#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 -5.17 0.00 0.13 -2.06 -3.43 132.00 121.47 2kh2 h PRO 2 Ca 0.00 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.48 2kh2 h PRO 2 Cb 0.00 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 30.87 2kh2 h PRO 2 CO 0.00 0.68 -0.73 0.54 -0.23 0.00 0.00 178.00 178.26 2kh2 s VAL 3 N -3.29 3.32 0.10 1.56 0.11 -1.26 -5.09 120.40 115.85 2kh2 s VAL 3 Ca 0.00 -0.54 -0.30 0.00 -2.93 0.00 0.00 61.98 58.21 2kh2 s VAL 3 Cb 0.11 -2.46 -0.06 0.00 -1.53 0.00 0.00 36.38 32.45 2kh2 s VAL 3 CO 0.77 0.48 1.01 0.00 -3.33 0.00 0.00 175.10 174.02 2kh2 s ARG 4 N 0.85 4.64 -0.01 1.54 1.70 -1.26 -5.02 118.95 121.39 2kh2 s ARG 4 Ca -0.02 1.53 -0.18 0.00 -0.47 0.00 0.00 55.73 56.58 2kh2 s ARG 4 Cb -0.15 -3.37 0.03 0.00 -0.57 0.00 0.00 34.95 30.90 2kh2 s ARG 4 CO 0.01 0.11 0.39 0.45 -1.08 0.00 0.00 175.30 175.18 2kh2 s SER 5 N 0.20 -0.29 0.24 -2.89 0.15 -1.26 -2.98 113.70 106.88 2kh2 s SER 5 Ca 0.49 0.16 -0.10 0.00 0.70 0.00 0.00 55.95 57.20 2kh2 s SER 5 Cb -0.25 0.37 -0.01 0.00 -1.71 0.00 0.00 66.02 64.43 2kh2 s SER 5 CO 0.31 -0.53 0.40 -1.48 1.20 0.00 0.00 173.24 173.14 2kh2 s LEU 6 N -1.47 0.52 -0.11 3.45 0.05 -1.16 -4.99 118.68 114.97 2kh2 s LEU 6 Ca -0.11 -1.05 0.00 0.00 0.05 0.00 0.00 54.13 53.03 2kh2 s LEU 6 Cb -0.03 1.45 -0.02 0.00 -2.05 0.00 0.00 46.19 45.53 2kh2 s LEU 6 CO 0.04 -1.08 -0.11 0.20 -0.55 0.00 0.00 176.35 174.85 2kh2 s ASN 7 N -3.06 4.22 0.07 1.48 0.01 -1.26 0.16 114.94 116.56 2kh2 s ASN 7 Ca 0.26 -0.23 -0.06 0.00 -0.71 0.00 0.00 52.86 52.13 2kh2 s ASN 7 Cb 0.01 -1.40 -0.02 0.00 0.41 0.00 0.00 41.25 40.25 2kh2 s ASN 7 CO 0.10 0.23 0.10 0.00 -1.51 0.00 0.00 177.10 176.02 2kh2 s THR 9 N -3.78 2.77 -0.20 0.00 -4.23 0.10 -0.27 115.64 110.03 2kh2 s THR 9 Ca 0.05 -0.75 -0.19 0.00 -1.18 0.00 0.00 61.69 59.62 2kh2 s THR 9 Cb 0.06 -2.15 -0.03 0.00 1.34 0.00 0.00 72.50 71.71 2kh2 s THR 9 CO -0.10 0.52 0.56 -0.76 -0.54 0.00 0.00 174.62 174.30 2kh2 s LEU 10 N 0.56 4.15 -0.05 4.79 1.43 -1.26 -2.70 118.68 125.60 2kh2 s LEU 10 Ca -0.09 0.74 0.03 0.00 -1.03 0.00 0.00 54.13 53.77 2kh2 s LEU 10 Cb -0.16 -2.78 0.01 0.00 0.03 0.00 0.00 46.19 43.29 2kh2 s LEU 10 CO 0.04 -0.21 -0.13 -0.13 0.23 0.00 0.00 176.35 176.15 2kh2 s ARG 11 N 1.72 1.53 0.99 1.70 1.81 -1.26 -4.10 118.95 121.35 2kh2 s ARG 11 Ca 0.26 -0.44 -0.17 0.00 -1.72 0.00 0.00 55.73 53.67 2kh2 s ARG 11 Cb -0.16 -1.32 0.21 0.00 -0.45 0.00 0.00 34.95 33.24 2kh2 s ARG 11 CO 0.10 0.11 1.31 0.16 -0.68 0.00 0.00 175.30 176.29 2kh2 s ASP 12 N 0.38 2.83 0.05 0.23 -4.77 -1.15 -1.09 116.67 113.15 2kh2 s ASP 12 Ca -0.09 0.29 0.07 0.00 -3.30 0.00 0.00 52.55 49.52 2kh2 s ASP 12 Cb -0.13 -0.34 0.32 0.00 -1.09 0.00 0.00 42.92 41.68 2kh2 s ASP 12 CO 0.02 -2.91 1.21 -1.54 0.70 0.00 0.00 175.17 172.65 2kh2 n SER 13 N -3.89 0.09 -0.99 2.11 3.41 -1.24 -0.64 113.62 112.48 2kh2 n SER 13 Ca 0.15 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.41 2kh2 n SER 13 Cb 0.59 -0.55 0.14 0.00 -0.26 0.00 0.00 64.21 64.13 2kh2 n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kh2 n GLN 14 N -1.62 2.27 -2.31 4.33 1.13 -1.26 -4.95 117.38 114.97 2kh2 n GLN 14 Ca 0.01 -2.02 -0.12 0.00 -1.94 0.00 0.00 57.00 52.93 2kh2 n GLN 14 Cb 0.05 -1.46 -0.00 0.00 0.11 0.00 0.00 30.24 28.94 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 1.34 -1.30 -2.76 -1.09 1.13 0.19 -4.93 117.38 109.97 2kh2 n GLN 15 Ca 0.16 0.57 -0.30 0.00 -1.94 0.00 0.00 57.00 55.48 2kh2 n GLN 15 Cb 0.57 -4.71 -0.03 0.00 0.11 0.00 0.00 30.24 26.19 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 -4.71 3.80 0.16 -1.09 1.02 -1.26 -3.95 119.74 113.71 2kh2 s LYS 16 Ca 0.03 0.55 0.11 0.00 0.02 0.00 0.00 55.97 56.68 2kh2 s LYS 16 Cb -0.01 -2.34 -0.04 0.00 -0.52 0.00 0.00 37.83 34.91 2kh2 s LYS 16 CO 0.04 -0.09 -0.25 -1.12 -0.92 0.00 0.00 175.35 173.01 2kh2 s SER 17 N -3.19 3.27 -0.14 2.83 0.01 0.10 -2.95 113.70 113.64 2kh2 s SER 17 Ca 0.52 -0.80 -0.20 0.00 1.31 0.00 0.00 55.95 56.78 2kh2 s SER 17 Cb -0.10 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.87 2kh2 s SER 17 CO 0.32 0.13 0.58 -0.76 0.41 0.00 0.00 173.24 173.93 2kh2 s LEU 18 N -2.33 4.23 0.14 2.44 1.43 -1.26 -1.67 118.68 121.67 2kh2 s LEU 18 Ca 0.16 0.90 0.10 0.00 -1.03 0.00 0.00 54.13 54.26 2kh2 s LEU 18 Cb -0.09 -2.85 -0.04 0.00 0.03 0.00 0.00 46.19 43.24 2kh2 s LEU 18 CO 0.07 -0.13 -0.23 0.68 0.23 0.00 0.00 176.35 176.98 2kh2 s VAL 19 N 1.15 2.07 -0.54 -1.59 -7.23 0.68 -0.50 120.40 114.44 2kh2 s VAL 19 Ca 0.29 -1.80 -0.27 0.00 -1.81 0.00 0.00 61.98 58.39 2kh2 s VAL 19 Cb -0.16 -1.89 0.03 0.00 0.56 0.00 0.00 36.38 34.92 2kh2 s VAL 19 CO 0.12 -0.07 1.11 -0.04 -0.31 0.00 0.00 175.10 175.91 2kh2 s MET 20 N -2.30 3.53 0.00 4.82 -1.94 -1.26 -1.08 119.30 121.07 2kh2 s MET 20 Ca 0.14 0.23 0.00 0.00 -1.71 0.00 0.00 55.69 54.35 2kh2 s MET 20 Cb -0.09 -3.99 0.00 0.00 2.01 0.00 0.00 34.83 32.76 2kh2 s MET 20 CO 0.07 -1.54 0.00 0.45 -0.01 0.00 0.00 175.02 173.99 2kh2 n SER 21 N 8.02 0.00 -4.94 3.03 2.88 -0.04 -4.98 113.62 117.59 2kh2 n SER 21 Ca 0.08 0.08 -0.25 0.00 -1.33 0.00 0.00 58.87 57.45 2kh2 n SER 21 Cb 0.49 -0.08 0.01 0.00 -0.75 0.00 0.00 64.21 63.88 2kh2 n SER 21 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2kh2 s GLY 22 N -1.17 2.19 0.55 0.46 0.00 -1.14 -4.94 107.32 103.27 2kh2 s GLY 22 Ca 0.00 -1.49 0.27 0.00 0.00 0.00 0.00 44.72 43.50 2kh2 s GLY 22 CO 0.00 -1.88 1.99 -0.56 0.00 0.00 0.00 173.10 172.65 2kh2 h PRO 23 N 0.57 0.00 -0.29 2.90 0.13 -2.03 -2.21 132.00 131.07 2kh2 h PRO 23 Ca -0.35 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.54 2kh2 h PRO 23 Cb 1.30 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.10 2kh2 h PRO 23 CO 0.52 0.00 -0.93 0.66 -0.23 0.00 0.00 178.00 178.02 2kh2 n TYR 24 N -4.14 0.96 -3.99 1.56 4.01 -1.26 -5.02 117.16 109.27 2kh2 n TYR 24 Ca 0.09 -1.56 -0.16 0.00 -0.16 0.00 0.00 57.90 56.11 2kh2 n TYR 24 Cb 0.59 -0.23 -0.15 0.00 -0.31 0.00 0.00 39.34 39.24 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 -2.54 0.28 -0.01 -0.72 2.12 -0.83 -4.29 118.70 112.71 2kh2 s GLU 25 Ca 0.36 -0.02 0.07 0.00 0.36 0.00 0.00 54.97 55.73 2kh2 s GLU 25 Cb 0.37 -0.36 -0.02 0.00 0.26 0.00 0.00 34.13 34.38 2kh2 s GLU 25 CO -0.07 -0.03 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.89 2kh2 s LEU 26 N 0.47 2.06 0.15 2.70 1.43 -1.26 -0.86 118.68 123.36 2kh2 s LEU 26 Ca -0.05 -0.41 0.09 0.00 -1.03 0.00 0.00 54.13 52.74 2kh2 s LEU 26 Cb -0.07 -1.10 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 2kh2 s LEU 26 CO -0.01 0.25 -0.21 -0.54 0.23 0.00 0.00 176.35 176.07 2kh2 s LYS 27 N -0.60 1.29 -0.17 1.70 1.02 -0.24 -1.85 119.74 120.89 2kh2 s LYS 27 Ca 0.08 -1.35 0.01 0.00 0.02 0.00 0.00 55.97 54.74 2kh2 s LYS 27 Cb -0.08 -1.53 0.01 0.00 -0.52 0.00 0.00 37.83 35.71 2kh2 s LYS 27 CO -0.00 0.34 -0.20 0.00 -0.92 0.00 0.00 175.35 174.56 2kh2 s ALA 28 N -1.56 2.33 0.07 5.17 0.00 0.11 -0.23 121.76 127.64 2kh2 s ALA 28 Ca 0.14 -1.16 -0.15 0.00 0.00 0.00 0.00 51.96 50.78 2kh2 s ALA 28 Cb -0.08 -1.13 0.03 0.00 0.00 0.00 0.00 23.12 21.93 2kh2 s ALA 28 CO 0.06 -0.21 0.35 -0.48 0.00 0.00 0.00 175.76 175.48 2kh2 s LEU 29 N 1.09 0.66 0.18 0.00 0.05 -0.67 -2.98 118.68 117.01 2kh2 s LEU 29 Ca -0.00 -0.19 -0.33 0.00 0.05 0.00 0.00 54.13 53.66 2kh2 s LEU 29 Cb -0.14 1.56 -0.13 0.00 -2.05 0.00 0.00 46.19 45.43 2kh2 s LEU 29 CO -0.08 -0.69 1.66 1.41 -0.55 0.00 0.00 176.35 178.10 2kh2 n HIS 30 N 0.32 2.53 -3.67 3.48 8.25 -1.26 0.02 115.22 124.88 2kh2 n HIS 30 Ca -0.18 0.14 -0.30 0.00 -0.26 0.00 0.00 57.72 57.13 2kh2 n HIS 30 Cb 0.61 -2.61 -0.15 0.00 1.12 0.00 0.00 29.99 28.96 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 1.08 1.84 -0.15 2.41 2.96 -1.25 -4.84 118.68 120.72 2kh2 s LEU 31 Ca 0.77 -1.71 -0.01 0.00 -0.22 0.00 0.00 54.13 52.96 2kh2 s LEU 31 Cb -0.59 -0.74 0.04 0.00 0.50 0.00 0.00 46.19 45.41 2kh2 s LEU 31 CO 0.35 -0.40 -0.01 -1.58 -1.32 0.00 0.00 176.35 173.39 2kh2 s GLN 32 N 1.55 1.00 0.00 1.98 -0.44 -1.26 -4.71 119.66 117.78 2kh2 s GLN 32 Ca 0.11 -0.34 0.00 0.00 -2.50 0.00 0.00 55.36 52.63 2kh2 s GLN 32 Cb -0.18 -1.80 0.00 0.00 -1.64 0.00 0.00 33.01 29.39 2kh2 s GLN 32 CO -0.23 -0.47 0.00 0.41 0.50 0.00 0.00 175.29 175.50 2kh2 n GLY 33 N 4.99 0.91 0.00 2.59 0.00 -1.26 -4.81 105.19 107.62 2kh2 n GLY 33 Ca -0.10 -1.94 0.07 0.00 0.00 0.00 0.00 46.02 44.05 2kh2 n GLY 33 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kh2 n GLN 34 N 0.00 0.69 0.00 1.61 3.00 -1.26 -1.98 117.38 119.44 2kh2 n GLN 34 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.07 2kh2 n GLN 34 Cb 0.00 -1.32 0.06 0.00 0.00 0.00 0.00 30.24 28.98 2kh2 n GLN 34 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2kh2 n ASP 35 N -0.82 2.21 0.24 1.08 9.92 -1.26 -4.44 116.55 123.49 2kh2 n ASP 35 Ca 0.10 -1.61 0.10 0.00 -0.53 0.00 0.00 54.79 52.86 2kh2 n ASP 35 Cb 0.05 0.07 0.63 0.00 -0.64 0.00 0.00 41.12 41.23 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 2.92 0.00 -0.98 -1.24 4.05 -1.68 -2.64 114.93 115.35 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 0.64 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.44 2kh2 h MET 36 CO 0.00 0.17 0.00 0.39 0.23 0.00 0.00 176.91 177.70 2kh2 n GLU 37 N -3.72 1.19 -0.19 0.39 -0.58 -1.26 -3.05 120.64 113.42 2kh2 n GLU 37 Ca -0.02 -0.16 0.06 0.00 -0.42 0.00 0.00 57.16 56.62 2kh2 n GLU 37 Cb 0.28 -1.49 0.16 0.00 -0.57 0.00 0.00 31.44 29.82 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 0.07 2.87 -1.84 3.49 6.02 -1.00 -5.02 117.38 121.98 2kh2 n GLN 38 Ca 0.02 -2.09 -0.31 0.00 -0.01 0.00 0.00 57.00 54.61 2kh2 n GLN 38 Cb 0.33 -1.29 0.03 0.00 1.02 0.00 0.00 30.24 30.32 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 -1.04 3.22 0.04 -1.09 -2.07 -1.17 -4.74 119.66 112.81 2kh2 s GLN 39 Ca 0.25 0.66 -0.25 0.00 -1.82 0.00 0.00 55.36 54.20 2kh2 s GLN 39 Cb 0.13 -2.05 -0.05 0.00 -1.09 0.00 0.00 33.01 29.95 2kh2 s GLN 39 CO 0.16 -0.82 0.76 0.08 -1.32 0.00 0.00 175.29 174.15 2kh2 s VAL 40 N -3.23 4.76 -0.18 3.63 1.01 0.35 -5.00 120.40 121.73 2kh2 s VAL 40 Ca 0.57 1.61 -0.08 0.00 0.00 0.00 0.00 61.98 64.07 2kh2 s VAL 40 Cb -0.11 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 2kh2 s VAL 40 CO 0.53 0.36 0.09 -0.69 0.00 0.00 0.00 175.10 175.39 2kh2 s VAL 41 N -0.00 5.04 -0.12 2.92 1.01 -1.26 -4.56 120.40 123.41 2kh2 s VAL 41 Ca 0.38 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.39 2kh2 s VAL 41 Cb -0.20 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 2kh2 s VAL 41 CO 0.22 0.47 -0.04 -0.36 0.00 0.00 0.00 175.10 175.39 2kh2 s PHE 42 N 0.25 3.03 -0.24 5.22 0.08 0.63 -0.85 117.98 126.10 2kh2 s PHE 42 Ca 0.06 -0.14 -0.24 0.00 0.12 0.00 0.00 56.93 56.72 2kh2 s PHE 42 Cb -0.12 -1.88 -0.01 0.00 -0.57 0.00 0.00 43.02 40.45 2kh2 s PHE 42 CO -0.00 0.13 0.81 -1.12 -0.10 0.00 0.00 175.22 174.94 2kh2 s SER 43 N -0.11 6.81 -0.78 1.36 0.01 0.71 -0.72 113.70 120.99 2kh2 s SER 43 Ca 0.02 1.01 -0.20 0.00 1.31 0.00 0.00 55.95 58.10 2kh2 s SER 43 Cb -0.13 -2.43 0.11 0.00 0.21 0.00 0.00 66.02 63.79 2kh2 s SER 43 CO 0.02 -0.50 0.98 -0.32 0.41 0.00 0.00 173.24 173.84 2kh2 s MET 44 N 2.78 3.35 -0.07 12.44 1.75 0.12 -3.08 119.30 136.58 2kh2 s MET 44 Ca 0.34 -1.44 -0.24 0.00 -1.25 0.00 0.00 55.69 53.10 2kh2 s MET 44 Cb -0.15 -4.56 -0.03 0.00 2.84 0.00 0.00 34.83 32.92 2kh2 s MET 44 CO 0.08 -1.72 0.73 -1.12 -0.65 0.00 0.00 175.02 172.34 2kh2 s SER 45 N 3.57 7.01 -0.62 1.11 0.01 -1.09 -3.00 113.70 120.68 2kh2 s SER 45 Ca 0.25 1.21 -0.23 0.00 1.31 0.00 0.00 55.95 58.49 2kh2 s SER 45 Cb -0.12 -2.42 0.06 0.00 0.21 0.00 0.00 66.02 63.74 2kh2 s SER 45 CO -0.01 -0.15 0.93 -0.36 0.41 0.00 0.00 173.24 174.06 2kh2 s PHE 46 N 0.94 2.74 0.00 2.43 0.40 -1.16 -0.17 117.98 123.15 2kh2 s PHE 46 Ca 0.38 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 56.30 2kh2 s PHE 46 Cb -0.18 -4.18 0.00 0.00 0.51 0.00 0.00 43.02 39.18 2kh2 s PHE 46 CO 0.18 -1.52 0.00 1.33 0.70 0.00 0.00 175.22 175.91 2kh2 n VAL 47 N 5.97 0.00 -4.01 -0.44 0.24 -1.19 -4.82 118.33 114.08 2kh2 n VAL 47 Ca -0.03 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.96 2kh2 n VAL 47 Cb 0.46 -1.98 -0.15 0.00 -1.47 0.00 0.00 33.84 30.70 2kh2 n VAL 47 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2kh2 s GLN 48 N -1.91 1.89 0.00 7.34 2.00 -1.09 -4.92 119.66 122.96 2kh2 s GLN 48 Ca 0.00 -1.30 0.00 0.00 -2.00 0.00 0.00 55.36 52.06 2kh2 s GLN 48 Cb 0.00 -2.81 0.00 0.00 0.80 0.00 0.00 33.01 31.00 2kh2 s GLN 48 CO 0.00 -0.65 0.00 0.41 -0.50 0.00 0.00 175.29 174.55 2kh2 n GLY 49 N 4.49 2.72 3.12 2.59 0.00 -1.26 -4.97 105.19 111.87 2kh2 n GLY 49 Ca -0.10 0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2kh2 n GLY 49 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kh2 n GLU 50 N 0.00 3.33 -2.45 1.61 2.13 -1.26 -4.93 120.64 119.07 2kh2 n GLU 50 Ca 0.00 -3.38 -0.38 0.00 0.66 0.00 0.00 57.16 54.06 2kh2 n GLU 50 Cb 0.00 -3.13 -0.03 0.00 0.27 0.00 0.00 31.44 28.55 2kh2 n GLU 50 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2kh2 s GLU 51 N 1.91 3.41 0.12 5.31 2.02 -1.26 -4.13 118.70 126.08 2kh2 s GLU 51 Ca 0.44 -1.12 0.02 0.00 0.02 0.00 0.00 54.97 54.34 2kh2 s GLU 51 Cb 0.06 -5.33 0.02 0.00 0.10 0.00 0.00 34.13 28.98 2kh2 s GLU 51 CO -0.00 -2.52 0.16 0.43 0.02 0.00 0.00 175.26 173.35 2kh2 n SER 52 N 10.01 0.50 0.04 -0.19 7.64 0.39 -5.03 113.62 126.99 2kh2 n SER 52 Ca 0.38 -1.32 -0.11 0.00 1.01 0.00 0.00 58.87 58.82 2kh2 n SER 52 Cb 0.49 -0.08 -0.13 0.00 -1.01 0.00 0.00 64.21 63.48 2kh2 n SER 52 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 2kh2 h ASN 53 N 0.03 0.15 0.00 6.43 -0.73 -2.00 -3.39 115.58 116.07 2kh2 h ASN 53 Ca -0.06 -0.21 -0.29 0.00 1.87 0.00 0.00 56.30 57.62 2kh2 h ASN 53 Cb 0.26 -0.05 -0.05 0.00 0.27 0.00 0.00 38.32 38.75 2kh2 h ASN 53 CO 0.08 1.17 -2.08 -0.90 -0.37 0.00 0.00 177.43 175.34 2kh2 n ASP 54 N -3.31 1.91 -4.41 1.15 5.75 -1.26 -4.88 116.55 111.51 2kh2 n ASP 54 Ca -0.11 -0.06 -0.43 0.00 -0.01 0.00 0.00 54.79 54.19 2kh2 n ASP 54 Cb 1.01 0.24 -0.09 0.00 -1.03 0.00 0.00 41.12 41.25 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 -2.38 2.92 -0.24 0.11 1.02 -1.26 -1.08 119.74 118.84 2kh2 s LYS 55 Ca -0.18 -1.18 -0.04 0.00 0.02 0.00 0.00 55.97 54.60 2kh2 s LYS 55 Cb 0.06 -3.99 0.01 0.00 -0.52 0.00 0.00 37.83 33.39 2kh2 s LYS 55 CO 0.53 -0.86 -0.03 0.42 -0.92 0.00 0.00 175.35 174.49 2kh2 s ILE 56 N 1.63 3.30 -0.26 2.17 -1.09 -0.23 -0.46 121.20 126.26 2kh2 s ILE 56 Ca 0.04 -0.70 -0.29 0.00 -2.23 0.00 0.00 60.65 57.47 2kh2 s ILE 56 Cb -0.21 -2.59 0.00 0.00 -1.58 0.00 0.00 42.46 38.08 2kh2 s ILE 56 CO 0.08 0.29 1.17 -2.16 -1.23 0.00 0.00 174.94 173.09 2kh2 s PRO 57 N 1.43 4.10 0.14 2.79 0.04 -1.26 0.31 135.00 142.56 2kh2 s PRO 57 Ca 0.03 1.31 -0.02 0.00 0.04 0.00 0.00 61.00 62.36 2kh2 s PRO 57 Cb -0.15 -3.76 -0.04 0.00 0.04 0.00 0.00 34.50 30.59 2kh2 s PRO 57 CO -0.03 -0.86 0.10 0.14 0.04 0.00 0.00 177.00 176.39 2kh2 s VAL 58 N 3.72 0.09 0.17 -0.36 -7.23 0.44 -3.15 120.40 114.08 2kh2 s VAL 58 Ca 0.50 -1.84 0.06 0.00 -1.81 0.00 0.00 61.98 58.88 2kh2 s VAL 58 Cb -0.16 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.68 2kh2 s VAL 58 CO 0.15 -0.39 0.12 0.00 -0.31 0.00 0.00 175.10 174.68 2kh2 s ALA 59 N -4.05 3.52 -0.27 1.32 0.00 0.76 -0.24 121.76 122.79 2kh2 s ALA 59 Ca 0.25 -1.26 0.01 0.00 0.00 0.00 0.00 51.96 50.96 2kh2 s ALA 59 Cb 0.07 -1.31 0.08 0.00 0.00 0.00 0.00 23.12 21.96 2kh2 s ALA 59 CO 0.03 0.48 0.02 -0.51 0.00 0.00 0.00 175.76 175.77 2kh2 s LEU 60 N -3.16 2.75 0.16 0.00 1.43 -1.26 -2.68 118.68 115.93 2kh2 s LEU 60 Ca 0.31 -1.46 0.08 0.00 -1.03 0.00 0.00 54.13 52.03 2kh2 s LEU 60 Cb -0.10 -1.12 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 2kh2 s LEU 60 CO 0.23 -0.32 -0.18 -0.83 0.23 0.00 0.00 176.35 175.48 2kh2 s GLY 61 N 1.41 1.36 0.32 -3.19 0.00 -1.18 -1.15 107.32 104.90 2kh2 s GLY 61 Ca 0.02 -1.47 -0.28 0.00 0.00 0.00 0.00 44.72 42.99 2kh2 s GLY 61 CO -0.12 -1.52 1.08 1.08 0.00 0.00 0.00 173.10 173.62 2kh2 s LEU 62 N -2.64 4.42 0.13 0.66 1.02 0.00 -0.21 118.68 122.06 2kh2 s LEU 62 Ca 0.15 2.20 -0.33 0.00 0.02 0.00 0.00 54.13 56.17 2kh2 s LEU 62 Cb -0.06 -3.80 -0.13 0.00 0.02 0.00 0.00 46.19 42.22 2kh2 s LEU 62 CO 0.06 -0.26 1.68 1.17 0.02 0.00 0.00 176.35 179.03 2kh2 n LYS 63 N 0.79 2.35 -3.19 1.70 4.81 -0.03 -2.09 118.16 122.50 2kh2 n LYS 63 Ca 0.01 0.85 -0.21 0.00 -0.87 0.00 0.00 58.31 58.09 2kh2 n LYS 63 Cb 0.46 -2.66 -0.00 0.00 0.02 0.00 0.00 35.03 32.85 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 4.28 -3.31 -4.00 1.64 0.28 -1.26 -4.95 120.64 113.31 2kh2 n GLU 64 Ca 0.18 0.51 -0.09 0.00 -0.16 0.00 0.00 57.16 57.60 2kh2 n GLU 64 Cb 0.31 -5.21 -0.11 0.00 1.43 0.00 0.00 31.44 27.87 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 -5.83 0.39 -0.25 3.44 1.02 -0.89 -5.04 119.74 112.59 2kh2 s LYS 65 Ca 0.33 -0.75 0.04 0.00 0.02 0.00 0.00 55.97 55.61 2kh2 s LYS 65 Cb -0.17 0.14 0.45 0.00 -0.52 0.00 0.00 37.83 37.73 2kh2 s LYS 65 CO 0.40 -0.07 1.50 0.27 -0.92 0.00 0.00 175.35 176.54 2kh2 n ASN 66 N 1.23 3.64 -4.52 2.83 6.94 -1.26 -4.39 115.26 119.73 2kh2 n ASN 66 Ca -0.22 -2.90 -0.37 0.00 -0.02 0.00 0.00 54.58 51.08 2kh2 n ASN 66 Cb 0.56 -0.69 -0.12 0.00 -2.36 0.00 0.00 39.78 37.18 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 -2.00 3.72 0.09 -4.53 1.43 -1.26 -1.69 118.68 114.44 2kh2 s LEU 67 Ca 0.36 -0.10 0.09 0.00 -1.03 0.00 0.00 54.13 53.44 2kh2 s LEU 67 Cb 0.29 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2kh2 s LEU 67 CO 0.08 -0.03 -0.23 -0.31 0.23 0.00 0.00 176.35 176.09 2kh2 s TYR 68 N 1.59 1.99 -0.07 0.29 1.51 -0.96 -0.82 117.35 120.88 2kh2 s TYR 68 Ca 0.06 -0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 55.43 2kh2 s TYR 68 Cb -0.15 -1.11 -0.04 0.00 -0.11 0.00 0.00 41.96 40.55 2kh2 s TYR 68 CO 0.07 0.21 1.38 -0.51 -1.11 0.00 0.00 175.55 175.59 2kh2 s LEU 69 N -1.74 4.27 -0.02 -1.29 1.43 -0.30 -1.16 118.68 119.86 2kh2 s LEU 69 Ca 0.09 1.96 0.08 0.00 -1.03 0.00 0.00 54.13 55.23 2kh2 s LEU 69 Cb -0.10 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 2kh2 s LEU 69 CO 0.04 -0.76 -0.26 -0.55 0.23 0.00 0.00 176.35 175.06 2kh2 s SER 70 N 2.15 3.03 -0.34 2.29 0.15 1.00 -4.39 113.70 117.59 2kh2 s SER 70 Ca 0.62 -0.47 -0.09 0.00 0.70 0.00 0.00 55.95 56.70 2kh2 s SER 70 Cb -0.28 -0.40 0.02 0.00 -1.71 0.00 0.00 66.02 63.65 2kh2 s SER 70 CO 0.23 0.31 0.16 0.00 1.20 0.00 0.00 173.24 175.13 2kh2 s VAL 72 N 1.54 0.71 -0.23 0.00 -7.23 -0.68 -4.73 120.40 109.78 2kh2 s VAL 72 Ca 0.02 -1.98 -0.16 0.00 -1.81 0.00 0.00 61.98 58.05 2kh2 s VAL 72 Cb -0.18 -2.10 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 2kh2 s VAL 72 CO 0.05 -0.49 0.41 -0.76 -0.31 0.00 0.00 175.10 174.01 2kh2 s LEU 73 N -3.17 4.11 -0.11 1.32 1.43 -1.26 0.25 118.68 121.24 2kh2 s LEU 73 Ca 0.23 0.46 0.01 0.00 -1.03 0.00 0.00 54.13 53.80 2kh2 s LEU 73 Cb 0.06 -2.52 0.02 0.00 0.03 0.00 0.00 46.19 43.78 2kh2 s LEU 73 CO 0.04 -0.14 -0.11 -0.54 0.23 0.00 0.00 176.35 175.82 2kh2 s LYS 74 N 1.69 1.83 -1.30 1.70 1.02 0.52 -4.77 119.74 120.43 2kh2 s LYS 74 Ca 0.18 -0.40 -0.02 0.00 0.02 0.00 0.00 55.97 55.75 2kh2 s LYS 74 Cb -0.15 -1.70 0.01 0.00 -0.52 0.00 0.00 37.83 35.47 2kh2 s LYS 74 CO 0.09 -0.16 0.85 -3.47 -0.92 0.00 0.00 175.35 171.73 2kh2 n ASP 75 N 4.53 -2.10 -1.94 2.83 -0.08 -1.26 -1.59 116.55 116.94 2kh2 n ASP 75 Ca -0.17 -0.74 -0.21 0.00 -1.51 0.00 0.00 54.79 52.17 2kh2 n ASP 75 Cb 0.51 -4.42 -0.05 0.00 2.34 0.00 0.00 41.12 39.49 2kh2 n ASP 75 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2kh2 n ASP 76 N -3.06 -5.66 -3.71 1.67 9.92 -1.26 -4.98 116.55 109.48 2kh2 n ASP 76 Ca -0.25 0.26 -0.15 0.00 -0.53 0.00 0.00 54.79 54.13 2kh2 n ASP 76 Cb 0.65 -4.83 -0.15 0.00 -0.64 0.00 0.00 41.12 36.16 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 -4.35 0.09 0.10 -1.24 2.47 -0.62 -5.13 119.74 111.07 2kh2 s LYS 77 Ca 0.00 0.47 -0.31 0.00 -1.56 0.00 0.00 55.97 54.57 2kh2 s LYS 77 Cb 0.00 -0.20 -0.09 0.00 -1.46 0.00 0.00 37.83 36.08 2kh2 s LYS 77 CO 0.00 -0.22 1.74 -2.14 0.16 0.00 0.00 175.35 174.89 2kh2 s PRO 78 N 1.63 4.17 0.08 4.03 0.02 -1.26 -0.36 135.00 143.31 2kh2 s PRO 78 Ca -0.05 2.47 0.03 0.00 0.02 0.00 0.00 61.00 63.48 2kh2 s PRO 78 Cb -0.12 -3.56 -0.03 0.00 0.02 0.00 0.00 34.50 30.81 2kh2 s PRO 78 CO -0.06 -0.78 -0.09 0.99 -0.33 0.00 0.00 177.00 176.72 2kh2 s THR 79 N 2.59 0.80 0.08 0.99 2.01 0.14 -4.73 115.64 117.51 2kh2 s THR 79 Ca 0.77 -1.55 -0.06 0.00 0.31 0.00 0.00 61.69 61.15 2kh2 s THR 79 Cb -0.43 -1.24 -0.05 0.00 0.01 0.00 0.00 72.50 70.79 2kh2 s THR 79 CO 0.34 -0.57 0.34 -0.22 -0.69 0.00 0.00 174.62 173.82 2kh2 s LEU 80 N -2.34 4.33 0.32 4.42 2.96 -1.26 -1.68 118.68 125.43 2kh2 s LEU 80 Ca 0.03 0.61 -0.16 0.00 -0.22 0.00 0.00 54.13 54.40 2kh2 s LEU 80 Cb -0.03 -2.99 0.03 0.00 0.50 0.00 0.00 46.19 43.69 2kh2 s LEU 80 CO -0.01 0.16 0.68 0.00 -1.32 0.00 0.00 176.35 175.86 2kh2 s GLN 81 N -2.15 1.93 -0.28 1.98 -2.07 -0.23 -4.87 119.66 113.97 2kh2 s GLN 81 Ca 0.34 -1.28 -0.07 0.00 -1.82 0.00 0.00 55.36 52.53 2kh2 s GLN 81 Cb -0.13 0.58 -0.01 0.00 -1.09 0.00 0.00 33.01 32.36 2kh2 s GLN 81 CO 0.20 -0.87 0.08 -0.51 -1.32 0.00 0.00 175.29 172.87 2kh2 s LEU 82 N -3.03 3.68 -0.20 2.60 2.01 -1.26 -0.00 118.68 122.48 2kh2 s LEU 82 Ca 0.17 -0.49 -0.09 0.00 0.01 0.00 0.00 54.13 53.73 2kh2 s LEU 82 Cb -0.04 -1.90 -0.04 0.00 0.01 0.00 0.00 46.19 44.21 2kh2 s LEU 82 CO 0.10 -0.13 0.10 -1.61 1.01 0.00 0.00 176.35 175.83 2kh2 s GLU 83 N 1.55 4.03 -0.84 1.70 2.02 -0.31 -4.89 118.70 121.96 2kh2 s GLU 83 Ca 0.04 -0.31 -0.22 0.00 0.02 0.00 0.00 54.97 54.51 2kh2 s GLU 83 Cb -0.16 -3.34 0.08 0.00 0.10 0.00 0.00 34.13 30.80 2kh2 s GLU 83 CO 0.03 0.21 1.18 -1.54 0.02 0.00 0.00 175.26 175.16 2kh2 s SER 84 N 0.59 6.39 0.46 -0.19 1.04 -1.26 -2.27 113.70 118.45 2kh2 s SER 84 Ca 0.05 -1.33 0.01 0.00 0.48 0.00 0.00 55.95 55.16 2kh2 s SER 84 Cb -0.12 -2.47 0.00 0.00 0.10 0.00 0.00 66.02 63.52 2kh2 s SER 84 CO 0.01 -1.41 0.67 0.68 0.98 0.00 0.00 173.24 174.17 2kh2 s VAL 85 N 4.15 3.80 -0.16 5.02 -7.23 -0.68 -5.01 120.40 120.28 2kh2 s VAL 85 Ca 0.33 -0.56 -0.29 0.00 -1.81 0.00 0.00 61.98 59.66 2kh2 s VAL 85 Cb -0.08 -3.40 -0.06 0.00 0.56 0.00 0.00 36.38 33.41 2kh2 s VAL 85 CO 0.00 -0.27 2.09 -0.62 -0.31 0.00 0.00 175.10 175.99 2kh2 s ASP 86 N -4.25 5.80 0.35 4.85 3.68 -1.26 -4.81 116.67 121.03 2kh2 s ASP 86 Ca 0.50 2.05 0.26 0.00 2.13 0.00 0.00 52.55 57.49 2kh2 s ASP 86 Cb -0.10 -2.52 1.20 0.00 -1.45 0.00 0.00 42.92 40.05 2kh2 s ASP 86 CO 0.37 -1.67 1.80 1.55 0.13 0.00 0.00 175.17 177.35 2kh2 h PRO 87 N 13.50 0.00 0.00 4.34 0.13 -1.90 -2.40 132.00 145.67 2kh2 h PRO 87 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2kh2 h PRO 87 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2kh2 h PRO 87 CO 0.96 0.00 -0.73 1.57 -0.23 0.00 0.00 178.00 179.57 2kh2 h LYS 88 N 0.00 0.00 -0.24 0.86 2.10 -2.01 -3.33 116.57 113.94 2kh2 h LYS 88 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2kh2 h LYS 88 Cb 0.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 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 -2.35 2.85 -4.11 7.07 3.02 -0.93 -4.99 115.26 115.82 2kh2 n ASN 89 Ca 0.02 -2.20 -0.16 0.00 -0.03 0.00 0.00 54.58 52.20 2kh2 n ASN 89 Cb 0.48 -0.24 -0.12 0.00 -0.61 0.00 0.00 39.78 39.29 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 -1.36 0.95 0.86 3.10 1.51 -1.06 -4.51 117.35 116.84 2kh2 s TYR 90 Ca 0.21 -0.43 -0.09 0.00 -1.01 0.00 0.00 57.07 55.76 2kh2 s TYR 90 Cb 0.14 -0.55 0.17 0.00 -0.11 0.00 0.00 41.96 41.61 2kh2 s TYR 90 CO 0.11 -0.01 1.18 -1.25 -1.11 0.00 0.00 175.55 174.47 2kh2 s PRO 91 N -1.46 1.06 0.07 -1.71 0.05 -1.26 -4.84 135.00 126.89 2kh2 s PRO 91 Ca -0.04 -0.80 -0.04 0.00 0.05 0.00 0.00 61.00 60.17 2kh2 s PRO 91 Cb -0.09 -2.08 -0.03 0.00 0.05 0.00 0.00 34.50 32.36 2kh2 s PRO 91 CO 0.01 -2.01 0.06 -1.59 0.05 0.00 0.00 177.00 173.53 2kh2 s LYS 92 N -5.55 0.72 0.13 4.56 -2.85 -1.26 -5.06 119.74 110.42 2kh2 s LYS 92 Ca 0.71 -1.13 -0.16 0.00 -1.00 0.00 0.00 55.97 54.40 2kh2 s LYS 92 Cb -0.04 0.26 -0.01 0.00 -2.06 0.00 0.00 37.83 35.98 2kh2 s LYS 92 CO 0.49 -0.18 1.63 -0.22 0.10 0.00 0.00 175.35 177.17 2kh2 h LYS 93 N 2.98 0.63 -3.64 1.78 3.11 -1.98 -3.34 116.57 116.11 2kh2 h LYS 93 Ca -0.34 -0.15 -0.75 0.00 -2.81 0.00 0.00 60.65 56.59 2kh2 h LYS 93 Cb 1.17 -0.08 -0.30 0.00 -1.00 0.00 0.00 32.23 32.01 2kh2 h LYS 93 CO 0.62 0.66 0.00 0.21 -2.81 0.00 0.00 179.45 178.13 2kh2 s LYS 94 N -5.30 3.38 0.56 1.90 2.47 -1.26 -2.69 119.74 118.81 2kh2 s LYS 94 Ca -0.13 -2.73 -0.07 0.00 -1.56 0.00 0.00 55.97 51.48 2kh2 s LYS 94 Cb 0.10 -4.19 -0.02 0.00 -1.46 0.00 0.00 37.83 32.26 2kh2 s LYS 94 CO 0.77 -1.25 0.89 -1.64 0.16 0.00 0.00 175.35 174.28 2kh2 s MET 95 N -0.36 3.26 0.47 4.03 -1.94 -1.26 -5.02 119.30 118.47 2kh2 s MET 95 Ca 0.21 0.23 -0.24 0.00 -1.71 0.00 0.00 55.69 54.18 2kh2 s MET 95 Cb -0.12 -2.26 -0.08 0.00 2.01 0.00 0.00 34.83 34.37 2kh2 s MET 95 CO -0.08 -0.52 1.28 0.39 -0.01 0.00 0.00 175.02 176.09 2kh2 n GLU 96 N -2.52 1.83 0.26 2.03 4.71 -1.26 -4.85 120.64 120.84 2kh2 n GLU 96 Ca 0.03 0.66 0.18 0.00 -0.01 0.00 0.00 57.16 58.02 2kh2 n GLU 96 Cb 0.56 -2.43 0.91 0.00 -1.01 0.00 0.00 31.44 29.47 2kh2 n GLU 96 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 2kh2 h LYS 97 N 1.84 0.00 0.00 3.49 3.64 -1.95 0.85 116.57 124.44 2kh2 h LYS 97 Ca -0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2kh2 h LYS 97 Cb 1.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2kh2 h LYS 97 CO 0.59 0.00 0.00 2.89 -2.27 0.00 0.00 179.45 180.66 2kh2 n ARG 98 N -3.58 0.12 -0.03 1.90 1.85 -1.26 -2.74 116.66 112.91 2kh2 n ARG 98 Ca -0.00 0.16 0.08 0.00 -1.00 0.00 0.00 57.85 57.08 2kh2 n ARG 98 Cb 0.25 -1.66 0.08 0.00 -1.05 0.00 0.00 32.46 30.09 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 -1.87 0.09 -3.59 2.89 3.72 0.28 -0.86 117.46 118.12 2kh2 n PHE 99 Ca 0.05 -0.07 -0.37 0.00 -0.05 0.00 0.00 57.45 57.01 2kh2 n PHE 99 Cb 0.34 -0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.78 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 -1.23 5.31 0.17 -4.37 1.01 -1.11 -4.04 120.40 116.15 2kh2 s VAL 100 Ca 0.20 0.29 0.10 0.00 0.00 0.00 0.00 61.98 62.56 2kh2 s VAL 100 Cb 0.13 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 2kh2 s VAL 100 CO 0.19 0.30 -0.16 -0.36 0.00 0.00 0.00 175.10 175.08 2kh2 s PHE 101 N 1.28 2.51 -0.47 5.22 0.08 0.66 -2.29 117.98 124.98 2kh2 s PHE 101 Ca 0.10 -0.27 -0.11 0.00 0.12 0.00 0.00 56.93 56.76 2kh2 s PHE 101 Cb -0.14 -1.26 0.11 0.00 -0.57 0.00 0.00 43.02 41.16 2kh2 s PHE 101 CO 0.06 0.48 0.36 -0.80 -0.10 0.00 0.00 175.22 175.22 2kh2 s ASN 102 N -2.62 5.83 -0.62 1.36 0.02 0.30 -0.42 114.94 118.79 2kh2 s ASN 102 Ca 0.22 -1.72 -0.27 0.00 -1.02 0.00 0.00 52.86 50.07 2kh2 s ASN 102 Cb -0.09 -2.06 0.01 0.00 0.02 0.00 0.00 41.25 39.13 2kh2 s ASN 102 CO 0.12 -0.68 1.43 -0.75 0.02 0.00 0.00 177.10 177.24 2kh2 s LYS 103 N 1.46 3.18 0.11 -0.60 2.20 0.15 -1.09 119.74 125.15 2kh2 s LYS 103 Ca 0.04 0.26 -0.14 0.00 -0.36 0.00 0.00 55.97 55.77 2kh2 s LYS 103 Cb -0.26 -4.18 -0.07 0.00 -1.51 0.00 0.00 37.83 31.82 2kh2 s LYS 103 CO 0.02 -2.11 0.52 0.42 -0.36 0.00 0.00 175.35 173.83 2kh2 s ILE 104 N 6.36 4.89 -0.01 5.43 1.01 0.84 -1.06 121.20 138.67 2kh2 s ILE 104 Ca 0.49 0.82 0.04 0.00 0.00 0.00 0.00 60.65 62.00 2kh2 s ILE 104 Cb -0.10 -3.74 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 2kh2 s ILE 104 CO 0.21 0.32 -0.11 -1.61 0.00 0.00 0.00 174.94 173.75 2kh2 s GLU 105 N -1.77 2.44 0.13 2.79 8.01 -0.24 -0.30 118.70 129.77 2kh2 s GLU 105 Ca 0.35 -0.76 0.00 0.00 0.01 0.00 0.00 54.97 54.56 2kh2 s GLU 105 Cb -0.16 -2.41 0.00 0.00 -4.31 0.00 0.00 34.13 27.26 2kh2 s GLU 105 CO 0.18 0.60 0.00 0.44 0.01 0.00 0.00 175.26 176.49 2kh2 n ILE 106 N 1.78 0.69 0.00 -1.63 -5.35 -1.17 -4.92 119.36 108.76 2kh2 n ILE 106 Ca -0.16 0.23 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 2kh2 n ILE 106 Cb 0.52 -1.25 0.00 0.00 -1.74 0.00 0.00 39.64 37.17 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 -3.36 0.00 -0.00 7.28 0.23 -1.26 -4.97 115.26 113.17 2kh2 n ASN 107 Ca 0.00 0.00 0.09 0.00 -0.53 0.00 0.00 54.58 54.14 2kh2 n ASN 107 Cb 0.07 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 37.66 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 0.87 -4.53 0.53 3.02 -1.26 -4.98 115.26 108.91 2kh2 n ASN 108 Ca 0.00 -0.87 -0.25 0.00 -0.03 0.00 0.00 54.58 53.43 2kh2 n ASN 108 Cb 0.00 1.07 -0.10 0.00 -0.61 0.00 0.00 39.78 40.14 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2kh2 s LYS 109 N -2.83 1.81 0.11 3.52 -0.14 -1.26 -4.94 119.74 116.01 2kh2 s LYS 109 Ca 0.06 -1.84 0.05 0.00 -1.36 0.00 0.00 55.97 52.88 2kh2 s LYS 109 Cb 0.14 -1.76 -0.04 0.00 -1.68 0.00 0.00 37.83 34.49 2kh2 s LYS 109 CO 0.78 0.22 -0.13 -0.48 -0.76 0.00 0.00 175.35 174.98 2kh2 s LEU 110 N -3.58 2.40 0.29 3.17 2.34 -0.37 -3.06 118.68 119.86 2kh2 s LEU 110 Ca 0.32 -0.80 0.10 0.00 0.06 0.00 0.00 54.13 53.81 2kh2 s LEU 110 Cb -0.01 -0.47 -0.06 0.00 -0.56 0.00 0.00 46.19 45.10 2kh2 s LEU 110 CO 0.16 -0.18 -0.14 -1.61 -1.06 0.00 0.00 176.35 173.53 2kh2 s GLU 111 N -2.66 1.66 -0.31 1.48 2.02 0.59 0.13 118.70 121.61 2kh2 s GLU 111 Ca 0.07 -1.80 0.02 0.00 0.02 0.00 0.00 54.97 53.28 2kh2 s GLU 111 Cb -0.05 -1.58 0.09 0.00 0.10 0.00 0.00 34.13 32.70 2kh2 s GLU 111 CO 0.02 0.21 0.04 -0.06 0.02 0.00 0.00 175.26 175.49 2kh2 s PHE 112 N -2.67 2.85 0.00 1.61 0.08 -1.26 -0.11 117.98 118.48 2kh2 s PHE 112 Ca 0.30 -2.36 -0.12 0.00 0.12 0.00 0.00 56.93 54.87 2kh2 s PHE 112 Cb -0.01 -2.27 -0.05 0.00 -0.57 0.00 0.00 43.02 40.12 2kh2 s PHE 112 CO 0.14 -0.89 0.35 -2.00 -0.10 0.00 0.00 175.22 172.72 2kh2 s GLU 113 N 1.22 3.77 -0.00 0.44 2.12 -0.25 -1.97 118.70 124.03 2kh2 s GLU 113 Ca 0.07 0.23 -0.30 0.00 0.36 0.00 0.00 54.97 55.32 2kh2 s GLU 113 Cb -0.18 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.02 2kh2 s GLU 113 CO -0.13 0.67 1.07 0.45 -0.54 0.00 0.00 175.26 176.78 2kh2 s SER 114 N -1.30 7.23 0.21 -1.70 0.15 0.70 0.11 113.70 119.09 2kh2 s SER 114 Ca 0.25 1.76 -0.03 0.00 0.70 0.00 0.00 55.95 58.64 2kh2 s SER 114 Cb -0.15 -2.57 0.16 0.00 -1.71 0.00 0.00 66.02 61.75 2kh2 s SER 114 CO 0.13 -0.38 1.56 0.00 1.20 0.00 0.00 173.24 175.75 2kh2 h ALA 115 N 6.92 0.79 -0.56 5.45 0.00 -1.71 -2.98 119.26 127.17 2kh2 h ALA 115 Ca -0.39 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 53.96 2kh2 h ALA 115 Cb 1.20 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2kh2 h ALA 115 CO 0.80 0.66 -0.08 0.37 0.00 0.00 0.00 179.25 180.99 2kh2 h GLN 116 N 0.50 1.03 -3.71 0.00 5.75 -1.75 -3.39 115.11 113.54 2kh2 h GLN 116 Ca 0.04 -0.37 -0.62 0.00 -0.15 0.00 0.00 58.65 57.55 2kh2 h GLN 116 Cb 0.95 -0.07 -0.40 0.00 1.07 0.00 0.00 27.48 29.02 2kh2 h GLN 116 CO 0.09 1.06 -0.72 -0.06 -2.65 0.00 0.00 178.83 176.55 2kh2 s PHE 117 N -4.89 2.67 0.54 3.99 0.08 -1.14 -5.10 117.98 114.14 2kh2 s PHE 117 Ca -0.11 -2.57 -0.22 0.00 0.12 0.00 0.00 56.93 54.15 2kh2 s PHE 117 Cb 0.13 -2.33 -0.05 0.00 -0.57 0.00 0.00 43.02 40.20 2kh2 s PHE 117 CO 0.86 -0.85 1.34 -2.14 -0.10 0.00 0.00 175.22 174.33 2kh2 s PRO 118 N 0.71 3.19 0.00 0.24 0.02 -1.17 -2.29 135.00 135.70 2kh2 s PRO 118 Ca 0.14 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.34 2kh2 s PRO 118 Cb -0.21 -2.26 0.00 0.00 0.02 0.00 0.00 34.50 32.04 2kh2 s PRO 118 CO -0.09 -1.13 0.00 0.09 -0.33 0.00 0.00 177.00 175.54 2kh2 n ASN 119 N -0.99 0.00 -4.47 2.53 5.03 -1.26 -4.98 115.26 111.11 2kh2 n ASN 119 Ca 0.10 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.18 2kh2 n ASN 119 Cb 0.45 -0.26 -0.12 0.00 -1.02 0.00 0.00 39.78 38.83 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 -3.30 3.14 0.25 3.10 0.52 -0.97 -4.34 118.94 117.34 2kh2 s TRP 120 Ca 0.00 -0.37 0.11 0.00 0.02 0.00 0.00 56.10 55.86 2kh2 s TRP 120 Cb 0.00 -2.30 -0.05 0.00 -1.15 0.00 0.00 33.47 29.97 2kh2 s TRP 120 CO 0.00 -0.35 -0.12 0.71 0.02 0.00 0.00 176.95 177.21 2kh2 s TYR 121 N 1.64 2.49 -0.32 -1.98 1.51 0.11 -0.22 117.35 120.60 2kh2 s TYR 121 Ca 0.06 -0.28 -0.29 0.00 -1.01 0.00 0.00 57.07 55.56 2kh2 s TYR 121 Cb -0.16 -1.13 -0.01 0.00 -0.11 0.00 0.00 41.96 40.55 2kh2 s TYR 121 CO 0.06 0.63 1.64 0.42 -1.11 0.00 0.00 175.55 177.19 2kh2 s ILE 122 N -2.23 3.66 0.25 2.71 1.01 -0.83 -0.59 121.20 125.18 2kh2 s ILE 122 Ca 0.29 0.69 0.10 0.00 0.00 0.00 0.00 60.65 61.73 2kh2 s ILE 122 Cb -0.06 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.55 2kh2 s ILE 122 CO 0.16 -0.46 -0.08 -0.44 0.00 0.00 0.00 174.94 174.13 2kh2 s SER 123 N 4.95 4.22 -0.10 3.58 0.01 0.53 -4.42 113.70 122.47 2kh2 s SER 123 Ca 0.72 -0.74 -0.10 0.00 1.31 0.00 0.00 55.95 57.15 2kh2 s SER 123 Cb -0.21 -0.67 0.03 0.00 0.21 0.00 0.00 66.02 65.38 2kh2 s SER 123 CO 0.32 0.03 0.27 0.42 0.41 0.00 0.00 173.24 174.69 2kh2 s THR 124 N -2.26 0.00 0.96 1.44 -4.23 -0.86 -2.22 115.64 108.48 2kh2 s THR 124 Ca 0.30 -0.04 -0.16 0.00 -1.18 0.00 0.00 61.69 60.61 2kh2 s THR 124 Cb -0.06 -0.40 0.19 0.00 1.34 0.00 0.00 72.50 73.57 2kh2 s THR 124 CO 0.18 -0.02 1.29 -0.44 -0.54 0.00 0.00 174.62 175.08 2kh2 s SER 125 N 0.03 3.11 0.12 3.99 0.01 -1.26 -0.21 113.70 119.49 2kh2 s SER 125 Ca -0.01 0.37 0.27 0.00 1.31 0.00 0.00 55.95 57.89 2kh2 s SER 125 Cb -0.02 -0.49 0.86 0.00 0.21 0.00 0.00 66.02 66.58 2kh2 s SER 125 CO 0.01 -2.75 1.74 0.00 0.41 0.00 0.00 173.24 172.65 2kh2 n GLN 126 N -3.80 0.17 -2.38 12.44 1.13 -1.26 -4.80 117.38 118.87 2kh2 n GLN 126 Ca 0.14 0.12 -0.35 0.00 -1.94 0.00 0.00 57.00 54.97 2kh2 n GLN 126 Cb 0.60 -1.67 -0.02 0.00 0.11 0.00 0.00 30.24 29.26 2kh2 n GLN 126 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2kh2 s ALA 127 N -3.07 2.84 0.27 -1.58 0.00 -1.26 -5.02 121.76 113.94 2kh2 s ALA 127 Ca 0.11 0.76 -0.19 0.00 0.00 0.00 0.00 51.96 52.64 2kh2 s ALA 127 Cb 0.15 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 19.86 2kh2 s ALA 127 CO 0.60 -0.54 0.77 -2.00 0.00 0.00 0.00 175.76 174.59 2kh2 s GLU 128 N -3.09 4.23 -1.08 0.00 2.56 -1.26 -3.92 118.70 116.14 2kh2 s GLU 128 Ca 0.68 0.90 0.00 0.00 0.00 0.00 0.00 54.97 56.55 2kh2 s GLU 128 Cb -0.22 -2.71 0.00 0.00 2.00 0.00 0.00 34.13 33.20 2kh2 s GLU 128 CO 0.26 0.29 0.00 -1.71 -0.56 0.00 0.00 175.26 173.54 2kh2 n ASN 129 N 0.33 -3.96 -4.83 -1.70 5.15 -1.16 -5.01 115.26 104.10 2kh2 n ASN 129 Ca 0.00 0.02 -0.38 0.00 -0.60 0.00 0.00 54.58 53.63 2kh2 n ASN 129 Cb 0.52 -3.10 -0.06 0.00 -0.53 0.00 0.00 39.78 36.60 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 -4.46 3.88 0.98 1.20 -1.94 -1.18 -4.82 119.30 112.96 2kh2 s MET 130 Ca 0.00 0.25 -0.12 0.00 -1.71 0.00 0.00 55.69 54.11 2kh2 s MET 130 Cb 0.00 -3.25 0.18 0.00 2.01 0.00 0.00 34.83 33.76 2kh2 s MET 130 CO 0.00 0.62 1.10 -2.14 -0.01 0.00 0.00 175.02 174.59 2kh2 s PRO 131 N -0.77 0.58 -0.06 2.03 0.02 -1.26 0.06 135.00 135.59 2kh2 s PRO 131 Ca 0.21 0.50 -0.15 0.00 0.02 0.00 0.00 61.00 61.58 2kh2 s PRO 131 Cb -0.15 -1.76 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 2kh2 s PRO 131 CO 0.10 -2.63 0.39 0.08 -0.33 0.00 0.00 177.00 174.61 2kh2 s VAL 132 N -3.01 5.14 0.27 3.83 1.01 -0.77 -4.72 120.40 122.16 2kh2 s VAL 132 Ca 0.65 0.79 -0.00 0.00 0.00 0.00 0.00 61.98 63.41 2kh2 s VAL 132 Cb -0.18 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2kh2 s VAL 132 CO 0.57 0.48 0.28 0.72 0.00 0.00 0.00 175.10 177.15 2kh2 s PHE 133 N -0.36 1.23 -0.21 5.22 -0.71 -0.94 -4.86 117.98 117.35 2kh2 s PHE 133 Ca 0.22 -1.38 -0.12 0.00 -1.04 0.00 0.00 56.93 54.62 2kh2 s PHE 133 Cb -0.15 -0.44 -0.05 0.00 -1.21 0.00 0.00 43.02 41.17 2kh2 s PHE 133 CO 0.10 -0.84 0.23 -1.17 -1.34 0.00 0.00 175.22 172.21 2kh2 s LEU 134 N -3.22 4.16 0.13 -1.99 2.96 -1.26 -0.35 118.68 119.11 2kh2 s LEU 134 Ca 0.36 0.29 0.06 0.00 -0.22 0.00 0.00 54.13 54.62 2kh2 s LEU 134 Cb 0.03 -2.24 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 2kh2 s LEU 134 CO 0.18 0.05 -0.14 -0.83 -1.32 0.00 0.00 176.35 174.29 2kh2 s GLY 135 N 0.85 1.11 -0.04 7.98 0.00 0.25 -4.87 107.32 112.59 2kh2 s GLY 135 Ca 0.12 -1.32 0.09 0.00 0.00 0.00 0.00 44.72 43.61 2kh2 s GLY 135 CO 0.04 -1.38 1.19 0.61 0.00 0.00 0.00 173.10 173.56 2kh2 n GLY 136 N 0.47 3.25 3.00 0.20 0.00 -1.26 0.08 105.19 110.93 2kh2 n GLY 136 Ca -0.15 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.16 4.10 -2.34 2.61 -1.04 -1.26 -4.89 114.28 111.30 2kh2 n THR 137 Ca 0.10 -5.50 -0.43 0.00 -2.04 0.00 0.00 64.05 56.18 2kh2 n THR 137 Cb 0.46 -2.26 -0.02 0.00 -1.82 0.00 0.00 70.33 66.69 2kh2 n THR 137 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2kh2 s LYS 138 N -2.09 4.25 0.00 -2.82 2.20 -1.26 -2.71 119.74 117.31 2kh2 s LYS 138 Ca 0.32 1.78 0.00 0.00 -0.36 0.00 0.00 55.97 57.71 2kh2 s LYS 138 Cb 0.00 -3.75 0.00 0.00 -1.51 0.00 0.00 37.83 32.58 2kh2 s LYS 138 CO -0.01 -0.67 0.00 0.41 -0.36 0.00 0.00 175.35 174.72 2kh2 n GLY 139 N 3.66 0.85 0.00 5.54 0.00 -1.26 -5.07 105.19 108.90 2kh2 n GLY 139 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.26 1.87 0.20 -0.02 0.00 -1.10 -5.00 105.19 98.87 2kh2 n GLY 140 Ca 0.00 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.07 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 0.62 -7.42 1.61 7.50 -1.98 -3.45 115.11 111.99 2kh2 h GLN 141 Ca 0.00 -0.55 -0.48 0.00 0.50 0.00 0.00 58.65 58.12 2kh2 h GLN 141 Cb 0.00 0.13 0.12 0.00 0.05 0.00 0.00 27.48 27.78 2kh2 h GLN 141 CO 0.00 1.17 0.31 -0.51 -1.50 0.00 0.00 178.83 178.30 2kh2 s ASP 142 N -7.10 4.06 -0.15 1.46 1.01 -1.26 -4.56 116.67 110.12 2kh2 s ASP 142 Ca -0.08 1.25 -0.04 0.00 0.71 0.00 0.00 52.55 54.40 2kh2 s ASP 142 Cb 0.09 -1.94 -0.03 0.00 1.01 0.00 0.00 42.92 42.05 2kh2 s ASP 142 CO 0.89 -2.24 -0.03 -0.63 0.21 0.00 0.00 175.17 173.37 2kh2 s ILE 143 N -3.14 4.01 -0.20 0.77 1.01 0.71 -4.68 121.20 119.67 2kh2 s ILE 143 Ca 0.62 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 60.98 2kh2 s ILE 143 Cb -0.15 -2.75 -0.02 0.00 0.01 0.00 0.00 42.46 39.55 2kh2 s ILE 143 CO 0.55 0.51 0.24 0.35 0.00 0.00 0.00 174.94 176.58 2kh2 n THR 144 N 3.33 0.00 -3.92 2.92 -2.24 -1.26 -2.02 114.28 111.08 2kh2 n THR 144 Ca -0.17 -0.45 -0.36 0.00 -2.27 0.00 0.00 64.05 60.80 2kh2 n THR 144 Cb 0.53 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.71 2kh2 n THR 144 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2kh2 s ASP 145 N -1.02 6.29 0.26 3.42 -4.77 -1.26 -4.02 116.67 115.57 2kh2 s ASP 145 Ca 0.02 0.41 0.06 0.00 -3.30 0.00 0.00 52.55 49.73 2kh2 s ASP 145 Cb 0.02 -2.00 -0.02 0.00 -1.09 0.00 0.00 42.92 39.83 2kh2 s ASP 145 CO 0.10 0.37 0.23 0.49 0.70 0.00 0.00 175.17 177.05 2kh2 n PHE 146 N 1.72 -0.65 -4.23 2.11 3.72 0.12 -3.60 117.46 116.65 2kh2 n PHE 146 Ca -0.18 -2.14 -0.27 0.00 -0.05 0.00 0.00 57.45 54.81 2kh2 n PHE 146 Cb 0.54 0.24 -0.06 0.00 -0.94 0.00 0.00 39.48 39.26 2kh2 n PHE 146 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2kh2 s THR 147 N -3.02 1.82 -0.45 4.37 -4.23 -0.25 -1.23 115.64 112.65 2kh2 s THR 147 Ca 0.30 -1.72 0.10 0.00 -1.18 0.00 0.00 61.69 59.18 2kh2 s THR 147 Cb 0.01 -2.55 0.36 0.00 1.34 0.00 0.00 72.50 71.67 2kh2 s THR 147 CO 0.21 0.00 0.86 0.80 -0.54 0.00 0.00 174.62 175.95 2kh2 n MET 148 N -1.39 1.99 -1.82 3.99 1.56 -1.26 -4.15 117.12 116.05 2kh2 n MET 148 Ca -0.06 -3.99 -0.43 0.00 -0.27 0.00 0.00 57.70 52.95 2kh2 n MET 148 Cb 0.65 -1.90 -0.03 0.00 2.15 0.00 0.00 33.22 34.10 2kh2 n MET 148 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 2kh2 s GLN 149 N -2.96 3.52 0.20 2.12 1.11 -1.10 -4.78 119.66 117.77 2kh2 s GLN 149 Ca 0.43 1.93 -0.24 0.00 0.01 0.00 0.00 55.36 57.49 2kh2 s GLN 149 Cb 0.34 -4.22 -0.08 0.00 -1.01 0.00 0.00 33.01 28.04 2kh2 s GLN 149 CO -0.10 -1.65 0.79 -0.06 0.01 0.00 0.00 175.29 174.28 2kh2 s PHE 150 N 6.58 3.83 0.41 0.91 0.08 -1.26 0.00 117.98 128.53 2kh2 s PHE 150 Ca 0.87 1.61 0.04 0.00 0.12 0.00 0.00 56.93 59.57 2kh2 s PHE 150 Cb -0.31 -2.76 -0.04 0.00 -0.57 0.00 0.00 43.02 39.34 2kh2 s PHE 150 CO 0.35 0.44 0.06 0.14 -0.10 0.00 0.00 175.22 176.11 2kh2 s VAL 151 N -1.28 1.15 -1.21 -0.44 -7.23 -0.96 -4.96 120.40 105.47 2kh2 s VAL 151 Ca 0.39 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.47 2kh2 s VAL 151 Cb -0.21 -2.56 0.21 0.00 0.56 0.00 0.00 36.38 34.38 2kh2 s VAL 151 CO 0.25 0.00 1.66 -1.54 -0.31 0.00 0.00 175.10 175.16 2kh2 n SER 152 N -1.04 5.46 0.00 4.85 3.41 -1.26 -4.64 113.62 120.40 2kh2 n SER 152 Ca -0.08 -3.16 0.00 0.00 -0.26 0.00 0.00 58.87 55.38 2kh2 n SER 152 Cb 0.66 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.18 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68