#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 0.87 -4.96 0.00 0.13 -2.08 -3.41 132.00 122.56 2kh2 h PRO 2 Ca 0.00 -0.22 -0.66 0.00 -0.87 0.00 0.00 66.00 64.25 2kh2 h PRO 2 Cb 0.00 -0.11 -0.29 0.00 0.13 0.00 0.00 31.00 30.73 2kh2 h PRO 2 CO 0.00 0.83 -0.73 0.54 -0.23 0.00 0.00 178.00 178.41 2kh2 s VAL 3 N -5.10 3.22 0.30 1.56 0.11 -1.26 -5.10 120.40 114.12 2kh2 s VAL 3 Ca -0.10 -0.68 -0.12 0.00 -2.93 0.00 0.00 61.98 58.15 2kh2 s VAL 3 Cb 0.15 -2.52 -0.08 0.00 -1.53 0.00 0.00 36.38 32.40 2kh2 s VAL 3 CO 0.82 0.34 0.66 -0.13 -3.33 0.00 0.00 175.10 173.46 2kh2 s ARG 4 N 1.43 3.87 -0.05 1.54 0.52 -1.26 -5.00 118.95 120.00 2kh2 s ARG 4 Ca 0.04 0.46 -0.13 0.00 -0.52 0.00 0.00 55.73 55.58 2kh2 s ARG 4 Cb -0.15 -2.51 0.02 0.00 0.52 0.00 0.00 34.95 32.83 2kh2 s ARG 4 CO -0.04 0.19 0.30 0.45 0.02 0.00 0.00 175.30 176.22 2kh2 s SER 5 N -2.50 -0.23 0.09 0.23 0.15 -1.26 -2.49 113.70 107.69 2kh2 s SER 5 Ca 0.51 0.26 0.06 0.00 0.70 0.00 0.00 55.95 57.48 2kh2 s SER 5 Cb -0.11 0.43 -0.03 0.00 -1.71 0.00 0.00 66.02 64.60 2kh2 s SER 5 CO 0.22 -0.32 -0.16 -0.76 1.20 0.00 0.00 173.24 173.41 2kh2 s LEU 6 N -0.81 2.31 -0.36 3.45 1.43 -0.91 -4.93 118.68 118.86 2kh2 s LEU 6 Ca -0.09 -0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 52.23 2kh2 s LEU 6 Cb -0.04 -0.62 0.03 0.00 0.03 0.00 0.00 46.19 45.58 2kh2 s LEU 6 CO 0.03 -0.06 0.18 0.20 0.23 0.00 0.00 176.35 176.93 2kh2 s ASN 7 N -1.96 5.64 0.07 2.29 -0.87 -1.26 0.14 114.94 118.98 2kh2 s ASN 7 Ca 0.03 -0.97 0.04 0.00 -1.57 0.00 0.00 52.86 50.39 2kh2 s ASN 7 Cb -0.09 -1.99 -0.03 0.00 -0.02 0.00 0.00 41.25 39.12 2kh2 s ASN 7 CO 0.03 -0.36 -0.11 0.00 -2.57 0.00 0.00 177.10 174.09 2kh2 s THR 9 N -1.67 4.24 -0.17 0.00 -4.23 -0.04 -0.65 115.64 113.11 2kh2 s THR 9 Ca -0.02 -0.51 -0.05 0.00 -1.18 0.00 0.00 61.69 59.93 2kh2 s THR 9 Cb -0.08 -2.87 -0.03 0.00 1.34 0.00 0.00 72.50 70.86 2kh2 s THR 9 CO 0.01 0.42 -0.00 -0.76 -0.54 0.00 0.00 174.62 173.75 2kh2 s LEU 10 N -1.44 3.39 -0.01 4.79 1.43 -1.26 -2.97 118.68 122.60 2kh2 s LEU 10 Ca 0.19 -0.10 0.01 0.00 -1.03 0.00 0.00 54.13 53.20 2kh2 s LEU 10 Cb -0.12 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.28 2kh2 s LEU 10 CO 0.09 0.15 -0.03 -0.13 0.23 0.00 0.00 176.35 176.65 2kh2 s ARG 11 N 0.51 0.40 0.89 1.70 0.52 -1.23 -3.25 118.95 118.48 2kh2 s ARG 11 Ca -0.01 -0.09 -0.13 0.00 -0.52 0.00 0.00 55.73 54.98 2kh2 s ARG 11 Cb -0.14 -0.43 0.16 0.00 0.52 0.00 0.00 34.95 35.06 2kh2 s ARG 11 CO 0.02 0.01 1.24 0.16 0.02 0.00 0.00 175.30 176.75 2kh2 s ASP 12 N 0.31 3.59 0.00 0.23 1.47 -0.00 -0.29 116.67 121.97 2kh2 s ASP 12 Ca -0.03 0.26 0.11 0.00 1.18 0.00 0.00 52.55 54.07 2kh2 s ASP 12 Cb -0.06 -0.45 0.55 0.00 -0.34 0.00 0.00 42.92 42.62 2kh2 s ASP 12 CO -0.00 -2.43 1.23 -1.54 0.68 0.00 0.00 175.17 173.11 2kh2 n SER 13 N -3.52 0.00 -1.22 2.11 3.41 -1.26 -1.75 113.62 111.40 2kh2 n SER 13 Ca 0.14 0.11 0.08 0.00 -0.26 0.00 0.00 58.87 58.94 2kh2 n SER 13 Cb 0.60 -0.27 0.29 0.00 -0.26 0.00 0.00 64.21 64.57 2kh2 n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kh2 n GLN 14 N -1.27 3.43 -1.69 4.33 1.13 -1.26 -4.93 117.38 117.12 2kh2 n GLN 14 Ca 0.05 -2.73 -0.14 0.00 -1.94 0.00 0.00 57.00 52.25 2kh2 n GLN 14 Cb 0.08 -1.78 -0.04 0.00 0.11 0.00 0.00 30.24 28.61 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 0.49 -0.99 -3.59 -1.09 1.13 -0.72 -4.92 117.38 107.70 2kh2 n GLN 15 Ca 0.22 0.87 -0.37 0.00 -1.94 0.00 0.00 57.00 55.78 2kh2 n GLN 15 Cb 0.82 -5.00 -0.07 0.00 0.11 0.00 0.00 30.24 26.10 2kh2 n GLN 15 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2kh2 s LYS 16 N -3.68 4.06 0.26 -1.09 1.02 -1.26 -3.50 119.74 115.56 2kh2 s LYS 16 Ca 0.00 0.11 0.09 0.00 0.02 0.00 0.00 55.97 56.19 2kh2 s LYS 16 Cb 0.00 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 2kh2 s LYS 16 CO 0.00 0.41 0.03 -1.12 -0.92 0.00 0.00 175.35 173.75 2kh2 s SER 17 N -0.05 4.72 -0.10 2.83 0.01 0.96 -0.82 113.70 121.24 2kh2 s SER 17 Ca 0.17 -0.57 -0.21 0.00 1.31 0.00 0.00 55.95 56.66 2kh2 s SER 17 Cb -0.13 -0.95 -0.04 0.00 0.21 0.00 0.00 66.02 65.11 2kh2 s SER 17 CO 0.05 -0.00 0.61 -0.76 0.41 0.00 0.00 173.24 173.55 2kh2 s LEU 18 N -3.66 4.28 0.10 2.44 1.43 -1.20 -1.75 118.68 120.31 2kh2 s LEU 18 Ca 0.31 1.01 0.06 0.00 -1.03 0.00 0.00 54.13 54.49 2kh2 s LEU 18 Cb -0.07 -2.91 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 2kh2 s LEU 18 CO 0.21 -0.09 -0.16 0.68 0.23 0.00 0.00 176.35 177.22 2kh2 s VAL 19 N 0.84 1.35 -0.39 -1.59 -7.23 0.52 -1.49 120.40 112.42 2kh2 s VAL 19 Ca 0.32 -1.50 -0.29 0.00 -1.81 0.00 0.00 61.98 58.70 2kh2 s VAL 19 Cb -0.16 -1.35 0.01 0.00 0.56 0.00 0.00 36.38 35.44 2kh2 s VAL 19 CO 0.14 -0.24 1.30 -0.04 -0.31 0.00 0.00 175.10 175.96 2kh2 s MET 20 N -2.08 3.73 0.00 4.82 -1.94 -1.26 -0.84 119.30 121.73 2kh2 s MET 20 Ca 0.04 0.95 0.00 0.00 -1.71 0.00 0.00 55.69 54.97 2kh2 s MET 20 Cb -0.08 -3.94 0.00 0.00 2.01 0.00 0.00 34.83 32.81 2kh2 s MET 20 CO 0.03 -1.36 0.18 0.45 -0.01 0.00 0.00 175.02 174.31 2kh2 n SER 21 N 8.17 0.00 0.00 3.03 2.88 0.44 -4.93 113.62 123.21 2kh2 n SER 21 Ca 0.15 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 2kh2 n SER 21 Cb 0.48 -0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.79 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 1.51 3.14 0.24 0.46 0.00 -1.21 -4.96 105.19 104.37 2kh2 n GLY 22 Ca 0.00 -1.88 -0.10 0.00 0.00 0.00 0.00 46.02 44.03 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 0.72 -0.28 1.61 0.13 -2.04 -3.34 132.00 128.80 2kh2 h PRO 23 Ca 0.00 -0.40 -0.24 0.00 -0.87 0.00 0.00 66.00 64.50 2kh2 h PRO 23 Cb 0.00 0.02 -0.34 0.00 0.13 0.00 0.00 31.00 30.82 2kh2 h PRO 23 CO 0.00 1.02 -0.94 0.66 -0.23 0.00 0.00 178.00 178.51 2kh2 n TYR 24 N -4.02 0.93 -4.56 1.56 4.01 -1.26 -5.06 117.16 108.75 2kh2 n TYR 24 Ca -0.02 -1.54 -0.21 0.00 -0.16 0.00 0.00 57.90 55.97 2kh2 n TYR 24 Cb 0.56 -0.23 -0.15 0.00 -0.31 0.00 0.00 39.34 39.21 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 -2.49 1.05 -0.06 -0.72 2.12 -1.25 -4.66 118.70 112.68 2kh2 s GLU 25 Ca 0.35 -0.45 0.05 0.00 0.36 0.00 0.00 54.97 55.29 2kh2 s GLU 25 Cb 0.37 -1.00 -0.01 0.00 0.26 0.00 0.00 34.13 33.74 2kh2 s GLU 25 CO -0.07 0.26 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.17 2kh2 s LEU 26 N -0.24 2.22 0.10 2.70 1.43 -1.26 -0.42 118.68 123.21 2kh2 s LEU 26 Ca 0.04 -0.45 0.09 0.00 -1.03 0.00 0.00 54.13 52.78 2kh2 s LEU 26 Cb -0.05 -1.42 -0.03 0.00 0.03 0.00 0.00 46.19 44.71 2kh2 s LEU 26 CO -0.00 0.25 -0.22 -0.54 0.23 0.00 0.00 176.35 176.07 2kh2 s LYS 27 N -0.21 1.23 -0.18 1.70 1.02 -0.02 -2.45 119.74 120.83 2kh2 s LYS 27 Ca -0.02 -1.18 -0.02 0.00 0.02 0.00 0.00 55.97 54.78 2kh2 s LYS 27 Cb -0.13 -1.53 -0.01 0.00 -0.52 0.00 0.00 37.83 35.64 2kh2 s LYS 27 CO 0.03 0.36 -0.10 0.00 -0.92 0.00 0.00 175.35 174.72 2kh2 s ALA 28 N -1.09 2.66 0.23 5.17 0.00 0.67 -0.35 121.76 129.04 2kh2 s ALA 28 Ca 0.08 -1.06 -0.15 0.00 0.00 0.00 0.00 51.96 50.84 2kh2 s ALA 28 Cb -0.10 -1.41 0.01 0.00 0.00 0.00 0.00 23.12 21.61 2kh2 s ALA 28 CO 0.04 -0.13 0.50 -0.48 0.00 0.00 0.00 175.76 175.69 2kh2 s LEU 29 N 0.97 0.24 -0.09 0.00 0.05 -0.72 -3.12 118.68 116.01 2kh2 s LEU 29 Ca -0.01 -0.75 -0.29 0.00 0.05 0.00 0.00 54.13 53.12 2kh2 s LEU 29 Cb -0.15 1.94 -0.06 0.00 -2.05 0.00 0.00 46.19 45.88 2kh2 s LEU 29 CO -0.01 -1.12 1.78 -1.00 -0.55 0.00 0.00 176.35 175.45 2kh2 s HIS 30 N -3.96 1.75 -0.70 3.48 3.76 -1.26 -0.03 115.29 118.33 2kh2 s HIS 30 Ca 0.17 0.16 0.01 0.00 -0.15 0.00 0.00 55.06 55.24 2kh2 s HIS 30 Cb -0.01 -4.01 0.17 0.00 1.11 0.00 0.00 32.58 29.84 2kh2 s HIS 30 CO 0.04 -4.07 0.52 -0.51 -0.85 0.00 0.00 174.74 169.87 2kh2 s LEU 31 N 4.89 5.04 -0.19 0.89 1.02 -1.23 -4.91 118.68 124.19 2kh2 s LEU 31 Ca 0.79 -3.41 -0.01 0.00 0.02 0.00 0.00 54.13 51.53 2kh2 s LEU 31 Cb -0.33 -1.77 0.05 0.00 0.02 0.00 0.00 46.19 44.16 2kh2 s LEU 31 CO 0.33 -0.21 -0.03 -1.58 0.02 0.00 0.00 176.35 174.88 2kh2 s GLN 32 N -0.86 1.29 0.00 1.70 -0.44 -1.26 -4.55 119.66 115.54 2kh2 s GLN 32 Ca 0.22 -0.62 0.00 0.00 -2.50 0.00 0.00 55.36 52.46 2kh2 s GLN 32 Cb -0.13 -2.18 0.00 0.00 -1.64 0.00 0.00 33.01 29.06 2kh2 s GLN 32 CO -0.09 -0.53 0.00 0.41 0.50 0.00 0.00 175.29 175.58 2kh2 n GLY 33 N 4.86 0.44 0.00 2.59 0.00 -1.26 -4.73 105.19 107.10 2kh2 n GLY 33 Ca -0.11 -1.69 0.06 0.00 0.00 0.00 0.00 46.02 44.28 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 0.87 -0.00 1.61 -0.06 -1.26 -2.20 117.38 116.34 2kh2 n GLN 34 Ca 0.00 0.00 0.09 0.00 -2.00 0.00 0.00 57.00 55.09 2kh2 n GLN 34 Cb 0.00 -1.23 0.07 0.00 -4.06 0.00 0.00 30.24 25.03 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 -0.73 2.48 0.02 1.69 9.92 -1.26 -4.45 116.55 124.22 2kh2 n ASP 35 Ca 0.10 -1.74 0.02 0.00 -0.53 0.00 0.00 54.79 52.64 2kh2 n ASP 35 Cb 0.04 -0.00 0.37 0.00 -0.64 0.00 0.00 41.12 40.89 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 3.46 0.49 -0.45 -1.24 4.05 -1.68 -2.16 114.93 117.39 2kh2 h MET 36 Ca 0.00 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 2kh2 h MET 36 Cb 0.74 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.45 2kh2 h MET 36 CO 0.00 0.44 0.00 0.39 0.23 0.00 0.00 176.91 177.97 2kh2 n GLU 37 N -4.37 0.94 -0.04 0.39 -0.58 -1.26 -2.41 120.64 113.31 2kh2 n GLU 37 Ca 0.02 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.88 2kh2 n GLU 37 Cb 0.16 -1.23 0.17 0.00 -0.57 0.00 0.00 31.44 29.97 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 -0.24 2.30 -1.84 3.49 6.02 -0.81 -4.97 117.38 121.32 2kh2 n GLN 38 Ca 0.00 -1.91 -0.41 0.00 -0.01 0.00 0.00 57.00 54.67 2kh2 n GLN 38 Cb 0.11 -1.47 -0.01 0.00 1.02 0.00 0.00 30.24 29.89 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 -1.89 4.15 0.07 -1.09 -2.07 -1.01 -4.67 119.66 113.15 2kh2 s GLN 39 Ca 0.31 2.52 -0.27 0.00 -1.82 0.00 0.00 55.36 56.10 2kh2 s GLN 39 Cb 0.21 -3.00 -0.06 0.00 -1.09 0.00 0.00 33.01 29.07 2kh2 s GLN 39 CO 0.31 -0.51 0.85 0.08 -1.32 0.00 0.00 175.29 174.70 2kh2 s VAL 40 N -0.88 4.63 -0.21 3.63 1.01 -0.55 -5.03 120.40 123.00 2kh2 s VAL 40 Ca 0.54 1.82 -0.09 0.00 0.00 0.00 0.00 61.98 64.26 2kh2 s VAL 40 Cb -0.46 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 2kh2 s VAL 40 CO 0.58 0.35 0.10 -0.69 0.00 0.00 0.00 175.10 175.44 2kh2 s VAL 41 N -0.04 4.95 -0.12 2.92 1.01 -1.26 -4.30 120.40 123.56 2kh2 s VAL 41 Ca 0.42 0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.39 2kh2 s VAL 41 Cb -0.22 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 2kh2 s VAL 41 CO 0.26 0.40 0.05 -0.36 0.00 0.00 0.00 175.10 175.45 2kh2 s PHE 42 N 0.77 3.29 -0.28 5.22 0.08 0.17 -1.34 117.98 125.89 2kh2 s PHE 42 Ca 0.05 0.23 -0.21 0.00 0.12 0.00 0.00 56.93 57.12 2kh2 s PHE 42 Cb -0.13 -1.91 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 2kh2 s PHE 42 CO 0.02 0.44 0.66 -1.12 -0.10 0.00 0.00 175.22 175.12 2kh2 s SER 43 N -0.56 6.57 -0.75 1.36 0.01 0.08 -1.67 113.70 118.74 2kh2 s SER 43 Ca 0.10 0.61 -0.19 0.00 1.31 0.00 0.00 55.95 57.79 2kh2 s SER 43 Cb -0.12 -2.35 0.12 0.00 0.21 0.00 0.00 66.02 63.89 2kh2 s SER 43 CO 0.02 -0.45 0.89 -0.04 0.41 0.00 0.00 173.24 174.07 2kh2 s MET 44 N 2.61 3.31 0.00 12.44 -1.94 0.12 -3.26 119.30 132.59 2kh2 s MET 44 Ca 0.27 -1.55 -0.26 0.00 -1.71 0.00 0.00 55.69 52.44 2kh2 s MET 44 Cb -0.15 -4.49 -0.04 0.00 2.01 0.00 0.00 34.83 32.15 2kh2 s MET 44 CO 0.10 -1.62 0.81 -1.12 -0.01 0.00 0.00 175.02 173.18 2kh2 s SER 45 N 3.43 7.20 -0.95 3.03 0.01 -1.20 -2.14 113.70 123.07 2kh2 s SER 45 Ca 0.21 1.44 -0.22 0.00 1.31 0.00 0.00 55.95 58.68 2kh2 s SER 45 Cb -0.15 -2.48 0.07 0.00 0.21 0.00 0.00 66.02 63.67 2kh2 s SER 45 CO -0.00 -0.10 1.33 -0.36 0.41 0.00 0.00 173.24 174.51 2kh2 s PHE 46 N 0.50 2.66 0.52 2.43 0.40 -1.04 -1.18 117.98 122.26 2kh2 s PHE 46 Ca 0.42 -0.88 -0.09 0.00 -0.60 0.00 0.00 56.93 55.78 2kh2 s PHE 46 Cb -0.20 -4.57 0.12 0.00 0.51 0.00 0.00 43.02 38.88 2kh2 s PHE 46 CO 0.23 -1.83 0.66 1.33 0.70 0.00 0.00 175.22 176.31 2kh2 n VAL 47 N 6.44 0.00 -3.93 -0.44 0.24 -1.18 -4.80 118.33 114.66 2kh2 n VAL 47 Ca 0.26 -0.46 -0.34 0.00 -2.04 0.00 0.00 64.34 61.76 2kh2 n VAL 47 Cb 0.50 -1.65 -0.14 0.00 -1.47 0.00 0.00 33.84 31.08 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 -4.45 2.10 0.00 7.34 2.00 -0.96 -4.87 119.66 120.82 2kh2 s GLN 48 Ca 0.38 -1.53 0.00 0.00 -2.00 0.00 0.00 55.36 52.21 2kh2 s GLN 48 Cb -0.01 -3.23 0.00 0.00 0.80 0.00 0.00 33.01 30.57 2kh2 s GLN 48 CO 0.27 -0.78 0.00 0.41 -0.50 0.00 0.00 175.29 174.69 2kh2 n GLY 49 N 4.51 3.91 3.60 2.59 0.00 -1.26 -4.91 105.19 113.63 2kh2 n GLY 49 Ca -0.07 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 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 4.76 3.56 0.03 1.61 2.56 -1.26 -4.94 118.70 125.03 2kh2 s GLU 50 Ca 0.00 0.74 0.07 0.00 0.00 0.00 0.00 54.97 55.78 2kh2 s GLU 50 Cb 0.00 -4.01 -0.03 0.00 2.00 0.00 0.00 34.13 32.09 2kh2 s GLU 50 CO 0.00 -1.59 -0.19 -2.00 -0.56 0.00 0.00 175.26 170.92 2kh2 s GLU 51 N 4.92 2.07 0.00 4.30 2.12 -1.26 -3.75 118.70 127.11 2kh2 s GLU 51 Ca 0.56 -0.97 0.00 0.00 0.36 0.00 0.00 54.97 54.92 2kh2 s GLU 51 Cb -0.11 -2.17 0.00 0.00 0.26 0.00 0.00 34.13 32.10 2kh2 s GLU 51 CO 0.31 0.54 0.00 -1.13 -0.54 0.00 0.00 175.26 174.44 2kh2 n SER 52 N 1.65 0.00 -0.61 -1.70 3.41 -0.34 -4.98 113.62 111.04 2kh2 n SER 52 Ca -0.16 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.58 2kh2 n SER 52 Cb 0.52 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.87 2kh2 n SER 52 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2kh2 n ASN 53 N 0.00 1.92 0.00 4.04 5.15 -1.26 -4.43 115.26 120.68 2kh2 n ASN 53 Ca 0.00 -1.63 0.00 0.00 -0.60 0.00 0.00 54.58 52.35 2kh2 n ASN 53 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2kh2 n ASN 53 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2kh2 n ASP 54 N 0.49 0.00 -4.31 1.20 5.75 -1.26 -5.02 116.55 113.40 2kh2 n ASP 54 Ca 0.17 0.00 -0.40 0.00 -0.01 0.00 0.00 54.79 54.55 2kh2 n ASP 54 Cb 0.42 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.41 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 -0.51 2.68 -0.19 0.11 1.02 -1.25 -1.00 119.74 120.60 2kh2 s LYS 55 Ca 0.00 -1.30 -0.06 0.00 0.02 0.00 0.00 55.97 54.63 2kh2 s LYS 55 Cb 0.00 -3.73 -0.03 0.00 -0.52 0.00 0.00 37.83 33.54 2kh2 s LYS 55 CO 0.00 -0.84 0.03 0.42 -0.92 0.00 0.00 175.35 174.04 2kh2 s ILE 56 N 1.47 4.30 -0.25 2.17 -1.09 -0.32 -1.20 121.20 126.27 2kh2 s ILE 56 Ca 0.02 -0.20 -0.29 0.00 -2.23 0.00 0.00 60.65 57.95 2kh2 s ILE 56 Cb -0.21 -2.94 -0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2kh2 s ILE 56 CO 0.04 0.44 1.25 -2.16 -1.23 0.00 0.00 174.94 173.28 2kh2 s PRO 57 N 0.71 4.06 0.08 2.79 0.04 -1.25 -0.24 135.00 141.19 2kh2 s PRO 57 Ca 0.01 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.43 2kh2 s PRO 57 Cb -0.14 -3.81 -0.04 0.00 0.04 0.00 0.00 34.50 30.55 2kh2 s PRO 57 CO 0.02 -0.93 -0.03 0.14 0.04 0.00 0.00 177.00 176.24 2kh2 s VAL 58 N 3.95 0.38 0.17 -0.36 -7.23 0.24 -3.11 120.40 114.44 2kh2 s VAL 58 Ca 0.54 -1.87 0.04 0.00 -1.81 0.00 0.00 61.98 58.88 2kh2 s VAL 58 Cb -0.18 -1.68 -0.04 0.00 0.56 0.00 0.00 36.38 35.05 2kh2 s VAL 58 CO 0.18 -0.86 0.23 0.00 -0.31 0.00 0.00 175.10 174.35 2kh2 s ALA 59 N -3.83 3.79 -0.31 1.32 0.00 -0.33 -0.47 121.76 121.93 2kh2 s ALA 59 Ca 0.12 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 50.94 2kh2 s ALA 59 Cb 0.07 -1.58 0.09 0.00 0.00 0.00 0.00 23.12 21.70 2kh2 s ALA 59 CO -0.06 0.47 0.05 -0.51 0.00 0.00 0.00 175.76 175.71 2kh2 s LEU 60 N -3.33 3.37 0.15 0.00 1.43 -1.26 -3.27 118.68 115.77 2kh2 s LEU 60 Ca 0.33 -1.77 0.08 0.00 -1.03 0.00 0.00 54.13 51.73 2kh2 s LEU 60 Cb -0.10 -1.25 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 2kh2 s LEU 60 CO 0.26 -0.37 -0.17 -0.83 0.23 0.00 0.00 176.35 175.47 2kh2 s GLY 61 N 1.27 1.29 0.15 -3.19 0.00 -1.20 -1.01 107.32 104.63 2kh2 s GLY 61 Ca 0.07 -1.41 -0.30 0.00 0.00 0.00 0.00 44.72 43.09 2kh2 s GLY 61 CO -0.14 -1.46 1.15 1.08 0.00 0.00 0.00 173.10 173.73 2kh2 s LEU 62 N -2.53 4.45 0.28 0.66 1.02 -0.06 -0.74 118.68 121.76 2kh2 s LEU 62 Ca 0.13 2.11 -0.30 0.00 0.02 0.00 0.00 54.13 56.09 2kh2 s LEU 62 Cb -0.06 -3.60 -0.12 0.00 0.02 0.00 0.00 46.19 42.43 2kh2 s LEU 62 CO 0.05 -0.33 1.50 1.17 0.02 0.00 0.00 176.35 178.77 2kh2 n LYS 63 N 2.80 2.43 -2.23 1.70 4.81 -0.45 -2.20 118.16 125.02 2kh2 n LYS 63 Ca 0.05 0.86 -0.10 0.00 -0.87 0.00 0.00 58.31 58.25 2kh2 n LYS 63 Cb 0.46 -2.58 -0.01 0.00 0.02 0.00 0.00 35.03 32.91 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 1.88 -2.13 -4.15 1.64 0.28 -1.26 -4.93 120.64 111.97 2kh2 n GLU 64 Ca 0.09 0.53 -0.11 0.00 -0.16 0.00 0.00 57.16 57.51 2kh2 n GLU 64 Cb 0.35 -5.04 -0.10 0.00 1.43 0.00 0.00 31.44 28.08 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 -4.61 0.78 -0.39 3.44 1.02 -0.93 -5.04 119.74 114.00 2kh2 s LYS 65 Ca 0.00 -1.24 0.06 0.00 0.02 0.00 0.00 55.97 54.81 2kh2 s LYS 65 Cb 0.00 -0.20 0.70 0.00 -0.52 0.00 0.00 37.83 37.81 2kh2 s LYS 65 CO 0.00 -0.01 1.87 0.27 -0.92 0.00 0.00 175.35 176.56 2kh2 n ASN 66 N 0.19 4.24 -4.50 2.83 6.94 -1.26 -4.56 115.26 119.14 2kh2 n ASN 66 Ca -0.14 -3.43 -0.36 0.00 -0.02 0.00 0.00 54.58 50.64 2kh2 n ASN 66 Cb 0.60 -0.80 -0.12 0.00 -2.36 0.00 0.00 39.78 37.10 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 -3.13 3.55 0.08 -4.53 1.43 -1.26 -1.83 118.68 112.99 2kh2 s LEU 67 Ca 0.56 -0.13 0.09 0.00 -1.03 0.00 0.00 54.13 53.62 2kh2 s LEU 67 Cb 0.46 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.71 2kh2 s LEU 67 CO 0.12 0.01 -0.24 -0.31 0.23 0.00 0.00 176.35 176.17 2kh2 s TYR 68 N 1.33 2.04 0.03 0.29 1.51 -0.90 -0.88 117.35 120.77 2kh2 s TYR 68 Ca 0.05 -0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 55.41 2kh2 s TYR 68 Cb -0.15 -1.16 -0.05 0.00 -0.11 0.00 0.00 41.96 40.50 2kh2 s TYR 68 CO 0.04 0.20 1.17 -0.51 -1.11 0.00 0.00 175.55 175.34 2kh2 s LEU 69 N -1.63 4.35 0.03 -1.29 1.43 -0.18 -1.19 118.68 120.20 2kh2 s LEU 69 Ca 0.10 1.93 0.03 0.00 -1.03 0.00 0.00 54.13 55.16 2kh2 s LEU 69 Cb -0.10 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.53 2kh2 s LEU 69 CO 0.04 -0.47 -0.09 -0.55 0.23 0.00 0.00 176.35 175.51 2kh2 s SER 70 N 1.14 0.98 -0.20 2.29 0.15 0.44 -4.52 113.70 113.99 2kh2 s SER 70 Ca 0.57 -0.42 -0.03 0.00 0.70 0.00 0.00 55.95 56.78 2kh2 s SER 70 Cb -0.27 -0.02 -0.01 0.00 -1.71 0.00 0.00 66.02 64.01 2kh2 s SER 70 CO 0.28 -0.08 -0.07 0.00 1.20 0.00 0.00 173.24 174.57 2kh2 s VAL 72 N 1.25 0.20 -0.23 0.00 -7.23 -0.64 -4.76 120.40 108.98 2kh2 s VAL 72 Ca 0.03 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.05 2kh2 s VAL 72 Cb -0.14 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 2kh2 s VAL 72 CO -0.02 0.00 0.34 -0.76 -0.31 0.00 0.00 175.10 174.35 2kh2 s LEU 73 N -3.26 4.11 -0.11 1.32 1.43 -1.26 0.38 118.68 121.29 2kh2 s LEU 73 Ca 0.38 0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 53.83 2kh2 s LEU 73 Cb 0.06 -2.40 0.02 0.00 0.03 0.00 0.00 46.19 43.91 2kh2 s LEU 73 CO 0.15 -0.09 -0.07 -0.54 0.23 0.00 0.00 176.35 176.03 2kh2 s LYS 74 N 1.53 1.49 -1.28 1.70 1.02 0.64 -4.78 119.74 120.07 2kh2 s LYS 74 Ca 0.15 -0.24 -0.03 0.00 0.02 0.00 0.00 55.97 55.87 2kh2 s LYS 74 Cb -0.15 -1.56 0.01 0.00 -0.52 0.00 0.00 37.83 35.61 2kh2 s LYS 74 CO 0.08 -0.26 0.96 -3.47 -0.92 0.00 0.00 175.35 171.74 2kh2 n ASP 75 N 4.92 -2.83 -1.70 2.83 4.64 -1.26 -1.69 116.55 121.46 2kh2 n ASP 75 Ca -0.13 -0.67 -0.21 0.00 -1.38 0.00 0.00 54.79 52.41 2kh2 n ASP 75 Cb 0.50 -4.76 -0.08 0.00 -1.04 0.00 0.00 41.12 35.74 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 -3.07 -5.55 -3.90 1.67 10.43 -1.26 -4.98 116.55 109.89 2kh2 n ASP 76 Ca -0.21 0.44 -0.17 0.00 2.57 0.00 0.00 54.79 57.41 2kh2 n ASP 76 Cb 0.64 -4.82 -0.15 0.00 1.84 0.00 0.00 41.12 38.62 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 -3.94 0.52 -0.06 -1.24 2.47 -0.68 -5.11 119.74 111.71 2kh2 s LYS 77 Ca 0.00 -0.10 -0.30 0.00 -1.56 0.00 0.00 55.97 54.02 2kh2 s LYS 77 Cb 0.00 -0.56 -0.06 0.00 -1.46 0.00 0.00 37.83 35.74 2kh2 s LYS 77 CO 0.00 -0.01 1.80 -2.14 0.16 0.00 0.00 175.35 175.16 2kh2 s PRO 78 N 0.49 4.02 0.02 4.03 0.02 -1.26 -0.26 135.00 142.06 2kh2 s PRO 78 Ca -0.06 2.24 0.06 0.00 0.02 0.00 0.00 61.00 63.26 2kh2 s PRO 78 Cb -0.09 -4.09 -0.02 0.00 0.02 0.00 0.00 34.50 30.32 2kh2 s PRO 78 CO -0.00 -1.06 -0.19 0.99 -0.33 0.00 0.00 177.00 176.41 2kh2 s THR 79 N 4.73 1.50 0.13 0.99 2.01 0.16 -4.77 115.64 120.39 2kh2 s THR 79 Ca 0.80 -1.02 -0.20 0.00 0.31 0.00 0.00 61.69 61.59 2kh2 s THR 79 Cb -0.35 -1.29 -0.07 0.00 0.01 0.00 0.00 72.50 70.79 2kh2 s THR 79 CO 0.34 0.25 0.64 -0.22 -0.69 0.00 0.00 174.62 174.94 2kh2 s LEU 80 N -0.90 4.48 0.26 4.42 2.96 -1.26 -1.61 118.68 127.02 2kh2 s LEU 80 Ca 0.06 1.35 -0.14 0.00 -0.22 0.00 0.00 54.13 55.19 2kh2 s LEU 80 Cb -0.08 -3.17 0.00 0.00 0.50 0.00 0.00 46.19 43.44 2kh2 s LEU 80 CO 0.01 0.19 0.52 0.00 -1.32 0.00 0.00 176.35 175.74 2kh2 s GLN 81 N -1.41 1.60 -0.21 1.98 -2.07 0.34 -4.87 119.66 115.02 2kh2 s GLN 81 Ca 0.34 -1.23 -0.06 0.00 -1.82 0.00 0.00 55.36 52.58 2kh2 s GLN 81 Cb -0.19 0.49 -0.03 0.00 -1.09 0.00 0.00 33.01 32.19 2kh2 s GLN 81 CO 0.21 -0.68 0.04 -0.51 -1.32 0.00 0.00 175.29 173.03 2kh2 s LEU 82 N -3.01 3.46 -0.15 2.60 2.01 -1.26 -0.42 118.68 121.90 2kh2 s LEU 82 Ca 0.21 -0.14 -0.02 0.00 0.01 0.00 0.00 54.13 54.19 2kh2 s LEU 82 Cb -0.01 -1.90 -0.02 0.00 0.01 0.00 0.00 46.19 44.27 2kh2 s LEU 82 CO 0.09 0.05 -0.07 -1.61 1.01 0.00 0.00 176.35 175.82 2kh2 s GLU 83 N 1.09 3.56 -0.84 1.70 2.02 -0.34 -4.92 118.70 120.97 2kh2 s GLU 83 Ca 0.03 -0.58 -0.24 0.00 0.02 0.00 0.00 54.97 54.20 2kh2 s GLU 83 Cb -0.14 -2.82 0.06 0.00 0.10 0.00 0.00 34.13 31.33 2kh2 s GLU 83 CO 0.03 0.22 1.25 -1.12 0.02 0.00 0.00 175.26 175.66 2kh2 s SER 84 N 0.39 6.33 0.44 -0.19 0.01 -1.26 -2.11 113.70 117.31 2kh2 s SER 84 Ca -0.06 -1.08 -0.03 0.00 1.31 0.00 0.00 55.95 56.08 2kh2 s SER 84 Cb -0.15 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.53 2kh2 s SER 84 CO 0.04 -1.56 0.71 0.68 0.41 0.00 0.00 173.24 173.52 2kh2 s VAL 85 N 4.78 4.95 -0.03 3.43 -7.23 -0.76 -5.01 120.40 120.54 2kh2 s VAL 85 Ca 0.36 -0.03 -0.29 0.00 -1.81 0.00 0.00 61.98 60.21 2kh2 s VAL 85 Cb -0.07 -3.86 -0.08 0.00 0.56 0.00 0.00 36.38 32.94 2kh2 s VAL 85 CO 0.03 -0.75 2.03 -0.62 -0.31 0.00 0.00 175.10 175.49 2kh2 s ASP 86 N -4.09 6.20 0.09 4.85 3.68 -1.26 -4.86 116.67 121.28 2kh2 s ASP 86 Ca 0.45 2.48 0.15 0.00 2.13 0.00 0.00 52.55 57.76 2kh2 s ASP 86 Cb -0.10 -2.53 0.65 0.00 -1.45 0.00 0.00 42.92 39.49 2kh2 s ASP 86 CO 0.42 -1.28 1.46 -0.81 0.13 0.00 0.00 175.17 175.09 2kh2 n PRO 87 N 7.85 0.06 -0.01 4.34 -0.04 -1.26 -2.09 135.00 143.86 2kh2 n PRO 87 Ca 0.22 0.37 0.10 0.00 -0.04 0.00 0.00 63.50 64.16 2kh2 n PRO 87 Cb 0.42 -1.63 -0.15 0.00 -0.04 0.00 0.00 33.50 32.10 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 -1.75 0.42 -0.08 0.54 2.85 -1.26 -4.34 118.16 114.54 2kh2 n LYS 88 Ca 0.02 -0.12 0.02 0.00 -1.05 0.00 0.00 58.31 57.19 2kh2 n LYS 88 Cb 0.14 -1.50 0.07 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 -1.95 2.40 -4.05 -5.58 3.02 -1.04 -5.00 115.26 103.07 2kh2 n ASN 89 Ca -0.01 -2.01 -0.18 0.00 -0.03 0.00 0.00 54.58 52.35 2kh2 n ASN 89 Cb 0.47 -0.10 -0.14 0.00 -0.61 0.00 0.00 39.78 39.40 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 -1.02 0.87 0.00 3.10 1.51 -0.89 -4.51 117.35 116.41 2kh2 s TYR 90 Ca 0.10 -0.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 2kh2 s TYR 90 Cb 0.05 -0.54 0.00 0.00 -0.11 0.00 0.00 41.96 41.36 2kh2 s TYR 90 CO 0.07 -0.01 0.00 -0.35 -1.11 0.00 0.00 175.55 174.15 2kh2 n PRO 91 N 2.47 0.31 -3.86 -1.71 -0.04 -1.26 -4.80 135.00 126.12 2kh2 n PRO 91 Ca -0.16 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.21 2kh2 n PRO 91 Cb 0.56 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.97 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 -2.65 1.27 0.11 0.54 -2.85 -1.26 -5.06 119.74 109.85 2kh2 s LYS 92 Ca 0.00 -1.03 -0.19 0.00 -1.00 0.00 0.00 55.97 53.76 2kh2 s LYS 92 Cb 0.00 0.45 -0.06 0.00 -2.06 0.00 0.00 37.83 36.16 2kh2 s LYS 92 CO 0.00 -0.51 1.69 -0.22 0.10 0.00 0.00 175.35 176.41 2kh2 h LYS 93 N 2.37 0.38 -3.85 1.78 3.11 -1.98 -3.35 116.57 115.03 2kh2 h LYS 93 Ca -0.30 -0.06 -0.74 0.00 -2.81 0.00 0.00 60.65 56.74 2kh2 h LYS 93 Cb 1.24 -0.07 -0.30 0.00 -1.00 0.00 0.00 32.23 32.11 2kh2 h LYS 93 CO 0.43 0.37 -0.18 0.21 -2.81 0.00 0.00 179.45 177.46 2kh2 s LYS 94 N -5.72 2.97 0.89 1.90 2.47 -1.26 -2.26 119.74 118.72 2kh2 s LYS 94 Ca -0.13 -2.32 -0.10 0.00 -1.56 0.00 0.00 55.97 51.86 2kh2 s LYS 94 Cb 0.08 -4.07 0.19 0.00 -1.46 0.00 0.00 37.83 32.58 2kh2 s LYS 94 CO 0.72 -1.23 1.21 -1.64 0.16 0.00 0.00 175.35 174.57 2kh2 s MET 95 N 0.38 0.87 0.42 4.03 -1.94 -1.26 -5.03 119.30 116.77 2kh2 s MET 95 Ca 0.14 -0.82 -0.23 0.00 -1.71 0.00 0.00 55.69 53.08 2kh2 s MET 95 Cb -0.18 -2.04 -0.09 0.00 2.01 0.00 0.00 34.83 34.54 2kh2 s MET 95 CO -0.05 -2.14 1.05 -1.21 -0.01 0.00 0.00 175.02 172.66 2kh2 s GLU 96 N -5.63 4.08 0.60 2.03 8.01 -1.26 -4.92 118.70 121.62 2kh2 s GLU 96 Ca 0.73 1.50 0.32 0.00 0.01 0.00 0.00 54.97 57.52 2kh2 s GLU 96 Cb -0.03 -2.46 1.88 0.00 -4.31 0.00 0.00 34.13 29.22 2kh2 s GLU 96 CO 0.50 -0.21 2.24 -0.22 0.01 0.00 0.00 175.26 177.58 2kh2 h LYS 97 N 2.31 0.00 -0.00 1.61 3.64 -1.96 0.86 116.57 123.03 2kh2 h LYS 97 Ca -0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2kh2 h LYS 97 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2kh2 h LYS 97 CO 0.62 0.00 -0.07 2.89 -2.27 0.00 0.00 179.45 180.62 2kh2 n ARG 98 N -3.69 0.23 0.00 1.90 1.85 -1.26 -2.79 116.66 112.89 2kh2 n ARG 98 Ca -0.02 -0.03 0.05 0.00 -1.00 0.00 0.00 57.85 56.85 2kh2 n ARG 98 Cb 0.14 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.08 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 -1.36 0.00 -3.59 2.89 3.72 0.26 -1.58 117.46 117.81 2kh2 n PHE 99 Ca 0.10 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.13 2kh2 n PHE 99 Cb 0.30 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.75 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 -0.98 5.32 0.07 -4.37 1.01 -0.98 -4.10 120.40 116.38 2kh2 s VAL 100 Ca 0.11 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.49 2kh2 s VAL 100 Cb 0.08 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2kh2 s VAL 100 CO 0.16 0.32 -0.16 -0.36 0.00 0.00 0.00 175.10 175.06 2kh2 s PHE 101 N 1.10 2.61 -0.49 5.22 0.08 0.38 -2.08 117.98 124.80 2kh2 s PHE 101 Ca 0.11 -0.22 -0.15 0.00 0.12 0.00 0.00 56.93 56.78 2kh2 s PHE 101 Cb -0.14 -1.44 0.09 0.00 -0.57 0.00 0.00 43.02 40.96 2kh2 s PHE 101 CO 0.05 0.32 0.42 1.21 -0.10 0.00 0.00 175.22 177.13 2kh2 s ASN 102 N -1.74 6.14 -0.55 1.36 3.04 0.21 -0.59 114.94 122.81 2kh2 s ASN 102 Ca 0.17 -1.46 -0.27 0.00 0.04 0.00 0.00 52.86 51.33 2kh2 s ASN 102 Cb -0.11 -2.18 -0.00 0.00 -1.54 0.00 0.00 41.25 37.42 2kh2 s ASN 102 CO 0.08 -0.70 1.60 -0.75 -3.04 0.00 0.00 177.10 174.29 2kh2 s LYS 103 N 1.62 3.09 0.00 0.43 2.20 0.66 -1.53 119.74 126.22 2kh2 s LYS 103 Ca 0.04 0.61 -0.24 0.00 -0.36 0.00 0.00 55.97 56.02 2kh2 s LYS 103 Cb -0.26 -4.22 -0.05 0.00 -1.51 0.00 0.00 37.83 31.79 2kh2 s LYS 103 CO 0.05 -2.19 0.73 0.42 -0.36 0.00 0.00 175.35 174.00 2kh2 s ILE 104 N 7.12 4.86 -0.21 5.43 1.01 0.13 -1.18 121.20 138.37 2kh2 s ILE 104 Ca 0.60 1.53 -0.05 0.00 0.00 0.00 0.00 60.65 62.73 2kh2 s ILE 104 Cb -0.13 -4.07 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 2kh2 s ILE 104 CO 0.24 0.33 -0.02 -1.61 0.00 0.00 0.00 174.94 173.89 2kh2 s GLU 105 N 0.22 3.54 0.00 2.79 2.02 -0.17 -0.56 118.70 126.53 2kh2 s GLU 105 Ca 0.37 -0.56 0.00 0.00 0.02 0.00 0.00 54.97 54.81 2kh2 s GLU 105 Cb -0.19 -3.05 0.00 0.00 0.10 0.00 0.00 34.13 30.99 2kh2 s GLU 105 CO 0.21 -0.05 0.00 -0.89 0.02 0.00 0.00 175.26 174.55 2kh2 n ILE 106 N 4.41 0.00 -0.78 -1.63 5.41 -0.59 -4.91 119.36 121.27 2kh2 n ILE 106 Ca -0.17 0.00 0.04 0.00 1.00 0.00 0.00 62.75 63.61 2kh2 n ILE 106 Cb 0.52 -0.45 0.36 0.00 -0.71 0.00 0.00 39.64 39.35 2kh2 n ILE 106 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2kh2 n ASN 107 N 0.00 5.24 0.12 4.38 6.94 -1.26 -4.68 115.26 125.99 2kh2 n ASN 107 Ca 0.00 -2.92 0.00 0.00 -0.02 0.00 0.00 54.58 51.64 2kh2 n ASN 107 Cb 0.00 -0.69 0.00 0.00 -2.36 0.00 0.00 39.78 36.73 2kh2 n ASN 107 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2kh2 n ASN 108 N 0.43 -2.08 -4.88 0.53 2.85 -1.26 -5.16 115.26 105.69 2kh2 n ASN 108 Ca 0.28 0.68 -0.26 0.00 -0.11 0.00 0.00 54.58 55.17 2kh2 n ASN 108 Cb 1.17 2.17 -0.02 0.00 1.24 0.00 0.00 39.78 44.34 2kh2 n ASN 108 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 2kh2 s LYS 109 N -2.00 2.26 0.13 1.20 0.00 -1.26 -4.98 119.74 115.09 2kh2 s LYS 109 Ca 0.00 -2.02 0.08 0.00 0.00 0.00 0.00 55.97 54.03 2kh2 s LYS 109 Cb 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 37.83 35.73 2kh2 s LYS 109 CO 0.00 -0.55 -0.19 -0.51 0.00 0.00 0.00 175.35 174.10 2kh2 s LEU 110 N -4.22 2.37 0.21 2.77 1.43 -0.16 -1.54 118.68 119.54 2kh2 s LEU 110 Ca 0.33 -0.78 0.11 0.00 -1.03 0.00 0.00 54.13 52.76 2kh2 s LEU 110 Cb -0.02 -0.84 -0.05 0.00 0.03 0.00 0.00 46.19 45.31 2kh2 s LEU 110 CO 0.20 0.00 -0.22 -1.61 0.23 0.00 0.00 176.35 174.95 2kh2 s GLU 111 N -2.38 1.54 -0.27 1.70 2.02 0.27 0.14 118.70 121.71 2kh2 s GLU 111 Ca 0.11 -1.58 0.03 0.00 0.02 0.00 0.00 54.97 53.55 2kh2 s GLU 111 Cb -0.08 -1.77 0.07 0.00 0.10 0.00 0.00 34.13 32.45 2kh2 s GLU 111 CO 0.05 0.37 -0.07 -0.06 0.02 0.00 0.00 175.26 175.58 2kh2 s PHE 112 N -1.93 3.25 0.05 1.61 0.08 -1.26 0.22 117.98 120.00 2kh2 s PHE 112 Ca 0.23 -2.40 -0.06 0.00 0.12 0.00 0.00 56.93 54.82 2kh2 s PHE 112 Cb -0.07 -2.10 -0.05 0.00 -0.57 0.00 0.00 43.02 40.23 2kh2 s PHE 112 CO 0.11 -0.88 0.31 -2.00 -0.10 0.00 0.00 175.22 172.66 2kh2 s GLU 113 N 1.10 3.61 -0.06 0.44 2.12 -0.58 -1.72 118.70 123.62 2kh2 s GLU 113 Ca -0.04 -0.06 -0.24 0.00 0.36 0.00 0.00 54.97 54.99 2kh2 s GLU 113 Cb -0.20 -3.01 -0.04 0.00 0.26 0.00 0.00 34.13 31.15 2kh2 s GLU 113 CO -0.06 0.59 0.72 0.45 -0.54 0.00 0.00 175.26 176.42 2kh2 s SER 114 N -1.93 7.03 0.19 -1.70 0.15 -0.27 0.64 113.70 117.81 2kh2 s SER 114 Ca 0.32 1.23 -0.02 0.00 0.70 0.00 0.00 55.95 58.18 2kh2 s SER 114 Cb -0.13 -2.43 0.10 0.00 -1.71 0.00 0.00 66.02 61.85 2kh2 s SER 114 CO 0.19 -0.12 1.48 0.00 1.20 0.00 0.00 173.24 175.99 2kh2 h ALA 115 N 6.70 0.66 -0.52 5.45 0.00 -1.62 -3.05 119.26 126.89 2kh2 h ALA 115 Ca -0.41 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 53.89 2kh2 h ALA 115 Cb 1.20 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2kh2 h ALA 115 CO 0.75 0.71 0.09 0.37 0.00 0.00 0.00 179.25 181.17 2kh2 h GLN 116 N 0.36 0.85 -3.51 0.00 5.75 -1.72 -3.38 115.11 113.45 2kh2 h GLN 116 Ca -0.01 -0.23 -0.61 0.00 -0.15 0.00 0.00 58.65 57.65 2kh2 h GLN 116 Cb 1.18 -0.10 -0.40 0.00 1.07 0.00 0.00 27.48 29.23 2kh2 h GLN 116 CO 0.11 0.84 -0.73 -0.06 -2.65 0.00 0.00 178.83 176.34 2kh2 s PHE 117 N -5.20 2.37 0.65 3.99 0.08 -1.18 -5.05 117.98 113.63 2kh2 s PHE 117 Ca -0.13 -2.42 -0.18 0.00 0.12 0.00 0.00 56.93 54.33 2kh2 s PHE 117 Cb 0.12 -2.14 -0.01 0.00 -0.57 0.00 0.00 43.02 40.42 2kh2 s PHE 117 CO 0.81 -0.84 1.24 -2.14 -0.10 0.00 0.00 175.22 174.19 2kh2 s PRO 118 N 0.75 2.61 0.00 0.24 0.02 -1.16 -2.63 135.00 134.84 2kh2 s PRO 118 Ca 0.14 1.91 0.00 0.00 0.02 0.00 0.00 61.00 63.07 2kh2 s PRO 118 Cb -0.22 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.43 2kh2 s PRO 118 CO -0.09 -1.51 0.00 0.09 -0.33 0.00 0.00 177.00 175.17 2kh2 n ASN 119 N -1.98 0.00 -4.37 2.53 5.03 -1.26 -4.99 115.26 110.23 2kh2 n ASN 119 Ca 0.14 0.00 -0.35 0.00 0.87 0.00 0.00 54.58 55.25 2kh2 n ASN 119 Cb 0.49 -0.28 -0.13 0.00 -1.02 0.00 0.00 39.78 38.84 2kh2 n ASN 119 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 2kh2 s TRP 120 N -3.49 2.98 0.20 3.10 0.52 -1.08 -4.45 118.94 116.72 2kh2 s TRP 120 Ca 0.00 -0.73 0.11 0.00 0.02 0.00 0.00 56.10 55.50 2kh2 s TRP 120 Cb 0.00 -2.08 -0.04 0.00 -1.15 0.00 0.00 33.47 30.19 2kh2 s TRP 120 CO 0.00 -0.41 -0.22 0.71 0.02 0.00 0.00 176.95 177.05 2kh2 s TYR 121 N 1.24 2.18 0.02 -1.98 1.51 0.66 -1.12 117.35 119.87 2kh2 s TYR 121 Ca 0.03 -0.38 -0.30 0.00 -1.01 0.00 0.00 57.07 55.41 2kh2 s TYR 121 Cb -0.14 -1.06 -0.07 0.00 -0.11 0.00 0.00 41.96 40.58 2kh2 s TYR 121 CO -0.01 0.50 1.58 0.42 -1.11 0.00 0.00 175.55 176.93 2kh2 s ILE 122 N -1.92 3.35 0.15 2.71 1.01 -0.70 -0.11 121.20 125.69 2kh2 s ILE 122 Ca 0.21 0.72 0.07 0.00 0.00 0.00 0.00 60.65 61.65 2kh2 s ILE 122 Cb -0.07 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 2kh2 s ILE 122 CO 0.10 -0.01 -0.16 -0.44 0.00 0.00 0.00 174.94 174.42 2kh2 s SER 123 N 2.43 2.37 0.05 3.58 0.01 0.43 -4.36 113.70 118.19 2kh2 s SER 123 Ca 0.71 -0.85 0.04 0.00 1.31 0.00 0.00 55.95 57.16 2kh2 s SER 123 Cb -0.36 -0.12 -0.02 0.00 0.21 0.00 0.00 66.02 65.73 2kh2 s SER 123 CO 0.30 -0.09 -0.12 0.42 0.41 0.00 0.00 173.24 174.16 2kh2 s THR 124 N -2.13 0.93 0.61 1.44 -4.23 -0.60 -2.53 115.64 109.14 2kh2 s THR 124 Ca 0.13 -1.05 -0.05 0.00 -1.18 0.00 0.00 61.69 59.54 2kh2 s THR 124 Cb -0.05 -0.89 0.03 0.00 1.34 0.00 0.00 72.50 72.93 2kh2 s THR 124 CO 0.05 -0.14 0.91 -0.44 -0.54 0.00 0.00 174.62 174.46 2kh2 s SER 125 N -1.33 5.35 0.30 3.99 0.01 -1.26 0.40 113.70 121.17 2kh2 s SER 125 Ca -0.02 0.56 0.15 0.00 1.31 0.00 0.00 55.95 57.95 2kh2 s SER 125 Cb -0.08 -1.46 0.40 0.00 0.21 0.00 0.00 66.02 65.09 2kh2 s SER 125 CO 0.01 -1.21 1.61 1.56 0.41 0.00 0.00 173.24 175.62 2kh2 h GLN 126 N -0.25 0.00 -6.97 12.44 1.08 -1.96 -3.45 115.11 116.00 2kh2 h GLN 126 Ca -0.45 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.24 2kh2 h GLN 126 Cb 1.28 0.00 0.06 0.00 -0.05 0.00 0.00 27.48 28.77 2kh2 h GLN 126 CO 0.60 0.53 0.51 0.00 -0.95 0.00 0.00 178.83 179.51 2kh2 s ALA 127 N -3.41 3.08 0.45 3.87 0.00 -1.26 -5.01 121.76 119.47 2kh2 s ALA 127 Ca 0.00 0.99 -0.21 0.00 0.00 0.00 0.00 51.96 52.74 2kh2 s ALA 127 Cb 0.11 -3.40 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 2kh2 s ALA 127 CO 0.73 -0.63 0.97 -2.00 0.00 0.00 0.00 175.76 174.83 2kh2 s GLU 128 N -2.47 4.12 -0.81 0.00 2.56 -1.26 -3.85 118.70 116.98 2kh2 s GLU 128 Ca 0.60 1.17 0.00 0.00 0.00 0.00 0.00 54.97 56.74 2kh2 s GLU 128 Cb -0.31 -2.16 0.00 0.00 2.00 0.00 0.00 34.13 33.66 2kh2 s GLU 128 CO 0.38 -0.13 0.00 -1.71 -0.56 0.00 0.00 175.26 173.24 2kh2 n ASN 129 N -0.76 -3.32 -4.87 -1.70 5.15 -1.18 -5.02 115.26 103.56 2kh2 n ASN 129 Ca 0.08 0.04 -0.36 0.00 -0.60 0.00 0.00 54.58 53.74 2kh2 n ASN 129 Cb 0.54 -2.39 -0.06 0.00 -0.53 0.00 0.00 39.78 37.34 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 -4.08 3.61 0.94 1.20 -1.94 -1.22 -4.87 119.30 112.95 2kh2 s MET 130 Ca 0.00 0.02 -0.13 0.00 -1.71 0.00 0.00 55.69 53.87 2kh2 s MET 130 Cb 0.00 -3.15 0.16 0.00 2.01 0.00 0.00 34.83 33.85 2kh2 s MET 130 CO 0.00 0.70 1.14 -2.14 -0.01 0.00 0.00 175.02 174.71 2kh2 s PRO 131 N -1.36 0.89 -0.22 2.03 0.02 -1.26 -0.24 135.00 134.85 2kh2 s PRO 131 Ca 0.23 0.24 -0.11 0.00 0.02 0.00 0.00 61.00 61.37 2kh2 s PRO 131 Cb -0.14 -1.81 -0.05 0.00 0.02 0.00 0.00 34.50 32.52 2kh2 s PRO 131 CO 0.11 -2.36 0.19 0.08 -0.33 0.00 0.00 177.00 174.69 2kh2 s VAL 132 N -3.27 5.35 0.28 3.83 1.01 -1.03 -4.62 120.40 121.95 2kh2 s VAL 132 Ca 0.65 0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.95 2kh2 s VAL 132 Cb -0.14 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 2kh2 s VAL 132 CO 0.54 0.36 0.21 2.22 0.00 0.00 0.00 175.10 178.43 2kh2 n PHE 133 N 4.07 -0.54 -3.68 5.22 1.16 -1.05 -4.91 117.46 117.72 2kh2 n PHE 133 Ca -0.14 -2.26 -0.36 0.00 -1.87 0.00 0.00 57.45 52.82 2kh2 n PHE 133 Cb 0.52 0.20 -0.09 0.00 -1.61 0.00 0.00 39.48 38.50 2kh2 n PHE 133 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 2kh2 s LEU 134 N 0.00 4.12 0.07 5.98 2.96 -1.26 -0.43 118.68 130.11 2kh2 s LEU 134 Ca 0.30 0.13 0.10 0.00 -0.22 0.00 0.00 54.13 54.44 2kh2 s LEU 134 Cb 0.01 -2.10 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 2kh2 s LEU 134 CO 0.21 0.09 -0.26 -0.83 -1.32 0.00 0.00 176.35 174.24 2kh2 s GLY 135 N 0.92 1.48 -0.04 7.98 0.00 0.85 -4.86 107.32 113.65 2kh2 s GLY 135 Ca 0.07 -1.32 0.20 0.00 0.00 0.00 0.00 44.72 43.67 2kh2 s GLY 135 CO 0.03 -1.24 1.53 0.61 0.00 0.00 0.00 173.10 174.03 2kh2 n GLY 136 N 1.49 2.65 3.24 0.20 0.00 -1.26 -0.24 105.19 111.26 2kh2 n GLY 136 Ca -0.17 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.29 3.18 -0.24 2.61 -4.23 -1.26 -4.87 115.64 109.53 2kh2 s THR 137 Ca 0.46 -0.96 -0.12 0.00 -1.18 0.00 0.00 61.69 59.89 2kh2 s THR 137 Cb 0.26 -2.64 -0.05 0.00 1.34 0.00 0.00 72.50 71.42 2kh2 s THR 137 CO 0.28 0.14 0.22 -0.75 -0.54 0.00 0.00 174.62 173.97 2kh2 s LYS 138 N 1.37 4.06 -0.60 3.99 2.20 -1.26 -4.28 119.74 125.22 2kh2 s LYS 138 Ca 0.00 -0.18 -0.01 0.00 -0.36 0.00 0.00 55.97 55.42 2kh2 s LYS 138 Cb -0.17 -3.57 0.00 0.00 -1.51 0.00 0.00 37.83 32.58 2kh2 s LYS 138 CO -0.02 -0.03 0.07 0.41 -0.36 0.00 0.00 175.35 175.42 2kh2 n GLY 139 N 4.41 0.13 0.00 5.54 0.00 -1.26 -5.02 105.19 108.99 2kh2 n GLY 139 Ca -0.13 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.01 0.93 0.10 -0.02 0.00 -1.26 -5.01 105.19 98.92 2kh2 n GLY 140 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.13 -7.41 1.61 7.50 -1.95 -3.46 115.11 111.27 2kh2 h GLN 141 Ca 0.00 0.01 -0.48 0.00 0.50 0.00 0.00 58.65 58.68 2kh2 h GLN 141 Cb 0.00 0.03 0.12 0.00 0.05 0.00 0.00 27.48 27.68 2kh2 h GLN 141 CO 0.00 0.38 0.32 -0.51 -1.50 0.00 0.00 178.83 177.52 2kh2 s ASP 142 N -5.62 4.19 -0.20 1.46 1.01 -1.26 -4.50 116.67 111.74 2kh2 s ASP 142 Ca -0.14 1.28 -0.08 0.00 0.71 0.00 0.00 52.55 54.31 2kh2 s ASP 142 Cb 0.00 -1.98 -0.04 0.00 1.01 0.00 0.00 42.92 41.91 2kh2 s ASP 142 CO 0.55 -2.16 0.09 -0.63 0.21 0.00 0.00 175.17 173.23 2kh2 s ILE 143 N -3.14 4.92 -1.24 0.77 1.01 0.16 -4.55 121.20 119.14 2kh2 s ILE 143 Ca 0.62 0.02 0.13 0.00 0.00 0.00 0.00 60.65 61.41 2kh2 s ILE 143 Cb -0.15 -3.24 0.01 0.00 0.01 0.00 0.00 42.46 39.09 2kh2 s ILE 143 CO 0.54 0.42 0.76 0.35 0.00 0.00 0.00 174.94 177.02 2kh2 n THR 144 N 3.83 0.00 -4.11 2.92 -2.24 -1.26 -1.56 114.28 111.86 2kh2 n THR 144 Ca -0.16 -0.39 -0.34 0.00 -2.27 0.00 0.00 64.05 60.89 2kh2 n THR 144 Cb 0.52 1.17 -0.07 0.00 -2.10 0.00 0.00 70.33 69.85 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 -1.52 5.74 0.16 3.42 -4.77 -1.26 -4.02 116.67 114.42 2kh2 s ASP 145 Ca 0.11 0.20 -0.01 0.00 -3.30 0.00 0.00 52.55 49.56 2kh2 s ASP 145 Cb 0.10 -1.68 -0.04 0.00 -1.09 0.00 0.00 42.92 40.21 2kh2 s ASP 145 CO 0.30 0.31 0.07 -0.36 0.70 0.00 0.00 175.17 176.19 2kh2 s PHE 146 N -1.12 1.02 0.04 2.11 0.08 0.12 -3.98 117.98 116.25 2kh2 s PHE 146 Ca 0.20 -1.25 0.04 0.00 0.12 0.00 0.00 56.93 56.05 2kh2 s PHE 146 Cb -0.12 -0.55 -0.04 0.00 -0.57 0.00 0.00 43.02 41.75 2kh2 s PHE 146 CO 0.11 -0.51 -0.06 0.95 -0.10 0.00 0.00 175.22 175.61 2kh2 s THR 147 N -4.02 3.69 -0.27 0.64 -4.23 0.60 -0.99 115.64 111.05 2kh2 s THR 147 Ca 0.29 -0.92 -0.07 0.00 -1.18 0.00 0.00 61.69 59.81 2kh2 s THR 147 Cb 0.07 -2.66 -0.01 0.00 1.34 0.00 0.00 72.50 71.24 2kh2 s THR 147 CO 0.05 0.27 0.06 -0.32 -0.54 0.00 0.00 174.62 174.15 2kh2 s MET 148 N -1.78 3.31 -0.08 3.99 1.75 -1.26 -3.53 119.30 121.69 2kh2 s MET 148 Ca 0.20 -0.70 0.03 0.00 -1.25 0.00 0.00 55.69 53.97 2kh2 s MET 148 Cb -0.11 -3.31 0.01 0.00 2.84 0.00 0.00 34.83 34.25 2kh2 s MET 148 CO 0.11 -0.33 -0.17 -0.65 -0.65 0.00 0.00 175.02 173.33 2kh2 s GLN 149 N 1.54 2.25 -0.05 4.11 1.11 -1.16 -4.96 119.66 122.50 2kh2 s GLN 149 Ca 0.04 -0.60 -0.15 0.00 0.01 0.00 0.00 55.36 54.66 2kh2 s GLN 149 Cb -0.16 -1.78 -0.05 0.00 -1.01 0.00 0.00 33.01 30.01 2kh2 s GLN 149 CO 0.02 0.08 0.39 -0.06 0.01 0.00 0.00 175.29 175.74 2kh2 s PHE 150 N 0.56 3.65 0.04 0.91 0.08 -1.26 -0.86 117.98 121.10 2kh2 s PHE 150 Ca -0.16 0.91 0.00 0.00 0.12 0.00 0.00 56.93 57.80 2kh2 s PHE 150 Cb -0.17 -2.33 -0.00 0.00 -0.57 0.00 0.00 43.02 39.96 2kh2 s PHE 150 CO 0.05 0.51 0.00 1.33 -0.10 0.00 0.00 175.22 177.02 2kh2 n VAL 151 N 2.38 0.00 -2.88 -0.44 0.24 -1.21 -5.00 118.33 111.42 2kh2 n VAL 151 Ca -0.13 -0.20 -0.43 0.00 -2.04 0.00 0.00 64.34 61.54 2kh2 n VAL 151 Cb 0.52 0.04 0.01 0.00 -1.47 0.00 0.00 33.84 32.94 2kh2 n VAL 151 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2kh2 n SER 152 N -1.10 6.03 0.00 -1.34 7.64 -1.26 -4.94 113.62 118.65 2kh2 n SER 152 Ca -0.02 -3.31 0.00 0.00 1.01 0.00 0.00 58.87 56.56 2kh2 n SER 152 Cb 0.05 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 61.92 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83