#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 -5.05 0.00 0.11 -2.07 -3.42 132.00 121.57 2kh2 h PRO 2 Ca 0.00 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.46 2kh2 h PRO 2 Cb 0.00 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 30.95 2kh2 h PRO 2 CO 0.00 0.62 -0.25 0.54 -0.21 0.00 0.00 178.00 178.70 2kh2 s VAL 3 N -3.32 5.16 0.18 3.15 0.11 -1.26 -5.06 120.40 119.34 2kh2 s VAL 3 Ca 0.00 0.25 -0.20 0.00 -2.93 0.00 0.00 61.98 59.10 2kh2 s VAL 3 Cb 0.11 -3.79 -0.08 0.00 -1.53 0.00 0.00 36.38 31.09 2kh2 s VAL 3 CO 0.75 -0.02 0.69 -0.13 -3.33 0.00 0.00 175.10 173.07 2kh2 s ARG 4 N 2.07 4.29 -0.04 1.54 0.52 -1.26 -4.98 118.95 121.09 2kh2 s ARG 4 Ca 0.13 0.87 -0.11 0.00 -0.52 0.00 0.00 55.73 56.11 2kh2 s ARG 4 Cb -0.16 -3.03 0.02 0.00 0.52 0.00 0.00 34.95 32.30 2kh2 s ARG 4 CO 0.11 0.48 0.24 -1.12 0.02 0.00 0.00 175.30 175.04 2kh2 s SER 5 N -1.45 -0.15 0.19 0.23 0.01 -1.26 -1.53 113.70 109.73 2kh2 s SER 5 Ca 0.38 0.14 0.02 0.00 1.31 0.00 0.00 55.95 57.80 2kh2 s SER 5 Cb -0.18 0.35 -0.05 0.00 0.21 0.00 0.00 66.02 66.35 2kh2 s SER 5 CO 0.22 -0.31 0.03 -1.48 0.41 0.00 0.00 173.24 172.10 2kh2 s LEU 6 N -0.87 1.99 -0.10 2.44 2.34 -0.43 -4.95 118.68 119.10 2kh2 s LEU 6 Ca -0.10 -1.22 0.02 0.00 0.06 0.00 0.00 54.13 52.90 2kh2 s LEU 6 Cb -0.05 -0.02 0.01 0.00 -0.56 0.00 0.00 46.19 45.57 2kh2 s LEU 6 CO 0.02 -0.61 -0.17 0.20 -1.06 0.00 0.00 176.35 174.73 2kh2 s ASN 7 N -3.20 2.51 0.14 1.48 0.01 -1.26 -0.15 114.94 114.47 2kh2 s ASN 7 Ca 0.27 -0.45 -0.19 0.00 -0.71 0.00 0.00 52.86 51.79 2kh2 s ASN 7 Cb 0.06 -1.14 0.05 0.00 0.41 0.00 0.00 41.25 40.64 2kh2 s ASN 7 CO 0.06 0.05 0.48 0.00 -1.51 0.00 0.00 177.10 176.18 2kh2 s THR 9 N -3.76 4.37 -0.12 0.00 2.01 0.25 -0.43 115.64 117.97 2kh2 s THR 9 Ca 0.02 -0.53 -0.02 0.00 0.31 0.00 0.00 61.69 61.48 2kh2 s THR 9 Cb 0.01 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 2kh2 s THR 9 CO -0.12 0.37 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.36 2kh2 s LEU 10 N -1.62 3.17 0.13 4.42 1.43 -1.26 -1.39 118.68 123.55 2kh2 s LEU 10 Ca 0.21 -0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 2kh2 s LEU 10 Cb -0.12 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 2kh2 s LEU 10 CO 0.12 0.25 -0.09 -0.13 0.23 0.00 0.00 176.35 176.72 2kh2 s ARG 11 N -0.10 0.97 0.00 1.70 0.52 -1.06 -4.25 118.95 116.72 2kh2 s ARG 11 Ca 0.01 -1.40 0.00 0.00 -0.52 0.00 0.00 55.73 53.82 2kh2 s ARG 11 Cb -0.13 -0.45 0.00 0.00 0.52 0.00 0.00 34.95 34.89 2kh2 s ARG 11 CO 0.03 0.04 0.00 -0.40 0.02 0.00 0.00 175.30 174.98 2kh2 n ASP 12 N -0.13 0.00 0.00 0.23 5.68 -1.03 0.98 116.55 122.28 2kh2 n ASP 12 Ca -0.11 -0.93 0.08 0.00 -0.50 0.00 0.00 54.79 53.33 2kh2 n ASP 12 Cb 0.61 0.00 0.37 0.00 -1.14 0.00 0.00 41.12 40.96 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 -2.79 0.00 -0.70 -1.12 7.64 -1.21 -1.96 113.62 113.48 2kh2 n SER 13 Ca 0.00 0.35 0.10 0.00 1.01 0.00 0.00 58.87 60.34 2kh2 n SER 13 Cb 0.00 -0.43 0.05 0.00 -1.01 0.00 0.00 64.21 62.82 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 -1.43 1.76 -2.18 1.43 1.13 -1.26 -4.96 117.38 111.87 2kh2 n GLN 14 Ca 0.05 -1.46 -0.07 0.00 -1.94 0.00 0.00 57.00 53.59 2kh2 n GLN 14 Cb 0.17 -1.41 -0.00 0.00 0.11 0.00 0.00 30.24 29.11 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 0.72 -0.68 -3.45 -1.09 1.13 -0.83 -5.02 117.38 108.17 2kh2 n GLN 15 Ca 0.11 0.33 -0.37 0.00 -1.94 0.00 0.00 57.00 55.12 2kh2 n GLN 15 Cb 0.49 -4.18 -0.06 0.00 0.11 0.00 0.00 30.24 26.61 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 -4.41 4.19 0.36 -1.09 1.02 -1.26 -4.41 119.74 114.13 2kh2 s LYS 16 Ca 0.01 0.30 0.07 0.00 0.02 0.00 0.00 55.97 56.38 2kh2 s LYS 16 Cb -0.01 -3.37 -0.02 0.00 -0.52 0.00 0.00 37.83 33.91 2kh2 s LYS 16 CO 0.02 0.33 0.34 -1.12 -0.92 0.00 0.00 175.35 174.00 2kh2 s SER 17 N 0.12 5.29 0.06 2.83 0.01 -0.12 -2.45 113.70 119.44 2kh2 s SER 17 Ca 0.22 -0.54 -0.06 0.00 1.31 0.00 0.00 55.95 56.88 2kh2 s SER 17 Cb -0.15 -0.87 -0.05 0.00 0.21 0.00 0.00 66.02 65.17 2kh2 s SER 17 CO 0.09 -0.46 0.32 -0.76 0.41 0.00 0.00 173.24 172.83 2kh2 s LEU 18 N -4.06 4.34 -0.00 2.44 1.43 -1.26 -1.04 118.68 120.52 2kh2 s LEU 18 Ca 0.44 0.58 0.02 0.00 -1.03 0.00 0.00 54.13 54.14 2kh2 s LEU 18 Cb -0.06 -2.93 -0.01 0.00 0.03 0.00 0.00 46.19 43.23 2kh2 s LEU 18 CO 0.28 0.18 -0.05 -0.69 0.23 0.00 0.00 176.35 176.29 2kh2 s VAL 19 N -1.43 0.42 -0.39 -1.59 1.01 -0.05 -2.18 120.40 116.18 2kh2 s VAL 19 Ca 0.33 -0.27 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 2kh2 s VAL 19 Cb -0.13 -0.37 0.00 0.00 0.00 0.00 0.00 36.38 35.88 2kh2 s VAL 19 CO 0.20 0.09 1.55 -0.32 0.00 0.00 0.00 175.10 176.61 2kh2 s MET 20 N -0.21 3.47 -0.12 2.72 1.75 -1.26 -1.31 119.30 124.34 2kh2 s MET 20 Ca 0.01 1.08 0.13 0.00 -1.25 0.00 0.00 55.69 55.66 2kh2 s MET 20 Cb -0.02 -4.09 -0.19 0.00 2.84 0.00 0.00 34.83 33.36 2kh2 s MET 20 CO -0.00 -1.70 0.11 0.43 -0.65 0.00 0.00 175.02 173.21 2kh2 n SER 21 N 9.41 1.43 -4.34 1.11 7.64 -1.15 -4.97 113.62 122.75 2kh2 n SER 21 Ca 0.19 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.89 2kh2 n SER 21 Cb 0.48 1.04 -0.10 0.00 -1.01 0.00 0.00 64.21 64.61 2kh2 n SER 21 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2kh2 s GLY 22 N -4.57 1.60 0.34 0.23 0.00 0.10 -4.99 107.32 100.02 2kh2 s GLY 22 Ca -0.07 -1.79 0.03 0.00 0.00 0.00 0.00 44.72 42.89 2kh2 s GLY 22 CO 0.60 -1.68 1.96 -2.55 0.00 0.00 0.00 173.10 171.44 2kh2 h PRO 23 N 2.44 0.87 0.00 2.90 0.11 -2.03 -3.10 132.00 133.19 2kh2 h PRO 23 Ca -0.38 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2kh2 h PRO 23 Cb 1.22 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2kh2 h PRO 23 CO 0.65 0.57 0.00 0.66 -0.21 0.00 0.00 178.00 179.67 2kh2 n TYR 24 N -4.46 0.00 -5.10 0.65 4.01 -1.26 -5.04 117.16 105.96 2kh2 n TYR 24 Ca 0.10 -0.19 -0.29 0.00 -0.16 0.00 0.00 57.90 57.36 2kh2 n TYR 24 Cb 0.16 -0.02 -0.16 0.00 -0.31 0.00 0.00 39.34 39.01 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 -0.38 2.08 0.46 -0.72 2.12 -1.17 -3.85 118.70 117.22 2kh2 s GLU 25 Ca 0.00 -0.79 0.04 0.00 0.36 0.00 0.00 54.97 54.58 2kh2 s GLU 25 Cb 0.00 -1.85 -0.04 0.00 0.26 0.00 0.00 34.13 32.49 2kh2 s GLU 25 CO 0.00 0.39 0.04 -0.51 -0.54 0.00 0.00 175.26 174.63 2kh2 s LEU 26 N -0.25 2.64 -0.04 2.70 1.43 -1.26 0.01 118.68 123.91 2kh2 s LEU 26 Ca 0.01 -1.46 -0.10 0.00 -1.03 0.00 0.00 54.13 51.55 2kh2 s LEU 26 Cb -0.11 -0.88 0.02 0.00 0.03 0.00 0.00 46.19 45.24 2kh2 s LEU 26 CO 0.02 -0.65 0.23 -0.54 0.23 0.00 0.00 176.35 175.63 2kh2 s LYS 27 N -3.82 0.46 -0.02 1.70 1.02 -0.43 -4.05 119.74 114.61 2kh2 s LYS 27 Ca 0.23 -0.04 -0.18 0.00 0.02 0.00 0.00 55.97 56.00 2kh2 s LYS 27 Cb 0.05 0.21 -0.05 0.00 -0.52 0.00 0.00 37.83 37.52 2kh2 s LYS 27 CO 0.12 -0.10 0.51 0.00 -0.92 0.00 0.00 175.35 174.95 2kh2 s ALA 28 N -0.77 3.57 0.10 5.17 0.00 -0.31 -0.88 121.76 128.64 2kh2 s ALA 28 Ca -0.09 -0.09 -0.11 0.00 0.00 0.00 0.00 51.96 51.67 2kh2 s ALA 28 Cb -0.05 -2.59 0.01 0.00 0.00 0.00 0.00 23.12 20.49 2kh2 s ALA 28 CO 0.02 0.26 0.27 -0.51 0.00 0.00 0.00 175.76 175.80 2kh2 s LEU 29 N -0.43 1.04 -0.68 0.00 1.43 -0.21 -1.05 118.68 118.78 2kh2 s LEU 29 Ca 0.27 -0.52 -0.26 0.00 -1.03 0.00 0.00 54.13 52.59 2kh2 s LEU 29 Cb -0.17 1.33 0.04 0.00 0.03 0.00 0.00 46.19 47.42 2kh2 s LEU 29 CO 0.15 -0.77 1.14 -1.00 0.23 0.00 0.00 176.35 176.10 2kh2 s HIS 30 N -3.82 2.48 0.16 0.29 3.76 -1.26 -0.94 115.29 115.97 2kh2 s HIS 30 Ca 0.04 -0.15 -0.28 0.00 -0.15 0.00 0.00 55.06 54.52 2kh2 s HIS 30 Cb 0.04 -4.46 -0.08 0.00 1.11 0.00 0.00 32.58 29.19 2kh2 s HIS 30 CO -0.11 -1.82 0.88 -0.51 -0.85 0.00 0.00 174.74 172.32 2kh2 s LEU 31 N 4.97 4.57 0.00 0.89 1.02 -1.26 -4.98 118.68 123.90 2kh2 s LEU 31 Ca 0.32 1.76 -0.08 0.00 0.02 0.00 0.00 54.13 56.15 2kh2 s LEU 31 Cb -0.11 -3.47 0.03 0.00 0.02 0.00 0.00 46.19 42.66 2kh2 s LEU 31 CO 0.15 0.10 0.46 0.00 0.02 0.00 0.00 176.35 177.09 2kh2 n GLN 32 N 1.99 0.66 0.00 1.70 6.02 -1.26 -4.93 117.38 121.56 2kh2 n GLN 32 Ca -0.02 -1.44 0.00 0.00 -0.01 0.00 0.00 57.00 55.53 2kh2 n GLN 32 Cb 0.48 1.72 0.00 0.00 1.02 0.00 0.00 30.24 33.46 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 -0.34 0.94 1.19 1.08 0.00 -1.26 -2.56 105.19 104.25 2kh2 n GLY 33 Ca -0.05 -0.67 0.04 0.00 0.00 0.00 0.00 46.02 45.35 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 2.98 -0.16 1.61 -0.06 -1.26 -3.58 117.38 116.91 2kh2 n GLN 34 Ca 0.00 -1.71 0.06 0.00 -2.00 0.00 0.00 57.00 53.36 2kh2 n GLN 34 Cb 0.00 -1.83 0.15 0.00 -4.06 0.00 0.00 30.24 24.50 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 0.40 2.86 0.22 1.69 9.92 -1.06 -4.46 116.55 126.13 2kh2 n ASP 35 Ca 0.15 -1.90 0.09 0.00 -0.53 0.00 0.00 54.79 52.60 2kh2 n ASP 35 Cb 0.71 -0.21 0.50 0.00 -0.64 0.00 0.00 41.12 41.48 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 2.38 0.00 0.00 -1.24 4.05 -1.58 -2.89 114.93 115.65 2kh2 h MET 36 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2kh2 h MET 36 Cb 0.72 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.52 2kh2 h MET 36 CO 0.00 0.25 0.00 0.39 0.23 0.00 0.00 176.91 177.78 2kh2 n GLU 37 N -3.60 0.73 -0.19 0.39 -0.58 -1.26 -2.59 120.64 113.54 2kh2 n GLU 37 Ca -0.01 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.81 2kh2 n GLU 37 Cb 0.39 -1.21 0.22 0.00 -0.57 0.00 0.00 31.44 30.27 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 -0.71 1.97 -2.13 3.49 6.02 -1.09 -4.92 117.38 120.01 2kh2 n GLN 38 Ca 0.08 -1.51 -0.34 0.00 -0.01 0.00 0.00 57.00 55.22 2kh2 n GLN 38 Cb 0.03 -1.35 0.01 0.00 1.02 0.00 0.00 30.24 29.95 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 -1.49 3.26 0.18 -1.09 -2.07 -1.07 -4.77 119.66 112.61 2kh2 s GLN 39 Ca 0.30 1.45 -0.18 0.00 -1.82 0.00 0.00 55.36 55.12 2kh2 s GLN 39 Cb 0.16 -2.01 -0.08 0.00 -1.09 0.00 0.00 33.01 29.99 2kh2 s GLN 39 CO 0.21 -0.89 0.64 0.08 -1.32 0.00 0.00 175.29 174.01 2kh2 s VAL 40 N -2.06 4.69 -0.13 3.63 1.01 -0.92 -5.03 120.40 121.59 2kh2 s VAL 40 Ca 0.69 1.11 -0.03 0.00 0.00 0.00 0.00 61.98 63.75 2kh2 s VAL 40 Cb -0.21 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 2kh2 s VAL 40 CO 0.31 0.26 -0.02 -0.69 0.00 0.00 0.00 175.10 174.97 2kh2 s VAL 41 N -1.46 4.13 -0.20 2.92 1.01 -1.26 -4.66 120.40 120.88 2kh2 s VAL 41 Ca 0.40 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.00 2kh2 s VAL 41 Cb -0.16 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 2kh2 s VAL 41 CO 0.20 0.54 0.10 -0.36 0.00 0.00 0.00 175.10 175.58 2kh2 s PHE 42 N -0.19 3.29 -0.05 5.22 0.08 0.43 -1.39 117.98 125.37 2kh2 s PHE 42 Ca 0.04 0.12 -0.19 0.00 0.12 0.00 0.00 56.93 57.03 2kh2 s PHE 42 Cb -0.13 -2.15 -0.05 0.00 -0.57 0.00 0.00 43.02 40.13 2kh2 s PHE 42 CO 0.02 0.13 0.53 -1.12 -0.10 0.00 0.00 175.22 174.68 2kh2 s SER 43 N 0.60 6.85 -0.31 1.36 0.01 0.53 -1.57 113.70 121.17 2kh2 s SER 43 Ca 0.05 1.01 -0.01 0.00 1.31 0.00 0.00 55.95 58.31 2kh2 s SER 43 Cb -0.13 -2.32 0.06 0.00 0.21 0.00 0.00 66.02 63.84 2kh2 s SER 43 CO 0.01 0.08 0.01 -0.04 0.41 0.00 0.00 173.24 173.71 2kh2 s MET 44 N 0.03 2.35 0.13 12.44 -1.94 0.79 -2.59 119.30 130.51 2kh2 s MET 44 Ca 0.29 -1.34 -0.12 0.00 -1.71 0.00 0.00 55.69 52.80 2kh2 s MET 44 Cb -0.17 -3.20 -0.07 0.00 2.01 0.00 0.00 34.83 33.41 2kh2 s MET 44 CO 0.14 -0.67 0.50 -1.12 -0.01 0.00 0.00 175.02 173.86 2kh2 s SER 45 N 1.28 6.74 -0.69 3.03 0.01 -1.23 -1.31 113.70 121.54 2kh2 s SER 45 Ca -0.04 0.96 -0.22 0.00 1.31 0.00 0.00 55.95 57.96 2kh2 s SER 45 Cb -0.20 -2.24 0.07 0.00 0.21 0.00 0.00 66.02 63.86 2kh2 s SER 45 CO -0.02 0.11 0.99 -0.36 0.41 0.00 0.00 173.24 174.37 2kh2 s PHE 46 N -1.47 2.70 0.74 2.43 0.40 -0.58 -2.30 117.98 119.89 2kh2 s PHE 46 Ca 0.37 -0.61 -0.09 0.00 -0.60 0.00 0.00 56.93 56.00 2kh2 s PHE 46 Cb -0.14 -4.30 0.06 0.00 0.51 0.00 0.00 43.02 39.14 2kh2 s PHE 46 CO 0.19 -1.65 1.07 0.14 0.70 0.00 0.00 175.22 175.68 2kh2 s VAL 47 N 4.00 2.36 -0.46 -0.44 -7.23 -1.25 -4.77 120.40 112.61 2kh2 s VAL 47 Ca 0.23 -0.09 -0.14 0.00 -1.81 0.00 0.00 61.98 60.17 2kh2 s VAL 47 Cb -0.16 -3.07 0.07 0.00 0.56 0.00 0.00 36.38 33.79 2kh2 s VAL 47 CO 0.08 -0.08 0.36 -1.58 -0.31 0.00 0.00 175.10 173.57 2kh2 s GLN 48 N -5.36 2.89 0.00 4.82 2.00 -1.16 -4.83 119.66 118.01 2kh2 s GLN 48 Ca 0.60 -1.36 0.00 0.00 -2.00 0.00 0.00 55.36 52.60 2kh2 s GLN 48 Cb -0.11 -4.04 0.00 0.00 0.80 0.00 0.00 33.01 29.67 2kh2 s GLN 48 CO 0.47 -1.00 0.00 0.41 -0.50 0.00 0.00 175.29 174.67 2kh2 n GLY 49 N 5.13 3.85 3.55 2.59 0.00 -1.26 -5.00 105.19 114.05 2kh2 n GLY 49 Ca -0.12 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 44.85 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 1.82 2.57 -0.33 1.61 2.56 -1.26 -4.91 118.70 120.76 2kh2 s GLU 50 Ca 0.00 0.55 -0.04 0.00 0.00 0.00 0.00 54.97 55.48 2kh2 s GLU 50 Cb 0.00 -4.48 0.05 0.00 2.00 0.00 0.00 34.13 31.70 2kh2 s GLU 50 CO 0.00 -2.86 0.07 -2.00 -0.56 0.00 0.00 175.26 169.91 2kh2 s GLU 51 N 7.14 2.46 0.00 4.30 2.12 -1.26 -3.89 118.70 129.57 2kh2 s GLU 51 Ca 0.70 -1.30 0.00 0.00 0.36 0.00 0.00 54.97 54.72 2kh2 s GLU 51 Cb -0.12 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.91 2kh2 s GLU 51 CO 0.18 -0.70 0.00 -1.13 -0.54 0.00 0.00 175.26 173.07 2kh2 n SER 52 N 4.70 1.73 -0.08 -1.70 3.41 0.46 -5.01 113.62 117.13 2kh2 n SER 52 Ca -0.12 -0.88 -0.14 0.00 -0.26 0.00 0.00 58.87 57.47 2kh2 n SER 52 Cb 0.44 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.35 2kh2 n SER 52 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2kh2 h ASN 53 N 0.00 0.97 -0.28 4.04 -0.26 -2.01 -3.28 115.58 114.76 2kh2 h ASN 53 Ca 0.00 -0.51 -0.03 0.00 -0.56 0.00 0.00 56.30 55.20 2kh2 h ASN 53 Cb 0.00 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 36.96 2kh2 h ASN 53 CO 0.00 1.31 0.00 -0.90 -1.06 0.00 0.00 177.43 176.78 2kh2 n ASP 54 N -4.01 3.69 -3.58 5.81 5.75 -1.26 -4.92 116.55 118.02 2kh2 n ASP 54 Ca -0.04 -3.13 -0.09 0.00 -0.01 0.00 0.00 54.79 51.52 2kh2 n ASP 54 Cb 0.61 -0.56 -0.09 0.00 -1.03 0.00 0.00 41.12 40.05 2kh2 n ASP 54 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2kh2 s LYS 55 N -2.90 0.31 -0.17 0.11 2.20 -1.24 -2.38 119.74 115.68 2kh2 s LYS 55 Ca 0.43 0.88 0.01 0.00 -0.36 0.00 0.00 55.97 56.93 2kh2 s LYS 55 Cb 0.35 0.09 0.02 0.00 -1.51 0.00 0.00 37.83 36.79 2kh2 s LYS 55 CO 0.08 -0.36 -0.18 0.42 -0.36 0.00 0.00 175.35 174.95 2kh2 s ILE 56 N 2.58 1.91 -0.09 5.43 -1.09 0.12 -0.40 121.20 129.66 2kh2 s ILE 56 Ca 0.02 -0.87 -0.30 0.00 -2.23 0.00 0.00 60.65 57.28 2kh2 s ILE 56 Cb -0.13 -1.76 -0.02 0.00 -1.58 0.00 0.00 42.46 38.98 2kh2 s ILE 56 CO -0.13 0.49 1.08 -2.16 -1.23 0.00 0.00 174.94 172.99 2kh2 s PRO 57 N 1.35 4.39 0.21 2.79 0.04 -1.25 -0.41 135.00 142.11 2kh2 s PRO 57 Ca 0.04 1.50 -0.06 0.00 0.04 0.00 0.00 61.00 62.53 2kh2 s PRO 57 Cb -0.13 -3.55 -0.02 0.00 0.04 0.00 0.00 34.50 30.83 2kh2 s PRO 57 CO -0.12 -0.38 0.26 0.14 0.04 0.00 0.00 177.00 176.94 2kh2 s VAL 58 N 2.13 0.02 0.01 -0.36 -7.23 -0.36 -3.76 120.40 110.84 2kh2 s VAL 58 Ca 0.51 -1.72 0.02 0.00 -1.81 0.00 0.00 61.98 58.98 2kh2 s VAL 58 Cb -0.21 -2.29 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 2kh2 s VAL 58 CO 0.19 -0.07 -0.01 0.00 -0.31 0.00 0.00 175.10 174.90 2kh2 s ALA 59 N -4.08 3.25 -0.31 1.32 0.00 -0.97 -0.34 121.76 120.63 2kh2 s ALA 59 Ca 0.30 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.30 2kh2 s ALA 59 Cb 0.04 -1.29 0.08 0.00 0.00 0.00 0.00 23.12 21.95 2kh2 s ALA 59 CO 0.09 0.65 -0.01 -0.51 0.00 0.00 0.00 175.76 175.97 2kh2 s LEU 60 N -1.63 4.15 0.13 0.00 1.43 -1.26 -3.49 118.68 118.01 2kh2 s LEU 60 Ca 0.20 -1.74 0.05 0.00 -1.03 0.00 0.00 54.13 51.61 2kh2 s LEU 60 Cb -0.11 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 2kh2 s LEU 60 CO 0.11 -0.30 -0.12 -0.83 0.23 0.00 0.00 176.35 175.44 2kh2 s GLY 61 N 1.08 1.06 0.02 -3.19 0.00 -1.07 -1.04 107.32 104.19 2kh2 s GLY 61 Ca 0.01 -1.35 -0.30 0.00 0.00 0.00 0.00 44.72 43.07 2kh2 s GLY 61 CO -0.06 -1.43 1.22 1.08 0.00 0.00 0.00 173.10 173.92 2kh2 s LEU 62 N -2.71 4.34 0.31 0.66 1.02 0.57 -0.35 118.68 122.52 2kh2 s LEU 62 Ca 0.11 1.97 -0.29 0.00 0.02 0.00 0.00 54.13 55.95 2kh2 s LEU 62 Cb -0.02 -3.57 -0.13 0.00 0.02 0.00 0.00 46.19 42.49 2kh2 s LEU 62 CO 0.02 -0.53 1.25 1.17 0.02 0.00 0.00 176.35 178.27 2kh2 n LYS 63 N 4.45 1.92 -2.33 1.70 4.81 -0.48 -2.05 118.16 126.18 2kh2 n LYS 63 Ca 0.10 0.68 -0.11 0.00 -0.87 0.00 0.00 58.31 58.11 2kh2 n LYS 63 Cb 0.46 -2.22 -0.01 0.00 0.02 0.00 0.00 35.03 33.28 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 0.87 -2.20 -4.11 1.64 0.28 -1.26 -4.93 120.64 110.92 2kh2 n GLU 64 Ca 0.07 0.54 -0.09 0.00 -0.16 0.00 0.00 57.16 57.52 2kh2 n GLU 64 Cb 0.34 -5.09 -0.10 0.00 1.43 0.00 0.00 31.44 28.02 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 -4.80 0.87 -0.57 3.44 1.02 -0.87 -5.05 119.74 113.78 2kh2 s LYS 65 Ca 0.00 -1.35 0.01 0.00 0.02 0.00 0.00 55.97 54.64 2kh2 s LYS 65 Cb 0.00 0.25 0.50 0.00 -0.52 0.00 0.00 37.83 38.06 2kh2 s LYS 65 CO 0.00 -0.24 1.91 0.27 -0.92 0.00 0.00 175.35 176.37 2kh2 n ASN 66 N -0.06 6.35 -4.28 2.83 6.94 -1.26 -4.64 115.26 121.14 2kh2 n ASN 66 Ca -0.08 -3.75 -0.34 0.00 -0.02 0.00 0.00 54.58 50.39 2kh2 n ASN 66 Cb 0.63 -0.88 -0.15 0.00 -2.36 0.00 0.00 39.78 37.03 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 -3.67 2.67 0.12 -4.53 1.43 -1.26 -0.79 118.68 112.66 2kh2 s LEU 67 Ca 0.61 -0.44 0.08 0.00 -1.03 0.00 0.00 54.13 53.35 2kh2 s LEU 67 Cb 0.49 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 45.02 2kh2 s LEU 67 CO 0.02 0.02 -0.19 -0.31 0.23 0.00 0.00 176.35 176.13 2kh2 s TYR 68 N 1.21 1.70 -0.26 0.29 1.51 -0.58 -0.32 117.35 120.90 2kh2 s TYR 68 Ca 0.02 -0.46 -0.29 0.00 -1.01 0.00 0.00 57.07 55.33 2kh2 s TYR 68 Cb -0.14 -0.90 -0.00 0.00 -0.11 0.00 0.00 41.96 40.81 2kh2 s TYR 68 CO -0.04 0.23 1.27 -0.51 -1.11 0.00 0.00 175.55 175.39 2kh2 s LEU 69 N -2.22 3.98 -0.05 -1.29 1.43 -0.21 -0.62 118.68 119.70 2kh2 s LEU 69 Ca 0.09 1.35 0.03 0.00 -1.03 0.00 0.00 54.13 54.57 2kh2 s LEU 69 Cb -0.08 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.57 2kh2 s LEU 69 CO 0.05 -0.97 -0.13 -0.55 0.23 0.00 0.00 176.35 174.98 2kh2 s SER 70 N 2.47 4.15 -0.30 2.29 0.15 0.12 -4.56 113.70 118.03 2kh2 s SER 70 Ca 0.55 -0.17 -0.09 0.00 0.70 0.00 0.00 55.95 56.94 2kh2 s SER 70 Cb -0.18 -0.91 -0.02 0.00 -1.71 0.00 0.00 66.02 63.21 2kh2 s SER 70 CO 0.20 0.35 0.14 0.00 1.20 0.00 0.00 173.24 175.13 2kh2 s VAL 72 N 1.63 0.51 -0.31 0.00 -7.23 -0.56 -4.74 120.40 109.70 2kh2 s VAL 72 Ca 0.05 -1.99 -0.09 0.00 -1.81 0.00 0.00 61.98 58.14 2kh2 s VAL 72 Cb -0.17 -2.46 -0.00 0.00 0.56 0.00 0.00 36.38 34.31 2kh2 s VAL 72 CO 0.06 -0.14 0.13 -0.76 -0.31 0.00 0.00 175.10 174.08 2kh2 s LEU 73 N -3.25 4.05 -0.17 1.32 1.43 -1.26 0.36 118.68 121.15 2kh2 s LEU 73 Ca 0.34 -0.58 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2kh2 s LEU 73 Cb 0.07 -1.97 0.03 0.00 0.03 0.00 0.00 46.19 44.35 2kh2 s LEU 73 CO 0.10 -0.20 -0.14 -0.54 0.23 0.00 0.00 176.35 175.81 2kh2 s LYS 74 N 1.58 2.37 -1.12 1.70 1.02 0.29 -4.73 119.74 120.85 2kh2 s LYS 74 Ca 0.04 -0.72 -0.00 0.00 0.02 0.00 0.00 55.97 55.31 2kh2 s LYS 74 Cb -0.17 -2.31 -0.00 0.00 -0.52 0.00 0.00 37.83 34.83 2kh2 s LYS 74 CO 0.05 -0.29 0.93 -3.47 -0.92 0.00 0.00 175.35 171.65 2kh2 n ASP 75 N 4.71 -2.26 -2.25 2.83 4.64 -1.26 -2.48 116.55 120.48 2kh2 n ASP 75 Ca -0.17 -0.59 -0.19 0.00 -1.38 0.00 0.00 54.79 52.46 2kh2 n ASP 75 Cb 0.49 -4.85 -0.02 0.00 -1.04 0.00 0.00 41.12 35.70 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 -3.00 -5.46 -3.72 1.67 9.92 -1.26 -4.97 116.55 109.73 2kh2 n ASP 76 Ca -0.26 0.11 -0.12 0.00 -0.53 0.00 0.00 54.79 53.98 2kh2 n ASP 76 Cb 0.66 -4.61 -0.13 0.00 -0.64 0.00 0.00 41.12 36.40 2kh2 n ASP 76 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2kh2 s LYS 77 N -4.78 0.20 0.01 -1.24 2.47 -1.03 -5.13 119.74 110.24 2kh2 s LYS 77 Ca 0.00 0.56 -0.30 0.00 -1.56 0.00 0.00 55.97 54.67 2kh2 s LYS 77 Cb 0.00 -0.11 -0.07 0.00 -1.46 0.00 0.00 37.83 36.19 2kh2 s LYS 77 CO 0.00 -0.18 1.73 -2.14 0.16 0.00 0.00 175.35 174.93 2kh2 s PRO 78 N 1.41 4.18 0.12 4.03 0.02 -1.26 -0.55 135.00 142.94 2kh2 s PRO 78 Ca -0.08 2.35 0.06 0.00 0.02 0.00 0.00 61.00 63.35 2kh2 s PRO 78 Cb -0.11 -3.90 -0.04 0.00 0.02 0.00 0.00 34.50 30.48 2kh2 s PRO 78 CO -0.09 -0.84 -0.14 0.95 -0.33 0.00 0.00 177.00 176.55 2kh2 s THR 79 N 3.66 1.34 -0.12 0.99 -4.23 0.16 -4.70 115.64 112.73 2kh2 s THR 79 Ca 0.77 -1.68 -0.04 0.00 -1.18 0.00 0.00 61.69 59.56 2kh2 s THR 79 Cb -0.38 -1.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.93 2kh2 s THR 79 CO 0.33 -0.38 0.05 -0.22 -0.54 0.00 0.00 174.62 173.87 2kh2 s LEU 80 N -2.37 3.83 0.13 4.79 2.96 -1.26 -1.50 118.68 125.26 2kh2 s LEU 80 Ca 0.08 0.20 -0.08 0.00 -0.22 0.00 0.00 54.13 54.11 2kh2 s LEU 80 Cb -0.06 -1.91 -0.01 0.00 0.50 0.00 0.00 46.19 44.71 2kh2 s LEU 80 CO 0.03 0.33 0.22 0.00 -1.32 0.00 0.00 176.35 175.62 2kh2 s GLN 81 N -0.58 1.01 -0.90 1.98 -2.07 -0.53 -4.86 119.66 113.70 2kh2 s GLN 81 Ca 0.11 -1.11 -0.16 0.00 -1.82 0.00 0.00 55.36 52.38 2kh2 s GLN 81 Cb -0.12 0.35 0.18 0.00 -1.09 0.00 0.00 33.01 32.34 2kh2 s GLN 81 CO 0.02 -0.34 0.95 -0.51 -1.32 0.00 0.00 175.29 174.09 2kh2 s LEU 82 N -2.93 5.98 -0.02 2.60 2.01 -1.25 0.16 118.68 125.23 2kh2 s LEU 82 Ca 0.13 -2.48 -0.30 0.00 0.01 0.00 0.00 54.13 51.49 2kh2 s LEU 82 Cb 0.04 -2.29 -0.04 0.00 0.01 0.00 0.00 46.19 43.91 2kh2 s LEU 82 CO -0.04 -0.77 1.21 -0.70 1.01 0.00 0.00 176.35 177.06 2kh2 s GLU 83 N 1.19 4.37 -0.41 1.70 2.12 0.21 -4.72 118.70 123.16 2kh2 s GLU 83 Ca 0.25 1.71 -0.26 0.00 0.36 0.00 0.00 54.97 57.03 2kh2 s GLU 83 Cb -0.08 -3.51 0.02 0.00 0.26 0.00 0.00 34.13 30.82 2kh2 s GLU 83 CO -0.09 -0.41 0.97 -1.12 -0.54 0.00 0.00 175.26 174.07 2kh2 s SER 84 N 1.41 6.64 0.12 -1.70 0.01 -1.26 -1.53 113.70 117.39 2kh2 s SER 84 Ca 0.57 0.46 0.00 0.00 1.31 0.00 0.00 55.95 58.29 2kh2 s SER 84 Cb -0.26 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2kh2 s SER 84 CO 0.24 -0.97 0.00 1.33 0.41 0.00 0.00 173.24 174.25 2kh2 n VAL 85 N 6.23 0.00 -3.38 3.43 0.24 0.03 -5.02 118.33 119.85 2kh2 n VAL 85 Ca 0.08 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.96 2kh2 n VAL 85 Cb 0.48 -1.19 -0.09 0.00 -1.47 0.00 0.00 33.84 31.57 2kh2 n VAL 85 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2kh2 s ASP 86 N -1.00 6.18 0.57 -1.34 3.68 -1.26 -4.91 116.67 118.59 2kh2 s ASP 86 Ca 0.00 -0.38 0.26 0.00 2.13 0.00 0.00 52.55 54.56 2kh2 s ASP 86 Cb 0.00 -2.20 1.56 0.00 -1.45 0.00 0.00 42.92 40.83 2kh2 s ASP 86 CO 0.00 -0.41 2.09 1.55 0.13 0.00 0.00 175.17 178.53 2kh2 h PRO 87 N 8.54 0.00 0.00 4.34 0.13 -1.91 0.03 132.00 143.13 2kh2 h PRO 87 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2kh2 h PRO 87 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2kh2 h PRO 87 CO 0.72 0.00 -0.73 0.36 -0.23 0.00 0.00 178.00 178.12 2kh2 n LYS 88 N -4.01 0.23 -0.02 0.86 2.85 -1.26 -3.95 118.16 112.87 2kh2 n LYS 88 Ca 0.02 0.04 0.05 0.00 -1.05 0.00 0.00 58.31 57.38 2kh2 n LYS 88 Cb 0.35 -1.62 0.06 0.00 -0.65 0.00 0.00 35.03 33.16 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 2.03 -4.08 -5.58 3.02 -0.36 -4.99 115.26 103.35 2kh2 n ASN 89 Ca 0.03 -1.52 -0.15 0.00 -0.03 0.00 0.00 54.58 52.91 2kh2 n ASN 89 Cb 0.42 -0.03 -0.12 0.00 -0.61 0.00 0.00 39.78 39.44 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 -0.92 0.83 0.68 3.10 1.51 -0.15 -4.52 117.35 117.87 2kh2 s TYR 90 Ca 0.14 -0.42 -0.03 0.00 -1.01 0.00 0.00 57.07 55.75 2kh2 s TYR 90 Cb 0.09 -0.49 0.09 0.00 -0.11 0.00 0.00 41.96 41.54 2kh2 s TYR 90 CO 0.14 -0.03 0.95 -1.25 -1.11 0.00 0.00 175.55 174.25 2kh2 s PRO 91 N -1.37 2.00 0.06 -1.71 0.04 -1.26 -4.72 135.00 128.03 2kh2 s PRO 91 Ca -0.05 -0.77 -0.00 0.00 0.04 0.00 0.00 61.00 60.22 2kh2 s PRO 91 Cb -0.09 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 2kh2 s PRO 91 CO 0.01 -1.24 -0.04 -1.59 0.04 0.00 0.00 177.00 174.18 2kh2 s LYS 92 N -5.10 0.65 0.13 4.56 -2.85 -1.26 -5.07 119.74 110.80 2kh2 s LYS 92 Ca 0.63 -1.22 -0.16 0.00 -1.00 0.00 0.00 55.97 54.22 2kh2 s LYS 92 Cb -0.08 0.12 -0.00 0.00 -2.06 0.00 0.00 37.83 35.80 2kh2 s LYS 92 CO 0.43 -0.09 1.67 -0.22 0.10 0.00 0.00 175.35 177.25 2kh2 h LYS 93 N 3.18 0.62 -3.76 1.78 3.64 -1.99 -3.33 116.57 116.70 2kh2 h LYS 93 Ca -0.34 -0.12 -0.79 0.00 -1.27 0.00 0.00 60.65 58.13 2kh2 h LYS 93 Cb 1.15 -0.10 -0.27 0.00 -0.41 0.00 0.00 32.23 32.61 2kh2 h LYS 93 CO 0.65 0.59 0.21 0.21 -2.27 0.00 0.00 179.45 178.83 2kh2 s LYS 94 N -5.51 3.79 0.42 1.90 2.47 -1.26 -3.00 119.74 118.55 2kh2 s LYS 94 Ca -0.13 -2.69 -0.07 0.00 -1.56 0.00 0.00 55.97 51.52 2kh2 s LYS 94 Cb 0.10 -4.47 0.10 0.00 -1.46 0.00 0.00 37.83 32.10 2kh2 s LYS 94 CO 0.76 -1.28 0.58 -1.33 0.16 0.00 0.00 175.35 174.23 2kh2 n MET 95 N 3.60 -0.54 -2.02 4.03 2.81 -1.25 -5.06 117.12 118.68 2kh2 n MET 95 Ca 0.17 -0.90 -0.31 0.00 -1.81 0.00 0.00 57.70 54.84 2kh2 n MET 95 Cb 0.45 -0.59 -0.00 0.00 -0.71 0.00 0.00 33.22 32.37 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 -4.24 3.68 0.56 0.03 8.01 -1.26 -4.94 118.70 120.53 2kh2 s GLU 96 Ca 0.33 0.83 0.31 0.00 0.01 0.00 0.00 54.97 56.45 2kh2 s GLU 96 Cb -0.01 -2.09 1.65 0.00 -4.31 0.00 0.00 34.13 29.37 2kh2 s GLU 96 CO 0.23 -0.50 2.14 -0.22 0.01 0.00 0.00 175.26 176.92 2kh2 h LYS 97 N 0.06 0.00 -0.01 1.61 1.63 -1.97 0.37 116.57 118.27 2kh2 h LYS 97 Ca -0.45 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 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 0.62 0.07 -0.16 2.89 -3.45 0.00 0.00 179.45 179.42 2kh2 n ARG 98 N -3.53 1.01 -0.20 1.90 1.85 -1.26 -3.43 116.66 112.99 2kh2 n ARG 98 Ca -0.02 -0.53 0.07 0.00 -1.00 0.00 0.00 57.85 56.36 2kh2 n ARG 98 Cb 0.19 -1.49 0.15 0.00 -1.05 0.00 0.00 32.46 30.27 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 -0.53 0.42 -5.21 2.89 3.72 0.10 -1.99 117.46 116.85 2kh2 n PHE 99 Ca 0.15 -0.74 -0.31 0.00 -0.05 0.00 0.00 57.45 56.49 2kh2 n PHE 99 Cb 0.33 -0.15 -0.15 0.00 -0.94 0.00 0.00 39.48 38.56 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 -2.03 2.27 0.10 -4.37 1.01 -1.10 -4.38 120.40 111.90 2kh2 s VAL 100 Ca 0.27 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 61.29 2kh2 s VAL 100 Cb 0.21 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 2kh2 s VAL 100 CO 0.07 0.58 -0.16 -0.36 0.00 0.00 0.00 175.10 175.24 2kh2 s PHE 101 N -0.60 1.45 -0.49 5.22 0.08 0.54 -2.38 117.98 121.80 2kh2 s PHE 101 Ca 0.09 -0.48 -0.17 0.00 0.12 0.00 0.00 56.93 56.50 2kh2 s PHE 101 Cb -0.10 -0.78 0.07 0.00 -0.57 0.00 0.00 43.02 41.64 2kh2 s PHE 101 CO -0.00 0.14 0.49 -0.80 -0.10 0.00 0.00 175.22 174.94 2kh2 s ASN 102 N -2.05 6.18 -0.38 1.36 0.01 0.23 -1.23 114.94 119.05 2kh2 s ASN 102 Ca 0.04 -1.24 -0.26 0.00 -0.71 0.00 0.00 52.86 50.69 2kh2 s ASN 102 Cb -0.08 -2.22 0.02 0.00 0.41 0.00 0.00 41.25 39.37 2kh2 s ASN 102 CO 0.03 -0.76 0.95 -0.75 -1.51 0.00 0.00 177.10 175.06 2kh2 s LYS 103 N 1.99 3.83 -0.15 -0.60 2.20 0.45 -0.52 119.74 126.94 2kh2 s LYS 103 Ca 0.08 0.59 -0.04 0.00 -0.36 0.00 0.00 55.97 56.23 2kh2 s LYS 103 Cb -0.23 -3.81 -0.03 0.00 -1.51 0.00 0.00 37.83 32.25 2kh2 s LYS 103 CO 0.08 -0.99 -0.03 0.42 -0.36 0.00 0.00 175.35 174.47 2kh2 s ILE 104 N 3.58 4.01 -0.25 5.43 1.01 0.17 0.15 121.20 135.31 2kh2 s ILE 104 Ca 0.39 -0.32 -0.07 0.00 0.00 0.00 0.00 60.65 60.66 2kh2 s ILE 104 Cb -0.11 -2.76 -0.02 0.00 0.01 0.00 0.00 42.46 39.57 2kh2 s ILE 104 CO 0.20 0.50 0.05 -1.61 0.00 0.00 0.00 174.94 174.08 2kh2 s GLU 105 N 0.28 3.59 0.00 2.79 8.01 -1.00 0.38 118.70 132.75 2kh2 s GLU 105 Ca -0.02 -0.51 0.00 0.00 0.01 0.00 0.00 54.97 54.44 2kh2 s GLU 105 Cb -0.14 -3.27 0.00 0.00 -4.31 0.00 0.00 34.13 26.41 2kh2 s GLU 105 CO 0.03 -0.20 0.00 0.44 0.01 0.00 0.00 175.26 175.54 2kh2 n ILE 106 N 4.90 0.00 0.00 -1.63 -5.35 -0.20 -4.87 119.36 112.20 2kh2 n ILE 106 Ca -0.16 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.32 2kh2 n ILE 106 Cb 0.51 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.41 2kh2 n ILE 106 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 2kh2 n ASN 107 N 0.00 0.00 0.00 7.28 6.94 -1.26 -4.82 115.26 123.40 2kh2 n ASN 107 Ca 0.00 0.11 0.00 0.00 -0.02 0.00 0.00 54.58 54.67 2kh2 n ASN 107 Cb 0.00 -0.36 0.00 0.00 -2.36 0.00 0.00 39.78 37.06 2kh2 n ASN 107 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 2kh2 n ASN 108 N -2.02 0.93 -4.64 0.53 6.94 -1.26 -5.04 115.26 110.70 2kh2 n ASN 108 Ca 0.00 -0.97 -0.24 0.00 -0.02 0.00 0.00 54.58 53.35 2kh2 n ASN 108 Cb 0.00 0.06 -0.08 0.00 -2.36 0.00 0.00 39.78 37.40 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2kh2 s LYS 109 N -0.06 2.12 0.10 -3.83 -0.14 -1.26 -5.01 119.74 111.67 2kh2 s LYS 109 Ca 0.00 -1.71 0.07 0.00 -1.36 0.00 0.00 55.97 52.97 2kh2 s LYS 109 Cb 0.00 -1.97 -0.03 0.00 -1.68 0.00 0.00 37.83 34.15 2kh2 s LYS 109 CO 0.00 0.14 -0.18 -0.48 -0.76 0.00 0.00 175.35 174.07 2kh2 s LEU 110 N -3.73 2.32 0.15 3.17 2.34 -1.13 -1.04 118.68 120.76 2kh2 s LEU 110 Ca 0.35 -0.71 0.06 0.00 0.06 0.00 0.00 54.13 53.89 2kh2 s LEU 110 Cb -0.01 -0.73 -0.04 0.00 -0.56 0.00 0.00 46.19 44.85 2kh2 s LEU 110 CO 0.20 -0.02 -0.13 -1.61 -1.06 0.00 0.00 176.35 173.73 2kh2 s GLU 111 N -2.07 1.10 -0.26 1.48 2.02 0.16 0.10 118.70 121.22 2kh2 s GLU 111 Ca 0.06 -1.38 0.01 0.00 0.02 0.00 0.00 54.97 53.68 2kh2 s GLU 111 Cb -0.09 -0.85 0.05 0.00 0.10 0.00 0.00 34.13 33.35 2kh2 s GLU 111 CO 0.04 0.14 -0.09 -0.06 0.02 0.00 0.00 175.26 175.31 2kh2 s PHE 112 N -2.72 3.20 0.10 1.61 0.08 -1.26 -0.65 117.98 118.33 2kh2 s PHE 112 Ca 0.14 -2.09 0.01 0.00 0.12 0.00 0.00 56.93 55.11 2kh2 s PHE 112 Cb -0.01 -1.98 -0.04 0.00 -0.57 0.00 0.00 43.02 40.42 2kh2 s PHE 112 CO 0.03 -0.84 0.23 -2.00 -0.10 0.00 0.00 175.22 172.54 2kh2 s GLU 113 N 1.17 3.40 0.25 0.44 2.12 0.32 -1.01 118.70 125.40 2kh2 s GLU 113 Ca -0.06 -0.52 -0.25 0.00 0.36 0.00 0.00 54.97 54.49 2kh2 s GLU 113 Cb -0.19 -2.99 -0.09 0.00 0.26 0.00 0.00 34.13 31.12 2kh2 s GLU 113 CO -0.05 0.57 0.86 0.45 -0.54 0.00 0.00 175.26 176.55 2kh2 s SER 114 N -2.80 7.34 -0.05 -1.70 0.15 0.12 0.74 113.70 117.50 2kh2 s SER 114 Ca 0.34 1.73 -0.26 0.00 0.70 0.00 0.00 55.95 58.46 2kh2 s SER 114 Cb -0.12 -2.53 -0.21 0.00 -1.71 0.00 0.00 66.02 61.44 2kh2 s SER 114 CO 0.28 0.05 1.14 0.00 1.20 0.00 0.00 173.24 175.91 2kh2 h ALA 115 N 3.63 -0.02 -0.37 5.45 0.00 -1.68 -3.29 119.26 122.98 2kh2 h ALA 115 Ca -0.47 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.01 2kh2 h ALA 115 Cb 1.20 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2kh2 h ALA 115 CO 0.66 -0.21 -0.31 0.37 0.00 0.00 0.00 179.25 179.75 2kh2 h GLN 116 N -0.62 0.82 -3.96 0.00 5.75 -1.81 -3.38 115.11 111.91 2kh2 h GLN 116 Ca -0.00 -0.38 -0.69 0.00 -0.15 0.00 0.00 58.65 57.42 2kh2 h GLN 116 Cb 0.59 -0.01 -0.35 0.00 1.07 0.00 0.00 27.48 28.78 2kh2 h GLN 116 CO 0.00 1.02 -0.46 -0.06 -2.65 0.00 0.00 178.83 176.68 2kh2 s PHE 117 N -4.47 3.48 0.53 3.99 0.08 -1.24 -5.09 117.98 115.26 2kh2 s PHE 117 Ca -0.10 -2.62 -0.20 0.00 0.12 0.00 0.00 56.93 54.13 2kh2 s PHE 117 Cb 0.12 -3.19 -0.06 0.00 -0.57 0.00 0.00 43.02 39.32 2kh2 s PHE 117 CO 0.85 -0.89 1.12 -2.14 -0.10 0.00 0.00 175.22 174.06 2kh2 s PRO 118 N 0.43 3.46 0.00 0.24 0.02 -1.24 -2.91 135.00 134.99 2kh2 s PRO 118 Ca 0.13 1.58 0.00 0.00 0.02 0.00 0.00 61.00 62.73 2kh2 s PRO 118 Cb -0.22 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.26 2kh2 s PRO 118 CO -0.04 -0.76 0.00 0.09 -0.33 0.00 0.00 177.00 175.97 2kh2 n ASN 119 N -1.19 0.00 -4.61 2.53 5.03 -1.26 -4.98 115.26 110.77 2kh2 n ASN 119 Ca 0.11 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.19 2kh2 n ASN 119 Cb 0.51 -0.19 -0.10 0.00 -1.02 0.00 0.00 39.78 38.98 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 -3.31 3.25 0.15 3.10 0.52 -1.15 -4.63 118.94 116.88 2kh2 s TRP 120 Ca 0.00 0.12 0.10 0.00 0.02 0.00 0.00 56.10 56.34 2kh2 s TRP 120 Cb 0.00 -2.30 -0.04 0.00 -1.15 0.00 0.00 33.47 29.98 2kh2 s TRP 120 CO 0.00 -0.05 -0.23 0.71 0.02 0.00 0.00 176.95 177.39 2kh2 s TYR 121 N 1.33 2.13 -0.20 -1.98 1.51 0.22 -0.70 117.35 119.66 2kh2 s TYR 121 Ca 0.07 -0.39 -0.29 0.00 -1.01 0.00 0.00 57.07 55.44 2kh2 s TYR 121 Cb -0.15 -1.11 -0.03 0.00 -0.11 0.00 0.00 41.96 40.57 2kh2 s TYR 121 CO 0.07 0.36 1.62 0.42 -1.11 0.00 0.00 175.55 176.91 2kh2 s ILE 122 N -1.44 3.69 0.39 2.71 1.01 -0.18 -0.06 121.20 127.32 2kh2 s ILE 122 Ca 0.15 0.79 0.08 0.00 0.00 0.00 0.00 60.65 61.66 2kh2 s ILE 122 Cb -0.09 -3.68 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 2kh2 s ILE 122 CO 0.07 -0.26 0.12 -0.44 0.00 0.00 0.00 174.94 174.44 2kh2 s SER 123 N 4.11 4.33 -0.22 3.58 0.01 0.53 -4.46 113.70 121.57 2kh2 s SER 123 Ca 0.72 -1.07 -0.13 0.00 1.31 0.00 0.00 55.95 56.78 2kh2 s SER 123 Cb -0.26 -0.50 0.07 0.00 0.21 0.00 0.00 66.02 65.54 2kh2 s SER 123 CO 0.29 -0.45 0.55 -0.89 0.41 0.00 0.00 173.24 173.15 2kh2 s THR 124 N -2.58 -0.02 0.82 1.44 2.01 -1.16 -2.56 115.64 113.59 2kh2 s THR 124 Ca 0.39 0.05 -0.14 0.00 0.31 0.00 0.00 61.69 62.30 2kh2 s THR 124 Cb 0.03 -0.80 0.06 0.00 0.01 0.00 0.00 72.50 71.80 2kh2 s THR 124 CO 0.21 0.02 1.00 -1.20 -0.69 0.00 0.00 174.62 173.97 2kh2 n SER 125 N 4.30 0.30 -0.05 3.53 7.64 -1.26 -3.07 113.62 125.02 2kh2 n SER 125 Ca -0.22 0.55 -0.01 0.00 1.01 0.00 0.00 58.87 60.21 2kh2 n SER 125 Cb 0.57 -1.43 0.26 0.00 -1.01 0.00 0.00 64.21 62.60 2kh2 n SER 125 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2kh2 h GLN 126 N -0.93 0.63 -7.16 1.43 1.08 -1.94 -3.43 115.11 104.78 2kh2 h GLN 126 Ca -0.46 -0.13 -0.51 0.00 -1.45 0.00 0.00 58.65 56.10 2kh2 h GLN 126 Cb 1.30 -0.09 0.10 0.00 -0.05 0.00 0.00 27.48 28.74 2kh2 h GLN 126 CO 0.44 0.62 0.40 0.00 -0.95 0.00 0.00 178.83 179.34 2kh2 s ALA 127 N -5.05 2.50 0.59 3.87 0.00 -1.26 -5.04 121.76 117.35 2kh2 s ALA 127 Ca -0.08 0.69 -0.01 0.00 0.00 0.00 0.00 51.96 52.56 2kh2 s ALA 127 Cb 0.15 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.96 2kh2 s ALA 127 CO 0.78 -1.20 0.83 -1.21 0.00 0.00 0.00 175.76 174.96 2kh2 s GLU 128 N -3.80 2.47 0.00 0.00 2.02 -1.26 -4.24 118.70 113.89 2kh2 s GLU 128 Ca 0.70 -0.65 0.00 0.00 0.02 0.00 0.00 54.97 55.04 2kh2 s GLU 128 Cb -0.23 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.59 2kh2 s GLU 128 CO 0.37 -0.83 0.00 -1.71 0.02 0.00 0.00 175.26 173.11 2kh2 n ASN 129 N -2.48 -3.71 -4.85 -0.19 5.15 -0.21 -4.99 115.26 103.98 2kh2 n ASN 129 Ca 0.08 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.69 2kh2 n ASN 129 Cb 0.60 -1.52 -0.06 0.00 -0.53 0.00 0.00 39.78 38.27 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 -0.69 3.69 1.10 1.20 -1.94 -1.25 -4.82 119.30 116.59 2kh2 s MET 130 Ca 0.00 0.10 -0.16 0.00 -1.71 0.00 0.00 55.69 53.92 2kh2 s MET 130 Cb 0.00 -3.22 0.24 0.00 2.01 0.00 0.00 34.83 33.86 2kh2 s MET 130 CO 0.00 0.71 1.13 -1.25 -0.01 0.00 0.00 175.02 175.60 2kh2 s PRO 131 N -0.94 -0.37 0.11 2.03 0.04 -1.26 -1.17 135.00 133.44 2kh2 s PRO 131 Ca 0.19 0.06 -0.08 0.00 0.04 0.00 0.00 61.00 61.21 2kh2 s PRO 131 Cb -0.14 -1.68 -0.06 0.00 0.04 0.00 0.00 34.50 32.66 2kh2 s PRO 131 CO 0.08 -3.17 0.40 0.08 0.04 0.00 0.00 177.00 174.43 2kh2 s VAL 132 N -3.14 5.12 0.27 -0.36 1.01 -1.26 -4.64 120.40 117.41 2kh2 s VAL 132 Ca 0.69 0.27 -0.18 0.00 0.00 0.00 0.00 61.98 62.77 2kh2 s VAL 132 Cb -0.12 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.65 2kh2 s VAL 132 CO 0.56 0.16 0.63 0.72 0.00 0.00 0.00 175.10 177.17 2kh2 s PHE 133 N -1.53 0.04 -0.15 5.22 -0.12 -1.06 -4.88 117.98 115.51 2kh2 s PHE 133 Ca 0.37 -0.47 -0.17 0.00 -0.05 0.00 0.00 56.93 56.60 2kh2 s PHE 133 Cb -0.13 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.74 2kh2 s PHE 133 CO 0.21 -1.17 0.44 -1.17 -0.05 0.00 0.00 175.22 173.48 2kh2 s LEU 134 N -2.97 4.23 0.16 -1.99 2.96 -1.26 -0.35 118.68 119.47 2kh2 s LEU 134 Ca 0.16 0.70 0.08 0.00 -0.22 0.00 0.00 54.13 54.85 2kh2 s LEU 134 Cb -0.04 -2.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.99 2kh2 s LEU 134 CO 0.08 -0.03 -0.18 -0.83 -1.32 0.00 0.00 176.35 174.08 2kh2 s GLY 135 N 0.75 1.36 -0.26 7.98 0.00 0.91 -4.84 107.32 113.22 2kh2 s GLY 135 Ca 0.23 -1.47 0.09 0.00 0.00 0.00 0.00 44.72 43.56 2kh2 s GLY 135 CO 0.09 -1.53 1.21 0.61 0.00 0.00 0.00 173.10 173.48 2kh2 n GLY 136 N 0.29 5.88 2.60 0.20 0.00 -1.26 -0.61 105.19 112.28 2kh2 n GLY 136 Ca -0.13 -2.10 -0.27 0.00 0.00 0.00 0.00 46.02 43.52 2kh2 n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2kh2 n THR 137 N -0.88 0.45 -2.26 2.61 -2.24 -1.26 -5.00 114.28 105.69 2kh2 n THR 137 Ca 0.34 -4.30 -0.42 0.00 -2.27 0.00 0.00 64.05 57.40 2kh2 n THR 137 Cb 0.85 -1.96 -0.03 0.00 -2.10 0.00 0.00 70.33 67.10 2kh2 n THR 137 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2kh2 s LYS 138 N -0.99 4.27 -0.35 -0.78 2.20 -1.26 -2.75 119.74 120.06 2kh2 s LYS 138 Ca 0.30 1.89 0.00 0.00 -0.36 0.00 0.00 55.97 57.81 2kh2 s LYS 138 Cb 0.03 -3.67 0.00 0.00 -1.51 0.00 0.00 37.83 32.67 2kh2 s LYS 138 CO -0.16 -0.63 0.00 0.41 -0.36 0.00 0.00 175.35 174.61 2kh2 n GLY 139 N 3.67 0.35 0.00 5.54 0.00 -1.26 -5.03 105.19 108.47 2kh2 n GLY 139 Ca 0.14 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.46 1.54 1.39 -0.02 0.00 -1.11 -4.95 105.19 100.58 2kh2 n GLY 140 Ca -0.04 -0.66 0.04 0.00 0.00 0.00 0.00 46.02 45.35 2kh2 n GLY 140 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kh2 n GLN 141 N 0.00 3.38 -3.00 1.61 3.00 -1.26 -4.88 117.38 116.23 2kh2 n GLN 141 Ca 0.00 -1.97 -0.11 0.00 -0.01 0.00 0.00 57.00 54.91 2kh2 n GLN 141 Cb 0.00 -1.97 -0.03 0.00 0.00 0.00 0.00 30.24 28.24 2kh2 n GLN 141 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2kh2 n ASP 142 N 0.35 1.65 -4.01 1.08 8.00 -1.26 -4.59 116.55 117.77 2kh2 n ASP 142 Ca 0.18 -1.87 -0.30 0.00 0.71 0.00 0.00 54.79 53.51 2kh2 n ASP 142 Cb 0.86 0.31 -0.16 0.00 -0.02 0.00 0.00 41.12 42.10 2kh2 n ASP 142 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2kh2 s ILE 143 N -1.98 1.59 -0.03 0.53 1.01 -1.17 -4.77 121.20 116.36 2kh2 s ILE 143 Ca 0.05 -0.71 0.08 0.00 0.00 0.00 0.00 60.65 60.07 2kh2 s ILE 143 Cb 0.00 -1.53 -0.12 0.00 0.01 0.00 0.00 42.46 40.82 2kh2 s ILE 143 CO 0.04 0.40 0.13 0.35 0.00 0.00 0.00 174.94 175.86 2kh2 n THR 144 N 4.75 0.18 -3.20 2.92 -2.24 -1.26 -2.99 114.28 112.45 2kh2 n THR 144 Ca -0.16 -0.24 -0.39 0.00 -2.27 0.00 0.00 64.05 60.98 2kh2 n THR 144 Cb 0.49 -0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.59 2kh2 n THR 144 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2kh2 s ASP 145 N -3.32 6.60 0.14 3.42 -4.77 -1.26 -4.06 116.67 113.43 2kh2 s ASP 145 Ca -0.03 0.73 0.10 0.00 -3.30 0.00 0.00 52.55 50.04 2kh2 s ASP 145 Cb 0.04 -2.31 -0.04 0.00 -1.09 0.00 0.00 42.92 39.52 2kh2 s ASP 145 CO 0.34 -0.21 -0.23 -0.36 0.70 0.00 0.00 175.17 175.41 2kh2 s PHE 146 N 1.74 2.08 0.12 2.11 0.08 0.11 -3.33 117.98 120.90 2kh2 s PHE 146 Ca 0.26 -0.40 -0.11 0.00 0.12 0.00 0.00 56.93 56.80 2kh2 s PHE 146 Cb -0.16 -1.09 -0.06 0.00 -0.57 0.00 0.00 43.02 41.14 2kh2 s PHE 146 CO 0.10 0.34 0.46 0.95 -0.10 0.00 0.00 175.22 176.97 2kh2 s THR 147 N -1.39 5.01 -0.27 0.64 -4.23 0.27 -2.83 115.64 112.85 2kh2 s THR 147 Ca 0.14 0.53 -0.07 0.00 -1.18 0.00 0.00 61.69 61.10 2kh2 s THR 147 Cb -0.09 -3.67 -0.02 0.00 1.34 0.00 0.00 72.50 70.07 2kh2 s THR 147 CO 0.06 0.21 0.08 -0.32 -0.54 0.00 0.00 174.62 174.12 2kh2 s MET 148 N -2.09 3.49 -0.21 3.99 1.75 -1.26 -2.57 119.30 122.40 2kh2 s MET 148 Ca 0.37 -0.59 0.02 0.00 -1.25 0.00 0.00 55.69 54.23 2kh2 s MET 148 Cb -0.14 -3.35 0.04 0.00 2.84 0.00 0.00 34.83 34.22 2kh2 s MET 148 CO 0.19 -0.27 -0.16 -0.65 -0.65 0.00 0.00 175.02 173.48 2kh2 s GLN 149 N 1.59 2.63 -0.27 4.11 1.11 -0.48 -4.96 119.66 123.39 2kh2 s GLN 149 Ca 0.05 -1.01 -0.27 0.00 0.01 0.00 0.00 55.36 54.14 2kh2 s GLN 149 Cb -0.16 -2.66 0.01 0.00 -1.01 0.00 0.00 33.01 29.19 2kh2 s GLN 149 CO 0.03 -0.36 0.97 -0.06 0.01 0.00 0.00 175.29 175.89 2kh2 s PHE 150 N 1.23 3.27 0.49 0.91 0.08 -1.26 -0.58 117.98 122.11 2kh2 s PHE 150 Ca -0.00 1.24 0.07 0.00 0.12 0.00 0.00 56.93 58.35 2kh2 s PHE 150 Cb -0.16 -3.33 0.01 0.00 -0.57 0.00 0.00 43.02 38.98 2kh2 s PHE 150 CO -0.10 -0.55 0.38 0.14 -0.10 0.00 0.00 175.22 174.99 2kh2 s VAL 151 N 3.21 2.06 -0.95 -0.44 -7.23 -1.24 -5.00 120.40 110.81 2kh2 s VAL 151 Ca 0.41 -1.46 -0.12 0.00 -1.81 0.00 0.00 61.98 59.00 2kh2 s VAL 151 Cb -0.14 -2.52 -0.08 0.00 0.56 0.00 0.00 36.38 34.19 2kh2 s VAL 151 CO 0.10 0.00 2.11 -1.54 -0.31 0.00 0.00 175.10 175.45 2kh2 n SER 152 N -1.64 4.28 0.00 4.85 3.41 -1.26 -4.90 113.62 118.35 2kh2 n SER 152 Ca 0.01 -2.49 0.00 0.00 -0.26 0.00 0.00 58.87 56.12 2kh2 n SER 152 Cb 0.63 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 2kh2 n SER 152 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64