#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 0.32 -5.96 0.00 0.11 -2.07 -3.44 132.00 120.96 2kh2 h PRO 2 Ca 0.00 -0.21 -0.59 0.00 0.11 0.00 0.00 66.00 65.31 2kh2 h PRO 2 Cb 0.00 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 31.08 2kh2 h PRO 2 CO 0.00 0.80 -0.16 0.54 -0.21 0.00 0.00 178.00 178.97 2kh2 s VAL 3 N -3.99 5.03 -0.17 3.15 0.11 -1.26 -5.06 120.40 118.21 2kh2 s VAL 3 Ca -0.14 0.93 -0.25 0.00 -2.93 0.00 0.00 61.98 59.58 2kh2 s VAL 3 Cb 0.04 -3.77 -0.01 0.00 -1.53 0.00 0.00 36.38 31.11 2kh2 s VAL 3 CO 0.76 0.50 0.82 -0.13 -3.33 0.00 0.00 175.10 173.72 2kh2 s ARG 4 N -0.59 4.29 0.09 1.54 0.52 -1.26 -5.02 118.95 118.51 2kh2 s ARG 4 Ca 0.25 1.00 -0.22 0.00 -0.52 0.00 0.00 55.73 56.24 2kh2 s ARG 4 Cb -0.17 -3.58 0.06 0.00 0.52 0.00 0.00 34.95 31.78 2kh2 s ARG 4 CO 0.13 -0.33 0.53 -1.12 0.02 0.00 0.00 175.30 174.54 2kh2 s SER 5 N 1.16 -0.46 0.28 0.23 0.01 -1.26 -0.73 113.70 112.94 2kh2 s SER 5 Ca 0.38 0.06 -0.11 0.00 1.31 0.00 0.00 55.95 57.59 2kh2 s SER 5 Cb -0.16 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.59 2kh2 s SER 5 CO 0.12 -0.82 0.50 -1.48 0.41 0.00 0.00 173.24 171.97 2kh2 s LEU 6 N -2.32 0.45 -0.04 2.44 0.05 -0.18 -4.98 118.68 114.10 2kh2 s LEU 6 Ca -0.02 -1.07 0.04 0.00 0.05 0.00 0.00 54.13 53.13 2kh2 s LEU 6 Cb -0.00 1.77 -0.00 0.00 -2.05 0.00 0.00 46.19 45.91 2kh2 s LEU 6 CO -0.06 -1.22 -0.17 0.54 -0.55 0.00 0.00 176.35 174.89 2kh2 s ASN 7 N -3.07 2.11 0.21 1.48 4.22 -1.26 0.50 114.94 119.13 2kh2 s ASN 7 Ca 0.24 -0.34 -0.14 0.00 -2.14 0.00 0.00 52.86 50.48 2kh2 s ASN 7 Cb -0.01 -0.53 0.01 0.00 1.28 0.00 0.00 41.25 42.00 2kh2 s ASN 7 CO 0.12 0.16 0.45 0.00 -2.04 0.00 0.00 177.10 175.79 2kh2 s THR 9 N -3.95 3.46 -0.24 0.00 -4.23 -0.13 -1.30 115.64 109.25 2kh2 s THR 9 Ca 0.16 -1.25 -0.08 0.00 -1.18 0.00 0.00 61.69 59.35 2kh2 s THR 9 Cb 0.00 -2.63 -0.03 0.00 1.34 0.00 0.00 72.50 71.18 2kh2 s THR 9 CO 0.02 0.10 0.09 -0.76 -0.54 0.00 0.00 174.62 173.53 2kh2 s LEU 10 N -2.25 3.60 -0.08 4.79 1.43 -1.26 -2.70 118.68 122.20 2kh2 s LEU 10 Ca 0.22 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 2kh2 s LEU 10 Cb -0.11 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.17 2kh2 s LEU 10 CO 0.15 0.00 -0.06 -0.13 0.23 0.00 0.00 176.35 176.54 2kh2 s ARG 11 N 1.39 1.15 0.63 1.70 1.81 -1.26 -3.75 118.95 120.62 2kh2 s ARG 11 Ca 0.06 -0.16 -0.11 0.00 -1.72 0.00 0.00 55.73 53.80 2kh2 s ARG 11 Cb -0.15 -1.20 0.15 0.00 -0.45 0.00 0.00 34.95 33.29 2kh2 s ARG 11 CO 0.04 -0.17 0.78 -0.40 -0.68 0.00 0.00 175.30 174.87 2kh2 n ASP 12 N 4.55 -0.28 0.03 0.23 5.68 -1.07 -2.20 116.55 123.48 2kh2 n ASP 12 Ca -0.16 -1.22 0.05 0.00 -0.50 0.00 0.00 54.79 52.96 2kh2 n ASP 12 Cb 0.51 -0.62 0.23 0.00 -1.14 0.00 0.00 41.12 40.09 2kh2 n ASP 12 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2kh2 n SER 13 N -3.65 0.12 -0.89 -1.12 7.64 -1.25 -0.76 113.62 113.71 2kh2 n SER 13 Ca 0.10 0.54 0.08 0.00 1.01 0.00 0.00 58.87 60.60 2kh2 n SER 13 Cb 0.35 -0.56 0.20 0.00 -1.01 0.00 0.00 64.21 63.19 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 -1.65 2.53 -2.28 1.43 1.13 -1.26 -4.95 117.38 112.33 2kh2 n GLN 14 Ca 0.01 -2.16 -0.16 0.00 -1.94 0.00 0.00 57.00 52.75 2kh2 n GLN 14 Cb 0.09 -1.38 -0.01 0.00 0.11 0.00 0.00 30.24 29.05 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 0.98 -1.30 -2.77 -1.09 1.13 0.06 -4.98 117.38 109.41 2kh2 n GLN 15 Ca 0.16 0.80 -0.32 0.00 -1.94 0.00 0.00 57.00 55.70 2kh2 n GLN 15 Cb 0.49 -5.21 -0.05 0.00 0.11 0.00 0.00 30.24 25.59 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 -4.77 4.01 0.09 -1.09 1.02 -1.26 -4.26 119.74 113.48 2kh2 s LYS 16 Ca 0.00 0.84 0.10 0.00 0.02 0.00 0.00 55.97 56.93 2kh2 s LYS 16 Cb 0.00 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 35.01 2kh2 s LYS 16 CO 0.00 -0.06 -0.27 -1.12 -0.92 0.00 0.00 175.35 172.98 2kh2 s SER 17 N -2.66 3.27 -0.16 2.83 0.01 0.13 -2.61 113.70 114.51 2kh2 s SER 17 Ca 0.57 -0.68 -0.23 0.00 1.31 0.00 0.00 55.95 56.92 2kh2 s SER 17 Cb -0.10 -0.26 -0.02 0.00 0.21 0.00 0.00 66.02 65.85 2kh2 s SER 17 CO 0.23 0.21 0.72 -0.76 0.41 0.00 0.00 173.24 174.05 2kh2 s LEU 18 N -1.72 4.20 0.12 2.44 1.43 -1.25 -1.66 118.68 122.23 2kh2 s LEU 18 Ca 0.13 1.04 0.09 0.00 -1.03 0.00 0.00 54.13 54.35 2kh2 s LEU 18 Cb -0.10 -3.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.03 2kh2 s LEU 18 CO 0.04 -0.28 -0.21 0.68 0.23 0.00 0.00 176.35 176.81 2kh2 s VAL 19 N 1.72 1.81 -0.46 -1.59 -7.23 0.40 -1.44 120.40 113.61 2kh2 s VAL 19 Ca 0.34 -1.63 -0.29 0.00 -1.81 0.00 0.00 61.98 58.60 2kh2 s VAL 19 Cb -0.16 -1.67 0.01 0.00 0.56 0.00 0.00 36.38 35.12 2kh2 s VAL 19 CO 0.13 -0.07 1.39 -0.04 -0.31 0.00 0.00 175.10 176.20 2kh2 s MET 20 N -2.06 3.50 0.00 4.82 -1.94 -1.26 -1.31 119.30 121.06 2kh2 s MET 20 Ca 0.09 0.76 0.00 0.00 -1.71 0.00 0.00 55.69 54.83 2kh2 s MET 20 Cb -0.09 -4.04 0.00 0.00 2.01 0.00 0.00 34.83 32.70 2kh2 s MET 20 CO 0.05 -1.66 0.10 0.45 -0.01 0.00 0.00 175.02 173.95 2kh2 n SER 21 N 8.97 0.00 -3.26 3.03 2.88 0.26 -4.95 113.62 120.55 2kh2 n SER 21 Ca 0.15 0.11 -0.09 0.00 -1.33 0.00 0.00 58.87 57.71 2kh2 n SER 21 Cb 0.48 -0.01 0.02 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 1.89 2.24 0.35 0.46 0.00 -1.18 -4.94 105.19 104.02 2kh2 n GLY 22 Ca 0.00 -2.19 0.15 0.00 0.00 0.00 0.00 46.02 43.98 2kh2 n GLY 22 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2kh2 h PRO 23 N 0.00 0.16 -0.46 1.61 0.11 -2.04 -2.95 132.00 128.43 2kh2 h PRO 23 Ca -0.13 -0.01 -0.30 0.00 0.11 0.00 0.00 66.00 65.68 2kh2 h PRO 23 Cb 0.54 -0.04 -0.40 0.00 0.11 0.00 0.00 31.00 31.22 2kh2 h PRO 23 CO 0.19 0.11 -1.04 0.66 -0.21 0.00 0.00 178.00 177.70 2kh2 n TYR 24 N -4.44 1.47 -4.08 0.65 4.01 -1.26 -5.07 117.16 108.44 2kh2 n TYR 24 Ca 0.08 -2.05 -0.15 0.00 -0.16 0.00 0.00 57.90 55.62 2kh2 n TYR 24 Cb 0.45 -0.25 -0.14 0.00 -0.31 0.00 0.00 39.34 39.09 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 -3.54 0.33 -0.02 -0.72 2.12 -1.12 -4.32 118.70 111.43 2kh2 s GLU 25 Ca 0.32 -0.19 0.06 0.00 0.36 0.00 0.00 54.97 55.52 2kh2 s GLU 25 Cb 0.34 -0.29 -0.02 0.00 0.26 0.00 0.00 34.13 34.42 2kh2 s GLU 25 CO -0.03 0.08 -0.21 -0.51 -0.54 0.00 0.00 175.26 174.05 2kh2 s LEU 26 N -0.23 2.03 0.12 2.70 1.43 -1.26 -0.57 118.68 122.90 2kh2 s LEU 26 Ca 0.00 -0.38 0.07 0.00 -1.03 0.00 0.00 54.13 52.79 2kh2 s LEU 26 Cb -0.02 -1.09 -0.04 0.00 0.03 0.00 0.00 46.19 45.07 2kh2 s LEU 26 CO -0.00 0.25 -0.17 -0.54 0.23 0.00 0.00 176.35 176.12 2kh2 s LYS 27 N -0.45 1.09 -0.20 1.70 1.02 -0.42 -1.81 119.74 120.67 2kh2 s LYS 27 Ca 0.07 -1.23 -0.02 0.00 0.02 0.00 0.00 55.97 54.82 2kh2 s LYS 27 Cb -0.09 -1.13 0.00 0.00 -0.52 0.00 0.00 37.83 36.10 2kh2 s LYS 27 CO -0.00 0.24 -0.12 0.00 -0.92 0.00 0.00 175.35 174.55 2kh2 s ALA 28 N -1.76 2.59 0.14 5.17 0.00 0.13 -0.46 121.76 127.59 2kh2 s ALA 28 Ca 0.09 -1.18 -0.07 0.00 0.00 0.00 0.00 51.96 50.80 2kh2 s ALA 28 Cb -0.07 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.58 2kh2 s ALA 28 CO 0.04 -0.36 0.20 -0.48 0.00 0.00 0.00 175.76 175.16 2kh2 s LEU 29 N 1.34 1.28 0.09 0.00 0.05 -0.66 -2.65 118.68 118.13 2kh2 s LEU 29 Ca 0.05 -0.93 -0.31 0.00 0.05 0.00 0.00 54.13 52.99 2kh2 s LEU 29 Cb -0.14 0.91 -0.08 0.00 -2.05 0.00 0.00 46.19 44.84 2kh2 s LEU 29 CO -0.07 -0.82 1.43 -1.00 -0.55 0.00 0.00 176.35 175.34 2kh2 s HIS 30 N -3.97 3.06 -0.45 3.48 3.76 -1.26 0.17 115.29 120.09 2kh2 s HIS 30 Ca 0.17 0.84 0.03 0.00 -0.15 0.00 0.00 55.06 55.95 2kh2 s HIS 30 Cb 0.05 -3.72 0.15 0.00 1.11 0.00 0.00 32.58 30.17 2kh2 s HIS 30 CO -0.01 -2.60 0.30 -1.17 -0.85 0.00 0.00 174.74 170.40 2kh2 s LEU 31 N 1.55 2.22 -0.14 0.89 2.96 -1.26 -4.89 118.68 120.01 2kh2 s LEU 31 Ca 0.66 -2.83 0.00 0.00 -0.22 0.00 0.00 54.13 51.74 2kh2 s LEU 31 Cb -0.36 -0.80 0.02 0.00 0.50 0.00 0.00 46.19 45.55 2kh2 s LEU 31 CO 0.30 -0.22 -0.14 -1.10 -1.32 0.00 0.00 176.35 173.86 2kh2 s GLN 32 N 0.18 2.30 0.00 1.98 -1.52 -1.26 -4.65 119.66 116.69 2kh2 s GLN 32 Ca 0.23 -0.56 0.00 0.00 -1.95 0.00 0.00 55.36 53.08 2kh2 s GLN 32 Cb -0.13 -2.09 0.00 0.00 -0.22 0.00 0.00 33.01 30.57 2kh2 s GLN 32 CO -0.08 -0.22 0.00 0.41 -0.25 0.00 0.00 175.29 175.15 2kh2 n GLY 33 N 4.71 0.89 0.00 3.09 0.00 -1.26 -4.79 105.19 107.84 2kh2 n GLY 33 Ca -0.17 -1.88 0.14 0.00 0.00 0.00 0.00 46.02 44.12 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 0.75 -0.12 1.61 -0.06 -1.26 -2.41 117.38 115.89 2kh2 n GLN 34 Ca 0.00 0.01 0.12 0.00 -2.00 0.00 0.00 57.00 55.13 2kh2 n GLN 34 Cb 0.00 -1.50 0.22 0.00 -4.06 0.00 0.00 30.24 24.90 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 -1.09 3.06 0.20 1.69 9.92 -1.26 -4.28 116.55 124.80 2kh2 n ASP 35 Ca 0.19 -1.94 0.05 0.00 -0.53 0.00 0.00 54.79 52.55 2kh2 n ASP 35 Cb 0.14 -0.16 0.48 0.00 -0.64 0.00 0.00 41.12 40.94 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 4.20 0.04 -2.02 -1.24 4.05 -1.74 -3.18 114.93 115.05 2kh2 h MET 36 Ca 0.00 -0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.37 2kh2 h MET 36 Cb 0.92 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.70 2kh2 h MET 36 CO 0.00 0.22 -0.06 0.39 0.23 0.00 0.00 176.91 177.69 2kh2 n GLU 37 N -4.31 1.08 0.00 0.39 -0.58 -1.26 -2.81 120.64 113.15 2kh2 n GLU 37 Ca -0.02 -0.19 0.00 0.00 -0.42 0.00 0.00 57.16 56.53 2kh2 n GLU 37 Cb 0.25 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 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 1.77 0.29 -2.12 3.49 6.02 -1.20 -5.07 117.38 120.56 2kh2 n GLN 38 Ca 0.08 -0.58 -0.33 0.00 -0.01 0.00 0.00 57.00 56.16 2kh2 n GLN 38 Cb 0.53 -0.78 0.01 0.00 1.02 0.00 0.00 30.24 31.01 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 -0.22 3.31 0.15 -1.09 -2.07 -1.12 -4.71 119.66 113.91 2kh2 s GLN 39 Ca 0.00 1.35 -0.30 0.00 -1.82 0.00 0.00 55.36 54.59 2kh2 s GLN 39 Cb 0.00 -2.02 -0.07 0.00 -1.09 0.00 0.00 33.01 29.83 2kh2 s GLN 39 CO 0.00 -0.83 0.94 0.08 -1.32 0.00 0.00 175.29 174.16 2kh2 s VAL 40 N -2.21 4.38 -0.24 3.63 1.01 -0.52 -5.03 120.40 121.43 2kh2 s VAL 40 Ca 0.67 2.04 -0.07 0.00 0.00 0.00 0.00 61.98 64.62 2kh2 s VAL 40 Cb -0.18 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.86 2kh2 s VAL 40 CO 0.33 0.38 0.05 -0.69 0.00 0.00 0.00 175.10 175.17 2kh2 s VAL 41 N -0.38 4.23 -0.02 2.92 1.01 -1.26 -4.43 120.40 122.47 2kh2 s VAL 41 Ca 0.44 -0.20 -0.08 0.00 0.00 0.00 0.00 61.98 62.14 2kh2 s VAL 41 Cb -0.24 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 2kh2 s VAL 41 CO 0.30 0.36 0.27 -0.36 0.00 0.00 0.00 175.10 175.68 2kh2 s PHE 42 N 1.45 3.61 -0.29 5.22 0.08 -0.42 -1.84 117.98 125.78 2kh2 s PHE 42 Ca 0.05 0.66 -0.18 0.00 0.12 0.00 0.00 56.93 57.58 2kh2 s PHE 42 Cb -0.15 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.24 2kh2 s PHE 42 CO 0.03 0.64 0.51 -1.12 -0.10 0.00 0.00 175.22 175.18 2kh2 s SER 43 N -1.44 6.38 -0.57 1.36 0.01 0.15 -1.95 113.70 117.65 2kh2 s SER 43 Ca 0.24 0.32 -0.17 0.00 1.31 0.00 0.00 55.95 57.65 2kh2 s SER 43 Cb -0.14 -2.27 0.12 0.00 0.21 0.00 0.00 66.02 63.94 2kh2 s SER 43 CO 0.13 -0.35 0.59 -0.32 0.41 0.00 0.00 173.24 173.70 2kh2 s MET 44 N 2.33 3.02 -0.06 12.44 1.75 0.18 -3.12 119.30 135.85 2kh2 s MET 44 Ca 0.20 -1.56 -0.13 0.00 -1.25 0.00 0.00 55.69 52.95 2kh2 s MET 44 Cb -0.15 -4.29 -0.05 0.00 2.84 0.00 0.00 34.83 33.17 2kh2 s MET 44 CO 0.11 -1.42 0.33 -1.12 -0.65 0.00 0.00 175.02 172.27 2kh2 s SER 45 N 3.60 6.64 -0.55 1.11 0.01 -1.16 -1.01 113.70 122.33 2kh2 s SER 45 Ca 0.07 0.76 -0.24 0.00 1.31 0.00 0.00 55.95 57.85 2kh2 s SER 45 Cb -0.27 -2.20 0.04 0.00 0.21 0.00 0.00 66.02 63.80 2kh2 s SER 45 CO 0.04 0.29 0.95 -0.36 0.41 0.00 0.00 173.24 174.56 2kh2 s PHE 46 N -0.69 2.79 0.59 2.43 0.40 0.09 -0.83 117.98 122.76 2kh2 s PHE 46 Ca 0.21 -0.03 -0.05 0.00 -0.60 0.00 0.00 56.93 56.46 2kh2 s PHE 46 Cb -0.15 -4.09 0.02 0.00 0.51 0.00 0.00 43.02 39.31 2kh2 s PHE 46 CO 0.09 -1.37 0.90 0.14 0.70 0.00 0.00 175.22 175.68 2kh2 s VAL 47 N 3.97 3.46 -1.00 -0.44 -7.23 -1.06 -4.73 120.40 113.36 2kh2 s VAL 47 Ca 0.30 -0.09 -0.20 0.00 -1.81 0.00 0.00 61.98 60.18 2kh2 s VAL 47 Cb -0.13 -3.38 0.10 0.00 0.56 0.00 0.00 36.38 33.54 2kh2 s VAL 47 CO 0.19 -0.38 1.30 -1.58 -0.31 0.00 0.00 175.10 174.32 2kh2 s GLN 48 N -4.99 3.66 0.00 4.82 2.00 -0.74 -4.82 119.66 119.59 2kh2 s GLN 48 Ca 0.54 -1.63 0.00 0.00 -2.00 0.00 0.00 55.36 52.28 2kh2 s GLN 48 Cb -0.11 -5.11 0.00 0.00 0.80 0.00 0.00 33.01 28.59 2kh2 s GLN 48 CO 0.44 -1.95 0.00 0.41 -0.50 0.00 0.00 175.29 173.70 2kh2 n GLY 49 N 5.84 5.42 3.55 2.59 0.00 -1.26 -4.96 105.19 116.37 2kh2 n GLY 49 Ca 0.29 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 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 1.84 3.34 -0.95 1.61 2.56 -1.26 -4.94 118.70 120.89 2kh2 s GLU 50 Ca 0.00 -0.56 -0.22 0.00 0.00 0.00 0.00 54.97 54.19 2kh2 s GLU 50 Cb 0.00 -4.62 0.08 0.00 2.00 0.00 0.00 34.13 31.58 2kh2 s GLU 50 CO 0.00 -2.18 1.30 -1.21 -0.56 0.00 0.00 175.26 172.62 2kh2 s GLU 51 N 5.46 3.53 0.28 4.30 2.02 -1.26 -4.22 118.70 128.81 2kh2 s GLU 51 Ca 0.39 -1.24 0.06 0.00 0.02 0.00 0.00 54.97 54.20 2kh2 s GLU 51 Cb -0.05 -5.05 -0.02 0.00 0.10 0.00 0.00 34.13 29.10 2kh2 s GLU 51 CO 0.06 -2.04 0.38 -1.12 0.02 0.00 0.00 175.26 172.55 2kh2 s SER 52 N 4.37 6.06 0.47 -0.19 0.01 0.53 -5.00 113.70 119.96 2kh2 s SER 52 Ca 0.39 -0.08 0.20 0.00 1.31 0.00 0.00 55.95 57.77 2kh2 s SER 52 Cb -0.03 -1.55 1.14 0.00 0.21 0.00 0.00 66.02 65.79 2kh2 s SER 52 CO -0.07 -0.20 1.99 -1.13 0.41 0.00 0.00 173.24 174.24 2kh2 h ASN 53 N 1.11 0.00 -0.15 2.44 -1.24 -2.00 -2.73 115.58 113.01 2kh2 h ASN 53 Ca -0.49 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.52 2kh2 h ASN 53 Cb 1.24 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.29 2kh2 h ASN 53 CO 0.58 0.19 0.00 -0.90 -1.29 0.00 0.00 177.43 176.01 2kh2 n ASP 54 N -3.96 2.38 -3.44 1.15 5.75 -1.26 -4.92 116.55 112.25 2kh2 n ASP 54 Ca -0.02 -1.97 -0.17 0.00 -0.01 0.00 0.00 54.79 52.62 2kh2 n ASP 54 Cb 0.28 -0.10 -0.11 0.00 -1.03 0.00 0.00 41.12 40.15 2kh2 n ASP 54 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2kh2 s LYS 55 N -0.98 0.26 -0.28 0.11 1.02 -1.03 -2.76 119.74 116.08 2kh2 s LYS 55 Ca 0.10 0.10 -0.07 0.00 0.02 0.00 0.00 55.97 56.13 2kh2 s LYS 55 Cb 0.06 -0.91 0.00 0.00 -0.52 0.00 0.00 37.83 36.45 2kh2 s LYS 55 CO 0.07 -0.80 0.07 0.42 -0.92 0.00 0.00 175.35 174.19 2kh2 s ILE 56 N 2.36 3.94 -0.31 2.17 -1.09 0.08 -0.34 121.20 128.01 2kh2 s ILE 56 Ca 0.09 -0.61 -0.29 0.00 -2.23 0.00 0.00 60.65 57.60 2kh2 s ILE 56 Cb -0.15 -2.99 0.00 0.00 -1.58 0.00 0.00 42.46 37.74 2kh2 s ILE 56 CO -0.21 0.14 1.30 -2.16 -1.23 0.00 0.00 174.94 172.78 2kh2 s PRO 57 N 1.51 3.90 0.13 2.79 0.04 -1.26 0.03 135.00 142.14 2kh2 s PRO 57 Ca 0.03 1.21 -0.01 0.00 0.04 0.00 0.00 61.00 62.27 2kh2 s PRO 57 Cb -0.17 -3.88 -0.04 0.00 0.04 0.00 0.00 34.50 30.45 2kh2 s PRO 57 CO 0.02 -1.14 0.07 0.14 0.04 0.00 0.00 177.00 176.12 2kh2 s VAL 58 N 4.41 0.10 0.17 -0.36 -7.23 0.22 -2.57 120.40 115.15 2kh2 s VAL 58 Ca 0.56 -1.89 0.05 0.00 -1.81 0.00 0.00 61.98 58.88 2kh2 s VAL 58 Cb -0.16 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 2kh2 s VAL 58 CO 0.24 -0.45 0.17 0.00 -0.31 0.00 0.00 175.10 174.75 2kh2 s ALA 59 N -4.05 3.65 -0.20 1.32 0.00 -0.01 -0.01 121.76 122.45 2kh2 s ALA 59 Ca 0.24 -1.20 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 2kh2 s ALA 59 Cb 0.07 -1.44 0.06 0.00 0.00 0.00 0.00 23.12 21.81 2kh2 s ALA 59 CO 0.02 0.48 0.00 -0.51 0.00 0.00 0.00 175.76 175.75 2kh2 s LEU 60 N -3.22 1.65 0.07 0.00 1.43 -1.26 -3.01 118.68 114.35 2kh2 s LEU 60 Ca 0.32 -0.92 -0.01 0.00 -1.03 0.00 0.00 54.13 52.49 2kh2 s LEU 60 Cb -0.10 -0.80 -0.04 0.00 0.03 0.00 0.00 46.19 45.28 2kh2 s LEU 60 CO 0.24 -0.27 -0.01 -0.83 0.23 0.00 0.00 176.35 175.71 2kh2 s GLY 61 N 1.69 0.59 0.17 -3.19 0.00 -1.18 -0.72 107.32 104.69 2kh2 s GLY 61 Ca -0.02 -1.27 -0.30 0.00 0.00 0.00 0.00 44.72 43.12 2kh2 s GLY 61 CO -0.07 -1.33 1.21 1.08 0.00 0.00 0.00 173.10 173.99 2kh2 s LEU 62 N -2.95 4.44 0.22 0.66 1.02 0.18 0.31 118.68 122.56 2kh2 s LEU 62 Ca 0.11 2.23 -0.31 0.00 0.02 0.00 0.00 54.13 56.18 2kh2 s LEU 62 Cb 0.08 -3.60 -0.11 0.00 0.02 0.00 0.00 46.19 42.58 2kh2 s LEU 62 CO -0.07 -0.40 1.58 -0.75 0.02 0.00 0.00 176.35 176.73 2kh2 s LYS 63 N -0.08 4.18 -0.87 1.70 2.20 -0.77 -2.09 119.74 124.01 2kh2 s LYS 63 Ca 0.54 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.60 2kh2 s LYS 63 Cb -0.33 -3.10 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 2kh2 s LYS 63 CO 0.36 -0.61 0.00 0.39 -0.36 0.00 0.00 175.35 175.13 2kh2 n GLU 64 N 3.26 -1.15 -4.39 4.03 1.02 -1.26 -4.97 120.64 117.18 2kh2 n GLU 64 Ca 0.12 0.72 -0.20 0.00 -0.02 0.00 0.00 57.16 57.78 2kh2 n GLU 64 Cb 0.38 -4.79 -0.10 0.00 -0.02 0.00 0.00 31.44 26.90 2kh2 n GLU 64 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2kh2 s LYS 65 N -2.42 1.49 -0.21 3.49 1.02 -0.89 -5.04 119.74 117.18 2kh2 s LYS 65 Ca 0.00 -1.78 0.15 0.00 0.02 0.00 0.00 55.97 54.36 2kh2 s LYS 65 Cb 0.00 -0.85 0.73 0.00 -0.52 0.00 0.00 37.83 37.18 2kh2 s LYS 65 CO 0.00 -0.08 1.64 0.27 -0.92 0.00 0.00 175.35 176.26 2kh2 n ASN 66 N -0.55 5.12 -4.59 2.83 6.94 -1.26 -4.68 115.26 119.07 2kh2 n ASN 66 Ca -0.04 -2.93 -0.38 0.00 -0.02 0.00 0.00 54.58 51.21 2kh2 n ASN 66 Cb 0.64 -0.63 -0.10 0.00 -2.36 0.00 0.00 39.78 37.33 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 -2.72 4.05 0.12 -4.53 1.43 -1.26 -2.20 118.68 113.57 2kh2 s LEU 67 Ca 0.51 0.05 0.08 0.00 -1.03 0.00 0.00 54.13 53.74 2kh2 s LEU 67 Cb 0.39 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2kh2 s LEU 67 CO 0.14 -0.10 -0.20 -0.31 0.23 0.00 0.00 176.35 176.11 2kh2 s TYR 68 N 1.85 1.81 -0.12 0.29 1.51 -0.78 -0.65 117.35 121.26 2kh2 s TYR 68 Ca 0.09 -0.43 -0.29 0.00 -1.01 0.00 0.00 57.07 55.43 2kh2 s TYR 68 Cb -0.16 -0.96 -0.03 0.00 -0.11 0.00 0.00 41.96 40.70 2kh2 s TYR 68 CO 0.11 0.25 1.33 -0.51 -1.11 0.00 0.00 175.55 175.62 2kh2 s LEU 69 N -2.15 4.23 -0.07 -1.29 1.43 0.10 -0.60 118.68 120.32 2kh2 s LEU 69 Ca 0.09 1.83 0.04 0.00 -1.03 0.00 0.00 54.13 55.06 2kh2 s LEU 69 Cb -0.09 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.58 2kh2 s LEU 69 CO 0.05 -0.77 -0.19 -0.55 0.23 0.00 0.00 176.35 175.12 2kh2 s SER 70 N 2.15 3.57 -0.35 2.29 0.15 0.76 -4.50 113.70 117.78 2kh2 s SER 70 Ca 0.59 -0.38 -0.10 0.00 0.70 0.00 0.00 55.95 56.76 2kh2 s SER 70 Cb -0.25 -1.05 0.02 0.00 -1.71 0.00 0.00 66.02 63.04 2kh2 s SER 70 CO 0.19 0.25 0.17 0.00 1.20 0.00 0.00 173.24 175.05 2kh2 s VAL 72 N 1.54 0.77 -0.31 0.00 -7.23 -0.76 -4.71 120.40 109.69 2kh2 s VAL 72 Ca 0.02 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.03 2kh2 s VAL 72 Cb -0.19 -2.26 -0.02 0.00 0.56 0.00 0.00 36.38 34.48 2kh2 s VAL 72 CO 0.06 -0.37 0.40 -0.76 -0.31 0.00 0.00 175.10 174.12 2kh2 s LEU 73 N -3.23 4.23 -0.07 1.32 1.43 -1.26 0.33 118.68 121.43 2kh2 s LEU 73 Ca 0.27 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 2kh2 s LEU 73 Cb 0.06 -2.43 0.02 0.00 0.03 0.00 0.00 46.19 43.87 2kh2 s LEU 73 CO 0.07 -0.29 -0.08 -0.54 0.23 0.00 0.00 176.35 175.73 2kh2 s LYS 74 N 2.12 1.34 -1.20 1.70 1.02 0.08 -4.77 119.74 120.03 2kh2 s LYS 74 Ca 0.15 -0.26 -0.04 0.00 0.02 0.00 0.00 55.97 55.84 2kh2 s LYS 74 Cb -0.16 -1.25 0.00 0.00 -0.52 0.00 0.00 37.83 35.91 2kh2 s LYS 74 CO 0.11 -0.09 1.03 -3.47 -0.92 0.00 0.00 175.35 172.01 2kh2 n ASP 75 N 4.20 -3.93 -1.93 2.83 -0.08 -1.26 -2.07 116.55 114.31 2kh2 n ASP 75 Ca -0.20 -0.55 -0.18 0.00 -1.51 0.00 0.00 54.79 52.35 2kh2 n ASP 75 Cb 0.51 -4.84 -0.04 0.00 2.34 0.00 0.00 41.12 39.08 2kh2 n ASP 75 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2kh2 n ASP 76 N -2.91 -4.86 -3.78 1.67 10.43 -1.26 -4.95 116.55 110.89 2kh2 n ASP 76 Ca -0.14 0.26 -0.13 0.00 2.57 0.00 0.00 54.79 57.35 2kh2 n ASP 76 Cb 0.61 -4.23 -0.14 0.00 1.84 0.00 0.00 41.12 39.21 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 -4.20 0.12 0.03 -1.24 2.47 -0.88 -5.12 119.74 110.92 2kh2 s LYS 77 Ca 0.00 0.30 -0.30 0.00 -1.56 0.00 0.00 55.97 54.41 2kh2 s LYS 77 Cb 0.00 -0.07 -0.08 0.00 -1.46 0.00 0.00 37.83 36.21 2kh2 s LYS 77 CO 0.00 -0.11 1.84 -2.14 0.16 0.00 0.00 175.35 175.10 2kh2 s PRO 78 N 0.73 4.16 0.02 4.03 0.02 -1.26 -0.74 135.00 141.96 2kh2 s PRO 78 Ca -0.05 2.48 0.06 0.00 0.02 0.00 0.00 61.00 63.50 2kh2 s PRO 78 Cb -0.07 -3.97 -0.02 0.00 0.02 0.00 0.00 34.50 30.46 2kh2 s PRO 78 CO -0.04 -0.89 -0.17 0.99 -0.33 0.00 0.00 177.00 176.57 2kh2 s THR 79 N 3.89 1.33 0.09 0.99 2.01 0.15 -4.69 115.64 119.40 2kh2 s THR 79 Ca 0.82 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 61.80 2kh2 s THR 79 Cb -0.41 -1.14 -0.06 0.00 0.01 0.00 0.00 72.50 70.90 2kh2 s THR 79 CO 0.37 0.22 0.44 -0.22 -0.69 0.00 0.00 174.62 174.73 2kh2 s LEU 80 N -0.80 4.36 0.33 4.42 2.96 -1.26 -1.83 118.68 126.85 2kh2 s LEU 80 Ca 0.05 0.87 -0.17 0.00 -0.22 0.00 0.00 54.13 54.67 2kh2 s LEU 80 Cb -0.07 -3.02 0.03 0.00 0.50 0.00 0.00 46.19 43.63 2kh2 s LEU 80 CO 0.01 0.17 0.71 0.00 -1.32 0.00 0.00 176.35 175.91 2kh2 s GLN 81 N -1.86 1.98 -0.26 1.98 -2.07 -0.48 -4.90 119.66 114.05 2kh2 s GLN 81 Ca 0.33 -1.27 -0.08 0.00 -1.82 0.00 0.00 55.36 52.52 2kh2 s GLN 81 Cb -0.14 0.59 -0.02 0.00 -1.09 0.00 0.00 33.01 32.35 2kh2 s GLN 81 CO 0.18 -0.90 0.09 -0.51 -1.32 0.00 0.00 175.29 172.83 2kh2 s LEU 82 N -3.02 3.62 0.05 2.60 2.01 -1.26 -0.17 118.68 122.51 2kh2 s LEU 82 Ca 0.15 -0.29 0.00 0.00 0.01 0.00 0.00 54.13 54.01 2kh2 s LEU 82 Cb -0.05 -1.94 -0.04 0.00 0.01 0.00 0.00 46.19 44.17 2kh2 s LEU 82 CO 0.10 -0.07 0.15 -1.61 1.01 0.00 0.00 176.35 175.93 2kh2 s GLU 83 N 1.61 3.24 -0.62 1.70 2.02 0.23 -4.90 118.70 121.98 2kh2 s GLU 83 Ca 0.06 -0.50 -0.13 0.00 0.02 0.00 0.00 54.97 54.41 2kh2 s GLU 83 Cb -0.16 -2.94 0.16 0.00 0.10 0.00 0.00 34.13 31.29 2kh2 s GLU 83 CO 0.04 0.61 0.55 -1.12 0.02 0.00 0.00 175.26 175.36 2kh2 s SER 84 N -2.32 6.21 0.36 -0.19 0.01 -1.26 -1.86 113.70 114.65 2kh2 s SER 84 Ca 0.31 -2.14 0.01 0.00 1.31 0.00 0.00 55.95 55.44 2kh2 s SER 84 Cb -0.13 -2.15 -0.03 0.00 0.21 0.00 0.00 66.02 63.93 2kh2 s SER 84 CO 0.24 -0.72 0.55 0.68 0.41 0.00 0.00 173.24 174.40 2kh2 s VAL 85 N 1.03 4.84 -0.03 3.43 -7.23 -0.94 -5.02 120.40 116.48 2kh2 s VAL 85 Ca 0.09 -0.54 -0.33 0.00 -1.81 0.00 0.00 61.98 59.39 2kh2 s VAL 85 Cb -0.23 -3.76 -0.11 0.00 0.56 0.00 0.00 36.38 32.84 2kh2 s VAL 85 CO -0.02 -0.48 1.87 -0.67 -0.31 0.00 0.00 175.10 175.49 2kh2 n ASP 86 N -1.81 3.58 0.21 4.85 2.03 -1.26 -4.85 116.55 119.30 2kh2 n ASP 86 Ca -0.04 0.97 0.15 0.00 0.52 0.00 0.00 54.79 56.39 2kh2 n ASP 86 Cb 0.57 -1.41 0.61 0.00 -0.72 0.00 0.00 41.12 40.16 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 9.08 0.00 0.00 -0.67 0.13 -1.92 -2.16 132.00 136.46 2kh2 h PRO 87 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2kh2 h PRO 87 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2kh2 h PRO 87 CO 0.94 0.00 -1.45 0.36 -0.23 0.00 0.00 178.00 177.62 2kh2 n LYS 88 N -2.68 0.74 -0.07 0.86 2.85 -1.26 -4.30 118.16 114.30 2kh2 n LYS 88 Ca 0.01 -0.10 0.09 0.00 -1.05 0.00 0.00 58.31 57.27 2kh2 n LYS 88 Cb 0.26 -1.41 0.12 0.00 -0.65 0.00 0.00 35.03 33.35 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 -1.86 2.82 -4.07 -5.58 3.02 -1.11 -4.96 115.26 103.52 2kh2 n ASN 89 Ca -0.01 -1.84 -0.13 0.00 -0.03 0.00 0.00 54.58 52.57 2kh2 n ASN 89 Cb 0.40 -0.09 -0.11 0.00 -0.61 0.00 0.00 39.78 39.37 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 -1.45 0.71 0.80 3.10 1.51 -0.83 -4.55 117.35 116.65 2kh2 s TYR 90 Ca 0.26 -0.49 -0.11 0.00 -1.01 0.00 0.00 57.07 55.72 2kh2 s TYR 90 Cb 0.17 -0.42 0.18 0.00 -0.11 0.00 0.00 41.96 41.78 2kh2 s TYR 90 CO 0.24 -0.07 1.10 -0.35 -1.11 0.00 0.00 175.55 175.36 2kh2 n PRO 91 N 1.47 -0.84 -4.06 -1.71 -0.05 -1.26 -4.79 135.00 123.75 2kh2 n PRO 91 Ca -0.23 -1.98 -0.10 0.00 -0.05 0.00 0.00 63.50 61.15 2kh2 n PRO 91 Cb 0.55 -1.04 -0.09 0.00 -0.05 0.00 0.00 33.50 32.87 2kh2 n PRO 91 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 175.50 173.86 2kh2 s LYS 92 N -5.35 1.05 0.20 0.54 -2.85 -1.26 -5.06 119.74 107.01 2kh2 s LYS 92 Ca 0.64 -1.32 -0.10 0.00 -1.00 0.00 0.00 55.97 54.19 2kh2 s LYS 92 Cb -0.02 0.31 0.23 0.00 -2.06 0.00 0.00 37.83 36.29 2kh2 s LYS 92 CO 0.45 -0.35 1.77 -0.22 0.10 0.00 0.00 175.35 177.10 2kh2 h LYS 93 N 2.70 0.48 -4.34 1.78 1.63 -1.98 -3.35 116.57 113.49 2kh2 h LYS 93 Ca -0.33 -0.03 -0.65 0.00 -0.85 0.00 0.00 60.65 58.79 2kh2 h LYS 93 Cb 1.22 -0.11 -0.40 0.00 -0.60 0.00 0.00 32.23 32.33 2kh2 h LYS 93 CO 0.53 0.32 -0.70 0.21 -3.45 0.00 0.00 179.45 176.36 2kh2 s LYS 94 N -6.10 1.55 0.69 1.90 2.47 -1.26 -1.79 119.74 117.20 2kh2 s LYS 94 Ca -0.13 -2.00 -0.10 0.00 -1.56 0.00 0.00 55.97 52.18 2kh2 s LYS 94 Cb 0.16 -3.17 0.02 0.00 -1.46 0.00 0.00 37.83 33.39 2kh2 s LYS 94 CO 0.75 -0.98 1.06 -1.64 0.16 0.00 0.00 175.35 174.69 2kh2 s MET 95 N 0.67 2.72 0.59 4.03 -1.94 -1.26 -5.01 119.30 119.12 2kh2 s MET 95 Ca 0.12 0.27 -0.19 0.00 -1.71 0.00 0.00 55.69 54.18 2kh2 s MET 95 Cb -0.20 -2.08 -0.04 0.00 2.01 0.00 0.00 34.83 34.52 2kh2 s MET 95 CO -0.07 -1.04 1.16 0.39 -0.01 0.00 0.00 175.02 175.45 2kh2 n GLU 96 N -2.94 1.17 0.26 2.03 4.71 -1.26 -4.83 120.64 119.78 2kh2 n GLU 96 Ca 0.07 0.44 0.15 0.00 -0.01 0.00 0.00 57.16 57.81 2kh2 n GLU 96 Cb 0.58 -2.36 0.85 0.00 -1.01 0.00 0.00 31.44 29.50 2kh2 n GLU 96 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 2kh2 h LYS 97 N 0.77 0.00 0.00 3.49 3.64 -1.95 0.12 116.57 122.64 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 1.34 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 2kh2 h LYS 97 CO 0.53 0.00 0.00 2.89 -2.27 0.00 0.00 179.45 180.60 2kh2 n ARG 98 N -3.95 0.22 -0.04 1.90 1.85 -1.26 -2.68 116.66 112.69 2kh2 n ARG 98 Ca -0.02 0.06 0.03 0.00 -1.00 0.00 0.00 57.85 56.93 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 -1.37 0.11 -3.51 2.89 3.72 0.39 -0.98 117.46 118.71 2kh2 n PHE 99 Ca 0.10 -0.22 -0.39 0.00 -0.05 0.00 0.00 57.45 56.89 2kh2 n PHE 99 Cb 0.23 -0.02 -0.10 0.00 -0.94 0.00 0.00 39.48 38.65 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 -0.71 5.25 0.04 -4.37 1.01 -1.09 -4.10 120.40 116.44 2kh2 s VAL 100 Ca 0.09 0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2kh2 s VAL 100 Cb 0.05 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 2kh2 s VAL 100 CO 0.08 0.15 -0.05 -0.36 0.00 0.00 0.00 175.10 174.92 2kh2 s PHE 101 N 1.87 2.90 -0.49 5.22 0.40 0.99 -1.94 117.98 126.93 2kh2 s PHE 101 Ca 0.10 -0.04 -0.16 0.00 -0.60 0.00 0.00 56.93 56.22 2kh2 s PHE 101 Cb -0.16 -1.57 0.09 0.00 0.51 0.00 0.00 43.02 41.89 2kh2 s PHE 101 CO 0.11 0.42 0.43 -0.80 0.70 0.00 0.00 175.22 176.07 2kh2 s ASN 102 N -1.78 6.16 -0.68 1.36 0.02 0.29 -0.61 114.94 119.70 2kh2 s ASN 102 Ca 0.20 -1.43 -0.27 0.00 -1.02 0.00 0.00 52.86 50.34 2kh2 s ASN 102 Cb -0.11 -2.19 0.01 0.00 0.02 0.00 0.00 41.25 38.98 2kh2 s ASN 102 CO 0.11 -0.70 1.47 -0.75 0.02 0.00 0.00 177.10 177.25 2kh2 s LYS 103 N 1.65 3.03 -0.02 -0.60 2.20 0.10 -1.31 119.74 124.80 2kh2 s LYS 103 Ca 0.04 0.10 -0.09 0.00 -0.36 0.00 0.00 55.97 55.66 2kh2 s LYS 103 Cb -0.26 -4.24 -0.05 0.00 -1.51 0.00 0.00 37.83 31.78 2kh2 s LYS 103 CO 0.06 -2.30 0.29 0.42 -0.36 0.00 0.00 175.35 173.46 2kh2 s ILE 104 N 6.80 5.25 -0.45 5.43 1.01 0.26 -0.74 121.20 138.75 2kh2 s ILE 104 Ca 0.47 0.40 0.03 0.00 0.00 0.00 0.00 60.65 61.55 2kh2 s ILE 104 Cb -0.10 -3.58 0.16 0.00 0.01 0.00 0.00 42.46 38.95 2kh2 s ILE 104 CO 0.18 0.48 0.31 -0.70 0.00 0.00 0.00 174.94 175.21 2kh2 s GLU 105 N -1.41 1.17 0.10 2.79 2.12 -1.11 0.11 118.70 122.48 2kh2 s GLU 105 Ca 0.24 -2.12 -0.24 0.00 0.36 0.00 0.00 54.97 53.21 2kh2 s GLU 105 Cb -0.14 -1.94 -0.11 0.00 0.26 0.00 0.00 34.13 32.20 2kh2 s GLU 105 CO 0.13 -1.28 1.70 -0.84 -0.54 0.00 0.00 175.26 174.43 2kh2 h ILE 106 N 4.82 0.80 0.00 -3.70 3.07 -1.87 -3.47 117.51 117.17 2kh2 h ILE 106 Ca 0.14 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.55 2kh2 h ILE 106 Cb 0.90 0.80 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 2kh2 h ILE 106 CO 0.43 0.00 0.00 -0.46 -1.05 0.00 0.00 178.15 177.07 2kh2 n ASN 107 N -5.20 0.00 -0.54 2.16 0.23 -1.26 -4.99 115.26 105.66 2kh2 n ASN 107 Ca -0.06 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.05 2kh2 n ASN 107 Cb 0.13 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 37.88 2kh2 n ASN 107 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2kh2 n ASN 108 N 0.00 2.13 -4.42 0.53 6.94 -1.26 -4.96 115.26 114.22 2kh2 n ASN 108 Ca 0.00 -1.56 -0.29 0.00 -0.02 0.00 0.00 54.58 52.71 2kh2 n ASN 108 Cb 0.00 0.01 -0.12 0.00 -2.36 0.00 0.00 39.78 37.30 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2kh2 s LYS 109 N -1.15 1.52 0.11 -3.83 -0.14 -1.26 -5.04 119.74 109.95 2kh2 s LYS 109 Ca 0.16 -1.31 0.11 0.00 -1.36 0.00 0.00 55.97 53.57 2kh2 s LYS 109 Cb 0.11 -1.96 -0.04 0.00 -1.68 0.00 0.00 37.83 34.27 2kh2 s LYS 109 CO 0.17 0.46 -0.27 -0.48 -0.76 0.00 0.00 175.35 174.47 2kh2 s LEU 110 N -2.11 2.29 0.25 3.17 2.34 -0.99 -3.38 118.68 120.25 2kh2 s LEU 110 Ca 0.15 -0.71 0.11 0.00 0.06 0.00 0.00 54.13 53.74 2kh2 s LEU 110 Cb -0.10 -1.24 -0.05 0.00 -0.56 0.00 0.00 46.19 44.24 2kh2 s LEU 110 CO 0.07 0.20 -0.19 -1.61 -1.06 0.00 0.00 176.35 173.76 2kh2 s GLU 111 N -1.86 1.56 -0.31 1.48 2.02 0.12 0.45 118.70 122.15 2kh2 s GLU 111 Ca 0.14 -1.69 0.03 0.00 0.02 0.00 0.00 54.97 53.47 2kh2 s GLU 111 Cb -0.10 -1.59 0.08 0.00 0.10 0.00 0.00 34.13 32.62 2kh2 s GLU 111 CO 0.05 0.30 -0.02 -0.06 0.02 0.00 0.00 175.26 175.55 2kh2 s PHE 112 N -2.54 3.54 -0.06 1.61 0.08 -1.26 -0.57 117.98 118.78 2kh2 s PHE 112 Ca 0.27 -2.67 -0.12 0.00 0.12 0.00 0.00 56.93 54.52 2kh2 s PHE 112 Cb -0.04 -2.48 -0.05 0.00 -0.57 0.00 0.00 43.02 39.87 2kh2 s PHE 112 CO 0.12 -0.92 0.32 -2.00 -0.10 0.00 0.00 175.22 172.64 2kh2 s GLU 113 N 1.00 3.84 0.04 0.44 2.12 -0.43 -2.22 118.70 123.50 2kh2 s GLU 113 Ca 0.02 0.21 -0.30 0.00 0.36 0.00 0.00 54.97 55.26 2kh2 s GLU 113 Cb -0.20 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 30.90 2kh2 s GLU 113 CO -0.06 0.64 1.17 0.45 -0.54 0.00 0.00 175.26 176.91 2kh2 s SER 114 N -0.80 7.11 0.21 -1.70 0.15 0.44 0.11 113.70 119.22 2kh2 s SER 114 Ca 0.20 1.95 -0.04 0.00 0.70 0.00 0.00 55.95 58.76 2kh2 s SER 114 Cb -0.15 -2.58 0.18 0.00 -1.71 0.00 0.00 66.02 61.77 2kh2 s SER 114 CO 0.09 -0.46 1.61 0.00 1.20 0.00 0.00 173.24 175.69 2kh2 h ALA 115 N 6.88 0.85 -0.19 5.45 0.00 -1.63 -3.09 119.26 127.53 2kh2 h ALA 115 Ca -0.41 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.11 2kh2 h ALA 115 Cb 1.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2kh2 h ALA 115 CO 0.81 0.63 0.10 0.37 0.00 0.00 0.00 179.25 181.16 2kh2 h GLN 116 N 0.63 0.27 -4.59 0.00 5.75 -1.77 -3.38 115.11 112.02 2kh2 h GLN 116 Ca 0.08 -0.04 -0.68 0.00 -0.15 0.00 0.00 58.65 57.86 2kh2 h GLN 116 Cb 0.79 -0.05 -0.36 0.00 1.07 0.00 0.00 27.48 28.92 2kh2 h GLN 116 CO 0.06 0.29 -0.63 -0.06 -2.65 0.00 0.00 178.83 175.84 2kh2 s PHE 117 N -5.77 3.61 0.27 3.99 0.08 -1.17 -5.09 117.98 113.90 2kh2 s PHE 117 Ca -0.13 -2.55 -0.30 0.00 0.12 0.00 0.00 56.93 54.06 2kh2 s PHE 117 Cb 0.08 -2.98 -0.11 0.00 -0.57 0.00 0.00 43.02 39.43 2kh2 s PHE 117 CO 0.70 -0.95 1.57 -2.14 -0.10 0.00 0.00 175.22 174.30 2kh2 s PRO 118 N 1.07 4.16 0.00 0.24 0.02 -1.24 -2.29 135.00 136.96 2kh2 s PRO 118 Ca 0.07 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.60 2kh2 s PRO 118 Cb -0.21 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.26 2kh2 s PRO 118 CO -0.05 -0.59 0.00 0.09 -0.33 0.00 0.00 177.00 176.12 2kh2 n ASN 119 N 2.38 -1.98 -4.35 2.53 5.03 -1.26 -5.01 115.26 112.60 2kh2 n ASN 119 Ca 0.08 0.00 -0.39 0.00 0.87 0.00 0.00 54.58 55.14 2kh2 n ASN 119 Cb 0.38 -0.33 -0.12 0.00 -1.02 0.00 0.00 39.78 38.69 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 -2.68 3.23 0.26 3.10 0.52 -0.97 -4.49 118.94 117.91 2kh2 s TRP 120 Ca 0.00 -1.03 0.08 0.00 0.02 0.00 0.00 56.10 55.17 2kh2 s TRP 120 Cb 0.00 -2.37 -0.04 0.00 -1.15 0.00 0.00 33.47 29.91 2kh2 s TRP 120 CO 0.00 -0.64 0.08 0.71 0.02 0.00 0.00 176.95 177.12 2kh2 s TYR 121 N 1.52 2.87 0.05 -1.98 1.51 0.15 -0.42 117.35 121.05 2kh2 s TYR 121 Ca 0.01 -0.18 -0.31 0.00 -1.01 0.00 0.00 57.07 55.59 2kh2 s TYR 121 Cb -0.19 -1.29 -0.06 0.00 -0.11 0.00 0.00 41.96 40.31 2kh2 s TYR 121 CO 0.05 0.58 1.36 0.42 -1.11 0.00 0.00 175.55 176.85 2kh2 s ILE 122 N -2.25 3.62 0.14 2.71 1.01 -0.94 -0.13 121.20 125.36 2kh2 s ILE 122 Ca 0.32 1.11 0.09 0.00 0.00 0.00 0.00 60.65 62.16 2kh2 s ILE 122 Cb -0.07 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 2kh2 s ILE 122 CO 0.22 0.05 -0.20 -0.44 0.00 0.00 0.00 174.94 174.57 2kh2 s SER 123 N 1.43 2.67 -0.02 3.58 0.01 0.71 -4.26 113.70 117.82 2kh2 s SER 123 Ca 0.63 -0.78 0.01 0.00 1.31 0.00 0.00 55.95 57.11 2kh2 s SER 123 Cb -0.33 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 65.76 2kh2 s SER 123 CO 0.28 0.02 -0.01 0.42 0.41 0.00 0.00 173.24 174.36 2kh2 s THR 124 N -1.62 0.19 0.99 1.44 -4.23 -0.73 -2.54 115.64 109.14 2kh2 s THR 124 Ca 0.12 0.02 -0.14 0.00 -1.18 0.00 0.00 61.69 60.51 2kh2 s THR 124 Cb -0.08 -0.25 0.19 0.00 1.34 0.00 0.00 72.50 73.70 2kh2 s THR 124 CO 0.06 0.12 1.15 -0.44 -0.54 0.00 0.00 174.62 174.97 2kh2 s SER 125 N 0.70 2.76 0.11 3.99 0.01 -1.26 -0.05 113.70 119.96 2kh2 s SER 125 Ca -0.07 0.84 0.26 0.00 1.31 0.00 0.00 55.95 58.29 2kh2 s SER 125 Cb -0.10 -1.29 0.67 0.00 0.21 0.00 0.00 66.02 65.50 2kh2 s SER 125 CO -0.01 -3.01 1.58 0.00 0.41 0.00 0.00 173.24 172.21 2kh2 n GLN 126 N -4.05 0.19 -2.28 12.44 1.13 -1.26 -4.80 117.38 118.74 2kh2 n GLN 126 Ca 0.09 0.10 -0.35 0.00 -1.94 0.00 0.00 57.00 54.90 2kh2 n GLN 126 Cb 0.59 -1.66 -0.00 0.00 0.11 0.00 0.00 30.24 29.28 2kh2 n GLN 126 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2kh2 s ALA 127 N -3.09 2.71 0.15 -1.58 0.00 -1.26 -5.00 121.76 113.70 2kh2 s ALA 127 Ca 0.10 0.77 -0.30 0.00 0.00 0.00 0.00 51.96 52.53 2kh2 s ALA 127 Cb 0.15 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.86 2kh2 s ALA 127 CO 0.65 -0.72 1.00 -2.00 0.00 0.00 0.00 175.76 174.69 2kh2 s GLU 128 N -3.32 4.70 -0.92 0.00 2.56 -1.26 -3.85 118.70 116.60 2kh2 s GLU 128 Ca 0.72 1.53 -0.05 0.00 0.00 0.00 0.00 54.97 57.16 2kh2 s GLU 128 Cb -0.22 -3.33 0.01 0.00 2.00 0.00 0.00 34.13 32.58 2kh2 s GLU 128 CO 0.26 0.23 0.80 -1.71 -0.56 0.00 0.00 175.26 174.28 2kh2 n ASN 129 N 2.45 -4.65 -4.88 -1.70 5.15 -1.17 -5.03 115.26 105.44 2kh2 n ASN 129 Ca 0.02 -0.38 -0.35 0.00 -0.60 0.00 0.00 54.58 53.27 2kh2 n ASN 129 Cb 0.48 -3.64 -0.06 0.00 -0.53 0.00 0.00 39.78 36.03 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 -5.78 3.40 1.04 1.20 -1.94 -1.08 -4.84 119.30 111.30 2kh2 s MET 130 Ca 0.35 -0.24 -0.12 0.00 -1.71 0.00 0.00 55.69 53.97 2kh2 s MET 130 Cb -0.16 -3.12 0.21 0.00 2.01 0.00 0.00 34.83 33.78 2kh2 s MET 130 CO 0.50 0.72 1.07 -2.14 -0.01 0.00 0.00 175.02 175.17 2kh2 s PRO 131 N -1.46 0.06 -0.15 2.03 0.02 -1.26 0.21 135.00 134.44 2kh2 s PRO 131 Ca 0.21 0.63 -0.08 0.00 0.02 0.00 0.00 61.00 61.78 2kh2 s PRO 131 Cb -0.12 -1.68 -0.04 0.00 0.02 0.00 0.00 34.50 32.67 2kh2 s PRO 131 CO 0.11 -3.01 0.13 0.08 -0.33 0.00 0.00 177.00 173.98 2kh2 s VAL 132 N -2.81 5.40 0.33 3.83 1.01 -0.75 -4.65 120.40 122.75 2kh2 s VAL 132 Ca 0.66 0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.84 2kh2 s VAL 132 Cb -0.20 -3.40 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 2kh2 s VAL 132 CO 0.60 0.54 0.36 0.72 0.00 0.00 0.00 175.10 177.32 2kh2 s PHE 133 N -0.39 1.40 -0.18 5.22 -0.71 -1.05 -4.88 117.98 117.38 2kh2 s PHE 133 Ca 0.12 -1.48 -0.09 0.00 -1.04 0.00 0.00 56.93 54.44 2kh2 s PHE 133 Cb -0.12 -0.41 -0.05 0.00 -1.21 0.00 0.00 43.02 41.23 2kh2 s PHE 133 CO 0.01 -0.98 0.13 -1.17 -1.34 0.00 0.00 175.22 171.87 2kh2 s LEU 134 N -3.30 4.22 0.15 -1.99 2.96 -1.26 -0.21 118.68 119.25 2kh2 s LEU 134 Ca 0.36 0.27 0.07 0.00 -0.22 0.00 0.00 54.13 54.61 2kh2 s LEU 134 Cb 0.01 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 2kh2 s LEU 134 CO 0.23 0.23 -0.15 -0.83 -1.32 0.00 0.00 176.35 174.51 2kh2 s GLY 135 N 0.07 1.23 -0.12 7.98 0.00 0.82 -4.84 107.32 112.45 2kh2 s GLY 135 Ca 0.09 -1.44 0.15 0.00 0.00 0.00 0.00 44.72 43.52 2kh2 s GLY 135 CO -0.01 -1.51 1.27 0.61 0.00 0.00 0.00 173.10 173.47 2kh2 n GLY 136 N 0.21 4.03 2.95 0.20 0.00 -1.26 -0.67 105.19 110.65 2kh2 n GLY 136 Ca -0.13 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 2kh2 n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kh2 s THR 137 N -2.42 3.17 -0.19 2.61 -4.23 -1.26 -4.94 115.64 108.38 2kh2 s THR 137 Ca 0.32 -4.05 -0.29 0.00 -1.18 0.00 0.00 61.69 56.49 2kh2 s THR 137 Cb 0.26 -3.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.01 2kh2 s THR 137 CO 0.07 -0.99 1.40 -0.75 -0.54 0.00 0.00 174.62 173.81 2kh2 s LYS 138 N -1.26 4.06 0.00 3.99 2.20 -1.26 -2.78 119.74 124.69 2kh2 s LYS 138 Ca 0.24 1.64 0.00 0.00 -0.36 0.00 0.00 55.97 57.49 2kh2 s LYS 138 Cb -0.08 -3.88 0.00 0.00 -1.51 0.00 0.00 37.83 32.36 2kh2 s LYS 138 CO -0.13 -0.95 0.00 0.41 -0.36 0.00 0.00 175.35 174.32 2kh2 n GLY 139 N 4.07 0.81 0.00 5.54 0.00 -1.26 -5.07 105.19 109.28 2kh2 n GLY 139 Ca 0.16 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.32 1.05 0.08 -0.02 0.00 -1.12 -5.01 105.19 97.86 2kh2 n GLY 140 Ca 0.00 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 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 0.09 -6.97 1.61 7.50 -1.98 -3.45 115.11 111.91 2kh2 h GLN 141 Ca 0.00 -0.09 -0.46 0.00 0.50 0.00 0.00 58.65 58.60 2kh2 h GLN 141 Cb 0.00 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 27.55 2kh2 h GLN 141 CO 0.00 0.82 0.36 -0.51 -1.50 0.00 0.00 178.83 178.01 2kh2 s ASP 142 N -6.12 7.00 0.07 1.46 1.01 -1.26 -4.54 116.67 114.29 2kh2 s ASP 142 Ca -0.17 1.85 -0.29 0.00 0.71 0.00 0.00 52.55 54.66 2kh2 s ASP 142 Cb 0.00 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 2kh2 s ASP 142 CO 0.71 -0.32 0.91 -0.63 0.21 0.00 0.00 175.17 176.05 2kh2 s ILE 143 N -1.82 4.64 -0.02 0.77 1.01 0.93 -4.51 121.20 122.20 2kh2 s ILE 143 Ca 0.57 1.94 0.07 0.00 0.00 0.00 0.00 60.65 63.24 2kh2 s ILE 143 Cb -0.16 -4.26 -0.11 0.00 0.01 0.00 0.00 42.46 37.93 2kh2 s ILE 143 CO 0.21 0.30 0.15 0.35 0.00 0.00 0.00 174.94 175.95 2kh2 n THR 144 N 3.01 0.05 -3.28 2.92 -2.24 -1.26 -1.77 114.28 111.70 2kh2 n THR 144 Ca 0.02 -0.18 -0.38 0.00 -2.27 0.00 0.00 64.05 61.23 2kh2 n THR 144 Cb 0.50 0.21 -0.06 0.00 -2.10 0.00 0.00 70.33 68.88 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 -2.97 7.02 0.06 3.42 -4.77 -1.26 -4.21 116.67 113.96 2kh2 s ASP 145 Ca -0.03 1.23 0.01 0.00 -3.30 0.00 0.00 52.55 50.47 2kh2 s ASP 145 Cb 0.05 -2.35 -0.00 0.00 -1.09 0.00 0.00 42.92 39.52 2kh2 s ASP 145 CO 0.31 0.23 0.04 0.49 0.70 0.00 0.00 175.17 176.94 2kh2 n PHE 146 N 1.50 -0.08 -4.55 2.11 3.72 0.17 -3.93 117.46 116.39 2kh2 n PHE 146 Ca -0.09 -0.49 -0.27 0.00 -0.05 0.00 0.00 57.45 56.56 2kh2 n PHE 146 Cb 0.51 0.03 -0.08 0.00 -0.94 0.00 0.00 39.48 39.00 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 -2.09 0.76 -0.37 4.37 -4.23 -0.94 -2.35 115.64 110.79 2kh2 s THR 147 Ca 0.06 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.70 2kh2 s THR 147 Cb 0.00 -2.36 0.38 0.00 1.34 0.00 0.00 72.50 71.87 2kh2 s THR 147 CO 0.04 0.00 0.81 0.23 -0.54 0.00 0.00 174.62 175.16 2kh2 n MET 148 N -0.96 1.24 -1.58 3.99 2.81 -1.26 -4.39 117.12 116.98 2kh2 n MET 148 Ca -0.08 -3.48 -0.43 0.00 -1.81 0.00 0.00 57.70 51.90 2kh2 n MET 148 Cb 0.65 -1.64 -0.03 0.00 -0.71 0.00 0.00 33.22 31.49 2kh2 n MET 148 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2kh2 n GLN 149 N 0.14 1.77 -2.36 0.03 3.00 -1.10 -4.71 117.38 114.15 2kh2 n GLN 149 Ca 0.22 0.44 -0.42 0.00 -0.01 0.00 0.00 57.00 57.23 2kh2 n GLN 149 Cb 0.68 -3.21 -0.03 0.00 0.00 0.00 0.00 30.24 27.68 2kh2 n GLN 149 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 2kh2 s PHE 150 N 8.82 3.39 0.45 1.08 0.08 -1.26 -0.96 117.98 129.58 2kh2 s PHE 150 Ca 1.01 1.24 0.07 0.00 0.12 0.00 0.00 56.93 59.38 2kh2 s PHE 150 Cb -0.35 -3.48 -0.01 0.00 -0.57 0.00 0.00 43.02 38.61 2kh2 s PHE 150 CO 0.35 -1.52 0.36 0.14 -0.10 0.00 0.00 175.22 174.46 2kh2 s VAL 151 N 0.87 2.35 -0.41 -0.44 -7.23 -1.22 -4.97 120.40 109.35 2kh2 s VAL 151 Ca 0.59 -1.42 -0.05 0.00 -1.81 0.00 0.00 61.98 59.28 2kh2 s VAL 151 Cb -0.32 -2.78 -0.07 0.00 0.56 0.00 0.00 36.38 33.77 2kh2 s VAL 151 CO 0.31 0.00 3.09 -1.20 -0.31 0.00 0.00 175.10 176.98 2kh2 n SER 152 N -1.57 6.25 0.00 4.85 7.64 -1.26 -4.89 113.62 124.64 2kh2 n SER 152 Ca 0.02 -2.89 0.00 0.00 1.01 0.00 0.00 58.87 57.01 2kh2 n SER 152 Cb 0.63 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83