#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 0.00 -5.78 0.00 0.13 -2.06 -3.42 132.00 120.87 2kh2 h PRO 2 Ca 0.00 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.51 2kh2 h PRO 2 Cb 0.00 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.01 2kh2 h PRO 2 CO 0.00 0.00 0.36 0.54 -0.23 0.00 0.00 178.00 178.67 2kh2 s VAL 3 N -3.32 4.72 -0.04 1.56 0.11 -1.26 -5.03 120.40 117.15 2kh2 s VAL 3 Ca 0.06 0.76 -0.28 0.00 -2.93 0.00 0.00 61.98 59.59 2kh2 s VAL 3 Cb 0.09 -4.23 -0.03 0.00 -1.53 0.00 0.00 36.38 30.68 2kh2 s VAL 3 CO 0.54 -0.50 0.91 -0.13 -3.33 0.00 0.00 175.10 172.59 2kh2 s ARG 4 N 3.14 4.50 0.17 1.54 0.52 -1.26 -4.99 118.95 122.57 2kh2 s ARG 4 Ca 0.31 1.27 -0.18 0.00 -0.52 0.00 0.00 55.73 56.61 2kh2 s ARG 4 Cb -0.13 -3.47 0.04 0.00 0.52 0.00 0.00 34.95 31.91 2kh2 s ARG 4 CO 0.18 -0.07 0.51 -1.12 0.02 0.00 0.00 175.30 174.83 2kh2 s SER 5 N 0.98 -0.30 0.21 0.23 0.01 -1.26 -1.48 113.70 112.08 2kh2 s SER 5 Ca 0.48 -0.37 -0.12 0.00 1.31 0.00 0.00 55.95 57.25 2kh2 s SER 5 Cb -0.20 0.56 -0.00 0.00 0.21 0.00 0.00 66.02 66.59 2kh2 s SER 5 CO 0.24 -1.00 0.41 -1.48 0.41 0.00 0.00 173.24 171.82 2kh2 s LEU 6 N -2.84 0.52 -0.06 2.44 0.05 -1.05 -4.99 118.68 112.75 2kh2 s LEU 6 Ca 0.06 -0.84 0.00 0.00 0.05 0.00 0.00 54.13 53.40 2kh2 s LEU 6 Cb -0.00 1.59 -0.03 0.00 -2.05 0.00 0.00 46.19 45.70 2kh2 s LEU 6 CO -0.07 -1.03 -0.05 0.20 -0.55 0.00 0.00 176.35 174.86 2kh2 s ASN 7 N -2.98 4.83 0.17 1.48 0.01 -1.26 -0.63 114.94 116.55 2kh2 s ASN 7 Ca 0.19 0.01 -0.23 0.00 -0.71 0.00 0.00 52.86 52.12 2kh2 s ASN 7 Cb 0.01 -1.25 0.07 0.00 0.41 0.00 0.00 41.25 40.49 2kh2 s ASN 7 CO 0.04 0.35 0.61 0.00 -1.51 0.00 0.00 177.10 176.60 2kh2 s THR 9 N -3.75 3.45 -0.14 0.00 2.01 0.21 -0.73 115.64 116.69 2kh2 s THR 9 Ca 0.02 -0.57 -0.04 0.00 0.31 0.00 0.00 61.69 61.41 2kh2 s THR 9 Cb -0.01 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 70.06 2kh2 s THR 9 CO -0.11 0.59 0.01 -0.76 -0.69 0.00 0.00 174.62 173.65 2kh2 s LEU 10 N -0.65 3.56 0.01 4.42 1.43 -1.26 -0.48 118.68 125.72 2kh2 s LEU 10 Ca 0.10 0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 2kh2 s LEU 10 Cb -0.11 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.24 2kh2 s LEU 10 CO 0.01 0.25 -0.08 -0.13 0.23 0.00 0.00 176.35 176.64 2kh2 s ARG 11 N -0.14 0.58 0.71 1.70 0.52 -1.14 -3.79 118.95 117.39 2kh2 s ARG 11 Ca 0.05 -0.43 -0.11 0.00 -0.52 0.00 0.00 55.73 54.72 2kh2 s ARG 11 Cb -0.13 -0.51 0.16 0.00 0.52 0.00 0.00 34.95 34.99 2kh2 s ARG 11 CO 0.02 0.13 0.97 -0.40 0.02 0.00 0.00 175.30 176.04 2kh2 n ASP 12 N 2.43 0.17 0.00 0.23 5.68 -1.10 0.20 116.55 124.16 2kh2 n ASP 12 Ca -0.16 -1.41 0.02 0.00 -0.50 0.00 0.00 54.79 52.75 2kh2 n ASP 12 Cb 0.57 -0.73 0.11 0.00 -1.14 0.00 0.00 41.12 39.92 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 -3.57 0.00 -0.72 -1.12 7.64 -1.24 -0.71 113.62 113.91 2kh2 n SER 13 Ca 0.12 0.40 0.07 0.00 1.01 0.00 0.00 58.87 60.48 2kh2 n SER 13 Cb 0.43 -0.42 0.13 0.00 -1.01 0.00 0.00 64.21 63.34 2kh2 n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kh2 n GLN 14 N -1.42 1.93 -1.76 1.43 1.13 -1.26 -4.95 117.38 112.47 2kh2 n GLN 14 Ca 0.02 -1.80 -0.12 0.00 -1.94 0.00 0.00 57.00 53.16 2kh2 n GLN 14 Cb 0.05 -1.32 -0.03 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 0.84 -0.88 -2.37 -1.09 1.13 0.11 -4.98 117.38 110.14 2kh2 n GLN 15 Ca 0.12 0.75 -0.33 0.00 -1.94 0.00 0.00 57.00 55.60 2kh2 n GLN 15 Cb 0.43 -4.83 -0.02 0.00 0.11 0.00 0.00 30.24 25.92 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 -3.76 3.73 0.04 -1.09 1.02 -1.26 -4.50 119.74 113.92 2kh2 s LYS 16 Ca 0.00 1.18 0.05 0.00 0.02 0.00 0.00 55.97 57.22 2kh2 s LYS 16 Cb 0.00 -2.09 -0.03 0.00 -0.52 0.00 0.00 37.83 35.18 2kh2 s LYS 16 CO 0.00 -0.47 -0.11 -1.12 -0.92 0.00 0.00 175.35 172.73 2kh2 s SER 17 N -2.54 4.34 -0.16 2.83 0.01 0.14 -2.71 113.70 115.60 2kh2 s SER 17 Ca 0.63 -0.29 -0.25 0.00 1.31 0.00 0.00 55.95 57.35 2kh2 s SER 17 Cb -0.14 -0.89 -0.02 0.00 0.21 0.00 0.00 66.02 65.19 2kh2 s SER 17 CO 0.28 0.25 0.83 -0.76 0.41 0.00 0.00 173.24 174.25 2kh2 s LEU 18 N -1.64 4.18 0.09 2.44 1.43 -1.25 -1.34 118.68 122.60 2kh2 s LEU 18 Ca 0.18 1.19 0.08 0.00 -1.03 0.00 0.00 54.13 54.55 2kh2 s LEU 18 Cb -0.11 -3.24 -0.03 0.00 0.03 0.00 0.00 46.19 42.83 2kh2 s LEU 18 CO 0.09 -0.39 -0.21 0.68 0.23 0.00 0.00 176.35 176.75 2kh2 s VAL 19 N 2.10 1.70 -0.44 -1.59 -7.23 0.99 -2.65 120.40 113.28 2kh2 s VAL 19 Ca 0.39 -1.50 -0.29 0.00 -1.81 0.00 0.00 61.98 58.77 2kh2 s VAL 19 Cb -0.17 -1.54 0.03 0.00 0.56 0.00 0.00 36.38 35.26 2kh2 s VAL 19 CO 0.13 -0.03 1.10 -0.04 -0.31 0.00 0.00 175.10 175.95 2kh2 s MET 20 N -1.81 3.79 0.00 4.82 -1.94 -1.26 -0.80 119.30 122.09 2kh2 s MET 20 Ca 0.06 0.64 0.00 0.00 -1.71 0.00 0.00 55.69 54.69 2kh2 s MET 20 Cb -0.10 -3.87 0.00 0.00 2.01 0.00 0.00 34.83 32.87 2kh2 s MET 20 CO 0.04 -1.25 0.08 0.45 -0.01 0.00 0.00 175.02 174.34 2kh2 n SER 21 N 7.53 0.00 -1.45 3.03 2.88 0.32 -4.95 113.62 120.98 2kh2 n SER 21 Ca 0.11 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 2kh2 n SER 21 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 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 1.99 1.92 0.22 0.46 0.00 -1.18 -4.93 105.19 103.68 2kh2 n GLY 22 Ca 0.00 -2.11 0.06 0.00 0.00 0.00 0.00 46.02 43.97 2kh2 n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kh2 h PRO 23 N 0.00 0.00 -0.37 1.61 0.13 -2.04 -3.17 132.00 128.16 2kh2 h PRO 23 Ca 0.00 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.87 2kh2 h PRO 23 Cb 0.00 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 30.75 2kh2 h PRO 23 CO 0.00 0.19 -1.02 0.66 -0.23 0.00 0.00 178.00 177.59 2kh2 n TYR 24 N -4.27 1.16 -4.24 1.56 4.01 -1.26 -5.07 117.16 109.05 2kh2 n TYR 24 Ca -0.02 -1.77 -0.18 0.00 -0.16 0.00 0.00 57.90 55.76 2kh2 n TYR 24 Cb 0.25 -0.23 -0.15 0.00 -0.31 0.00 0.00 39.34 38.90 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 -2.95 0.69 -0.02 -0.72 2.12 -1.20 -4.34 118.70 112.27 2kh2 s GLU 25 Ca 0.33 -0.20 0.07 0.00 0.36 0.00 0.00 54.97 55.53 2kh2 s GLU 25 Cb 0.35 -0.68 -0.02 0.00 0.26 0.00 0.00 34.13 34.04 2kh2 s GLU 25 CO -0.06 0.06 -0.23 -0.51 -0.54 0.00 0.00 175.26 173.99 2kh2 s LEU 26 N 0.25 2.24 0.12 2.70 1.43 -1.26 -0.52 118.68 123.64 2kh2 s LEU 26 Ca -0.03 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.70 2kh2 s LEU 26 Cb -0.08 -1.39 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 2kh2 s LEU 26 CO -0.00 0.32 -0.10 -0.54 0.23 0.00 0.00 176.35 176.26 2kh2 s LYS 27 N -0.70 0.94 -0.11 1.70 1.02 0.02 -1.16 119.74 121.44 2kh2 s LYS 27 Ca 0.11 -1.27 0.02 0.00 0.02 0.00 0.00 55.97 54.85 2kh2 s LYS 27 Cb -0.10 -0.59 0.01 0.00 -0.52 0.00 0.00 37.83 36.63 2kh2 s LYS 27 CO -0.00 0.08 -0.18 0.00 -0.92 0.00 0.00 175.35 174.33 2kh2 s ALA 28 N -2.76 1.88 0.10 5.17 0.00 0.49 -0.01 121.76 126.64 2kh2 s ALA 28 Ca 0.10 -0.83 -0.19 0.00 0.00 0.00 0.00 51.96 51.03 2kh2 s ALA 28 Cb -0.01 -0.83 0.05 0.00 0.00 0.00 0.00 23.12 22.32 2kh2 s ALA 28 CO 0.00 0.04 0.46 -0.48 0.00 0.00 0.00 175.76 175.79 2kh2 s LEU 29 N 0.76 0.13 0.42 0.00 0.05 -0.45 -3.32 118.68 116.26 2kh2 s LEU 29 Ca -0.10 -0.11 -0.26 0.00 0.05 0.00 0.00 54.13 53.70 2kh2 s LEU 29 Cb -0.16 2.02 -0.10 0.00 -2.05 0.00 0.00 46.19 45.91 2kh2 s LEU 29 CO 0.01 -0.82 1.42 1.41 -0.55 0.00 0.00 176.35 177.83 2kh2 n HIS 30 N -0.01 2.70 -3.73 3.48 8.25 -1.26 0.25 115.22 124.90 2kh2 n HIS 30 Ca -0.17 0.45 -0.16 0.00 -0.26 0.00 0.00 57.72 57.59 2kh2 n HIS 30 Cb 0.63 -2.47 -0.16 0.00 1.12 0.00 0.00 29.99 29.11 2kh2 n HIS 30 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2kh2 s LEU 31 N -2.30 0.67 0.00 2.41 2.96 -1.26 -4.82 118.68 116.34 2kh2 s LEU 31 Ca 0.59 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.65 2kh2 s LEU 31 Cb -0.47 0.08 0.00 0.00 0.50 0.00 0.00 46.19 46.30 2kh2 s LEU 31 CO 0.60 -0.17 0.00 0.00 -1.32 0.00 0.00 176.35 175.46 2kh2 n GLN 32 N 4.52 0.00 0.00 1.98 6.02 -1.26 -4.97 117.38 123.67 2kh2 n GLN 32 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 2kh2 n GLN 32 Cb 0.50 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.76 2kh2 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kh2 n GLY 33 N 0.00 2.29 0.09 1.08 0.00 -1.26 -3.17 105.19 104.22 2kh2 n GLY 33 Ca 0.00 -0.37 0.01 0.00 0.00 0.00 0.00 46.02 45.66 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 13.24 1.38 -0.44 1.61 -0.06 -1.26 -4.60 117.38 127.25 2kh2 n GLN 34 Ca 0.00 -1.17 0.04 0.00 -2.00 0.00 0.00 57.00 53.87 2kh2 n GLN 34 Cb 0.00 -1.04 0.21 0.00 -4.06 0.00 0.00 30.24 25.35 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 -0.15 3.30 0.11 1.69 9.92 -1.19 -4.33 116.55 125.91 2kh2 n ASP 35 Ca 0.02 -2.41 0.19 0.00 -0.53 0.00 0.00 54.79 52.05 2kh2 n ASP 35 Cb 0.18 -0.54 0.76 0.00 -0.64 0.00 0.00 41.12 40.87 2kh2 n ASP 35 CO 0.00 0.00 0.00 -0.03 0.13 0.00 0.00 177.20 177.30 2kh2 h MET 36 N 2.17 0.00 0.00 -1.24 4.05 -1.81 -1.27 114.93 116.83 2kh2 h MET 36 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2kh2 h MET 36 Cb 1.17 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.97 2kh2 h MET 36 CO 0.22 0.00 0.00 0.39 0.23 0.00 0.00 176.91 177.75 2kh2 n GLU 37 N -3.91 0.03 0.00 0.39 -0.58 -1.26 -1.79 120.64 113.52 2kh2 n GLU 37 Ca 0.06 0.32 0.13 0.00 -0.42 0.00 0.00 57.16 57.24 2kh2 n GLU 37 Cb 0.51 -1.50 0.63 0.00 -0.57 0.00 0.00 31.44 30.51 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 -1.45 0.29 -2.09 3.49 6.02 -0.48 -4.83 117.38 118.33 2kh2 n GLN 38 Ca 0.03 0.05 -0.41 0.00 -0.01 0.00 0.00 57.00 56.65 2kh2 n GLN 38 Cb 0.09 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.83 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 -2.67 4.33 0.08 -1.09 0.00 -0.74 -4.79 119.66 114.78 2kh2 s GLN 39 Ca 0.22 2.23 -0.20 0.00 -0.00 0.00 0.00 55.36 57.61 2kh2 s GLN 39 Cb 0.17 -3.10 -0.07 0.00 0.00 0.00 0.00 33.01 30.02 2kh2 s GLN 39 CO 0.41 -0.27 0.58 0.08 0.00 0.00 0.00 175.29 176.09 2kh2 s VAL 40 N -0.61 4.72 -0.18 3.63 1.01 -1.08 -5.07 120.40 122.83 2kh2 s VAL 40 Ca 0.53 1.24 -0.05 0.00 0.00 0.00 0.00 61.98 63.70 2kh2 s VAL 40 Cb -0.40 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 2kh2 s VAL 40 CO 0.48 0.55 0.01 -0.69 0.00 0.00 0.00 175.10 175.45 2kh2 s VAL 41 N -1.10 4.21 -0.13 2.92 1.01 -1.26 -4.58 120.40 121.46 2kh2 s VAL 41 Ca 0.29 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 2kh2 s VAL 41 Cb -0.20 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 2kh2 s VAL 41 CO 0.19 0.46 -0.01 -0.36 0.00 0.00 0.00 175.10 175.38 2kh2 s PHE 42 N 0.58 3.10 -0.20 5.22 0.08 0.09 -1.58 117.98 125.27 2kh2 s PHE 42 Ca -0.00 -0.07 -0.21 0.00 0.12 0.00 0.00 56.93 56.77 2kh2 s PHE 42 Cb -0.14 -1.91 -0.02 0.00 -0.57 0.00 0.00 43.02 40.38 2kh2 s PHE 42 CO 0.02 0.17 0.65 -1.12 -0.10 0.00 0.00 175.22 174.84 2kh2 s SER 43 N -0.09 6.70 -0.49 1.36 0.01 0.35 -1.72 113.70 119.81 2kh2 s SER 43 Ca 0.03 0.85 -0.14 0.00 1.31 0.00 0.00 55.95 58.00 2kh2 s SER 43 Cb -0.13 -2.36 0.10 0.00 0.21 0.00 0.00 66.02 63.85 2kh2 s SER 43 CO 0.02 -0.29 0.42 -0.04 0.41 0.00 0.00 173.24 173.76 2kh2 s MET 44 N 1.97 2.89 0.04 12.44 -1.94 0.19 -2.67 119.30 132.22 2kh2 s MET 44 Ca 0.29 -1.54 -0.23 0.00 -1.71 0.00 0.00 55.69 52.50 2kh2 s MET 44 Cb -0.16 -4.14 -0.06 0.00 2.01 0.00 0.00 34.83 32.49 2kh2 s MET 44 CO 0.10 -1.15 0.69 -1.12 -0.01 0.00 0.00 175.02 173.54 2kh2 s SER 45 N 2.94 7.14 -0.45 3.03 0.01 -1.07 -2.52 113.70 122.78 2kh2 s SER 45 Ca 0.04 1.36 -0.20 0.00 1.31 0.00 0.00 55.95 58.46 2kh2 s SER 45 Cb -0.27 -2.43 0.03 0.00 0.21 0.00 0.00 66.02 63.57 2kh2 s SER 45 CO 0.04 0.09 0.62 -0.36 0.41 0.00 0.00 173.24 174.03 2kh2 s PHE 46 N -0.30 3.07 0.40 2.43 0.40 -0.55 -0.24 117.98 123.19 2kh2 s PHE 46 Ca 0.35 -0.18 0.02 0.00 -0.60 0.00 0.00 56.93 56.52 2kh2 s PHE 46 Cb -0.20 -3.32 -0.01 0.00 0.51 0.00 0.00 43.02 40.00 2kh2 s PHE 46 CO 0.21 -0.88 0.59 0.14 0.70 0.00 0.00 175.22 175.98 2kh2 s VAL 47 N 2.71 4.15 -0.51 -0.44 -7.23 -1.02 -4.65 120.40 113.41 2kh2 s VAL 47 Ca 0.20 -0.66 -0.22 0.00 -1.81 0.00 0.00 61.98 59.49 2kh2 s VAL 47 Cb -0.15 -3.50 0.04 0.00 0.56 0.00 0.00 36.38 33.33 2kh2 s VAL 47 CO 0.17 -0.30 0.80 -1.10 -0.31 0.00 0.00 175.10 174.36 2kh2 s GLN 48 N -4.40 3.28 0.00 4.82 1.11 -1.22 -4.76 119.66 118.49 2kh2 s GLN 48 Ca 0.46 -0.41 0.00 0.00 0.01 0.00 0.00 55.36 55.42 2kh2 s GLN 48 Cb -0.10 -4.03 0.00 0.00 -1.01 0.00 0.00 33.01 27.87 2kh2 s GLN 48 CO 0.35 -1.30 0.00 0.41 0.01 0.00 0.00 175.29 174.77 2kh2 n GLY 49 N 5.10 0.77 3.17 3.09 0.00 -1.26 -5.00 105.19 111.06 2kh2 n GLY 49 Ca -0.01 0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 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 1.43 3.35 -0.92 1.61 2.56 -1.26 -4.98 118.70 120.49 2kh2 s GLU 50 Ca 0.00 -3.06 -0.04 0.00 0.00 0.00 0.00 54.97 51.87 2kh2 s GLU 50 Cb 0.00 -4.07 0.23 0.00 2.00 0.00 0.00 34.13 32.29 2kh2 s GLU 50 CO 0.00 -1.25 0.83 -2.00 -0.56 0.00 0.00 175.26 172.28 2kh2 s GLU 51 N -0.97 3.46 0.00 4.30 2.12 -1.26 -3.76 118.70 122.59 2kh2 s GLU 51 Ca 0.25 -3.18 0.00 0.00 0.36 0.00 0.00 54.97 52.41 2kh2 s GLU 51 Cb -0.10 -4.10 0.00 0.00 0.26 0.00 0.00 34.13 30.19 2kh2 s GLU 51 CO -0.10 -1.25 0.00 -1.13 -0.54 0.00 0.00 175.26 172.24 2kh2 n SER 52 N 2.57 0.00 0.00 -1.70 3.41 -1.19 -5.02 113.62 111.69 2kh2 n SER 52 Ca 0.21 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 2kh2 n SER 52 Cb 0.38 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 -1.49 0.00 -0.08 4.04 2.85 -1.26 -4.96 115.26 114.36 2kh2 n ASN 53 Ca 0.00 0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.28 2kh2 n ASN 53 Cb 0.00 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 40.90 2kh2 n ASN 53 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 2kh2 h ASP 54 N 0.00 0.03 -3.53 1.20 2.03 -1.95 -3.44 116.42 110.77 2kh2 h ASP 54 Ca 0.00 -0.74 -0.61 0.00 -0.73 0.00 0.00 57.03 54.95 2kh2 h ASP 54 Cb 0.00 -0.01 -0.12 0.00 -0.83 0.00 0.00 39.33 38.37 2kh2 h ASP 54 CO 0.00 1.30 0.10 -0.54 -1.03 0.00 0.00 179.24 179.07 2kh2 s LYS 55 N -2.31 4.04 -0.20 4.15 1.02 -1.26 -2.72 119.74 122.44 2kh2 s LYS 55 Ca -0.24 0.40 -0.03 0.00 0.02 0.00 0.00 55.97 56.12 2kh2 s LYS 55 Cb 0.02 -3.67 -0.01 0.00 -0.52 0.00 0.00 37.83 33.65 2kh2 s LYS 55 CO 0.65 -0.44 -0.06 0.42 -0.92 0.00 0.00 175.35 175.00 2kh2 s ILE 56 N 2.47 3.31 -0.55 2.17 -1.09 0.14 -3.15 121.20 124.49 2kh2 s ILE 56 Ca 0.24 -0.52 -0.28 0.00 -2.23 0.00 0.00 60.65 57.86 2kh2 s ILE 56 Cb -0.15 -2.48 0.03 0.00 -1.58 0.00 0.00 42.46 38.27 2kh2 s ILE 56 CO 0.10 0.44 1.15 -2.16 -1.23 0.00 0.00 174.94 173.24 2kh2 s PRO 57 N 1.27 3.54 0.11 2.79 0.04 -1.25 -0.41 135.00 141.10 2kh2 s PRO 57 Ca 0.03 0.25 0.04 0.00 0.04 0.00 0.00 61.00 61.36 2kh2 s PRO 57 Cb -0.14 -4.00 -0.04 0.00 0.04 0.00 0.00 34.50 30.36 2kh2 s PRO 57 CO -0.02 -1.59 -0.10 0.14 0.04 0.00 0.00 177.00 175.47 2kh2 s VAL 58 N 4.72 0.98 0.13 -0.36 -7.23 -0.22 -2.43 120.40 115.98 2kh2 s VAL 58 Ca 0.42 -1.82 0.03 0.00 -1.81 0.00 0.00 61.98 58.81 2kh2 s VAL 58 Cb -0.08 -1.56 -0.04 0.00 0.56 0.00 0.00 36.38 35.26 2kh2 s VAL 58 CO 0.26 -0.66 0.15 0.00 -0.31 0.00 0.00 175.10 174.54 2kh2 s ALA 59 N -2.90 3.69 -0.26 1.32 0.00 0.67 -0.29 121.76 124.00 2kh2 s ALA 59 Ca 0.10 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 50.99 2kh2 s ALA 59 Cb 0.00 -1.51 0.07 0.00 0.00 0.00 0.00 23.12 21.68 2kh2 s ALA 59 CO -0.01 0.62 -0.03 -0.51 0.00 0.00 0.00 175.76 175.83 2kh2 s LEU 60 N -2.86 2.88 0.12 0.00 1.02 -1.26 -2.59 118.68 116.00 2kh2 s LEU 60 Ca 0.32 -1.35 0.05 0.00 0.02 0.00 0.00 54.13 53.17 2kh2 s LEU 60 Cb -0.11 -1.24 -0.04 0.00 0.02 0.00 0.00 46.19 44.82 2kh2 s LEU 60 CO 0.24 -0.26 -0.12 -0.83 0.02 0.00 0.00 176.35 175.40 2kh2 s GLY 61 N 1.33 1.03 0.28 -3.19 0.00 -1.09 -0.93 107.32 104.75 2kh2 s GLY 61 Ca -0.03 -1.31 -0.29 0.00 0.00 0.00 0.00 44.72 43.09 2kh2 s GLY 61 CO -0.08 -1.38 1.12 1.08 0.00 0.00 0.00 173.10 173.84 2kh2 s LEU 62 N -2.60 4.54 0.13 0.66 1.02 -0.11 -0.50 118.68 121.82 2kh2 s LEU 62 Ca 0.10 2.30 -0.35 0.00 0.02 0.00 0.00 54.13 56.20 2kh2 s LEU 62 Cb -0.03 -3.63 -0.15 0.00 0.02 0.00 0.00 46.19 42.41 2kh2 s LEU 62 CO 0.02 -0.18 1.51 1.17 0.02 0.00 0.00 176.35 178.89 2kh2 n LYS 63 N 1.22 1.84 -2.53 1.70 4.81 -0.62 -1.74 118.16 122.85 2kh2 n LYS 63 Ca -0.01 0.66 -0.13 0.00 -0.87 0.00 0.00 58.31 57.97 2kh2 n LYS 63 Cb 0.45 -2.40 -0.00 0.00 0.02 0.00 0.00 35.03 33.09 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 3.20 -2.39 -4.31 1.64 0.28 -1.26 -4.95 120.64 112.86 2kh2 n GLU 64 Ca 0.17 0.58 -0.16 0.00 -0.16 0.00 0.00 57.16 57.59 2kh2 n GLU 64 Cb 0.26 -5.19 -0.10 0.00 1.43 0.00 0.00 31.44 27.84 2kh2 n GLU 64 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2kh2 s LYS 65 N -5.12 1.32 -0.12 3.44 1.02 -0.71 -5.03 119.74 114.54 2kh2 s LYS 65 Ca 0.04 -1.68 0.17 0.00 0.02 0.00 0.00 55.97 54.52 2kh2 s LYS 65 Cb -0.02 -0.43 0.68 0.00 -0.52 0.00 0.00 37.83 37.53 2kh2 s LYS 65 CO 0.05 -0.17 1.59 0.27 -0.92 0.00 0.00 175.35 176.16 2kh2 n ASN 66 N -0.40 4.60 -4.60 2.83 6.94 -1.26 -4.62 115.26 118.74 2kh2 n ASN 66 Ca -0.04 -2.50 -0.40 0.00 -0.02 0.00 0.00 54.58 51.62 2kh2 n ASN 66 Cb 0.65 -0.55 -0.07 0.00 -2.36 0.00 0.00 39.78 37.44 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 -1.93 4.14 0.12 -4.53 1.43 -1.26 -1.96 118.68 114.69 2kh2 s LEU 67 Ca 0.48 0.35 0.09 0.00 -1.03 0.00 0.00 54.13 54.02 2kh2 s LEU 67 Cb 0.32 -2.66 -0.04 0.00 0.03 0.00 0.00 46.19 43.84 2kh2 s LEU 67 CO 0.22 -0.37 -0.22 -0.31 0.23 0.00 0.00 176.35 175.90 2kh2 s TYR 68 N 2.39 1.91 -0.20 0.29 1.51 -0.57 -0.94 117.35 121.74 2kh2 s TYR 68 Ca 0.21 -0.41 -0.29 0.00 -1.01 0.00 0.00 57.07 55.57 2kh2 s TYR 68 Cb -0.15 -1.03 -0.02 0.00 -0.11 0.00 0.00 41.96 40.64 2kh2 s TYR 68 CO 0.11 0.25 1.45 -0.51 -1.11 0.00 0.00 175.55 175.74 2kh2 s LEU 69 N -2.03 4.03 -0.14 -1.29 1.43 -0.10 -0.54 118.68 120.05 2kh2 s LEU 69 Ca 0.09 1.64 -0.03 0.00 -1.03 0.00 0.00 54.13 54.80 2kh2 s LEU 69 Cb -0.10 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.56 2kh2 s LEU 69 CO 0.05 -1.03 -0.04 -0.55 0.23 0.00 0.00 176.35 175.00 2kh2 s SER 70 N 3.14 4.76 -0.43 2.29 0.15 0.10 -4.44 113.70 119.27 2kh2 s SER 70 Ca 0.64 -0.11 -0.13 0.00 0.70 0.00 0.00 55.95 57.05 2kh2 s SER 70 Cb -0.23 -1.67 0.06 0.00 -1.71 0.00 0.00 66.02 62.46 2kh2 s SER 70 CO 0.24 0.21 0.31 0.00 1.20 0.00 0.00 173.24 175.20 2kh2 s VAL 72 N 1.57 0.43 -0.26 0.00 -7.23 -0.95 -4.69 120.40 109.28 2kh2 s VAL 72 Ca 0.03 -1.97 -0.17 0.00 -1.81 0.00 0.00 61.98 58.07 2kh2 s VAL 72 Cb -0.22 -2.27 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 2kh2 s VAL 72 CO 0.06 -0.30 0.45 -0.76 -0.31 0.00 0.00 175.10 174.24 2kh2 s LEU 73 N -3.17 4.05 -0.19 1.32 1.43 -1.26 0.08 118.68 120.94 2kh2 s LEU 73 Ca 0.29 0.43 0.01 0.00 -1.03 0.00 0.00 54.13 53.83 2kh2 s LEU 73 Cb 0.07 -2.56 0.04 0.00 0.03 0.00 0.00 46.19 43.76 2kh2 s LEU 73 CO 0.07 -0.23 -0.12 -0.54 0.23 0.00 0.00 176.35 175.76 2kh2 s LYS 74 N 2.14 2.14 -1.14 1.70 1.02 0.62 -4.74 119.74 121.47 2kh2 s LYS 74 Ca 0.19 -0.80 -0.01 0.00 0.02 0.00 0.00 55.97 55.37 2kh2 s LYS 74 Cb -0.16 -2.37 -0.01 0.00 -0.52 0.00 0.00 37.83 34.77 2kh2 s LYS 74 CO 0.09 -0.38 0.96 -3.47 -0.92 0.00 0.00 175.35 171.63 2kh2 n ASP 75 N 4.69 -2.96 -2.40 2.83 -0.08 -1.26 -2.60 116.55 114.77 2kh2 n ASP 75 Ca -0.15 -0.62 -0.18 0.00 -1.51 0.00 0.00 54.79 52.32 2kh2 n ASP 75 Cb 0.47 -5.03 -0.01 0.00 2.34 0.00 0.00 41.12 38.89 2kh2 n ASP 75 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2kh2 n ASP 76 N -3.10 -5.30 -3.71 1.67 4.64 -1.26 -4.97 116.55 104.51 2kh2 n ASP 76 Ca -0.24 0.05 -0.12 0.00 -1.38 0.00 0.00 54.79 53.10 2kh2 n ASP 76 Cb 0.66 -4.44 -0.13 0.00 -1.04 0.00 0.00 41.12 36.17 2kh2 n ASP 76 CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 2kh2 s LYS 77 N -5.03 0.23 -0.02 -0.67 2.47 -1.07 -5.12 119.74 110.53 2kh2 s LYS 77 Ca 0.00 0.60 -0.30 0.00 -1.56 0.00 0.00 55.97 54.72 2kh2 s LYS 77 Cb 0.00 -0.09 -0.07 0.00 -1.46 0.00 0.00 37.83 36.21 2kh2 s LYS 77 CO 0.00 -0.18 1.91 -2.14 0.16 0.00 0.00 175.35 175.11 2kh2 s PRO 78 N 1.42 4.02 0.06 4.03 0.02 -1.26 -0.28 135.00 143.01 2kh2 s PRO 78 Ca -0.08 2.42 0.06 0.00 0.02 0.00 0.00 61.00 63.41 2kh2 s PRO 78 Cb -0.10 -4.14 -0.03 0.00 0.02 0.00 0.00 34.50 30.25 2kh2 s PRO 78 CO -0.09 -1.07 -0.16 0.99 -0.33 0.00 0.00 177.00 176.34 2kh2 s THR 79 N 4.82 1.25 0.14 0.99 2.01 0.11 -4.66 115.64 120.30 2kh2 s THR 79 Ca 0.86 -1.20 -0.11 0.00 0.31 0.00 0.00 61.69 61.55 2kh2 s THR 79 Cb -0.39 -1.15 -0.06 0.00 0.01 0.00 0.00 72.50 70.91 2kh2 s THR 79 CO 0.38 -0.06 0.48 -0.22 -0.69 0.00 0.00 174.62 174.51 2kh2 s LEU 80 N -1.45 4.31 0.29 4.42 2.96 -1.26 -2.23 118.68 125.72 2kh2 s LEU 80 Ca 0.02 0.90 -0.15 0.00 -0.22 0.00 0.00 54.13 54.68 2kh2 s LEU 80 Cb -0.09 -3.24 0.02 0.00 0.50 0.00 0.00 46.19 43.38 2kh2 s LEU 80 CO 0.02 0.09 0.62 0.00 -1.32 0.00 0.00 176.35 175.77 2kh2 s GLN 81 N -2.15 1.80 -0.29 1.98 -2.07 -0.52 -4.87 119.66 113.54 2kh2 s GLN 81 Ca 0.38 -1.24 -0.08 0.00 -1.82 0.00 0.00 55.36 52.60 2kh2 s GLN 81 Cb -0.14 0.55 -0.00 0.00 -1.09 0.00 0.00 33.01 32.33 2kh2 s GLN 81 CO 0.19 -0.80 0.10 -0.51 -1.32 0.00 0.00 175.29 172.96 2kh2 s LEU 82 N -3.01 3.85 -0.19 2.60 2.01 -1.26 0.01 118.68 122.68 2kh2 s LEU 82 Ca 0.18 -0.55 -0.07 0.00 0.01 0.00 0.00 54.13 53.70 2kh2 s LEU 82 Cb -0.03 -1.93 -0.04 0.00 0.01 0.00 0.00 46.19 44.20 2kh2 s LEU 82 CO 0.10 -0.16 0.05 -0.70 1.01 0.00 0.00 176.35 176.65 2kh2 s GLU 83 N 1.56 3.90 -0.68 1.70 2.12 0.30 -4.88 118.70 122.72 2kh2 s GLU 83 Ca 0.04 -0.38 -0.20 0.00 0.36 0.00 0.00 54.97 54.79 2kh2 s GLU 83 Cb -0.17 -3.20 0.10 0.00 0.26 0.00 0.00 34.13 31.13 2kh2 s GLU 83 CO 0.04 0.21 0.87 -1.54 -0.54 0.00 0.00 175.26 174.31 2kh2 s SER 84 N 0.52 6.28 0.48 -1.70 1.04 -1.26 -1.51 113.70 117.55 2kh2 s SER 84 Ca 0.02 -1.42 0.08 0.00 0.48 0.00 0.00 55.95 55.12 2kh2 s SER 84 Cb -0.13 -2.36 0.04 0.00 0.10 0.00 0.00 66.02 63.67 2kh2 s SER 84 CO 0.01 -1.21 0.66 0.68 0.98 0.00 0.00 173.24 174.36 2kh2 s VAL 85 N 3.11 2.69 0.05 5.02 -7.23 -0.83 -5.02 120.40 118.18 2kh2 s VAL 85 Ca 0.19 -0.98 -0.33 0.00 -1.81 0.00 0.00 61.98 59.05 2kh2 s VAL 85 Cb -0.18 -2.70 -0.12 0.00 0.56 0.00 0.00 36.38 33.94 2kh2 s VAL 85 CO 0.04 0.00 1.81 -0.67 -0.31 0.00 0.00 175.10 175.98 2kh2 n ASP 86 N -2.02 3.65 0.00 4.85 2.03 -1.26 -4.81 116.55 118.99 2kh2 n ASP 86 Ca 0.11 0.99 0.10 0.00 0.52 0.00 0.00 54.79 56.51 2kh2 n ASP 86 Cb 0.60 -1.46 0.44 0.00 -0.72 0.00 0.00 41.12 39.98 2kh2 n ASP 86 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2kh2 n PRO 87 N 5.69 0.08 -0.01 -0.67 -0.04 -1.26 -2.07 135.00 136.71 2kh2 n PRO 87 Ca 0.20 0.15 0.07 0.00 -0.04 0.00 0.00 63.50 63.88 2kh2 n PRO 87 Cb 0.33 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.16 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 -1.44 0.60 0.00 0.54 2.85 -1.26 -4.34 118.16 115.10 2kh2 n LYS 88 Ca 0.06 -0.15 0.11 0.00 -1.05 0.00 0.00 58.31 57.29 2kh2 n LYS 88 Cb 0.21 -1.42 0.04 0.00 -0.65 0.00 0.00 35.03 33.21 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 -2.15 2.42 -4.02 -5.58 3.02 -1.15 -4.92 115.26 102.89 2kh2 n ASN 89 Ca -0.05 -1.71 -0.17 0.00 -0.03 0.00 0.00 54.58 52.61 2kh2 n ASN 89 Cb 0.50 0.29 -0.14 0.00 -0.61 0.00 0.00 39.78 39.82 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 -2.29 0.73 0.77 3.10 1.51 -0.88 -4.36 117.35 115.92 2kh2 s TYR 90 Ca 0.22 -0.17 -0.12 0.00 -1.01 0.00 0.00 57.07 55.99 2kh2 s TYR 90 Cb 0.19 -0.46 0.17 0.00 -0.11 0.00 0.00 41.96 41.75 2kh2 s TYR 90 CO 0.47 -0.01 1.04 -0.35 -1.11 0.00 0.00 175.55 175.58 2kh2 n PRO 91 N 2.72 -0.94 -4.00 -1.71 -0.04 -1.26 -4.71 135.00 125.05 2kh2 n PRO 91 Ca -0.14 -1.69 -0.10 0.00 -0.04 0.00 0.00 63.50 61.53 2kh2 n PRO 91 Cb 0.57 -1.05 -0.07 0.00 -0.04 0.00 0.00 33.50 32.92 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 -5.26 1.33 0.17 0.54 -2.85 -1.26 -5.06 119.74 107.35 2kh2 s LYS 92 Ca 0.60 -1.26 -0.14 0.00 -1.00 0.00 0.00 55.97 54.17 2kh2 s LYS 92 Cb -0.02 0.40 0.10 0.00 -2.06 0.00 0.00 37.83 36.25 2kh2 s LYS 92 CO 0.42 -0.51 1.81 -0.22 0.10 0.00 0.00 175.35 176.94 2kh2 h LYS 93 N 2.42 0.58 -4.49 1.78 1.63 -1.96 -3.36 116.57 113.17 2kh2 h LYS 93 Ca -0.30 -0.03 -0.66 0.00 -0.85 0.00 0.00 60.65 58.81 2kh2 h LYS 93 Cb 1.24 -0.13 -0.40 0.00 -0.60 0.00 0.00 32.23 32.34 2kh2 h LYS 93 CO 0.43 0.38 -0.69 0.21 -3.45 0.00 0.00 179.45 176.33 2kh2 s LYS 94 N -6.14 1.59 0.76 1.90 2.47 -1.26 -3.43 119.74 115.64 2kh2 s LYS 94 Ca -0.13 -1.98 -0.11 0.00 -1.56 0.00 0.00 55.97 52.19 2kh2 s LYS 94 Cb 0.13 -3.25 0.06 0.00 -1.46 0.00 0.00 37.83 33.30 2kh2 s LYS 94 CO 0.74 -0.97 1.12 -1.64 0.16 0.00 0.00 175.35 174.76 2kh2 s MET 95 N 0.74 2.22 0.72 4.03 -1.94 -1.26 -5.03 119.30 118.78 2kh2 s MET 95 Ca 0.12 0.12 -0.15 0.00 -1.71 0.00 0.00 55.69 54.06 2kh2 s MET 95 Cb -0.20 -2.01 0.03 0.00 2.01 0.00 0.00 34.83 34.66 2kh2 s MET 95 CO -0.07 -1.39 1.18 -1.21 -0.01 0.00 0.00 175.02 173.53 2kh2 s GLU 96 N -5.46 2.27 0.51 2.03 8.01 -1.26 -4.85 118.70 119.96 2kh2 s GLU 96 Ca 0.61 1.68 0.17 0.00 0.01 0.00 0.00 54.97 57.43 2kh2 s GLU 96 Cb -0.11 -1.86 1.26 0.00 -4.31 0.00 0.00 34.13 29.11 2kh2 s GLU 96 CO 0.49 -1.72 2.11 -0.22 0.01 0.00 0.00 175.26 175.93 2kh2 h LYS 97 N -0.24 0.04 0.00 1.61 1.63 -1.96 0.61 116.57 118.27 2kh2 h LYS 97 Ca -0.47 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 2kh2 h LYS 97 Cb 1.28 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 2kh2 h LYS 97 CO 0.51 0.03 0.00 2.89 -3.45 0.00 0.00 179.45 179.42 2kh2 n ARG 98 N -4.51 0.38 -0.03 1.90 1.85 -1.26 -2.81 116.66 112.18 2kh2 n ARG 98 Ca -0.00 0.03 0.03 0.00 -1.00 0.00 0.00 57.85 56.91 2kh2 n ARG 98 Cb 0.18 -1.50 0.04 0.00 -1.05 0.00 0.00 32.46 30.14 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 -1.28 0.08 -3.56 2.89 3.72 0.17 -0.70 117.46 118.77 2kh2 n PHE 99 Ca 0.13 -0.16 -0.38 0.00 -0.05 0.00 0.00 57.45 56.98 2kh2 n PHE 99 Cb 0.21 -0.01 -0.11 0.00 -0.94 0.00 0.00 39.48 38.63 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 -0.65 5.29 0.08 -4.37 1.01 -1.02 -4.15 120.40 116.59 2kh2 s VAL 100 Ca 0.09 0.23 0.06 0.00 0.00 0.00 0.00 61.98 62.35 2kh2 s VAL 100 Cb 0.05 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2kh2 s VAL 100 CO 0.08 0.24 -0.07 -0.36 0.00 0.00 0.00 175.10 174.99 2kh2 s PHE 101 N 1.80 2.84 -0.67 5.22 0.40 0.60 -2.24 117.98 125.93 2kh2 s PHE 101 Ca 0.08 -0.10 -0.12 0.00 -0.60 0.00 0.00 56.93 56.19 2kh2 s PHE 101 Cb -0.16 -1.50 0.17 0.00 0.51 0.00 0.00 43.02 42.04 2kh2 s PHE 101 CO 0.11 0.43 0.58 -0.80 0.70 0.00 0.00 175.22 176.24 2kh2 s ASN 102 N -2.06 6.22 -0.68 1.36 0.02 0.28 -1.05 114.94 119.03 2kh2 s ASN 102 Ca 0.22 -2.37 -0.26 0.00 -1.02 0.00 0.00 52.86 49.43 2kh2 s ASN 102 Cb -0.11 -2.12 0.04 0.00 0.02 0.00 0.00 41.25 39.07 2kh2 s ASN 102 CO 0.14 -0.63 1.17 -0.75 0.02 0.00 0.00 177.10 177.04 2kh2 s LYS 103 N 0.67 3.24 0.24 -0.60 2.20 0.46 -0.69 119.74 125.26 2kh2 s LYS 103 Ca 0.12 -0.29 0.03 0.00 -0.36 0.00 0.00 55.97 55.47 2kh2 s LYS 103 Cb -0.19 -4.15 -0.03 0.00 -1.51 0.00 0.00 37.83 31.94 2kh2 s LYS 103 CO -0.04 -1.94 0.39 0.42 -0.36 0.00 0.00 175.35 173.82 2kh2 s ILE 104 N 5.08 5.23 -0.61 5.43 1.01 0.45 -0.69 121.20 137.11 2kh2 s ILE 104 Ca 0.33 -0.75 0.05 0.00 0.00 0.00 0.00 60.65 60.28 2kh2 s ILE 104 Cb -0.10 -3.83 0.18 0.00 0.01 0.00 0.00 42.46 38.73 2kh2 s ILE 104 CO 0.16 -0.32 0.49 -0.62 0.00 0.00 0.00 174.94 174.65 2kh2 n GLU 105 N -1.26 1.44 0.15 2.79 4.71 -1.10 -0.59 120.64 126.79 2kh2 n GLU 105 Ca -0.07 -4.11 -0.12 0.00 -0.01 0.00 0.00 57.16 52.85 2kh2 n GLU 105 Cb 0.56 -2.07 -0.06 0.00 -1.01 0.00 0.00 31.44 28.85 2kh2 n GLU 105 CO 0.00 0.00 0.00 -0.84 0.09 0.00 0.00 177.13 176.38 2kh2 h ILE 106 N 4.17 0.00 0.00 -3.67 3.07 -1.89 -3.46 117.51 115.72 2kh2 h ILE 106 Ca 0.18 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.59 2kh2 h ILE 106 Cb 0.79 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.34 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 -4.41 0.00 -1.07 2.16 0.23 -1.26 -4.96 115.26 105.95 2kh2 n ASN 107 Ca -0.07 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 54.08 2kh2 n ASN 107 Cb 0.29 0.00 0.24 0.00 -2.08 0.00 0.00 39.78 38.23 2kh2 n ASN 107 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2kh2 n ASN 108 N 0.00 3.46 -4.28 0.53 4.05 -1.26 -4.91 115.26 112.84 2kh2 n ASN 108 Ca 0.00 -1.97 -0.24 0.00 0.45 0.00 0.00 54.58 52.82 2kh2 n ASN 108 Cb 0.00 -0.33 -0.13 0.00 1.23 0.00 0.00 39.78 40.55 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 2kh2 s LYS 109 N -1.12 1.18 -0.06 1.20 -0.14 -1.26 -4.98 119.74 114.56 2kh2 s LYS 109 Ca 0.38 -1.11 0.02 0.00 -1.36 0.00 0.00 55.97 53.89 2kh2 s LYS 109 Cb 0.20 -1.42 -0.03 0.00 -1.68 0.00 0.00 37.83 34.91 2kh2 s LYS 109 CO 0.27 0.34 -0.09 -0.48 -0.76 0.00 0.00 175.35 174.63 2kh2 s LEU 110 N -1.74 3.06 0.14 3.17 2.34 -0.24 -3.15 118.68 122.26 2kh2 s LEU 110 Ca 0.07 -0.07 0.08 0.00 0.06 0.00 0.00 54.13 54.27 2kh2 s LEU 110 Cb -0.10 -1.66 -0.04 0.00 -0.56 0.00 0.00 46.19 43.83 2kh2 s LEU 110 CO 0.04 0.36 -0.11 -1.83 -1.06 0.00 0.00 176.35 173.74 2kh2 s GLU 111 N -0.82 2.03 -0.38 1.48 -1.05 0.25 -0.08 118.70 120.13 2kh2 s GLU 111 Ca 0.12 -1.16 -0.01 0.00 -0.15 0.00 0.00 54.97 53.78 2kh2 s GLU 111 Cb -0.11 -2.21 0.10 0.00 -0.44 0.00 0.00 34.13 31.48 2kh2 s GLU 111 CO 0.01 0.47 0.15 -0.06 0.95 0.00 0.00 175.26 176.78 2kh2 s PHE 112 N -1.41 3.63 0.26 4.83 0.40 -1.26 -0.41 117.98 124.02 2kh2 s PHE 112 Ca 0.22 -2.58 -0.09 0.00 -0.60 0.00 0.00 56.93 53.88 2kh2 s PHE 112 Cb -0.10 -3.09 -0.07 0.00 0.51 0.00 0.00 43.02 40.27 2kh2 s PHE 112 CO 0.14 -0.96 0.58 -2.00 0.70 0.00 0.00 175.22 173.68 2kh2 s GLU 113 N 1.07 3.79 -0.13 0.44 2.12 0.13 -1.77 118.70 124.36 2kh2 s GLU 113 Ca 0.08 0.28 -0.20 0.00 0.36 0.00 0.00 54.97 55.50 2kh2 s GLU 113 Cb -0.22 -2.61 -0.04 0.00 0.26 0.00 0.00 34.13 31.53 2kh2 s GLU 113 CO -0.05 0.26 0.58 0.45 -0.54 0.00 0.00 175.26 175.96 2kh2 s SER 114 N -2.52 6.77 0.22 -1.70 0.15 0.27 0.10 113.70 116.99 2kh2 s SER 114 Ca 0.48 0.92 -0.03 0.00 0.70 0.00 0.00 55.95 58.02 2kh2 s SER 114 Cb -0.11 -2.34 0.20 0.00 -1.71 0.00 0.00 66.02 62.07 2kh2 s SER 114 CO 0.23 -0.11 1.61 0.00 1.20 0.00 0.00 173.24 176.17 2kh2 h ALA 115 N 6.95 0.87 -0.55 5.45 0.00 -1.69 -2.97 119.26 127.31 2kh2 h ALA 115 Ca -0.38 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.03 2kh2 h ALA 115 Cb 1.17 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2kh2 h ALA 115 CO 0.76 0.63 -0.03 0.37 0.00 0.00 0.00 179.25 180.98 2kh2 h GLN 116 N 0.58 1.00 -4.23 0.00 5.75 -1.78 -3.39 115.11 113.03 2kh2 h GLN 116 Ca 0.07 -0.33 -0.64 0.00 -0.15 0.00 0.00 58.65 57.59 2kh2 h GLN 116 Cb 0.81 -0.08 -0.40 0.00 1.07 0.00 0.00 27.48 28.88 2kh2 h GLN 116 CO 0.07 1.01 -0.71 -0.06 -2.65 0.00 0.00 178.83 176.48 2kh2 s PHE 117 N -4.97 3.26 0.35 3.99 0.08 -1.13 -5.11 117.98 114.46 2kh2 s PHE 117 Ca -0.12 -2.80 -0.28 0.00 0.12 0.00 0.00 56.93 53.85 2kh2 s PHE 117 Cb 0.13 -2.67 -0.11 0.00 -0.57 0.00 0.00 43.02 39.80 2kh2 s PHE 117 CO 0.85 -0.90 1.42 -1.25 -0.10 0.00 0.00 175.22 175.24 2kh2 s PRO 118 N 0.81 4.20 0.00 0.24 0.04 -1.21 -2.42 135.00 136.67 2kh2 s PRO 118 Ca 0.12 2.43 0.00 0.00 0.04 0.00 0.00 61.00 63.59 2kh2 s PRO 118 Cb -0.20 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.33 2kh2 s PRO 118 CO -0.09 -0.41 0.00 0.09 0.04 0.00 0.00 177.00 176.63 2kh2 n ASN 119 N 0.69 -2.51 -4.36 6.66 5.03 -1.26 -5.00 115.26 114.50 2kh2 n ASN 119 Ca 0.01 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.09 2kh2 n ASN 119 Cb 0.40 -0.80 -0.13 0.00 -1.02 0.00 0.00 39.78 38.24 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 -2.31 3.12 0.24 3.10 0.52 -1.02 -4.44 118.94 118.15 2kh2 s TRP 120 Ca 0.00 -0.86 0.11 0.00 0.02 0.00 0.00 56.10 55.37 2kh2 s TRP 120 Cb 0.00 -2.24 -0.05 0.00 -1.15 0.00 0.00 33.47 30.03 2kh2 s TRP 120 CO 0.00 -0.53 -0.16 0.71 0.02 0.00 0.00 176.95 176.99 2kh2 s TYR 121 N 1.52 2.41 0.03 -1.98 1.51 0.87 -0.56 117.35 121.14 2kh2 s TYR 121 Ca 0.04 -0.31 -0.30 0.00 -1.01 0.00 0.00 57.07 55.49 2kh2 s TYR 121 Cb -0.16 -1.10 -0.07 0.00 -0.11 0.00 0.00 41.96 40.51 2kh2 s TYR 121 CO 0.02 0.62 1.65 0.42 -1.11 0.00 0.00 175.55 177.15 2kh2 s ILE 122 N -2.16 3.25 0.14 2.71 1.01 -0.73 -0.35 121.20 125.07 2kh2 s ILE 122 Ca 0.27 0.58 0.08 0.00 0.00 0.00 0.00 60.65 61.58 2kh2 s ILE 122 Cb -0.06 -3.37 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 2kh2 s ILE 122 CO 0.15 -0.02 -0.18 -0.44 0.00 0.00 0.00 174.94 174.44 2kh2 s SER 123 N 2.73 2.51 -0.05 3.58 0.01 0.63 -4.47 113.70 118.65 2kh2 s SER 123 Ca 0.74 -0.79 -0.03 0.00 1.31 0.00 0.00 55.95 57.17 2kh2 s SER 123 Cb -0.37 -0.14 0.02 0.00 0.21 0.00 0.00 66.02 65.74 2kh2 s SER 123 CO 0.31 -0.02 0.12 0.42 0.41 0.00 0.00 173.24 174.48 2kh2 s THR 124 N -1.74 -0.02 0.84 1.44 -4.23 -0.93 -2.23 115.64 108.77 2kh2 s THR 124 Ca 0.11 0.06 -0.11 0.00 -1.18 0.00 0.00 61.69 60.57 2kh2 s THR 124 Cb -0.07 -0.18 0.09 0.00 1.34 0.00 0.00 72.50 73.68 2kh2 s THR 124 CO 0.05 0.02 1.09 -0.44 -0.54 0.00 0.00 174.62 174.81 2kh2 s SER 125 N 0.42 4.00 0.52 3.99 0.01 -1.26 -0.30 113.70 121.07 2kh2 s SER 125 Ca -0.03 1.61 0.31 0.00 1.31 0.00 0.00 55.95 59.14 2kh2 s SER 125 Cb -0.04 -2.30 1.10 0.00 0.21 0.00 0.00 66.02 64.99 2kh2 s SER 125 CO -0.02 -2.32 1.89 1.56 0.41 0.00 0.00 173.24 174.76 2kh2 h GLN 126 N -1.33 0.00 -7.01 12.44 1.08 -1.97 -3.45 115.11 114.87 2kh2 h GLN 126 Ca -0.47 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.23 2kh2 h GLN 126 Cb 1.26 0.00 0.05 0.00 -0.05 0.00 0.00 27.48 28.74 2kh2 h GLN 126 CO 0.54 0.02 0.45 0.00 -0.95 0.00 0.00 178.83 178.89 2kh2 s ALA 127 N -3.56 2.94 0.46 3.87 0.00 -1.26 -5.02 121.76 119.20 2kh2 s ALA 127 Ca 0.02 0.84 -0.20 0.00 0.00 0.00 0.00 51.96 52.62 2kh2 s ALA 127 Cb 0.08 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 2kh2 s ALA 127 CO 0.58 -0.55 1.00 -2.00 0.00 0.00 0.00 175.76 174.79 2kh2 s GLU 128 N -2.80 3.97 -0.83 0.00 2.56 -1.26 -3.79 118.70 116.54 2kh2 s GLU 128 Ca 0.64 1.26 0.00 0.00 0.00 0.00 0.00 54.97 56.87 2kh2 s GLU 128 Cb -0.25 -2.13 0.00 0.00 2.00 0.00 0.00 34.13 33.75 2kh2 s GLU 128 CO 0.31 -0.27 0.00 -1.71 -0.56 0.00 0.00 175.26 173.02 2kh2 n ASN 129 N -0.85 -3.44 -4.83 -1.70 5.15 -1.21 -5.02 115.26 103.37 2kh2 n ASN 129 Ca 0.08 0.07 -0.38 0.00 -0.60 0.00 0.00 54.58 53.75 2kh2 n ASN 129 Cb 0.53 -2.40 -0.06 0.00 -0.53 0.00 0.00 39.78 37.32 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 -3.90 3.88 1.10 1.20 -1.94 -1.22 -4.89 119.30 113.54 2kh2 s MET 130 Ca 0.00 0.28 -0.17 0.00 -1.71 0.00 0.00 55.69 54.09 2kh2 s MET 130 Cb 0.00 -3.25 0.24 0.00 2.01 0.00 0.00 34.83 33.83 2kh2 s MET 130 CO 0.00 0.63 1.14 -2.14 -0.01 0.00 0.00 175.02 174.65 2kh2 s PRO 131 N -0.81 -0.43 -0.22 2.03 0.02 -1.26 -0.38 135.00 133.94 2kh2 s PRO 131 Ca 0.21 0.00 -0.10 0.00 0.02 0.00 0.00 61.00 61.14 2kh2 s PRO 131 Cb -0.15 -1.68 -0.05 0.00 0.02 0.00 0.00 34.50 32.64 2kh2 s PRO 131 CO 0.10 -3.20 0.14 0.08 -0.33 0.00 0.00 177.00 173.79 2kh2 s VAL 132 N -3.17 5.28 0.30 3.83 1.01 -0.31 -4.64 120.40 122.70 2kh2 s VAL 132 Ca 0.70 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.86 2kh2 s VAL 132 Cb -0.11 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 2kh2 s VAL 132 CO 0.55 0.38 0.18 0.72 0.00 0.00 0.00 175.10 176.93 2kh2 s PHE 133 N 0.82 1.58 -0.23 5.22 -0.12 -0.95 -4.83 117.98 119.46 2kh2 s PHE 133 Ca 0.07 -1.42 -0.09 0.00 -0.05 0.00 0.00 56.93 55.44 2kh2 s PHE 133 Cb -0.13 -0.80 -0.04 0.00 -0.63 0.00 0.00 43.02 41.42 2kh2 s PHE 133 CO 0.02 -0.59 0.12 -1.17 -0.05 0.00 0.00 175.22 173.55 2kh2 s LEU 134 N -3.35 3.90 0.17 -1.99 2.96 -1.26 -0.27 118.68 118.84 2kh2 s LEU 134 Ca 0.37 0.03 0.07 0.00 -0.22 0.00 0.00 54.13 54.37 2kh2 s LEU 134 Cb 0.05 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 2kh2 s LEU 134 CO 0.19 0.07 -0.13 -0.83 -1.32 0.00 0.00 176.35 174.32 2kh2 s GLY 135 N 1.04 1.27 -0.07 7.98 0.00 0.53 -4.86 107.32 113.21 2kh2 s GLY 135 Ca 0.06 -1.55 0.11 0.00 0.00 0.00 0.00 44.72 43.34 2kh2 s GLY 135 CO 0.04 -1.64 1.20 0.61 0.00 0.00 0.00 173.10 173.31 2kh2 n GLY 136 N -0.15 3.62 2.56 0.20 0.00 -1.26 -0.09 105.19 110.07 2kh2 n GLY 136 Ca -0.10 -0.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.92 2kh2 n GLY 136 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2kh2 n THR 137 N -0.46 5.38 -1.64 2.61 -1.04 -1.26 -4.94 114.28 112.91 2kh2 n THR 137 Ca 0.12 -4.86 -0.43 0.00 -2.04 0.00 0.00 64.05 56.84 2kh2 n THR 137 Cb 0.53 -1.81 -0.03 0.00 -1.82 0.00 0.00 70.33 67.21 2kh2 n THR 137 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2kh2 n LYS 138 N 0.89 2.61 -1.28 -2.82 4.81 -1.26 -0.91 118.16 120.20 2kh2 n LYS 138 Ca 0.55 0.91 -0.02 0.00 -0.87 0.00 0.00 58.31 58.89 2kh2 n LYS 138 Cb 0.27 -3.05 -0.01 0.00 0.02 0.00 0.00 35.03 32.26 2kh2 n LYS 138 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kh2 n GLY 139 N 4.87 0.48 0.00 3.14 0.00 -1.26 -5.03 105.19 107.39 2kh2 n GLY 139 Ca 0.23 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.35 1.09 0.12 -0.02 0.00 -0.08 -5.02 105.19 98.93 2kh2 n GLY 140 Ca -0.02 -0.75 -0.21 0.00 0.00 0.00 0.00 46.02 45.04 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 0.24 -6.88 1.61 7.50 -1.96 -3.46 115.11 112.17 2kh2 h GLN 141 Ca 0.00 -0.42 -0.49 0.00 0.50 0.00 0.00 58.65 58.24 2kh2 h GLN 141 Cb 0.00 0.16 0.02 0.00 0.05 0.00 0.00 27.48 27.70 2kh2 h GLN 141 CO 0.00 1.20 0.44 -0.51 -1.50 0.00 0.00 178.83 178.46 2kh2 s ASP 142 N -7.00 7.03 0.00 1.46 1.01 -1.26 -4.60 116.67 113.30 2kh2 s ASP 142 Ca -0.19 2.16 -0.30 0.00 0.71 0.00 0.00 52.55 54.93 2kh2 s ASP 142 Cb 0.03 -2.61 -0.06 0.00 1.01 0.00 0.00 42.92 41.29 2kh2 s ASP 142 CO 0.77 -0.31 1.56 -0.63 0.21 0.00 0.00 175.17 176.78 2kh2 s ILE 143 N -1.39 3.46 -0.67 0.77 1.01 0.58 -4.64 121.20 120.32 2kh2 s ILE 143 Ca 0.51 0.78 0.06 0.00 0.00 0.00 0.00 60.65 61.99 2kh2 s ILE 143 Cb -0.27 -3.50 0.07 0.00 0.01 0.00 0.00 42.46 38.76 2kh2 s ILE 143 CO 0.35 -0.03 0.77 0.35 0.00 0.00 0.00 174.94 176.38 2kh2 n THR 144 N 4.97 0.19 -4.77 2.92 -2.24 -1.26 -2.19 114.28 111.90 2kh2 n THR 144 Ca 0.15 -0.60 -0.30 0.00 -2.27 0.00 0.00 64.05 61.04 2kh2 n THR 144 Cb 0.42 1.00 -0.14 0.00 -2.10 0.00 0.00 70.33 69.51 2kh2 n THR 144 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2kh2 s ASP 145 N -0.57 3.36 0.35 3.42 -4.77 -1.26 -4.50 116.67 112.69 2kh2 s ASP 145 Ca 0.08 -0.57 0.04 0.00 -3.30 0.00 0.00 52.55 48.80 2kh2 s ASP 145 Cb 0.05 -0.37 -0.03 0.00 -1.09 0.00 0.00 42.92 41.48 2kh2 s ASP 145 CO 0.07 0.25 0.17 -0.36 0.70 0.00 0.00 175.17 176.00 2kh2 s PHE 146 N -0.87 1.71 0.08 2.11 0.40 0.88 -3.60 117.98 118.68 2kh2 s PHE 146 Ca 0.13 -1.40 0.08 0.00 -0.60 0.00 0.00 56.93 55.14 2kh2 s PHE 146 Cb -0.10 -0.94 -0.03 0.00 0.51 0.00 0.00 43.02 42.45 2kh2 s PHE 146 CO 0.03 -0.51 -0.22 0.95 0.70 0.00 0.00 175.22 176.18 2kh2 s THR 147 N -3.42 1.77 -0.35 0.64 -4.23 0.13 -1.08 115.64 109.10 2kh2 s THR 147 Ca 0.32 -1.40 -0.12 0.00 -1.18 0.00 0.00 61.69 59.31 2kh2 s THR 147 Cb 0.03 -1.57 -0.00 0.00 1.34 0.00 0.00 72.50 72.31 2kh2 s THR 147 CO 0.19 0.09 0.23 -0.32 -0.54 0.00 0.00 174.62 174.27 2kh2 s MET 148 N -1.57 3.28 -0.72 3.99 1.75 -1.26 -2.88 119.30 121.89 2kh2 s MET 148 Ca 0.08 -0.78 -0.09 0.00 -1.25 0.00 0.00 55.69 53.64 2kh2 s MET 148 Cb -0.09 -3.77 0.19 0.00 2.84 0.00 0.00 34.83 33.99 2kh2 s MET 148 CO 0.03 -0.52 0.61 -0.65 -0.65 0.00 0.00 175.02 173.83 2kh2 s GLN 149 N 1.67 3.11 0.03 4.11 1.11 0.37 -4.95 119.66 125.10 2kh2 s GLN 149 Ca 0.05 -2.45 -0.32 0.00 0.01 0.00 0.00 55.36 52.65 2kh2 s GLN 149 Cb -0.18 -4.11 -0.11 0.00 -1.01 0.00 0.00 33.01 27.60 2kh2 s GLN 149 CO 0.09 -1.24 1.88 1.19 0.01 0.00 0.00 175.29 177.22 2kh2 n PHE 150 N 3.84 2.46 -3.89 0.91 3.72 -1.26 -0.62 117.46 122.62 2kh2 n PHE 150 Ca 0.10 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 2kh2 n PHE 150 Cb 0.43 -2.72 0.00 0.00 -0.94 0.00 0.00 39.48 36.25 2kh2 n PHE 150 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 2kh2 n VAL 151 N 5.02 0.00 0.00 -4.37 0.24 -1.19 -4.93 118.33 113.10 2kh2 n VAL 151 Ca 0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.50 2kh2 n VAL 151 Cb 0.35 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 2kh2 n VAL 151 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2kh2 n SER 152 N -2.25 0.00 0.00 -1.34 3.41 -1.26 -4.63 113.62 107.55 2kh2 n SER 152 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2kh2 n SER 152 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68