#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 0.59 -4.84 0.00 0.13 -2.06 -3.40 132.00 122.43 2kh2 h PRO 2 Ca 0.00 -0.12 -0.65 0.00 -0.87 0.00 0.00 66.00 64.37 2kh2 h PRO 2 Cb 0.00 -0.09 -0.36 0.00 0.13 0.00 0.00 31.00 30.68 2kh2 h PRO 2 CO 0.00 0.58 -0.83 0.54 -0.23 0.00 0.00 178.00 178.06 2kh2 s VAL 3 N -5.47 1.91 0.30 1.56 0.11 -1.26 -5.02 120.40 112.53 2kh2 s VAL 3 Ca -0.13 -1.06 -0.27 0.00 -2.93 0.00 0.00 61.98 57.58 2kh2 s VAL 3 Cb 0.10 -1.86 -0.10 0.00 -1.53 0.00 0.00 36.38 32.99 2kh2 s VAL 3 CO 0.75 0.31 0.96 -0.13 -3.33 0.00 0.00 175.10 173.67 2kh2 s ARG 4 N 1.30 4.63 -0.09 1.54 0.52 -1.26 -4.90 118.95 120.68 2kh2 s ARG 4 Ca 0.00 1.43 -0.08 0.00 -0.52 0.00 0.00 55.73 56.56 2kh2 s ARG 4 Cb -0.15 -2.94 0.03 0.00 0.52 0.00 0.00 34.95 32.41 2kh2 s ARG 4 CO -0.10 0.30 0.24 -1.12 0.02 0.00 0.00 175.30 174.65 2kh2 s SER 5 N -1.44 -0.25 0.22 0.23 0.01 -1.26 -1.37 113.70 109.84 2kh2 s SER 5 Ca 0.48 0.49 0.05 0.00 1.31 0.00 0.00 55.95 58.28 2kh2 s SER 5 Cb -0.22 0.47 -0.05 0.00 0.21 0.00 0.00 66.02 66.43 2kh2 s SER 5 CO 0.28 -0.10 -0.06 -1.48 0.41 0.00 0.00 173.24 172.29 2kh2 s LEU 6 N 0.40 2.39 -0.02 2.44 0.05 -0.41 -4.95 118.68 118.57 2kh2 s LEU 6 Ca -0.02 -1.14 0.05 0.00 0.05 0.00 0.00 54.13 53.07 2kh2 s LEU 6 Cb -0.04 -0.45 -0.03 0.00 -2.05 0.00 0.00 46.19 43.63 2kh2 s LEU 6 CO -0.02 -0.38 -0.17 0.20 -0.55 0.00 0.00 176.35 175.43 2kh2 s ASN 7 N -3.32 3.82 0.20 1.48 0.01 -1.26 0.17 114.94 116.04 2kh2 s ASN 7 Ca 0.25 -0.30 -0.19 0.00 -0.71 0.00 0.00 52.86 51.92 2kh2 s ASN 7 Cb 0.04 -0.71 0.03 0.00 0.41 0.00 0.00 41.25 41.02 2kh2 s ASN 7 CO 0.08 0.32 0.55 0.00 -1.51 0.00 0.00 177.10 176.54 2kh2 s THR 9 N -3.86 3.43 -0.22 0.00 -4.23 -0.34 -1.25 115.64 109.17 2kh2 s THR 9 Ca 0.08 -0.53 -0.11 0.00 -1.18 0.00 0.00 61.69 59.95 2kh2 s THR 9 Cb -0.01 -2.46 -0.05 0.00 1.34 0.00 0.00 72.50 71.32 2kh2 s THR 9 CO -0.04 0.52 0.18 -0.76 -0.54 0.00 0.00 174.62 173.99 2kh2 s LEU 10 N 0.17 4.14 -0.01 4.79 1.43 -1.26 -1.91 118.68 126.04 2kh2 s LEU 10 Ca -0.05 0.19 0.03 0.00 -1.03 0.00 0.00 54.13 53.27 2kh2 s LEU 10 Cb -0.14 -2.15 -0.00 0.00 0.03 0.00 0.00 46.19 43.92 2kh2 s LEU 10 CO 0.04 0.08 -0.09 -0.13 0.23 0.00 0.00 176.35 176.48 2kh2 s ARG 11 N 0.90 0.80 0.65 1.70 0.52 -1.22 -4.11 118.95 118.20 2kh2 s ARG 11 Ca 0.09 -0.31 -0.11 0.00 -0.52 0.00 0.00 55.73 54.88 2kh2 s ARG 11 Cb -0.13 -0.77 0.15 0.00 0.52 0.00 0.00 34.95 34.72 2kh2 s ARG 11 CO 0.03 0.16 0.81 -0.40 0.02 0.00 0.00 175.30 175.93 2kh2 n ASP 12 N 3.02 -0.28 0.01 0.23 5.68 -1.19 0.27 116.55 124.29 2kh2 n ASP 12 Ca -0.15 -1.23 0.03 0.00 -0.50 0.00 0.00 54.79 52.94 2kh2 n ASP 12 Cb 0.56 -0.64 0.13 0.00 -1.14 0.00 0.00 41.12 40.02 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 -3.67 0.04 -0.96 -1.12 7.64 -1.23 -0.45 113.62 113.87 2kh2 n SER 13 Ca 0.10 0.52 0.10 0.00 1.01 0.00 0.00 58.87 60.60 2kh2 n SER 13 Cb 0.37 -0.52 0.16 0.00 -1.01 0.00 0.00 64.21 63.20 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 -1.56 2.21 -1.89 1.43 1.13 -1.26 -4.94 117.38 112.50 2kh2 n GLN 14 Ca 0.01 -2.03 -0.15 0.00 -1.94 0.00 0.00 57.00 52.88 2kh2 n GLN 14 Cb 0.05 -1.43 -0.03 0.00 0.11 0.00 0.00 30.24 28.93 2kh2 n GLN 14 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2kh2 n GLN 15 N 1.24 -1.13 -2.16 -1.09 1.13 0.40 -4.94 117.38 110.82 2kh2 n GLN 15 Ca 0.16 0.87 -0.32 0.00 -1.94 0.00 0.00 57.00 55.76 2kh2 n GLN 15 Cb 0.54 -5.12 -0.00 0.00 0.11 0.00 0.00 30.24 25.77 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 -4.07 3.53 0.12 -1.09 1.02 -1.26 -4.35 119.74 113.64 2kh2 s LYS 16 Ca 0.00 1.12 0.09 0.00 0.02 0.00 0.00 55.97 57.20 2kh2 s LYS 16 Cb 0.00 -2.07 -0.04 0.00 -0.52 0.00 0.00 37.83 35.20 2kh2 s LYS 16 CO 0.00 -0.63 -0.20 -1.12 -0.92 0.00 0.00 175.35 172.49 2kh2 s SER 17 N -2.90 3.77 -0.15 2.83 0.01 0.91 -3.18 113.70 114.99 2kh2 s SER 17 Ca 0.62 -0.59 -0.20 0.00 1.31 0.00 0.00 55.95 57.08 2kh2 s SER 17 Cb -0.14 -0.48 -0.03 0.00 0.21 0.00 0.00 66.02 65.58 2kh2 s SER 17 CO 0.35 0.18 0.58 -0.76 0.41 0.00 0.00 173.24 174.01 2kh2 s LEU 18 N -2.10 4.22 0.10 2.44 1.43 -1.26 -1.81 118.68 121.69 2kh2 s LEU 18 Ca 0.17 0.88 0.08 0.00 -1.03 0.00 0.00 54.13 54.22 2kh2 s LEU 18 Cb -0.10 -2.85 -0.03 0.00 0.03 0.00 0.00 46.19 43.23 2kh2 s LEU 18 CO 0.09 -0.15 -0.20 0.68 0.23 0.00 0.00 176.35 177.01 2kh2 s VAL 19 N 1.27 1.62 -0.48 -1.59 -7.23 0.59 -1.75 120.40 112.84 2kh2 s VAL 19 Ca 0.29 -1.52 -0.28 0.00 -1.81 0.00 0.00 61.98 58.65 2kh2 s VAL 19 Cb -0.16 -1.49 0.02 0.00 0.56 0.00 0.00 36.38 35.31 2kh2 s VAL 19 CO 0.12 -0.10 1.35 -0.04 -0.31 0.00 0.00 175.10 176.12 2kh2 s MET 20 N -1.93 3.51 0.00 4.82 -1.94 -1.26 -0.40 119.30 122.10 2kh2 s MET 20 Ca 0.05 0.68 0.00 0.00 -1.71 0.00 0.00 55.69 54.71 2kh2 s MET 20 Cb -0.10 -4.04 0.00 0.00 2.01 0.00 0.00 34.83 32.71 2kh2 s MET 20 CO 0.04 -1.66 0.10 0.45 -0.01 0.00 0.00 175.02 173.94 2kh2 n SER 21 N 8.87 0.00 -1.60 3.03 2.88 0.79 -4.92 113.62 122.67 2kh2 n SER 21 Ca 0.14 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 2kh2 n SER 21 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2kh2 n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kh2 n GLY 22 N 1.81 1.79 0.26 0.46 0.00 -1.19 -4.92 105.19 103.41 2kh2 n GLY 22 Ca 0.00 -2.09 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 -2.55 0.00 0.00 0.00 173.32 170.77 2kh2 h PRO 23 N 0.00 0.13 -0.30 1.61 0.11 -2.03 -3.11 132.00 128.41 2kh2 h PRO 23 Ca 0.00 -0.01 -0.24 0.00 0.11 0.00 0.00 66.00 65.86 2kh2 h PRO 23 Cb 0.00 -0.03 -0.36 0.00 0.11 0.00 0.00 31.00 30.72 2kh2 h PRO 23 CO 0.00 0.12 -0.99 0.66 -0.21 0.00 0.00 178.00 177.58 2kh2 n TYR 24 N -4.48 0.97 -4.26 0.65 4.01 -1.26 -5.04 117.16 107.74 2kh2 n TYR 24 Ca -0.01 -1.59 -0.17 0.00 -0.16 0.00 0.00 57.90 55.96 2kh2 n TYR 24 Cb 0.11 -0.22 -0.14 0.00 -0.31 0.00 0.00 39.34 38.78 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 -2.56 0.68 -0.00 -0.72 2.12 -1.18 -3.95 118.70 113.09 2kh2 s GLU 25 Ca 0.34 -0.50 0.08 0.00 0.36 0.00 0.00 54.97 55.25 2kh2 s GLU 25 Cb 0.36 -0.63 -0.02 0.00 0.26 0.00 0.00 34.13 34.10 2kh2 s GLU 25 CO -0.07 0.16 -0.25 -0.51 -0.54 0.00 0.00 175.26 174.05 2kh2 s LEU 26 N -0.72 2.08 0.09 2.70 1.43 -1.26 -0.15 118.68 122.86 2kh2 s LEU 26 Ca -0.00 -0.48 0.08 0.00 -1.03 0.00 0.00 54.13 52.70 2kh2 s LEU 26 Cb -0.06 -1.25 -0.03 0.00 0.03 0.00 0.00 46.19 44.88 2kh2 s LEU 26 CO 0.00 0.28 -0.20 -0.54 0.23 0.00 0.00 176.35 176.12 2kh2 s LYS 27 N -0.76 1.13 -0.14 1.70 1.02 0.46 -1.37 119.74 121.78 2kh2 s LYS 27 Ca 0.10 -1.11 0.01 0.00 0.02 0.00 0.00 55.97 54.98 2kh2 s LYS 27 Cb -0.10 -1.35 -0.00 0.00 -0.52 0.00 0.00 37.83 35.86 2kh2 s LYS 27 CO -0.00 0.32 -0.17 0.00 -0.92 0.00 0.00 175.35 174.58 2kh2 s ALA 28 N -1.12 2.43 0.07 5.17 0.00 0.89 -0.30 121.76 128.90 2kh2 s ALA 28 Ca 0.06 -1.03 -0.19 0.00 0.00 0.00 0.00 51.96 50.80 2kh2 s ALA 28 Cb -0.10 -1.13 0.04 0.00 0.00 0.00 0.00 23.12 21.93 2kh2 s ALA 28 CO 0.04 0.04 0.45 -0.48 0.00 0.00 0.00 175.76 175.81 2kh2 s LEU 29 N 0.70 0.21 0.10 0.00 0.05 -0.75 -2.92 118.68 116.08 2kh2 s LEU 29 Ca -0.08 -0.03 -0.31 0.00 0.05 0.00 0.00 54.13 53.76 2kh2 s LEU 29 Cb -0.16 1.92 -0.09 0.00 -2.05 0.00 0.00 46.19 45.81 2kh2 s LEU 29 CO 0.01 -0.74 1.66 -1.00 -0.55 0.00 0.00 176.35 175.73 2kh2 s HIS 30 N -2.86 2.55 -0.19 3.48 3.76 -1.26 -0.06 115.29 120.70 2kh2 s HIS 30 Ca -0.03 0.35 -0.04 0.00 -0.15 0.00 0.00 55.06 55.19 2kh2 s HIS 30 Cb -0.00 -3.99 -0.02 0.00 1.11 0.00 0.00 32.58 29.69 2kh2 s HIS 30 CO -0.05 -3.90 -0.04 -1.17 -0.85 0.00 0.00 174.74 168.72 2kh2 s LEU 31 N 2.27 3.00 0.00 0.89 2.96 -1.26 -4.89 118.68 121.65 2kh2 s LEU 31 Ca 0.74 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 54.36 2kh2 s LEU 31 Cb -0.42 -1.75 -0.00 0.00 0.50 0.00 0.00 46.19 44.52 2kh2 s LEU 31 CO 0.33 0.06 0.07 0.00 -1.32 0.00 0.00 176.35 175.48 2kh2 n GLN 32 N 4.29 0.10 0.00 1.98 6.02 -1.26 -4.93 117.38 123.58 2kh2 n GLN 32 Ca -0.18 -0.71 0.00 0.00 -0.01 0.00 0.00 57.00 56.10 2kh2 n GLN 32 Cb 0.52 0.60 0.00 0.00 1.02 0.00 0.00 30.24 32.38 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 -0.14 3.59 1.42 1.08 0.00 -1.26 -2.40 105.19 107.48 2kh2 n GLY 33 Ca 0.01 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 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 13.90 2.58 -0.24 1.61 -0.06 -1.26 -4.55 117.38 129.35 2kh2 n GLN 34 Ca 0.00 -3.66 0.11 0.00 -2.00 0.00 0.00 57.00 51.44 2kh2 n GLN 34 Cb 0.00 -1.98 0.23 0.00 -4.06 0.00 0.00 30.24 24.43 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 -0.93 3.49 -0.10 1.69 10.43 -1.01 -4.50 116.55 125.62 2kh2 n ASP 35 Ca 0.35 -1.97 0.04 0.00 2.57 0.00 0.00 54.79 55.78 2kh2 n ASP 35 Cb 0.87 -0.32 0.36 0.00 1.84 0.00 0.00 41.12 43.88 2kh2 n ASP 35 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 2kh2 h MET 36 N 3.97 0.70 0.00 -1.24 2.86 -1.80 -0.80 114.93 118.62 2kh2 h MET 36 Ca 0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2kh2 h MET 36 Cb 0.93 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.43 2kh2 h MET 36 CO 0.00 0.46 0.00 -0.85 1.06 0.00 0.00 176.91 177.58 2kh2 n GLU 37 N -4.46 0.70 0.00 1.72 0.00 -1.26 -2.81 120.64 114.53 2kh2 n GLU 37 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.33 2kh2 n GLU 37 Cb 0.09 -1.42 0.12 0.00 0.00 0.00 0.00 31.44 30.22 2kh2 n GLU 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2kh2 n GLN 38 N -0.92 0.43 -1.60 3.44 6.02 -0.30 -4.96 117.38 119.49 2kh2 n GLN 38 Ca 0.14 -0.32 -0.30 0.00 -0.01 0.00 0.00 57.00 56.52 2kh2 n GLN 38 Cb 0.07 -1.49 0.09 0.00 1.02 0.00 0.00 30.24 29.92 2kh2 n GLN 38 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2kh2 s GLN 39 N -2.78 2.03 -0.12 -1.09 -2.07 -1.12 -4.80 119.66 109.71 2kh2 s GLN 39 Ca 0.15 0.56 -0.08 0.00 -1.82 0.00 0.00 55.36 54.16 2kh2 s GLN 39 Cb 0.18 -1.92 -0.04 0.00 -1.09 0.00 0.00 33.01 30.13 2kh2 s GLN 39 CO 0.68 -1.64 0.17 0.08 -1.32 0.00 0.00 175.29 173.27 2kh2 s VAL 40 N -3.21 5.44 -0.16 3.63 1.01 -0.71 -5.02 120.40 121.38 2kh2 s VAL 40 Ca 0.61 0.28 -0.07 0.00 0.00 0.00 0.00 61.98 62.81 2kh2 s VAL 40 Cb -0.14 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2kh2 s VAL 40 CO 0.54 0.58 0.07 -0.69 0.00 0.00 0.00 175.10 175.60 2kh2 s VAL 41 N -0.78 4.90 -0.01 2.92 1.01 -1.26 -4.68 120.40 122.51 2kh2 s VAL 41 Ca 0.15 -0.00 -0.00 0.00 0.00 0.00 0.00 61.98 62.12 2kh2 s VAL 41 Cb -0.12 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 2kh2 s VAL 41 CO 0.04 0.51 0.07 -0.36 0.00 0.00 0.00 175.10 175.36 2kh2 s PHE 42 N -0.06 3.25 -0.24 5.22 0.40 -0.38 -1.59 117.98 124.59 2kh2 s PHE 42 Ca 0.07 0.19 -0.10 0.00 -0.60 0.00 0.00 56.93 56.49 2kh2 s PHE 42 Cb -0.12 -1.73 -0.05 0.00 0.51 0.00 0.00 43.02 41.63 2kh2 s PHE 42 CO 0.01 0.54 0.14 -1.12 0.70 0.00 0.00 175.22 175.49 2kh2 s SER 43 N -1.69 5.99 -0.38 1.36 0.01 0.70 -1.44 113.70 118.24 2kh2 s SER 43 Ca 0.22 0.08 -0.11 0.00 1.31 0.00 0.00 55.95 57.45 2kh2 s SER 43 Cb -0.12 -2.08 0.04 0.00 0.21 0.00 0.00 66.02 64.07 2kh2 s SER 43 CO 0.13 0.07 0.22 -0.04 0.41 0.00 0.00 173.24 174.02 2kh2 s MET 44 N 1.05 2.78 -0.08 12.44 -1.94 0.13 -2.52 119.30 131.16 2kh2 s MET 44 Ca 0.07 -1.15 -0.05 0.00 -1.71 0.00 0.00 55.69 52.85 2kh2 s MET 44 Cb -0.14 -3.74 -0.04 0.00 2.01 0.00 0.00 34.83 32.92 2kh2 s MET 44 CO 0.04 -0.75 0.13 -1.12 -0.01 0.00 0.00 175.02 173.31 2kh2 s SER 45 N 1.65 6.16 -0.75 3.03 0.01 -1.12 -1.29 113.70 121.39 2kh2 s SER 45 Ca 0.02 0.36 -0.24 0.00 1.31 0.00 0.00 55.95 57.41 2kh2 s SER 45 Cb -0.20 -1.93 0.06 0.00 0.21 0.00 0.00 66.02 64.17 2kh2 s SER 45 CO 0.06 0.36 1.13 -0.36 0.41 0.00 0.00 173.24 174.83 2kh2 s PHE 46 N -1.10 2.58 0.94 2.43 0.08 -0.47 -0.93 117.98 121.51 2kh2 s PHE 46 Ca 0.18 -0.50 -0.14 0.00 0.12 0.00 0.00 56.93 56.59 2kh2 s PHE 46 Cb -0.12 -4.44 0.16 0.00 -0.57 0.00 0.00 43.02 38.05 2kh2 s PHE 46 CO 0.08 -1.80 1.21 0.14 -0.10 0.00 0.00 175.22 174.75 2kh2 s VAL 47 N 4.56 1.95 -0.95 -0.44 -7.23 -1.16 -4.67 120.40 112.46 2kh2 s VAL 47 Ca 0.30 0.00 -0.13 0.00 -1.81 0.00 0.00 61.98 60.34 2kh2 s VAL 47 Cb -0.11 -2.87 0.23 0.00 0.56 0.00 0.00 36.38 34.19 2kh2 s VAL 47 CO 0.08 0.00 0.94 -1.58 -0.31 0.00 0.00 175.10 174.23 2kh2 s GLN 48 N -5.58 3.84 0.00 4.82 2.00 -0.09 -4.88 119.66 119.76 2kh2 s GLN 48 Ca 0.68 -2.70 0.00 0.00 -2.00 0.00 0.00 55.36 51.33 2kh2 s GLN 48 Cb -0.09 -4.53 0.00 0.00 0.80 0.00 0.00 33.01 29.19 2kh2 s GLN 48 CO 0.52 -1.32 0.00 0.41 -0.50 0.00 0.00 175.29 174.41 2kh2 n GLY 49 N 3.60 5.40 3.56 2.59 0.00 -1.26 -4.88 105.19 114.20 2kh2 n GLY 49 Ca 0.19 -1.24 -0.41 0.00 0.00 0.00 0.00 46.02 44.57 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 1.77 3.41 -0.74 1.61 2.56 -1.26 -4.94 118.70 121.11 2kh2 s GLU 50 Ca 0.00 -0.75 -0.15 0.00 0.00 0.00 0.00 54.97 54.06 2kh2 s GLU 50 Cb 0.00 -4.90 0.18 0.00 2.00 0.00 0.00 34.13 31.41 2kh2 s GLU 50 CO 0.00 -2.21 0.73 -2.00 -0.56 0.00 0.00 175.26 171.21 2kh2 s GLU 51 N 5.33 3.39 0.00 4.30 2.12 -1.26 -4.17 118.70 128.40 2kh2 s GLU 51 Ca 0.43 -2.08 0.00 0.00 0.36 0.00 0.00 54.97 53.67 2kh2 s GLU 51 Cb -0.03 -4.43 0.00 0.00 0.26 0.00 0.00 34.13 29.93 2kh2 s GLU 51 CO -0.00 -1.37 0.00 -1.13 -0.54 0.00 0.00 175.26 172.22 2kh2 n SER 52 N 4.79 0.00 0.00 -1.70 3.41 -0.68 -5.01 113.62 114.44 2kh2 n SER 52 Ca 0.05 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.77 2kh2 n SER 52 Cb 0.45 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.26 2kh2 n SER 52 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2kh2 n ASN 53 N 0.00 0.33 -0.00 4.04 4.13 -1.26 -4.60 115.26 117.90 2kh2 n ASN 53 Ca 0.00 -0.25 -0.00 0.00 1.68 0.00 0.00 54.58 56.01 2kh2 n ASN 53 Cb 0.00 1.59 -0.00 0.00 -1.54 0.00 0.00 39.78 39.83 2kh2 n ASN 53 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2kh2 n ASP 54 N -2.07 4.30 -4.49 6.41 5.75 -1.26 -4.97 116.55 120.22 2kh2 n ASP 54 Ca -0.01 -0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.34 2kh2 n ASP 54 Cb 0.50 0.15 -0.09 0.00 -1.03 0.00 0.00 41.12 40.65 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 -2.00 3.19 -0.27 0.11 1.02 -1.26 -2.39 119.74 118.14 2kh2 s LYS 55 Ca -0.00 -0.76 -0.07 0.00 0.02 0.00 0.00 55.97 55.16 2kh2 s LYS 55 Cb 0.00 -3.92 -0.01 0.00 -0.52 0.00 0.00 37.83 33.38 2kh2 s LYS 55 CO 0.00 -0.71 0.06 0.42 -0.92 0.00 0.00 175.35 174.20 2kh2 s ILE 56 N 1.92 4.06 -0.30 2.17 -1.09 -0.03 -1.69 121.20 126.26 2kh2 s ILE 56 Ca 0.09 -0.44 -0.29 0.00 -2.23 0.00 0.00 60.65 57.78 2kh2 s ILE 56 Cb -0.18 -2.99 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2kh2 s ILE 56 CO 0.12 0.23 1.25 -2.16 -1.23 0.00 0.00 174.94 173.14 2kh2 s PRO 57 N 1.55 3.97 0.12 2.79 0.04 -1.26 -0.34 135.00 141.88 2kh2 s PRO 57 Ca 0.05 1.23 0.01 0.00 0.04 0.00 0.00 61.00 62.33 2kh2 s PRO 57 Cb -0.16 -3.84 -0.04 0.00 0.04 0.00 0.00 34.50 30.50 2kh2 s PRO 57 CO 0.02 -1.04 -0.01 0.14 0.04 0.00 0.00 177.00 176.15 2kh2 s VAL 58 N 4.15 0.51 0.03 -0.36 -7.23 0.10 -2.96 120.40 114.63 2kh2 s VAL 58 Ca 0.54 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.77 2kh2 s VAL 58 Cb -0.16 -1.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.85 2kh2 s VAL 58 CO 0.21 -0.67 0.18 0.00 -0.31 0.00 0.00 175.10 174.51 2kh2 s ALA 59 N -3.76 3.92 -0.31 1.32 0.00 -0.10 -0.73 121.76 122.10 2kh2 s ALA 59 Ca 0.18 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.34 2kh2 s ALA 59 Cb 0.06 -1.80 0.09 0.00 0.00 0.00 0.00 23.12 21.47 2kh2 s ALA 59 CO -0.01 0.78 0.02 -0.51 0.00 0.00 0.00 175.76 176.04 2kh2 s LEU 60 N -2.22 3.92 0.26 0.00 1.43 -1.26 -2.79 118.68 118.02 2kh2 s LEU 60 Ca 0.31 -1.85 0.09 0.00 -1.03 0.00 0.00 54.13 51.65 2kh2 s LEU 60 Cb -0.13 -1.45 -0.05 0.00 0.03 0.00 0.00 46.19 44.59 2kh2 s LEU 60 CO 0.23 -0.34 -0.13 -0.83 0.23 0.00 0.00 176.35 175.51 2kh2 s GLY 61 N 1.10 1.73 0.11 -3.19 0.00 -1.05 -1.46 107.32 104.56 2kh2 s GLY 61 Ca 0.06 -1.83 -0.30 0.00 0.00 0.00 0.00 44.72 42.65 2kh2 s GLY 61 CO -0.10 -1.86 0.96 1.08 0.00 0.00 0.00 173.10 173.18 2kh2 s LEU 62 N -3.43 4.50 0.12 0.66 1.02 0.04 -0.21 118.68 121.37 2kh2 s LEU 62 Ca 0.27 1.79 -0.34 0.00 0.02 0.00 0.00 54.13 55.88 2kh2 s LEU 62 Cb -0.00 -3.59 -0.14 0.00 0.02 0.00 0.00 46.19 42.48 2kh2 s LEU 62 CO 0.11 -0.07 1.61 1.17 0.02 0.00 0.00 176.35 179.20 2kh2 n LYS 63 N 2.78 2.12 -1.32 1.70 4.81 -0.62 -1.50 118.16 126.13 2kh2 n LYS 63 Ca 0.02 0.77 -0.12 0.00 -0.87 0.00 0.00 58.31 58.11 2kh2 n LYS 63 Cb 0.49 -2.54 -0.05 0.00 0.02 0.00 0.00 35.03 32.95 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 3.84 -1.67 -4.32 1.64 0.00 -1.26 -4.96 120.64 113.91 2kh2 n GLU 64 Ca 0.18 0.89 -0.20 0.00 0.00 0.00 0.00 57.16 58.03 2kh2 n GLU 64 Cb 0.29 -5.29 -0.11 0.00 0.00 0.00 0.00 31.44 26.33 2kh2 n GLU 64 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2kh2 s LYS 65 N -2.96 1.24 -0.33 3.44 1.02 -0.56 -5.03 119.74 116.57 2kh2 s LYS 65 Ca 0.00 -1.42 0.04 0.00 0.02 0.00 0.00 55.97 54.61 2kh2 s LYS 65 Cb 0.00 -1.22 0.51 0.00 -0.52 0.00 0.00 37.83 36.60 2kh2 s LYS 65 CO 0.00 0.24 1.68 0.27 -0.92 0.00 0.00 175.35 176.61 2kh2 n ASN 66 N 0.20 3.65 -4.50 2.83 6.94 -1.26 -4.43 115.26 118.69 2kh2 n ASN 66 Ca -0.12 -3.18 -0.36 0.00 -0.02 0.00 0.00 54.58 50.90 2kh2 n ASN 66 Cb 0.58 -0.75 -0.12 0.00 -2.36 0.00 0.00 39.78 37.13 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 -2.46 3.52 0.11 -4.53 1.43 -1.26 -0.92 118.68 114.57 2kh2 s LEU 67 Ca 0.43 -0.12 0.09 0.00 -1.03 0.00 0.00 54.13 53.50 2kh2 s LEU 67 Cb 0.36 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 2kh2 s LEU 67 CO 0.09 0.05 -0.21 -0.31 0.23 0.00 0.00 176.35 176.19 2kh2 s TYR 68 N 1.13 1.86 -0.17 0.29 1.51 -0.11 -0.78 117.35 121.08 2kh2 s TYR 68 Ca 0.04 -0.42 -0.29 0.00 -1.01 0.00 0.00 57.07 55.39 2kh2 s TYR 68 Cb -0.14 -1.01 -0.03 0.00 -0.11 0.00 0.00 41.96 40.67 2kh2 s TYR 68 CO 0.03 0.24 1.46 -0.51 -1.11 0.00 0.00 175.55 175.65 2kh2 s LEU 69 N -1.99 4.10 -0.12 -1.29 1.43 -0.54 -0.51 118.68 119.76 2kh2 s LEU 69 Ca 0.08 1.75 -0.01 0.00 -1.03 0.00 0.00 54.13 54.92 2kh2 s LEU 69 Cb -0.10 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 2kh2 s LEU 69 CO 0.05 -0.97 -0.08 -0.55 0.23 0.00 0.00 176.35 175.02 2kh2 s SER 70 N 3.01 4.47 -0.42 2.29 0.15 0.10 -4.40 113.70 118.90 2kh2 s SER 70 Ca 0.64 -0.17 -0.14 0.00 0.70 0.00 0.00 55.95 56.98 2kh2 s SER 70 Cb -0.25 -1.53 0.04 0.00 -1.71 0.00 0.00 66.02 62.57 2kh2 s SER 70 CO 0.23 0.22 0.30 0.00 1.20 0.00 0.00 173.24 175.20 2kh2 s VAL 72 N 1.64 0.93 -0.28 0.00 -7.23 -0.91 -4.68 120.40 109.86 2kh2 s VAL 72 Ca 0.04 -2.02 -0.16 0.00 -1.81 0.00 0.00 61.98 58.03 2kh2 s VAL 72 Cb -0.20 -2.17 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 2kh2 s VAL 72 CO 0.08 -0.45 0.43 -0.76 -0.31 0.00 0.00 175.10 174.09 2kh2 s LEU 73 N -3.23 4.10 -0.17 1.32 1.43 -1.26 0.11 118.68 120.97 2kh2 s LEU 73 Ca 0.25 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.64 2kh2 s LEU 73 Cb 0.05 -2.51 0.03 0.00 0.03 0.00 0.00 46.19 43.80 2kh2 s LEU 73 CO 0.06 -0.26 -0.11 -0.54 0.23 0.00 0.00 176.35 175.73 2kh2 s LYS 74 N 2.18 2.04 -1.11 1.70 1.02 0.44 -4.76 119.74 121.25 2kh2 s LYS 74 Ca 0.17 -0.69 -0.01 0.00 0.02 0.00 0.00 55.97 55.46 2kh2 s LYS 74 Cb -0.16 -2.24 -0.01 0.00 -0.52 0.00 0.00 37.83 34.91 2kh2 s LYS 74 CO 0.10 -0.36 0.93 -3.47 -0.92 0.00 0.00 175.35 171.63 2kh2 n ASP 75 N 4.74 -2.55 -2.21 2.83 4.64 -1.26 -2.55 116.55 120.20 2kh2 n ASP 75 Ca -0.15 -0.59 -0.19 0.00 -1.38 0.00 0.00 54.79 52.48 2kh2 n ASP 75 Cb 0.48 -4.85 -0.03 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 -3.01 -5.41 -3.73 1.67 10.43 -1.26 -4.97 116.55 110.27 2kh2 n ASP 76 Ca -0.25 0.13 -0.12 0.00 2.57 0.00 0.00 54.79 57.12 2kh2 n ASP 76 Cb 0.65 -4.58 -0.13 0.00 1.84 0.00 0.00 41.12 38.90 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 -4.71 0.25 -0.03 -1.24 2.47 -1.06 -5.12 119.74 110.30 2kh2 s LYS 77 Ca 0.00 0.56 -0.30 0.00 -1.56 0.00 0.00 55.97 54.68 2kh2 s LYS 77 Cb 0.00 -0.08 -0.07 0.00 -1.46 0.00 0.00 37.83 36.22 2kh2 s LYS 77 CO 0.00 -0.15 1.81 -2.14 0.16 0.00 0.00 175.35 175.03 2kh2 s PRO 78 N 1.20 4.11 0.02 4.03 0.02 -1.26 -0.42 135.00 142.71 2kh2 s PRO 78 Ca -0.09 2.35 0.04 0.00 0.02 0.00 0.00 61.00 63.33 2kh2 s PRO 78 Cb -0.09 -4.08 -0.02 0.00 0.02 0.00 0.00 34.50 30.33 2kh2 s PRO 78 CO -0.09 -0.95 -0.13 0.99 -0.33 0.00 0.00 177.00 176.49 2kh2 s THR 79 N 4.41 1.01 0.24 0.99 2.01 0.12 -4.63 115.64 119.79 2kh2 s THR 79 Ca 0.81 -0.82 -0.20 0.00 0.31 0.00 0.00 61.69 61.79 2kh2 s THR 79 Cb -0.37 -0.90 -0.09 0.00 0.01 0.00 0.00 72.50 71.16 2kh2 s THR 79 CO 0.35 0.08 0.76 -0.22 -0.69 0.00 0.00 174.62 174.89 2kh2 s LEU 80 N -0.85 4.33 0.26 4.42 2.96 -1.26 -2.14 118.68 126.39 2kh2 s LEU 80 Ca 0.02 1.47 -0.13 0.00 -0.22 0.00 0.00 54.13 55.27 2kh2 s LEU 80 Cb -0.07 -3.67 0.00 0.00 0.50 0.00 0.00 46.19 42.95 2kh2 s LEU 80 CO 0.01 0.01 0.51 0.00 -1.32 0.00 0.00 176.35 175.56 2kh2 s GLN 81 N -2.04 1.61 -0.31 1.98 -2.07 -0.28 -4.88 119.66 113.68 2kh2 s GLN 81 Ca 0.45 -1.25 -0.10 0.00 -1.82 0.00 0.00 55.36 52.64 2kh2 s GLN 81 Cb -0.17 0.49 -0.01 0.00 -1.09 0.00 0.00 33.01 32.23 2kh2 s GLN 81 CO 0.21 -0.68 0.15 -0.51 -1.32 0.00 0.00 175.29 173.14 2kh2 s LEU 82 N -3.02 4.07 -0.11 2.60 2.01 -1.25 0.00 118.68 122.98 2kh2 s LEU 82 Ca 0.21 -0.48 -0.02 0.00 0.01 0.00 0.00 54.13 53.85 2kh2 s LEU 82 Cb -0.01 -2.00 -0.03 0.00 0.01 0.00 0.00 46.19 44.15 2kh2 s LEU 82 CO 0.09 -0.18 -0.04 -0.70 1.01 0.00 0.00 176.35 176.54 2kh2 s GLU 83 N 1.62 3.19 -0.08 1.70 2.12 0.33 -4.90 118.70 122.68 2kh2 s GLU 83 Ca 0.05 -0.50 -0.23 0.00 0.36 0.00 0.00 54.97 54.65 2kh2 s GLU 83 Cb -0.17 -2.78 -0.04 0.00 0.26 0.00 0.00 34.13 31.41 2kh2 s GLU 83 CO 0.06 0.51 0.67 -1.12 -0.54 0.00 0.00 175.26 174.84 2kh2 s SER 84 N -0.36 6.94 0.21 -1.70 0.01 -1.26 -0.93 113.70 116.61 2kh2 s SER 84 Ca 0.06 1.13 0.11 0.00 1.31 0.00 0.00 55.95 58.57 2kh2 s SER 84 Cb -0.12 -2.40 -0.05 0.00 0.21 0.00 0.00 66.02 63.67 2kh2 s SER 84 CO 0.02 -0.11 -0.23 0.68 0.41 0.00 0.00 173.24 174.01 2kh2 s VAL 85 N 0.84 2.35 -0.07 3.43 -7.23 -0.10 -5.00 120.40 114.62 2kh2 s VAL 85 Ca 0.36 -2.11 -0.29 0.00 -1.81 0.00 0.00 61.98 58.13 2kh2 s VAL 85 Cb -0.17 -2.15 -0.07 0.00 0.56 0.00 0.00 36.38 34.55 2kh2 s VAL 85 CO 0.17 -0.19 2.06 -0.62 -0.31 0.00 0.00 175.10 176.20 2kh2 s ASP 86 N -2.86 6.05 0.56 4.85 3.68 -1.26 -4.81 116.67 122.87 2kh2 s ASP 86 Ca 0.23 2.33 0.24 0.00 2.13 0.00 0.00 52.55 57.47 2kh2 s ASP 86 Cb -0.07 -2.52 1.53 0.00 -1.45 0.00 0.00 42.92 40.41 2kh2 s ASP 86 CO 0.11 -1.42 2.14 1.55 0.13 0.00 0.00 175.17 177.67 2kh2 h PRO 87 N 12.38 0.00 0.00 4.34 0.13 -1.92 -1.61 132.00 145.32 2kh2 h PRO 87 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2kh2 h PRO 87 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2kh2 h PRO 87 CO 0.95 0.00 -0.69 1.57 -0.23 0.00 0.00 178.00 179.61 2kh2 h LYS 88 N 0.00 0.00 -0.18 0.86 2.10 -2.01 -3.31 116.57 114.03 2kh2 h LYS 88 Ca 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.71 2kh2 h LYS 88 Cb 0.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.62 2kh2 h LYS 88 CO -0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 2kh2 n ASN 89 N -2.57 2.96 -4.09 7.07 3.02 -0.68 -4.96 115.26 116.02 2kh2 n ASN 89 Ca 0.02 -1.89 -0.13 0.00 -0.03 0.00 0.00 54.58 52.55 2kh2 n ASN 89 Cb 0.51 -0.10 -0.11 0.00 -0.61 0.00 0.00 39.78 39.47 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 -1.55 0.75 0.74 3.10 1.51 -0.80 -4.62 117.35 116.48 2kh2 s TYR 90 Ca 0.29 -0.60 -0.06 0.00 -1.01 0.00 0.00 57.07 55.68 2kh2 s TYR 90 Cb 0.18 -0.44 0.16 0.00 -0.11 0.00 0.00 41.96 41.75 2kh2 s TYR 90 CO 0.27 -0.09 1.01 -0.35 -1.11 0.00 0.00 175.55 175.27 2kh2 n PRO 91 N 1.08 -0.50 -3.90 -1.71 -0.04 -1.26 -4.78 135.00 123.87 2kh2 n PRO 91 Ca -0.20 -2.17 -0.10 0.00 -0.04 0.00 0.00 63.50 60.99 2kh2 n PRO 91 Cb 0.56 -0.85 -0.06 0.00 -0.04 0.00 0.00 33.50 33.11 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 -5.13 1.24 -0.06 0.54 -2.85 -1.26 -5.08 119.74 107.13 2kh2 s LYS 92 Ca 0.62 -1.09 -0.26 0.00 -1.00 0.00 0.00 55.97 54.24 2kh2 s LYS 92 Cb -0.03 0.42 -0.23 0.00 -2.06 0.00 0.00 37.83 35.94 2kh2 s LYS 92 CO 0.42 -0.48 1.05 -0.22 0.10 0.00 0.00 175.35 176.23 2kh2 h LYS 93 N 2.43 0.09 -4.88 1.78 3.64 -1.95 -3.37 116.57 114.31 2kh2 h LYS 93 Ca -0.31 -0.09 -0.72 0.00 -1.27 0.00 0.00 60.65 58.27 2kh2 h LYS 93 Cb 1.24 0.02 -0.17 0.00 -0.41 0.00 0.00 32.23 32.91 2kh2 h LYS 93 CO 0.45 0.80 1.30 0.21 -2.27 0.00 0.00 179.45 179.94 2kh2 s LYS 94 N -3.30 3.98 0.94 1.90 2.47 -1.26 -0.91 119.74 123.56 2kh2 s LYS 94 Ca -0.17 -2.38 -0.15 0.00 -1.56 0.00 0.00 55.97 51.72 2kh2 s LYS 94 Cb 0.00 -5.06 0.22 0.00 -1.46 0.00 0.00 37.83 31.53 2kh2 s LYS 94 CO 0.71 -1.80 1.29 -1.33 0.16 0.00 0.00 175.35 174.38 2kh2 n MET 95 N 6.00 -1.18 -2.63 4.03 2.81 -1.26 -5.01 117.12 119.87 2kh2 n MET 95 Ca 0.35 -2.08 -0.33 0.00 -1.81 0.00 0.00 57.70 53.83 2kh2 n MET 95 Cb 0.44 -1.29 -0.05 0.00 -0.71 0.00 0.00 33.22 31.61 2kh2 n MET 95 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2kh2 s GLU 96 N -5.80 4.08 0.54 0.03 8.01 -1.26 -4.93 118.70 119.37 2kh2 s GLU 96 Ca 0.74 1.08 0.22 0.00 0.01 0.00 0.00 54.97 57.02 2kh2 s GLU 96 Cb -0.02 -2.15 1.44 0.00 -4.31 0.00 0.00 34.13 29.08 2kh2 s GLU 96 CO 0.51 -0.16 2.11 -0.22 0.01 0.00 0.00 175.26 177.51 2kh2 h LYS 97 N 1.50 0.00 0.00 1.61 1.63 -1.97 0.61 116.57 119.96 2kh2 h LYS 97 Ca -0.48 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 2kh2 h LYS 97 Cb 1.19 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.82 2kh2 h LYS 97 CO 0.61 0.00 0.00 2.89 -3.45 0.00 0.00 179.45 179.50 2kh2 n ARG 98 N -4.28 0.02 0.00 1.90 1.85 -1.26 -3.04 116.66 111.85 2kh2 n ARG 98 Ca 0.01 0.07 0.05 0.00 -1.00 0.00 0.00 57.85 56.99 2kh2 n ARG 98 Cb 0.27 -1.53 0.03 0.00 -1.05 0.00 0.00 32.46 30.19 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 -1.57 0.00 -3.52 2.89 3.72 0.17 -1.09 117.46 118.06 2kh2 n PHE 99 Ca 0.06 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.08 2kh2 n PHE 99 Cb 0.31 0.00 -0.10 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 -1.03 5.26 0.10 -4.37 1.01 -0.94 -4.02 120.40 116.41 2kh2 s VAL 100 Ca 0.11 0.35 0.07 0.00 0.00 0.00 0.00 61.98 62.51 2kh2 s VAL 100 Cb 0.09 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 2kh2 s VAL 100 CO 0.17 0.23 -0.10 -0.36 0.00 0.00 0.00 175.10 175.04 2kh2 s PHE 101 N 1.73 2.74 -0.42 5.22 0.40 0.09 -2.29 117.98 125.46 2kh2 s PHE 101 Ca 0.11 -0.15 -0.11 0.00 -0.60 0.00 0.00 56.93 56.18 2kh2 s PHE 101 Cb -0.15 -1.44 0.06 0.00 0.51 0.00 0.00 43.02 42.00 2kh2 s PHE 101 CO 0.09 0.42 0.27 -0.80 0.70 0.00 0.00 175.22 175.90 2kh2 s ASN 102 N -2.15 5.75 -0.59 1.36 0.02 0.21 -0.73 114.94 118.82 2kh2 s ASN 102 Ca 0.21 -1.34 -0.28 0.00 -1.02 0.00 0.00 52.86 50.43 2kh2 s ASN 102 Cb -0.11 -2.03 0.03 0.00 0.02 0.00 0.00 41.25 39.16 2kh2 s ASN 102 CO 0.13 -0.52 1.19 -0.75 0.02 0.00 0.00 177.10 177.17 2kh2 s LYS 103 N 1.50 3.47 -0.02 -0.60 2.20 0.54 -0.92 119.74 125.91 2kh2 s LYS 103 Ca 0.03 0.17 -0.18 0.00 -0.36 0.00 0.00 55.97 55.63 2kh2 s LYS 103 Cb -0.22 -4.03 -0.05 0.00 -1.51 0.00 0.00 37.83 32.01 2kh2 s LYS 103 CO 0.04 -1.72 0.52 0.42 -0.36 0.00 0.00 175.35 174.25 2kh2 s ILE 104 N 4.98 4.98 -0.61 5.43 1.01 0.11 -0.85 121.20 136.26 2kh2 s ILE 104 Ca 0.41 1.07 0.04 0.00 0.00 0.00 0.00 60.65 62.18 2kh2 s ILE 104 Cb -0.08 -3.85 0.16 0.00 0.01 0.00 0.00 42.46 38.71 2kh2 s ILE 104 CO 0.24 0.45 0.42 -1.61 0.00 0.00 0.00 174.94 174.44 2kh2 s GLU 105 N -0.32 2.03 0.02 2.79 2.02 -1.01 -0.37 118.70 123.87 2kh2 s GLU 105 Ca 0.28 -2.93 -0.15 0.00 0.02 0.00 0.00 54.97 52.19 2kh2 s GLU 105 Cb -0.17 -2.96 -0.08 0.00 0.10 0.00 0.00 34.13 31.02 2kh2 s GLU 105 CO 0.15 -1.27 1.15 -0.84 0.02 0.00 0.00 175.26 174.46 2kh2 h ILE 106 N 4.63 0.00 0.00 -1.63 3.07 -1.89 -3.48 117.51 118.21 2kh2 h ILE 106 Ca 0.13 -0.03 0.00 0.00 1.55 0.00 0.00 64.86 66.51 2kh2 h ILE 106 Cb 0.81 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.36 2kh2 h ILE 106 CO 0.63 0.00 0.00 -0.46 -1.05 0.00 0.00 178.15 177.27 2kh2 n ASN 107 N -3.52 0.00 -0.12 2.16 0.23 -1.26 -4.98 115.26 107.78 2kh2 n ASN 107 Ca -0.07 0.00 0.06 0.00 -0.53 0.00 0.00 54.58 54.04 2kh2 n ASN 107 Cb 0.21 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.87 2kh2 n ASN 107 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2kh2 n ASN 108 N 0.00 0.90 -4.68 0.53 5.03 -1.26 -4.97 115.26 110.81 2kh2 n ASN 108 Ca 0.00 -0.95 -0.31 0.00 0.87 0.00 0.00 54.58 54.19 2kh2 n ASN 108 Cb 0.00 0.79 -0.08 0.00 -1.02 0.00 0.00 39.78 39.46 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2kh2 s LYS 109 N -1.92 2.58 -0.02 3.52 -0.14 -1.26 -4.93 119.74 117.57 2kh2 s LYS 109 Ca 0.07 -0.80 0.08 0.00 -1.36 0.00 0.00 55.97 53.96 2kh2 s LYS 109 Cb 0.10 -2.55 -0.02 0.00 -1.68 0.00 0.00 37.83 33.67 2kh2 s LYS 109 CO 0.42 0.56 -0.25 -0.48 -0.76 0.00 0.00 175.35 174.84 2kh2 s LEU 110 N -2.11 2.10 0.14 3.17 2.34 -0.43 -3.40 118.68 120.49 2kh2 s LEU 110 Ca 0.24 -0.45 0.09 0.00 0.06 0.00 0.00 54.13 54.07 2kh2 s LEU 110 Cb -0.12 -1.36 -0.04 0.00 -0.56 0.00 0.00 46.19 44.12 2kh2 s LEU 110 CO 0.16 0.32 -0.18 -1.61 -1.06 0.00 0.00 176.35 173.98 2kh2 s GLU 111 N -0.59 1.77 -0.31 1.48 2.02 0.50 0.18 118.70 123.76 2kh2 s GLU 111 Ca 0.09 -1.27 -0.03 0.00 0.02 0.00 0.00 54.97 53.79 2kh2 s GLU 111 Cb -0.10 -2.07 0.05 0.00 0.10 0.00 0.00 34.13 32.11 2kh2 s GLU 111 CO -0.01 0.46 0.02 -0.06 0.02 0.00 0.00 175.26 175.69 2kh2 s PHE 112 N -1.34 3.27 0.06 1.61 0.08 -1.26 0.09 117.98 120.48 2kh2 s PHE 112 Ca 0.20 -1.81 -0.03 0.00 0.12 0.00 0.00 56.93 55.41 2kh2 s PHE 112 Cb -0.10 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.14 2kh2 s PHE 112 CO 0.11 -0.80 0.25 -2.00 -0.10 0.00 0.00 175.22 172.68 2kh2 s GLU 113 N 1.28 3.50 -0.03 0.44 2.12 -0.10 -1.48 118.70 124.43 2kh2 s GLU 113 Ca -0.04 -0.28 -0.24 0.00 0.36 0.00 0.00 54.97 54.76 2kh2 s GLU 113 Cb -0.20 -3.01 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 2kh2 s GLU 113 CO -0.00 0.60 0.73 0.45 -0.54 0.00 0.00 175.26 176.49 2kh2 s SER 114 N -2.26 7.08 0.19 -1.70 0.15 0.11 0.68 113.70 117.95 2kh2 s SER 114 Ca 0.34 1.29 -0.03 0.00 0.70 0.00 0.00 55.95 58.25 2kh2 s SER 114 Cb -0.13 -2.44 0.12 0.00 -1.71 0.00 0.00 66.02 61.87 2kh2 s SER 114 CO 0.24 -0.08 1.51 0.00 1.20 0.00 0.00 173.24 176.11 2kh2 h ALA 115 N 6.39 0.71 -0.43 5.45 0.00 -1.68 -3.04 119.26 126.66 2kh2 h ALA 115 Ca -0.42 -0.51 -0.10 0.00 0.00 0.00 0.00 54.91 53.87 2kh2 h ALA 115 Cb 1.20 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2kh2 h ALA 115 CO 0.74 0.69 -0.15 0.37 0.00 0.00 0.00 179.25 180.90 2kh2 h GLN 116 N 0.41 0.80 -3.56 0.00 5.75 -1.77 -3.38 115.11 113.36 2kh2 h GLN 116 Ca 0.01 -0.29 -0.63 0.00 -0.15 0.00 0.00 58.65 57.59 2kh2 h GLN 116 Cb 1.09 -0.05 -0.40 0.00 1.07 0.00 0.00 27.48 29.19 2kh2 h GLN 116 CO 0.10 0.90 -0.70 -0.06 -2.65 0.00 0.00 178.83 176.42 2kh2 s PHE 117 N -4.73 2.69 0.44 3.99 0.08 -1.15 -5.09 117.98 114.21 2kh2 s PHE 117 Ca -0.09 -2.68 -0.26 0.00 0.12 0.00 0.00 56.93 54.02 2kh2 s PHE 117 Cb 0.13 -2.37 -0.09 0.00 -0.57 0.00 0.00 43.02 40.12 2kh2 s PHE 117 CO 0.83 -0.82 1.43 -2.14 -0.10 0.00 0.00 175.22 174.42 2kh2 s PRO 118 N 0.47 3.77 0.00 0.24 0.02 -1.20 -2.29 135.00 136.00 2kh2 s PRO 118 Ca 0.15 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.59 2kh2 s PRO 118 Cb -0.23 -2.71 0.00 0.00 0.02 0.00 0.00 34.50 31.58 2kh2 s PRO 118 CO -0.05 -0.76 0.00 0.09 -0.33 0.00 0.00 177.00 175.95 2kh2 n ASN 119 N -0.08 -0.59 -4.38 2.53 5.03 -1.26 -4.99 115.26 111.52 2kh2 n ASN 119 Ca 0.04 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.11 2kh2 n ASN 119 Cb 0.42 -0.45 -0.12 0.00 -1.02 0.00 0.00 39.78 38.60 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 -3.28 3.18 0.22 3.10 0.52 -0.97 -4.42 118.94 117.30 2kh2 s TRP 120 Ca 0.00 -0.87 0.09 0.00 0.02 0.00 0.00 56.10 55.34 2kh2 s TRP 120 Cb 0.00 -2.32 -0.04 0.00 -1.15 0.00 0.00 33.47 29.96 2kh2 s TRP 120 CO 0.00 -0.56 -0.02 0.71 0.02 0.00 0.00 176.95 177.10 2kh2 s TYR 121 N 1.54 2.73 -0.12 -1.98 1.51 0.56 -0.71 117.35 120.88 2kh2 s TYR 121 Ca 0.03 -0.20 -0.29 0.00 -1.01 0.00 0.00 57.07 55.60 2kh2 s TYR 121 Cb -0.18 -1.26 -0.05 0.00 -0.11 0.00 0.00 41.96 40.36 2kh2 s TYR 121 CO 0.04 0.57 1.68 0.42 -1.11 0.00 0.00 175.55 177.15 2kh2 s ILE 122 N -2.03 3.58 0.14 2.71 1.01 -0.55 -0.86 121.20 125.19 2kh2 s ILE 122 Ca 0.29 0.68 0.09 0.00 0.00 0.00 0.00 60.65 61.71 2kh2 s ILE 122 Cb -0.08 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 2kh2 s ILE 122 CO 0.19 -0.13 -0.17 -0.44 0.00 0.00 0.00 174.94 174.39 2kh2 s SER 123 N 3.93 3.94 0.09 3.58 0.01 0.53 -4.39 113.70 121.39 2kh2 s SER 123 Ca 0.75 -0.59 0.03 0.00 1.31 0.00 0.00 55.95 57.45 2kh2 s SER 123 Cb -0.31 -0.57 -0.03 0.00 0.21 0.00 0.00 66.02 65.32 2kh2 s SER 123 CO 0.30 0.16 -0.09 0.42 0.41 0.00 0.00 173.24 174.43 2kh2 s THR 124 N -1.31 0.85 0.53 1.44 -4.23 -0.65 -2.20 115.64 110.07 2kh2 s THR 124 Ca 0.20 -1.56 -0.03 0.00 -1.18 0.00 0.00 61.69 59.11 2kh2 s THR 124 Cb -0.10 -1.26 0.00 0.00 1.34 0.00 0.00 72.50 72.48 2kh2 s THR 124 CO 0.11 -0.55 0.80 -0.44 -0.54 0.00 0.00 174.62 174.01 2kh2 s SER 125 N -2.34 5.73 0.23 3.99 0.01 -1.26 -0.30 113.70 119.76 2kh2 s SER 125 Ca 0.03 0.57 0.11 0.00 1.31 0.00 0.00 55.95 57.97 2kh2 s SER 125 Cb -0.03 -1.68 0.12 0.00 0.21 0.00 0.00 66.02 64.64 2kh2 s SER 125 CO -0.00 -0.89 1.46 1.56 0.41 0.00 0.00 173.24 175.78 2kh2 h GLN 126 N 0.07 0.00 -7.18 12.44 1.08 -1.98 -3.46 115.11 116.08 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 1.25 0.00 0.12 0.00 -0.05 0.00 0.00 27.48 28.80 2kh2 h GLN 126 CO 0.59 0.71 0.39 0.00 -0.95 0.00 0.00 178.83 179.57 2kh2 s ALA 127 N -3.12 2.34 0.30 3.87 0.00 -1.26 -5.01 121.76 118.88 2kh2 s ALA 127 Ca 0.01 0.71 -0.20 0.00 0.00 0.00 0.00 51.96 52.48 2kh2 s ALA 127 Cb 0.10 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.75 2kh2 s ALA 127 CO 0.77 -1.48 0.80 -2.00 0.00 0.00 0.00 175.76 173.85 2kh2 s GLU 128 N -3.95 4.25 -0.97 0.00 2.56 -1.26 -3.97 118.70 115.36 2kh2 s GLU 128 Ca 0.71 0.94 -0.00 0.00 0.00 0.00 0.00 54.97 56.62 2kh2 s GLU 128 Cb -0.24 -2.65 0.00 0.00 2.00 0.00 0.00 34.13 33.24 2kh2 s GLU 128 CO 0.42 0.25 0.04 -1.71 -0.56 0.00 0.00 175.26 173.70 2kh2 n ASN 129 N 0.22 -3.76 -4.83 -1.70 5.15 -1.15 -5.01 115.26 104.18 2kh2 n ASN 129 Ca 0.01 -0.03 -0.37 0.00 -0.60 0.00 0.00 54.58 53.60 2kh2 n ASN 129 Cb 0.52 -2.95 -0.06 0.00 -0.53 0.00 0.00 39.78 36.75 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 -4.64 3.73 1.00 1.20 -1.94 -1.17 -4.85 119.30 112.63 2kh2 s MET 130 Ca 0.02 -0.02 -0.12 0.00 -1.71 0.00 0.00 55.69 53.86 2kh2 s MET 130 Cb -0.01 -3.26 0.19 0.00 2.01 0.00 0.00 34.83 33.77 2kh2 s MET 130 CO 0.02 0.63 1.08 -2.14 -0.01 0.00 0.00 175.02 174.61 2kh2 s PRO 131 N -0.66 0.40 -0.11 2.03 0.02 -1.26 -0.08 135.00 135.34 2kh2 s PRO 131 Ca 0.16 0.71 -0.11 0.00 0.02 0.00 0.00 61.00 61.78 2kh2 s PRO 131 Cb -0.13 -1.72 -0.05 0.00 0.02 0.00 0.00 34.50 32.63 2kh2 s PRO 131 CO 0.05 -2.80 0.24 0.08 -0.33 0.00 0.00 177.00 174.24 2kh2 s VAL 132 N -2.84 5.33 0.31 3.83 1.01 -0.47 -4.57 120.40 123.01 2kh2 s VAL 132 Ca 0.65 0.44 0.02 0.00 0.00 0.00 0.00 61.98 63.10 2kh2 s VAL 132 Cb -0.20 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 2kh2 s VAL 132 CO 0.59 0.53 0.33 0.72 0.00 0.00 0.00 175.10 177.26 2kh2 s PHE 133 N -0.48 1.41 -0.20 5.22 -0.71 -0.93 -4.85 117.98 117.43 2kh2 s PHE 133 Ca 0.16 -1.48 -0.09 0.00 -1.04 0.00 0.00 56.93 54.49 2kh2 s PHE 133 Cb -0.13 -0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 41.17 2kh2 s PHE 133 CO 0.05 -0.93 0.10 -1.17 -1.34 0.00 0.00 175.22 171.94 2kh2 s LEU 134 N -3.29 3.99 0.15 -1.99 2.96 -1.26 -0.35 118.68 118.88 2kh2 s LEU 134 Ca 0.37 0.13 0.03 0.00 -0.22 0.00 0.00 54.13 54.44 2kh2 s LEU 134 Cb 0.02 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 2kh2 s LEU 134 CO 0.22 0.15 -0.07 -0.83 -1.32 0.00 0.00 176.35 174.51 2kh2 s GLY 135 N 0.53 1.07 -0.08 7.98 0.00 -0.04 -4.86 107.32 111.91 2kh2 s GLY 135 Ca 0.06 -1.50 0.12 0.00 0.00 0.00 0.00 44.72 43.39 2kh2 s GLY 135 CO 0.00 -1.56 1.19 0.61 0.00 0.00 0.00 173.10 173.35 2kh2 n GLY 136 N -0.19 3.77 3.16 0.20 0.00 -1.26 -0.32 105.19 110.54 2kh2 n GLY 136 Ca -0.10 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 44.88 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 -1.99 4.61 -0.04 2.61 -4.23 -1.26 -4.93 115.64 110.41 2kh2 s THR 137 Ca 0.24 -3.48 -0.27 0.00 -1.18 0.00 0.00 61.69 57.00 2kh2 s THR 137 Cb 0.19 -3.86 -0.03 0.00 1.34 0.00 0.00 72.50 70.13 2kh2 s THR 137 CO 0.06 -1.06 0.85 -0.75 -0.54 0.00 0.00 174.62 173.19 2kh2 s LYS 138 N -0.93 4.48 0.00 3.99 2.20 -1.26 -3.39 119.74 124.84 2kh2 s LYS 138 Ca 0.25 1.16 0.00 0.00 -0.36 0.00 0.00 55.97 57.02 2kh2 s LYS 138 Cb -0.11 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 2kh2 s LYS 138 CO -0.10 -0.03 0.00 0.41 -0.36 0.00 0.00 175.35 175.27 2kh2 n GLY 139 N 3.03 0.45 0.00 5.54 0.00 -1.26 -5.01 105.19 107.94 2kh2 n GLY 139 Ca 0.03 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.97 0.87 0.12 -0.02 0.00 -1.22 -5.00 105.19 96.97 2kh2 n GLY 140 Ca 0.00 -0.43 -0.19 0.00 0.00 0.00 0.00 46.02 45.39 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 0.34 -7.25 1.61 7.50 -1.95 -3.46 115.11 111.90 2kh2 h GLN 141 Ca 0.00 -0.51 -0.50 0.00 0.50 0.00 0.00 58.65 58.14 2kh2 h GLN 141 Cb 0.00 0.18 0.08 0.00 0.05 0.00 0.00 27.48 27.79 2kh2 h GLN 141 CO 0.00 1.21 0.37 -0.51 -1.50 0.00 0.00 178.83 178.40 2kh2 s ASP 142 N -6.93 5.51 -0.17 1.46 1.01 -1.26 -4.64 116.67 111.65 2kh2 s ASP 142 Ca -0.13 1.78 -0.14 0.00 0.71 0.00 0.00 52.55 54.76 2kh2 s ASP 142 Cb 0.02 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 2kh2 s ASP 142 CO 0.83 -1.35 0.31 -0.63 0.21 0.00 0.00 175.17 174.54 2kh2 s ILE 143 N -2.64 5.28 -0.02 0.77 1.01 0.58 -4.50 121.20 121.68 2kh2 s ILE 143 Ca 0.62 0.57 0.07 0.00 0.00 0.00 0.00 60.65 61.91 2kh2 s ILE 143 Cb -0.16 -3.65 -0.11 0.00 0.01 0.00 0.00 42.46 38.55 2kh2 s ILE 143 CO 0.44 0.35 0.15 0.35 0.00 0.00 0.00 174.94 176.23 2kh2 n THR 144 N 3.81 0.05 -3.26 2.92 -2.24 -1.26 -1.63 114.28 112.66 2kh2 n THR 144 Ca -0.11 -0.18 -0.38 0.00 -2.27 0.00 0.00 64.05 61.11 2kh2 n THR 144 Cb 0.52 0.21 -0.06 0.00 -2.10 0.00 0.00 70.33 68.90 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 -2.95 7.04 0.35 3.42 -4.77 -1.26 -4.18 116.67 114.32 2kh2 s ASP 145 Ca -0.03 1.26 0.05 0.00 -3.30 0.00 0.00 52.55 50.53 2kh2 s ASP 145 Cb 0.04 -2.36 -0.03 0.00 -1.09 0.00 0.00 42.92 39.49 2kh2 s ASP 145 CO 0.30 0.23 0.18 -0.36 0.70 0.00 0.00 175.17 176.22 2kh2 s PHE 146 N -1.19 1.72 0.20 2.11 0.08 0.13 -3.55 117.98 117.48 2kh2 s PHE 146 Ca 0.31 -1.41 0.11 0.00 0.12 0.00 0.00 56.93 56.06 2kh2 s PHE 146 Cb -0.19 -0.95 -0.04 0.00 -0.57 0.00 0.00 43.02 41.27 2kh2 s PHE 146 CO 0.19 -0.52 -0.20 0.95 -0.10 0.00 0.00 175.22 175.54 2kh2 s THR 147 N -3.40 2.54 -0.32 0.64 -4.23 0.14 -1.31 115.64 109.69 2kh2 s THR 147 Ca 0.32 -2.02 -0.03 0.00 -1.18 0.00 0.00 61.69 58.78 2kh2 s THR 147 Cb 0.03 -2.25 0.06 0.00 1.34 0.00 0.00 72.50 71.68 2kh2 s THR 147 CO 0.19 -0.16 0.05 -0.32 -0.54 0.00 0.00 174.62 173.84 2kh2 s MET 148 N -2.84 2.40 -0.56 3.99 1.75 -1.26 -3.43 119.30 119.34 2kh2 s MET 148 Ca 0.23 -1.34 -0.08 0.00 -1.25 0.00 0.00 55.69 53.25 2kh2 s MET 148 Cb -0.08 -3.30 0.15 0.00 2.84 0.00 0.00 34.83 34.44 2kh2 s MET 148 CO 0.12 -0.70 0.43 -0.65 -0.65 0.00 0.00 175.02 173.57 2kh2 s GLN 149 N 1.26 2.65 0.23 4.11 1.11 -0.80 -4.93 119.66 123.29 2kh2 s GLN 149 Ca -0.02 -2.08 -0.31 0.00 0.01 0.00 0.00 55.36 52.96 2kh2 s GLN 149 Cb -0.20 -3.94 -0.10 0.00 -1.01 0.00 0.00 33.01 27.76 2kh2 s GLN 149 CO -0.01 -1.20 1.52 -0.06 0.01 0.00 0.00 175.29 175.55 2kh2 s PHE 150 N 0.78 2.98 0.31 0.91 0.40 -1.26 -1.20 117.98 120.90 2kh2 s PHE 150 Ca 0.11 0.83 0.08 0.00 -0.60 0.00 0.00 56.93 57.35 2kh2 s PHE 150 Cb -0.22 -3.91 -0.06 0.00 0.51 0.00 0.00 43.02 39.34 2kh2 s PHE 150 CO -0.03 -3.13 -0.08 0.14 0.70 0.00 0.00 175.22 172.81 2kh2 s VAL 151 N 0.39 1.96 -1.35 -0.44 -7.23 -1.09 -4.96 120.40 107.68 2kh2 s VAL 151 Ca 0.64 -2.17 -0.10 0.00 -1.81 0.00 0.00 61.98 58.54 2kh2 s VAL 151 Cb -0.44 -2.53 0.11 0.00 0.56 0.00 0.00 36.38 34.08 2kh2 s VAL 151 CO 0.40 -0.26 2.10 -1.54 -0.31 0.00 0.00 175.10 175.49 2kh2 n SER 152 N -0.68 5.45 0.00 4.85 3.41 -1.26 -4.68 113.62 120.71 2kh2 n SER 152 Ca -0.05 -3.02 0.00 0.00 -0.26 0.00 0.00 58.87 55.54 2kh2 n SER 152 Cb 0.63 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68