 2kh2 s THR 147 CO 0.22 -0.19 -0.10 -0.32 -0.54 0.00 0.00 174.62 173.69 2kh2 s MET 148 N -3.64 1.78 -0.11 3.99 1.75 -1.26 -3.49 119.30 118.31 2kh2 s MET 148 Ca 0.33 -0.37 0.02 0.00 -1.25 0.00 0.00 55.69 54.42 2kh2 s MET 148 Cb 0.02 -1.69 0.01 0.00 2.84 0.00 0.00 34.83 36.02 2kh2 s MET 148 CO 0.17 -0.19 -0.16 -0.65 -0.65 0.00 0.00 175.02 173.54 2kh2 s GLN 149 N 1.41 2.32 0.08 4.11 1.11 -0.97 -4.96 119.66 122.77 2kh2 s GLN 149 Ca 0.00 -0.60 -0.25 0.00 0.01 0.00 0.00 55.36 54.52 2kh2 s GLN 149 Cb -0.13 -1.96 -0.06 0.00 -1.01 0.00 0.00 33.01 29.84 2kh2 s GLN 149 CO -0.06 -0.06 0.78 -0.06 0.01 0.00 0.00 175.29 175.90 2kh2 s PHE 150 N 0.98 3.78 0.42 0.91 0.08 -1.26 -0.86 117.98 122.02 2kh2 s PHE 150 Ca -0.06 1.54 0.08 0.00 0.12 0.00 0.00 56.93 58.60 2kh2 s PHE 150 Cb -0.15 -2.83 -0.01 0.00 -0.57 0.00 0.00 43.02 39.47 2kh2 s PHE 150 CO -0.02 0.32 0.46 0.14 -0.10 0.00 0.00 175.22 176.03 2kh2 s VAL 151 N -0.31 2.84 -0.29 -0.44 -7.23 -1.04 -4.97 120.40 108.96 2kh2 s VAL 151 Ca 0.39 -1.18 -0.07 0.00 -1.81 0.00 0.00 61.98 59.30 2kh2 s VAL 151 Cb -0.21 -3.01 -0.24 0.00 0.56 0.00 0.00 36.38 33.48 2kh2 s VAL 151 CO 0.24 -0.00 3.51 -1.54 -0.31 0.00 0.00 175.10 177.00 2kh2 n SER 152 N -1.68 5.86 0.00 4.85 3.41 -1.26 -4.86 113.62 119.94 2kh2 n SER 152 Ca 0.05 -2.49 0.00 0.00 -0.26 0.00 0.00 58.87 56.17 2kh2 n SER 152 Cb 0.60 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68