#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 1.08 -4.10 0.00 0.11 -2.04 -3.36 132.00 123.69 2kh2 h PRO 2 Ca 0.00 -0.16 -0.76 0.00 0.11 0.00 0.00 66.00 65.20 2kh2 h PRO 2 Cb 0.00 -0.20 -0.25 0.00 0.11 0.00 0.00 31.00 30.66 2kh2 h PRO 2 CO 0.00 0.84 -0.22 0.54 -0.21 0.00 0.00 178.00 178.95 2kh2 s VAL 3 N -5.71 5.08 0.17 3.15 0.11 -1.26 -4.93 120.40 117.01 2kh2 s VAL 3 Ca -0.13 -1.62 -0.30 0.00 -2.93 0.00 0.00 61.98 57.00 2kh2 s VAL 3 Cb 0.15 -4.26 -0.07 0.00 -1.53 0.00 0.00 36.38 30.66 2kh2 s VAL 3 CO 0.81 -0.87 0.95 -0.13 -3.33 0.00 0.00 175.10 172.54 2kh2 s ARG 4 N 1.45 4.77 -0.04 1.54 0.52 -1.26 -4.92 118.95 121.01 2kh2 s ARG 4 Ca 0.05 1.47 -0.07 0.00 -0.52 0.00 0.00 55.73 56.65 2kh2 s ARG 4 Cb -0.28 -3.33 0.01 0.00 0.52 0.00 0.00 34.95 31.87 2kh2 s ARG 4 CO 0.02 0.36 0.18 -1.12 0.02 0.00 0.00 175.30 174.75 2kh2 s SER 5 N -0.55 -0.12 0.23 0.23 0.01 -1.26 -1.24 113.70 111.00 2kh2 s SER 5 Ca 0.44 0.16 0.08 0.00 1.31 0.00 0.00 55.95 57.94 2kh2 s SER 5 Cb -0.25 0.32 -0.05 0.00 0.21 0.00 0.00 66.02 66.25 2kh2 s SER 5 CO 0.31 -0.19 -0.12 -0.76 0.41 0.00 0.00 173.24 172.88 2kh2 s LEU 6 N -0.50 2.53 -0.18 2.44 1.43 -0.90 -4.92 118.68 118.58 2kh2 s LEU 6 Ca -0.06 -1.07 -0.02 0.00 -1.03 0.00 0.00 54.13 51.96 2kh2 s LEU 6 Cb -0.04 -0.67 -0.00 0.00 0.03 0.00 0.00 46.19 45.51 2kh2 s LEU 6 CO 0.01 -0.21 -0.10 0.20 0.23 0.00 0.00 176.35 176.47 2kh2 s ASN 7 N -3.35 3.95 0.15 2.29 0.01 -1.26 0.47 114.94 117.19 2kh2 s ASN 7 Ca 0.25 -0.43 -0.11 0.00 -0.71 0.00 0.00 52.86 51.86 2kh2 s ASN 7 Cb 0.00 -1.64 0.00 0.00 0.41 0.00 0.00 41.25 40.03 2kh2 s ASN 7 CO 0.08 0.04 0.31 0.00 -1.51 0.00 0.00 177.10 176.03 2kh2 s THR 9 N -3.91 4.02 -0.13 0.00 -4.23 -0.17 -0.51 115.64 110.71 2kh2 s THR 9 Ca 0.11 -1.09 0.01 0.00 -1.18 0.00 0.00 61.69 59.54 2kh2 s THR 9 Cb 0.03 -2.95 -0.01 0.00 1.34 0.00 0.00 72.50 70.91 2kh2 s THR 9 CO -0.04 0.04 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.16 2kh2 s LEU 10 N -2.54 2.51 0.02 4.79 1.43 -1.26 -2.67 118.68 120.95 2kh2 s LEU 10 Ca 0.27 -0.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 2kh2 s LEU 10 Cb -0.11 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 2kh2 s LEU 10 CO 0.19 0.14 -0.08 -0.13 0.23 0.00 0.00 176.35 176.70 2kh2 s ARG 11 N 0.47 0.61 0.96 1.70 0.52 -1.26 -3.68 118.95 118.27 2kh2 s ARG 11 Ca -0.11 -0.48 -0.16 0.00 -0.52 0.00 0.00 55.73 54.46 2kh2 s ARG 11 Cb -0.16 -0.53 0.20 0.00 0.52 0.00 0.00 34.95 34.97 2kh2 s ARG 11 CO 0.05 0.13 1.32 0.16 0.02 0.00 0.00 175.30 176.98 2kh2 s ASP 12 N -0.74 3.12 0.00 0.23 1.47 -0.88 -0.05 116.67 119.83 2kh2 s ASP 12 Ca -0.01 0.26 0.15 0.00 1.18 0.00 0.00 52.55 54.13 2kh2 s ASP 12 Cb -0.06 -0.30 0.67 0.00 -0.34 0.00 0.00 42.92 42.90 2kh2 s ASP 12 CO 0.00 -2.73 1.46 -1.54 0.68 0.00 0.00 175.17 173.04 2kh2 n SER 13 N -3.76 0.00 -1.39 2.11 3.41 -1.25 -2.01 113.62 110.72 2kh2 n SER 13 Ca 0.15 0.38 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 2kh2 n SER 13 Cb 0.59 -0.44 0.33 0.00 -0.26 0.00 0.00 64.21 64.43 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 -1.44 3.09 -1.52 4.33 1.13 -1.26 -4.92 117.38 116.79 2kh2 n GLN 14 Ca 0.05 -2.72 -0.13 0.00 -1.94 0.00 0.00 57.00 52.26 2kh2 n GLN 14 Cb 0.16 -1.67 -0.05 0.00 0.11 0.00 0.00 30.24 28.79 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 1.39 -0.92 -3.02 -1.09 1.13 -0.85 -4.96 117.38 109.05 2kh2 n GLN 15 Ca 0.24 0.90 -0.32 0.00 -1.94 0.00 0.00 57.00 55.88 2kh2 n GLN 15 Cb 0.71 -4.98 -0.05 0.00 0.11 0.00 0.00 30.24 26.03 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 -3.35 3.97 0.18 -1.09 1.02 -1.26 -4.26 119.74 114.95 2kh2 s LYS 16 Ca 0.00 0.68 0.09 0.00 0.02 0.00 0.00 55.97 56.76 2kh2 s LYS 16 Cb 0.00 -2.39 -0.04 0.00 -0.52 0.00 0.00 37.83 34.88 2kh2 s LYS 16 CO 0.00 0.08 -0.12 -1.12 -0.92 0.00 0.00 175.35 173.27 2kh2 s SER 17 N -2.48 4.10 -0.20 2.83 0.01 0.14 -2.07 113.70 116.03 2kh2 s SER 17 Ca 0.54 -0.62 -0.19 0.00 1.31 0.00 0.00 55.95 56.99 2kh2 s SER 17 Cb -0.10 -0.64 -0.03 0.00 0.21 0.00 0.00 66.02 65.46 2kh2 s SER 17 CO 0.20 0.11 0.55 -0.76 0.41 0.00 0.00 173.24 173.76 2kh2 s LEU 18 N -2.74 4.15 0.11 2.44 1.43 -1.24 -1.50 118.68 121.32 2kh2 s LEU 18 Ca 0.24 0.73 0.09 0.00 -1.03 0.00 0.00 54.13 54.15 2kh2 s LEU 18 Cb -0.09 -2.77 -0.04 0.00 0.03 0.00 0.00 46.19 43.33 2kh2 s LEU 18 CO 0.14 -0.21 -0.22 0.68 0.23 0.00 0.00 176.35 176.97 2kh2 s VAL 19 N 1.70 1.83 -0.47 -1.59 -7.23 0.42 -1.95 120.40 113.12 2kh2 s VAL 19 Ca 0.26 -1.59 -0.29 0.00 -1.81 0.00 0.00 61.98 58.55 2kh2 s VAL 19 Cb -0.16 -1.65 0.02 0.00 0.56 0.00 0.00 36.38 35.15 2kh2 s VAL 19 CO 0.10 -0.02 1.22 -0.04 -0.31 0.00 0.00 175.10 176.05 2kh2 s MET 20 N -1.93 3.66 0.00 4.82 -1.94 -1.26 0.13 119.30 122.78 2kh2 s MET 20 Ca 0.08 0.65 0.00 0.00 -1.71 0.00 0.00 55.69 54.71 2kh2 s MET 20 Cb -0.10 -3.95 0.00 0.00 2.01 0.00 0.00 34.83 32.79 2kh2 s MET 20 CO 0.05 -1.46 0.16 0.45 -0.01 0.00 0.00 175.02 174.20 2kh2 n SER 21 N 8.19 0.00 -2.00 3.03 2.88 -0.07 -4.92 113.62 120.73 2kh2 n SER 21 Ca 0.13 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 2kh2 n SER 21 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2kh2 n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kh2 n GLY 22 N 1.37 2.29 0.27 0.46 0.00 -1.22 -4.94 105.19 103.41 2kh2 n GLY 22 Ca 0.00 -2.14 0.11 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.53 1.61 0.13 -2.04 -3.09 132.00 128.09 2kh2 h PRO 23 Ca 0.00 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.78 2kh2 h PRO 23 Cb 0.00 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 30.73 2kh2 h PRO 23 CO 0.00 0.05 -0.99 0.66 -0.23 0.00 0.00 178.00 177.49 2kh2 n TYR 24 N -4.12 1.77 -3.79 1.56 4.01 -1.26 -4.99 117.16 110.34 2kh2 n TYR 24 Ca -0.03 -2.10 -0.12 0.00 -0.16 0.00 0.00 57.90 55.49 2kh2 n TYR 24 Cb 0.13 -0.27 -0.09 0.00 -0.31 0.00 0.00 39.34 38.80 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 -3.59 0.66 0.03 -0.72 2.12 -1.17 -4.14 118.70 111.89 2kh2 s GLU 25 Ca 0.37 -0.35 0.06 0.00 0.36 0.00 0.00 54.97 55.41 2kh2 s GLU 25 Cb 0.36 0.29 -0.02 0.00 0.26 0.00 0.00 34.13 35.01 2kh2 s GLU 25 CO -0.01 -0.19 -0.17 -0.51 -0.54 0.00 0.00 175.26 173.84 2kh2 s LEU 26 N -1.57 2.15 0.21 2.70 1.43 -1.26 -0.89 118.68 121.44 2kh2 s LEU 26 Ca -0.11 -0.47 0.09 0.00 -1.03 0.00 0.00 54.13 52.61 2kh2 s LEU 26 Cb -0.04 -0.81 -0.05 0.00 0.03 0.00 0.00 46.19 45.32 2kh2 s LEU 26 CO 0.01 0.12 -0.17 -0.54 0.23 0.00 0.00 176.35 176.00 2kh2 s LYS 27 N -1.05 1.39 -0.18 1.70 1.02 0.12 -1.20 119.74 121.53 2kh2 s LYS 27 Ca 0.05 -1.57 0.01 0.00 0.02 0.00 0.00 55.97 54.48 2kh2 s LYS 27 Cb -0.08 -1.32 0.03 0.00 -0.52 0.00 0.00 37.83 35.94 2kh2 s LYS 27 CO 0.01 0.24 -0.16 0.00 -0.92 0.00 0.00 175.35 174.53 2kh2 s ALA 28 N -2.60 2.17 0.10 5.17 0.00 0.12 -0.43 121.76 126.28 2kh2 s ALA 28 Ca 0.22 -1.19 -0.16 0.00 0.00 0.00 0.00 51.96 50.83 2kh2 s ALA 28 Cb -0.03 -1.21 0.03 0.00 0.00 0.00 0.00 23.12 21.91 2kh2 s ALA 28 CO 0.08 -0.54 0.39 -0.48 0.00 0.00 0.00 175.76 175.22 2kh2 s LEU 29 N 1.34 0.48 0.14 0.00 0.05 -0.56 -2.87 118.68 117.25 2kh2 s LEU 29 Ca 0.02 -0.25 -0.31 0.00 0.05 0.00 0.00 54.13 53.64 2kh2 s LEU 29 Cb -0.14 1.75 -0.10 0.00 -2.05 0.00 0.00 46.19 45.64 2kh2 s LEU 29 CO -0.11 -0.79 1.75 -1.00 -0.55 0.00 0.00 176.35 175.65 2kh2 s HIS 30 N -3.42 2.47 -0.03 3.48 3.76 -1.26 0.27 115.29 120.55 2kh2 s HIS 30 Ca 0.01 0.19 -0.01 0.00 -0.15 0.00 0.00 55.06 55.10 2kh2 s HIS 30 Cb 0.01 -4.11 0.03 0.00 1.11 0.00 0.00 32.58 29.62 2kh2 s HIS 30 CO -0.09 -4.42 0.04 -1.17 -0.85 0.00 0.00 174.74 168.25 2kh2 s LEU 31 N 2.17 0.59 -0.28 0.89 2.96 -1.26 -4.87 118.68 118.88 2kh2 s LEU 31 Ca 0.77 0.04 -0.21 0.00 -0.22 0.00 0.00 54.13 54.52 2kh2 s LEU 31 Cb -0.46 -0.15 0.10 0.00 0.50 0.00 0.00 46.19 46.18 2kh2 s LEU 31 CO 0.34 -0.19 0.83 -1.58 -1.32 0.00 0.00 176.35 174.43 2kh2 s GLN 32 N 1.67 0.64 0.00 1.98 0.74 -1.26 -4.81 119.66 118.62 2kh2 s GLN 32 Ca -0.01 0.91 0.00 0.00 0.05 0.00 0.00 55.36 56.31 2kh2 s GLN 32 Cb -0.13 0.23 0.00 0.00 1.10 0.00 0.00 33.01 34.22 2kh2 s GLN 32 CO -0.03 -0.10 0.00 0.41 -0.55 0.00 0.00 175.29 175.02 2kh2 n GLY 33 N 3.24 0.63 0.00 2.59 0.00 -1.26 -4.28 105.19 106.11 2kh2 n GLY 33 Ca -0.16 -1.62 0.14 0.00 0.00 0.00 0.00 46.02 44.38 2kh2 n GLY 33 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2kh2 n GLN 34 N 0.00 0.62 0.02 1.61 -0.06 -1.26 -2.19 117.38 116.12 2kh2 n GLN 34 Ca 0.00 0.01 0.12 0.00 -2.00 0.00 0.00 57.00 55.13 2kh2 n GLN 34 Cb 0.00 -1.50 0.16 0.00 -4.06 0.00 0.00 30.24 24.84 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 -1.17 0.60 -0.12 1.69 9.92 -1.26 -4.16 116.55 122.05 2kh2 n ASP 35 Ca 0.17 -0.19 0.08 0.00 -0.53 0.00 0.00 54.79 54.32 2kh2 n ASP 35 Cb 0.17 0.40 0.41 0.00 -0.64 0.00 0.00 41.12 41.46 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 0.00 0.60 0.00 -1.24 4.05 -1.69 -1.72 114.93 114.93 2kh2 h MET 36 Ca 0.00 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 2kh2 h MET 36 Cb 0.62 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.28 2kh2 h MET 36 CO 0.00 0.39 0.00 0.39 0.23 0.00 0.00 176.91 177.92 2kh2 n GLU 37 N -4.48 0.05 0.00 0.39 -0.58 -1.26 -1.25 120.64 113.52 2kh2 n GLU 37 Ca 0.09 0.28 0.14 0.00 -0.42 0.00 0.00 57.16 57.25 2kh2 n GLU 37 Cb 0.25 -1.50 0.58 0.00 -0.57 0.00 0.00 31.44 30.19 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 -1.32 1.26 -2.22 3.49 6.02 -0.65 -4.91 117.38 119.06 2kh2 n GLN 38 Ca 0.02 -0.62 -0.34 0.00 -0.01 0.00 0.00 57.00 56.05 2kh2 n GLN 38 Cb 0.04 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.81 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 -2.17 3.38 -0.07 -1.09 -2.07 -0.38 -4.61 119.66 112.66 2kh2 s GLN 39 Ca 0.36 1.42 -0.15 0.00 -1.82 0.00 0.00 55.36 55.17 2kh2 s GLN 39 Cb 0.21 -2.03 -0.05 0.00 -1.09 0.00 0.00 33.01 30.05 2kh2 s GLN 39 CO 0.40 -0.79 0.39 0.08 -1.32 0.00 0.00 175.29 174.05 2kh2 s VAL 40 N -2.06 5.15 -0.26 3.63 1.01 -0.82 -5.02 120.40 122.03 2kh2 s VAL 40 Ca 0.68 0.78 -0.10 0.00 0.00 0.00 0.00 61.98 63.35 2kh2 s VAL 40 Cb -0.20 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 2kh2 s VAL 40 CO 0.29 0.48 0.15 -0.69 0.00 0.00 0.00 175.10 175.33 2kh2 s VAL 41 N -0.32 5.09 -0.16 2.92 1.01 -1.26 -4.52 120.40 123.16 2kh2 s VAL 41 Ca 0.22 0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.21 2kh2 s VAL 41 Cb -0.15 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 2kh2 s VAL 41 CO 0.10 0.30 0.13 -0.36 0.00 0.00 0.00 175.10 175.27 2kh2 s PHE 42 N 1.47 3.47 -0.25 5.22 0.08 0.33 -1.76 117.98 126.55 2kh2 s PHE 42 Ca 0.07 0.39 -0.21 0.00 0.12 0.00 0.00 56.93 57.30 2kh2 s PHE 42 Cb -0.15 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.23 2kh2 s PHE 42 CO 0.07 0.47 0.65 -1.12 -0.10 0.00 0.00 175.22 175.19 2kh2 s SER 43 N -0.25 6.61 -0.69 1.36 0.01 0.12 -1.34 113.70 119.51 2kh2 s SER 43 Ca 0.11 0.75 -0.19 0.00 1.31 0.00 0.00 55.95 57.93 2kh2 s SER 43 Cb -0.12 -2.35 0.11 0.00 0.21 0.00 0.00 66.02 63.88 2kh2 s SER 43 CO 0.01 -0.37 0.85 -0.32 0.41 0.00 0.00 173.24 173.81 2kh2 s MET 44 N 2.46 3.21 -0.05 12.44 1.75 0.18 -2.27 119.30 137.02 2kh2 s MET 44 Ca 0.27 -1.40 -0.27 0.00 -1.25 0.00 0.00 55.69 53.04 2kh2 s MET 44 Cb -0.16 -4.40 -0.03 0.00 2.84 0.00 0.00 34.83 33.09 2kh2 s MET 44 CO 0.09 -1.63 0.87 -1.12 -0.65 0.00 0.00 175.02 172.58 2kh2 s SER 45 N 3.52 7.19 -0.60 1.11 0.01 -0.83 -2.11 113.70 121.99 2kh2 s SER 45 Ca 0.18 1.44 -0.20 0.00 1.31 0.00 0.00 55.95 58.68 2kh2 s SER 45 Cb -0.18 -2.50 0.09 0.00 0.21 0.00 0.00 66.02 63.64 2kh2 s SER 45 CO 0.03 -0.24 0.77 -0.36 0.41 0.00 0.00 173.24 173.85 2kh2 s PHE 46 N 1.14 2.91 0.00 2.43 0.40 -0.37 0.09 117.98 124.58 2kh2 s PHE 46 Ca 0.45 -0.76 0.00 0.00 -0.60 0.00 0.00 56.93 56.02 2kh2 s PHE 46 Cb -0.19 -4.02 0.00 0.00 0.51 0.00 0.00 43.02 39.32 2kh2 s PHE 46 CO 0.22 -1.35 0.00 1.33 0.70 0.00 0.00 175.22 176.12 2kh2 n VAL 47 N 5.68 0.00 -4.00 -0.44 0.24 -1.22 -4.48 118.33 114.10 2kh2 n VAL 47 Ca -0.07 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.92 2kh2 n VAL 47 Cb 0.44 -1.88 -0.15 0.00 -1.47 0.00 0.00 33.84 30.78 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 0.21 1.57 0.00 7.34 2.00 -1.13 -4.95 119.66 124.69 2kh2 s GLN 48 Ca 0.00 -1.66 0.00 0.00 -2.00 0.00 0.00 55.36 51.70 2kh2 s GLN 48 Cb 0.00 -3.02 0.00 0.00 0.80 0.00 0.00 33.01 30.79 2kh2 s GLN 48 CO 0.00 -0.85 0.00 0.41 -0.50 0.00 0.00 175.29 174.35 2kh2 n GLY 49 N 4.36 4.34 3.56 2.59 0.00 -1.26 -4.99 105.19 113.79 2kh2 n GLY 49 Ca -0.01 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.89 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 2.48 3.62 -0.86 1.61 2.56 -1.26 -4.92 118.70 121.93 2kh2 s GLU 50 Ca 0.00 -1.23 -0.16 0.00 0.00 0.00 0.00 54.97 53.58 2kh2 s GLU 50 Cb 0.00 -5.38 0.19 0.00 2.00 0.00 0.00 34.13 30.94 2kh2 s GLU 50 CO 0.00 -2.26 0.89 -2.00 -0.56 0.00 0.00 175.26 171.34 2kh2 s GLU 51 N 4.93 3.60 0.00 4.30 2.12 -1.26 -4.19 118.70 128.20 2kh2 s GLU 51 Ca 0.48 -2.23 0.00 0.00 0.36 0.00 0.00 54.97 53.58 2kh2 s GLU 51 Cb 0.00 -4.59 0.00 0.00 0.26 0.00 0.00 34.13 29.80 2kh2 s GLU 51 CO -0.07 -1.45 0.00 -1.13 -0.54 0.00 0.00 175.26 172.07 2kh2 n SER 52 N 4.84 0.00 0.00 -1.70 3.41 -1.01 -5.04 113.62 114.12 2kh2 n SER 52 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 2kh2 n SER 52 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 2kh2 n SER 52 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2kh2 n ASN 53 N 0.00 0.00 -1.10 4.04 2.85 -1.26 -4.89 115.26 114.90 2kh2 n ASN 53 Ca 0.00 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.59 2kh2 n ASN 53 Cb 0.00 0.26 0.20 0.00 1.24 0.00 0.00 39.78 41.48 2kh2 n ASN 53 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 2kh2 n ASP 54 N -2.07 3.32 -3.55 1.20 5.75 -1.26 -4.79 116.55 115.15 2kh2 n ASP 54 Ca 0.00 -1.98 -0.19 0.00 -0.01 0.00 0.00 54.79 52.60 2kh2 n ASP 54 Cb 0.00 -0.20 -0.14 0.00 -1.03 0.00 0.00 41.12 39.75 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 -1.60 0.14 -0.18 0.11 2.20 -1.25 -0.17 119.74 118.98 2kh2 s LYS 55 Ca 0.37 0.22 -0.01 0.00 -0.36 0.00 0.00 55.97 56.19 2kh2 s LYS 55 Cb 0.22 -1.15 0.00 0.00 -1.51 0.00 0.00 37.83 35.39 2kh2 s LYS 55 CO 0.31 -0.59 -0.12 0.42 -0.36 0.00 0.00 175.35 175.01 2kh2 s ILE 56 N 2.29 2.80 -0.38 5.43 -1.09 0.51 -2.40 121.20 128.35 2kh2 s ILE 56 Ca 0.05 -0.70 -0.29 0.00 -2.23 0.00 0.00 60.65 57.48 2kh2 s ILE 56 Cb -0.15 -2.22 0.02 0.00 -1.58 0.00 0.00 42.46 38.53 2kh2 s ILE 56 CO -0.10 0.49 1.15 -2.16 -1.23 0.00 0.00 174.94 173.09 2kh2 s PRO 57 N 1.13 3.88 0.15 2.79 0.04 -1.26 -0.12 135.00 141.62 2kh2 s PRO 57 Ca 0.01 0.89 -0.00 0.00 0.04 0.00 0.00 61.00 61.94 2kh2 s PRO 57 Cb -0.14 -3.84 -0.04 0.00 0.04 0.00 0.00 34.50 30.51 2kh2 s PRO 57 CO -0.04 -1.16 0.06 0.14 0.04 0.00 0.00 177.00 176.04 2kh2 s VAL 58 N 4.18 0.22 0.24 -0.36 -7.23 -0.00 -3.46 120.40 113.99 2kh2 s VAL 58 Ca 0.49 -1.94 0.08 0.00 -1.81 0.00 0.00 61.98 58.81 2kh2 s VAL 58 Cb -0.11 -2.14 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 2kh2 s VAL 58 CO 0.24 -0.39 0.05 0.00 -0.31 0.00 0.00 175.10 174.68 2kh2 s ALA 59 N -3.97 3.27 -0.17 1.32 0.00 0.11 0.18 121.76 122.50 2kh2 s ALA 59 Ca 0.26 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.68 2kh2 s ALA 59 Cb 0.07 -0.95 0.05 0.00 0.00 0.00 0.00 23.12 22.29 2kh2 s ALA 59 CO 0.04 0.31 -0.03 -0.51 0.00 0.00 0.00 175.76 175.57 2kh2 s LEU 60 N -3.57 1.58 0.27 0.00 1.43 -1.26 -1.97 118.68 115.17 2kh2 s LEU 60 Ca 0.31 -0.73 0.04 0.00 -1.03 0.00 0.00 54.13 52.72 2kh2 s LEU 60 Cb -0.07 -0.85 -0.06 0.00 0.03 0.00 0.00 46.19 45.24 2kh2 s LEU 60 CO 0.21 -0.22 0.02 -0.83 0.23 0.00 0.00 176.35 175.76 2kh2 s GLY 61 N 1.67 1.79 0.05 -3.19 0.00 -0.96 -0.84 107.32 105.84 2kh2 s GLY 61 Ca -0.00 -1.90 -0.24 0.00 0.00 0.00 0.00 44.72 42.58 2kh2 s GLY 61 CO -0.07 -1.74 0.71 1.08 0.00 0.00 0.00 173.10 173.08 2kh2 s LEU 62 N -3.39 4.46 0.07 0.66 1.02 0.41 0.11 118.68 122.02 2kh2 s LEU 62 Ca 0.32 1.38 -0.32 0.00 0.02 0.00 0.00 54.13 55.54 2kh2 s LEU 62 Cb 0.07 -3.14 -0.11 0.00 0.02 0.00 0.00 46.19 43.03 2kh2 s LEU 62 CO 0.12 0.07 1.82 1.17 0.02 0.00 0.00 176.35 179.56 2kh2 n LYS 63 N 2.59 2.54 -1.64 1.70 4.81 -0.72 -1.62 118.16 125.83 2kh2 n LYS 63 Ca -0.04 0.93 -0.17 0.00 -0.87 0.00 0.00 58.31 58.16 2kh2 n LYS 63 Cb 0.50 -2.79 -0.06 0.00 0.02 0.00 0.00 35.03 32.70 2kh2 n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2kh2 n GLU 64 N 5.73 -1.18 -4.14 1.64 1.02 -1.26 -4.99 120.64 117.46 2kh2 n GLU 64 Ca 0.19 1.03 -0.14 0.00 -0.02 0.00 0.00 57.16 58.22 2kh2 n GLU 64 Cb 0.34 -5.28 -0.11 0.00 -0.02 0.00 0.00 31.44 26.38 2kh2 n GLU 64 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2kh2 s LYS 65 N -3.67 0.73 -0.29 3.49 1.02 -0.64 -5.03 119.74 115.36 2kh2 s LYS 65 Ca 0.00 -1.02 0.02 0.00 0.02 0.00 0.00 55.97 54.99 2kh2 s LYS 65 Cb 0.00 -0.44 0.42 0.00 -0.52 0.00 0.00 37.83 37.29 2kh2 s LYS 65 CO 0.00 0.07 1.59 0.27 -0.92 0.00 0.00 175.35 176.36 2kh2 n ASN 66 N 0.87 3.54 -4.52 2.83 6.94 -1.26 -4.40 115.26 119.26 2kh2 n ASN 66 Ca -0.18 -3.02 -0.37 0.00 -0.02 0.00 0.00 54.58 50.99 2kh2 n ASN 66 Cb 0.57 -0.72 -0.12 0.00 -2.36 0.00 0.00 39.78 37.15 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 -2.08 3.71 0.10 -4.53 1.43 -1.26 -1.30 118.68 114.75 2kh2 s LEU 67 Ca 0.36 -0.10 0.08 0.00 -1.03 0.00 0.00 54.13 53.44 2kh2 s LEU 67 Cb 0.30 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.48 2kh2 s LEU 67 CO 0.07 -0.02 -0.21 -0.31 0.23 0.00 0.00 176.35 176.10 2kh2 s TYR 68 N 1.58 1.82 -0.18 0.29 1.51 -0.34 -0.45 117.35 121.58 2kh2 s TYR 68 Ca 0.06 -0.41 -0.29 0.00 -1.01 0.00 0.00 57.07 55.42 2kh2 s TYR 68 Cb -0.15 -1.00 -0.01 0.00 -0.11 0.00 0.00 41.96 40.68 2kh2 s TYR 68 CO 0.06 0.21 1.30 -0.51 -1.11 0.00 0.00 175.55 175.50 2kh2 s LEU 69 N -1.87 4.13 -0.04 -1.29 1.43 -0.02 -0.12 118.68 120.90 2kh2 s LEU 69 Ca 0.07 1.64 0.06 0.00 -1.03 0.00 0.00 54.13 54.87 2kh2 s LEU 69 Cb -0.10 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 2kh2 s LEU 69 CO 0.04 -0.83 -0.21 -0.55 0.23 0.00 0.00 176.35 175.03 2kh2 s SER 70 N 2.24 3.47 -0.37 2.29 0.15 0.53 -4.49 113.70 117.51 2kh2 s SER 70 Ca 0.56 -0.37 -0.13 0.00 0.70 0.00 0.00 55.95 56.72 2kh2 s SER 70 Cb -0.22 -0.67 0.01 0.00 -1.71 0.00 0.00 66.02 63.43 2kh2 s SER 70 CO 0.17 0.31 0.24 0.00 1.20 0.00 0.00 173.24 175.16 2kh2 s VAL 72 N 1.65 0.94 -0.29 0.00 -7.23 -0.27 -4.78 120.40 110.42 2kh2 s VAL 72 Ca 0.05 -2.01 -0.18 0.00 -1.81 0.00 0.00 61.98 58.03 2kh2 s VAL 72 Cb -0.18 -1.87 -0.02 0.00 0.56 0.00 0.00 36.38 34.86 2kh2 s VAL 72 CO 0.09 -0.71 0.50 -0.76 -0.31 0.00 0.00 175.10 173.91 2kh2 s LEU 73 N -3.14 4.13 -0.37 1.32 1.43 -1.26 0.25 118.68 121.05 2kh2 s LEU 73 Ca 0.17 0.34 -0.00 0.00 -1.03 0.00 0.00 54.13 53.61 2kh2 s LEU 73 Cb 0.04 -2.62 0.10 0.00 0.03 0.00 0.00 46.19 43.74 2kh2 s LEU 73 CO -0.00 -0.34 0.12 -0.54 0.23 0.00 0.00 176.35 175.82 2kh2 s LYS 74 N 2.33 1.87 -0.67 1.70 1.02 0.62 -4.74 119.74 121.87 2kh2 s LYS 74 Ca 0.20 -1.76 -0.03 0.00 0.02 0.00 0.00 55.97 54.40 2kh2 s LYS 74 Cb -0.16 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.74 2kh2 s LYS 74 CO 0.11 -0.96 0.60 -3.47 -0.92 0.00 0.00 175.35 170.71 2kh2 n ASP 75 N 4.47 -5.70 -2.21 2.83 -0.08 -1.26 -3.41 116.55 111.19 2kh2 n ASP 75 Ca -0.02 -0.33 -0.16 0.00 -1.51 0.00 0.00 54.79 52.78 2kh2 n ASP 75 Cb 0.42 -4.00 -0.02 0.00 2.34 0.00 0.00 41.12 39.86 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 -2.28 -4.54 -3.69 1.67 9.92 -1.26 -4.95 116.55 111.43 2kh2 n ASP 76 Ca -0.03 0.17 -0.12 0.00 -0.53 0.00 0.00 54.79 54.28 2kh2 n ASP 76 Cb 0.55 -3.88 -0.13 0.00 -0.64 0.00 0.00 41.12 37.02 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 -4.66 0.20 0.05 -1.24 2.47 -1.22 -5.13 119.74 110.22 2kh2 s LYS 77 Ca 0.00 0.70 -0.30 0.00 -1.56 0.00 0.00 55.97 54.81 2kh2 s LYS 77 Cb 0.00 -0.03 -0.08 0.00 -1.46 0.00 0.00 37.83 36.26 2kh2 s LYS 77 CO 0.00 -0.23 1.65 -2.14 0.16 0.00 0.00 175.35 174.79 2kh2 s PRO 78 N 1.95 4.20 0.10 4.03 0.02 -1.26 -0.28 135.00 143.75 2kh2 s PRO 78 Ca -0.04 2.31 0.01 0.00 0.02 0.00 0.00 61.00 63.30 2kh2 s PRO 78 Cb -0.11 -3.67 -0.04 0.00 0.02 0.00 0.00 34.50 30.70 2kh2 s PRO 78 CO -0.09 -0.75 -0.05 0.99 -0.33 0.00 0.00 177.00 176.77 2kh2 s THR 79 N 2.87 0.57 0.11 0.99 2.01 0.14 -4.68 115.64 117.65 2kh2 s THR 79 Ca 0.74 -1.91 0.02 0.00 0.31 0.00 0.00 61.69 60.85 2kh2 s THR 79 Cb -0.39 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.38 2kh2 s THR 79 CO 0.32 -0.85 0.17 -0.22 -0.69 0.00 0.00 174.62 173.35 2kh2 s LEU 80 N -3.03 4.08 0.31 4.42 2.96 -1.26 -1.12 118.68 125.05 2kh2 s LEU 80 Ca 0.12 0.09 -0.19 0.00 -0.22 0.00 0.00 54.13 53.93 2kh2 s LEU 80 Cb 0.06 -2.70 0.05 0.00 0.50 0.00 0.00 46.19 44.10 2kh2 s LEU 80 CO -0.05 0.12 0.81 0.00 -1.32 0.00 0.00 176.35 175.91 2kh2 s GLN 81 N -2.76 1.92 -0.23 1.98 -2.07 -0.32 -4.88 119.66 113.31 2kh2 s GLN 81 Ca 0.32 -1.17 -0.10 0.00 -1.82 0.00 0.00 55.36 52.60 2kh2 s GLN 81 Cb -0.12 0.58 -0.05 0.00 -1.09 0.00 0.00 33.01 32.33 2kh2 s GLN 81 CO 0.25 -0.89 0.13 -0.51 -1.32 0.00 0.00 175.29 172.96 2kh2 s LEU 82 N -3.05 3.99 -0.13 2.60 2.01 -1.26 -0.35 118.68 122.50 2kh2 s LEU 82 Ca 0.14 0.07 -0.00 0.00 0.01 0.00 0.00 54.13 54.35 2kh2 s LEU 82 Cb -0.05 -2.06 -0.02 0.00 0.01 0.00 0.00 46.19 44.07 2kh2 s LEU 82 CO 0.09 0.08 -0.12 -1.61 1.01 0.00 0.00 176.35 175.79 2kh2 s GLU 83 N 0.99 3.34 -0.28 1.70 2.02 0.82 -4.91 118.70 122.39 2kh2 s GLU 83 Ca 0.07 -0.66 -0.24 0.00 0.02 0.00 0.00 54.97 54.15 2kh2 s GLU 83 Cb -0.13 -2.65 -0.00 0.00 0.10 0.00 0.00 34.13 31.45 2kh2 s GLU 83 CO 0.04 0.26 0.83 -1.12 0.02 0.00 0.00 175.26 175.29 2kh2 s SER 84 N 0.24 6.77 0.29 -0.19 0.01 -1.26 -1.20 113.70 118.36 2kh2 s SER 84 Ca -0.08 0.88 0.11 0.00 1.31 0.00 0.00 55.95 58.17 2kh2 s SER 84 Cb -0.15 -2.43 -0.05 0.00 0.21 0.00 0.00 66.02 63.60 2kh2 s SER 84 CO 0.05 -0.58 -0.11 0.68 0.41 0.00 0.00 173.24 173.69 2kh2 s VAL 85 N 2.95 2.71 -0.25 3.43 -7.23 -0.42 -5.03 120.40 116.56 2kh2 s VAL 85 Ca 0.35 -2.20 -0.35 0.00 -1.81 0.00 0.00 61.98 57.97 2kh2 s VAL 85 Cb -0.15 -2.55 -0.11 0.00 0.56 0.00 0.00 36.38 34.13 2kh2 s VAL 85 CO 0.10 -0.34 2.04 -0.67 -0.31 0.00 0.00 175.10 175.92 2kh2 n ASP 86 N -0.76 2.68 0.14 4.85 4.64 -1.26 -4.82 116.55 122.02 2kh2 n ASP 86 Ca -0.05 0.65 0.12 0.00 -1.38 0.00 0.00 54.79 54.12 2kh2 n ASP 86 Cb 0.61 -1.31 0.52 0.00 -1.04 0.00 0.00 41.12 39.90 2kh2 n ASP 86 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2kh2 n PRO 87 N 7.40 0.18 -0.00 -0.67 -0.04 -1.26 -1.45 135.00 139.15 2kh2 n PRO 87 Ca 0.32 0.49 0.10 0.00 -0.04 0.00 0.00 63.50 64.37 2kh2 n PRO 87 Cb 0.26 -1.90 -0.13 0.00 -0.04 0.00 0.00 33.50 31.69 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 -2.24 0.23 -0.05 0.54 2.85 -1.26 -4.29 118.16 113.93 2kh2 n LYS 88 Ca 0.01 -0.05 0.02 0.00 -1.05 0.00 0.00 58.31 57.24 2kh2 n LYS 88 Cb 0.17 -1.49 0.05 0.00 -0.65 0.00 0.00 35.03 33.11 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 -1.68 2.06 -3.95 -5.58 3.02 -0.90 -5.00 115.26 103.23 2kh2 n ASN 89 Ca 0.02 -1.74 -0.16 0.00 -0.03 0.00 0.00 54.58 52.68 2kh2 n ASN 89 Cb 0.38 -0.06 -0.14 0.00 -0.61 0.00 0.00 39.78 39.35 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 -0.80 0.43 0.35 3.10 1.51 -0.53 -4.42 117.35 116.98 2kh2 s TYR 90 Ca 0.08 -0.08 -0.05 0.00 -1.01 0.00 0.00 57.07 56.01 2kh2 s TYR 90 Cb 0.05 -0.28 0.08 0.00 -0.11 0.00 0.00 41.96 41.70 2kh2 s TYR 90 CO 0.06 -0.01 0.47 -0.35 -1.11 0.00 0.00 175.55 174.61 2kh2 n PRO 91 N 2.99 -0.34 -3.97 -1.71 -0.04 -1.26 -4.73 135.00 125.94 2kh2 n PRO 91 Ca -0.13 -0.80 -0.09 0.00 -0.04 0.00 0.00 63.50 62.44 2kh2 n PRO 91 Cb 0.58 -0.46 -0.05 0.00 -0.04 0.00 0.00 33.50 33.53 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 -3.96 1.57 0.07 0.54 -2.85 -1.26 -5.07 119.74 108.78 2kh2 s LYS 92 Ca 0.27 -1.19 -0.27 0.00 -1.00 0.00 0.00 55.97 53.78 2kh2 s LYS 92 Cb -0.01 0.49 -0.17 0.00 -2.06 0.00 0.00 37.83 36.09 2kh2 s LYS 92 CO 0.19 -0.66 1.62 -0.22 0.10 0.00 0.00 175.35 176.38 2kh2 h LYS 93 N 2.22 -0.32 -4.18 1.78 1.63 -1.91 -3.37 116.57 112.40 2kh2 h LYS 93 Ca -0.25 0.02 -0.72 0.00 -0.85 0.00 0.00 60.65 58.85 2kh2 h LYS 93 Cb 1.25 0.07 -0.31 0.00 -0.60 0.00 0.00 32.23 32.64 2kh2 h LYS 93 CO 0.34 -0.17 -0.38 0.21 -3.45 0.00 0.00 179.45 176.00 2kh2 s LYS 94 N -5.86 2.48 0.60 1.90 2.47 -1.26 -2.84 119.74 117.22 2kh2 s LYS 94 Ca -0.15 -1.95 -0.05 0.00 -1.56 0.00 0.00 55.97 52.26 2kh2 s LYS 94 Cb 0.04 -3.87 0.02 0.00 -1.46 0.00 0.00 37.83 32.57 2kh2 s LYS 94 CO 0.63 -1.18 0.90 -1.64 0.16 0.00 0.00 175.35 174.23 2kh2 s MET 95 N 1.00 2.77 0.60 4.03 -1.94 -1.26 -5.04 119.30 119.45 2kh2 s MET 95 Ca 0.09 -0.13 -0.19 0.00 -1.71 0.00 0.00 55.69 53.74 2kh2 s MET 95 Cb -0.23 -2.29 -0.03 0.00 2.01 0.00 0.00 34.83 34.29 2kh2 s MET 95 CO -0.02 -0.77 1.28 -1.21 -0.01 0.00 0.00 175.02 174.29 2kh2 s GLU 96 N -4.99 2.88 0.57 2.03 8.01 -1.26 -4.87 118.70 121.06 2kh2 s GLU 96 Ca 0.55 2.03 0.27 0.00 0.01 0.00 0.00 54.97 57.83 2kh2 s GLU 96 Cb -0.11 -2.00 1.68 0.00 -4.31 0.00 0.00 34.13 29.39 2kh2 s GLU 96 CO 0.44 -1.34 2.21 -0.22 0.01 0.00 0.00 175.26 176.37 2kh2 h LYS 97 N 0.94 0.00 0.00 1.61 3.64 -1.96 0.18 116.57 120.98 2kh2 h LYS 97 Ca -0.51 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2kh2 h LYS 97 Cb 1.31 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 2kh2 h LYS 97 CO 0.55 0.02 0.00 2.89 -2.27 0.00 0.00 179.45 180.64 2kh2 n ARG 98 N -3.95 0.05 -0.06 1.90 1.85 -1.26 -2.25 116.66 112.95 2kh2 n ARG 98 Ca -0.03 0.25 0.04 0.00 -1.00 0.00 0.00 57.85 57.11 2kh2 n ARG 98 Cb 0.10 -1.59 0.06 0.00 -1.05 0.00 0.00 32.46 29.99 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 -1.68 0.15 -3.45 2.89 3.72 0.04 -1.07 117.46 118.05 2kh2 n PHE 99 Ca 0.04 -0.25 -0.40 0.00 -0.05 0.00 0.00 57.45 56.79 2kh2 n PHE 99 Cb 0.22 -0.02 -0.10 0.00 -0.94 0.00 0.00 39.48 38.64 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 -0.80 5.21 0.13 -4.37 1.01 -0.95 -4.22 120.40 116.41 2kh2 s VAL 100 Ca 0.12 0.19 0.06 0.00 0.00 0.00 0.00 61.98 62.35 2kh2 s VAL 100 Cb 0.07 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2kh2 s VAL 100 CO 0.10 0.06 0.01 -0.36 0.00 0.00 0.00 175.10 174.91 2kh2 s PHE 101 N 1.95 2.94 -0.46 5.22 0.08 0.13 -2.01 117.98 125.84 2kh2 s PHE 101 Ca 0.11 -0.07 -0.10 0.00 0.12 0.00 0.00 56.93 56.98 2kh2 s PHE 101 Cb -0.16 -1.47 0.10 0.00 -0.57 0.00 0.00 43.02 40.92 2kh2 s PHE 101 CO 0.11 0.50 0.33 -0.80 -0.10 0.00 0.00 175.22 175.26 2kh2 s ASN 102 N -2.65 5.77 -0.55 1.36 0.02 0.24 -0.82 114.94 118.30 2kh2 s ASN 102 Ca 0.27 -1.67 -0.28 0.00 -1.02 0.00 0.00 52.86 50.16 2kh2 s ASN 102 Cb -0.11 -2.04 0.03 0.00 0.02 0.00 0.00 41.25 39.16 2kh2 s ASN 102 CO 0.19 -0.64 1.13 -0.75 0.02 0.00 0.00 177.10 177.05 2kh2 s LYS 103 N 1.44 3.53 0.07 -0.60 2.20 0.83 -0.79 119.74 126.42 2kh2 s LYS 103 Ca 0.04 0.24 -0.21 0.00 -0.36 0.00 0.00 55.97 55.68 2kh2 s LYS 103 Cb -0.25 -3.99 -0.07 0.00 -1.51 0.00 0.00 37.83 32.01 2kh2 s LYS 103 CO 0.02 -1.56 0.61 0.42 -0.36 0.00 0.00 175.35 174.47 2kh2 s ILE 104 N 4.64 4.72 -0.71 5.43 1.01 0.91 -0.36 121.20 136.84 2kh2 s ILE 104 Ca 0.42 1.31 0.04 0.00 0.00 0.00 0.00 60.65 62.41 2kh2 s ILE 104 Cb -0.08 -3.95 0.31 0.00 0.01 0.00 0.00 42.46 38.75 2kh2 s ILE 104 CO 0.26 0.51 1.08 -0.62 0.00 0.00 0.00 174.94 176.17 2kh2 n GLU 105 N 1.96 3.51 0.23 2.79 -0.58 0.76 -1.38 120.64 127.94 2kh2 n GLU 105 Ca -0.09 -4.77 -0.11 0.00 -0.42 0.00 0.00 57.16 51.78 2kh2 n GLU 105 Cb 0.50 -2.30 -0.06 0.00 -0.57 0.00 0.00 31.44 29.02 2kh2 n GLU 105 CO 0.00 0.00 0.00 -0.84 -0.48 0.00 0.00 177.13 175.81 2kh2 h ILE 106 N 2.94 0.00 0.00 -3.67 3.07 -1.81 -3.46 117.51 114.58 2kh2 h ILE 106 Ca 0.22 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.63 2kh2 h ILE 106 Cb 0.52 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.07 2kh2 h ILE 106 CO 0.92 0.00 0.00 -0.46 -1.05 0.00 0.00 178.15 177.56 2kh2 n ASN 107 N -4.05 0.00 0.07 2.16 0.23 -1.26 -4.99 115.26 107.41 2kh2 n ASN 107 Ca -0.08 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.09 2kh2 n ASN 107 Cb 0.28 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 38.10 2kh2 n ASN 107 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 2kh2 h ASN 108 N 0.00 0.00 -3.21 0.53 -0.26 -1.98 -3.46 115.58 107.20 2kh2 h ASN 108 Ca 0.00 -0.19 -0.64 0.00 -0.56 0.00 0.00 56.30 54.91 2kh2 h ASN 108 Cb 0.00 0.00 -0.11 0.00 -1.06 0.00 0.00 38.32 37.15 2kh2 h ASN 108 CO 0.00 0.10 -0.64 -0.54 -1.06 0.00 0.00 177.43 175.28 2kh2 s LYS 109 N -3.20 2.61 0.17 0.81 -0.14 -1.26 -4.90 119.74 113.82 2kh2 s LYS 109 Ca 0.05 -0.85 0.08 0.00 -1.36 0.00 0.00 55.97 53.89 2kh2 s LYS 109 Cb 0.13 -2.56 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 2kh2 s LYS 109 CO 0.74 0.53 -0.07 -0.51 -0.76 0.00 0.00 175.35 175.28 2kh2 s LEU 110 N -2.47 3.09 0.16 3.17 1.43 -0.19 -3.89 118.68 119.99 2kh2 s LEU 110 Ca 0.27 -0.50 0.11 0.00 -1.03 0.00 0.00 54.13 52.98 2kh2 s LEU 110 Cb -0.11 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 2kh2 s LEU 110 CO 0.19 0.11 -0.23 -1.61 0.23 0.00 0.00 176.35 175.04 2kh2 s GLU 111 N -2.80 1.55 -0.34 1.70 2.02 -0.48 -0.13 118.70 120.23 2kh2 s GLU 111 Ca 0.25 -1.39 0.03 0.00 0.02 0.00 0.00 54.97 53.89 2kh2 s GLU 111 Cb -0.09 -1.93 0.10 0.00 0.10 0.00 0.00 34.13 32.31 2kh2 s GLU 111 CO 0.16 0.43 0.06 -0.06 0.02 0.00 0.00 175.26 175.88 2kh2 s PHE 112 N -1.35 3.45 0.37 1.61 0.08 -1.26 -0.06 117.98 120.81 2kh2 s PHE 112 Ca 0.18 -2.82 0.01 0.00 0.12 0.00 0.00 56.93 54.42 2kh2 s PHE 112 Cb -0.09 -2.74 -0.02 0.00 -0.57 0.00 0.00 43.02 39.59 2kh2 s PHE 112 CO 0.09 -0.93 0.56 -2.00 -0.10 0.00 0.00 175.22 172.83 2kh2 s GLU 113 N 0.97 3.33 -0.18 0.44 2.12 0.03 -1.06 118.70 124.35 2kh2 s GLU 113 Ca 0.11 -0.48 -0.10 0.00 0.36 0.00 0.00 54.97 54.86 2kh2 s GLU 113 Cb -0.19 -2.67 -0.05 0.00 0.26 0.00 0.00 34.13 31.48 2kh2 s GLU 113 CO -0.10 0.05 0.16 0.45 -0.54 0.00 0.00 175.26 175.27 2kh2 s SER 114 N -4.10 6.28 0.10 -1.70 0.15 -0.12 0.79 113.70 115.11 2kh2 s SER 114 Ca 0.42 0.32 -0.15 0.00 0.70 0.00 0.00 55.95 57.24 2kh2 s SER 114 Cb -0.10 -2.10 -0.08 0.00 -1.71 0.00 0.00 66.02 62.03 2kh2 s SER 114 CO 0.35 0.21 1.42 0.00 1.20 0.00 0.00 173.24 176.42 2kh2 h ALA 115 N 6.36 0.43 -0.29 5.45 0.00 -1.66 -2.95 119.26 126.60 2kh2 h ALA 115 Ca -0.43 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 53.99 2kh2 h ALA 115 Cb 1.17 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2kh2 h ALA 115 CO 0.73 0.45 -0.16 0.37 0.00 0.00 0.00 179.25 180.64 2kh2 h GLN 116 N 0.46 0.50 -3.07 0.00 4.15 -1.77 -3.36 115.11 112.02 2kh2 h GLN 116 Ca 0.04 -0.16 -0.62 0.00 0.77 0.00 0.00 58.65 58.69 2kh2 h GLN 116 Cb 0.87 -0.05 -0.41 0.00 0.21 0.00 0.00 27.48 28.11 2kh2 h GLN 116 CO 0.07 0.65 -0.69 -0.06 -1.93 0.00 0.00 178.83 176.87 2kh2 s PHE 117 N -4.67 2.64 0.62 3.99 0.08 -1.17 -5.11 117.98 114.35 2kh2 s PHE 117 Ca -0.07 -2.86 -0.19 0.00 0.12 0.00 0.00 56.93 53.93 2kh2 s PHE 117 Cb 0.14 -2.27 -0.02 0.00 -0.57 0.00 0.00 43.02 40.30 2kh2 s PHE 117 CO 0.78 -0.72 1.32 -2.14 -0.10 0.00 0.00 175.22 174.36 2kh2 s PRO 118 N -0.31 2.73 0.00 0.24 0.02 -1.12 -2.42 135.00 134.13 2kh2 s PRO 118 Ca 0.21 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.35 2kh2 s PRO 118 Cb -0.17 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.38 2kh2 s PRO 118 CO -0.06 -1.48 0.00 0.09 -0.33 0.00 0.00 177.00 175.22 2kh2 n ASN 119 N -1.64 0.00 -4.43 2.53 5.03 -1.26 -4.98 115.26 110.51 2kh2 n ASN 119 Ca 0.14 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.23 2kh2 n ASN 119 Cb 0.47 -0.22 -0.13 0.00 -1.02 0.00 0.00 39.78 38.88 2kh2 n ASN 119 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 2kh2 s TRP 120 N -3.28 3.09 0.30 3.10 0.52 -1.02 -4.45 118.94 117.19 2kh2 s TRP 120 Ca 0.00 -0.51 0.10 0.00 0.02 0.00 0.00 56.10 55.71 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 -0.39 -0.04 0.71 0.02 0.00 0.00 176.95 177.24 2kh2 s TYR 121 N 1.60 2.54 -0.45 -1.98 1.51 0.47 -0.94 117.35 120.10 2kh2 s TYR 121 Ca 0.06 -0.33 -0.28 0.00 -1.01 0.00 0.00 57.07 55.51 2kh2 s TYR 121 Cb -0.15 -1.26 0.01 0.00 -0.11 0.00 0.00 41.96 40.45 2kh2 s TYR 121 CO 0.03 0.59 1.46 0.42 -1.11 0.00 0.00 175.55 176.94 2kh2 s ILE 122 N -2.44 3.82 0.23 2.71 1.01 -0.23 -0.10 121.20 126.21 2kh2 s ILE 122 Ca 0.32 0.80 0.08 0.00 0.00 0.00 0.00 60.65 61.85 2kh2 s ILE 122 Cb -0.04 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 2kh2 s ILE 122 CO 0.19 -0.83 0.09 -0.44 0.00 0.00 0.00 174.94 173.95 2kh2 s SER 123 N 4.39 5.07 0.01 3.58 0.01 0.35 -4.65 113.70 122.47 2kh2 s SER 123 Ca 0.61 -0.39 0.02 0.00 1.31 0.00 0.00 55.95 57.50 2kh2 s SER 123 Cb -0.14 -1.16 -0.01 0.00 0.21 0.00 0.00 66.02 64.92 2kh2 s SER 123 CO 0.31 0.01 -0.06 0.42 0.41 0.00 0.00 173.24 174.32 2kh2 s THR 124 N -2.09 0.44 0.58 1.44 -4.23 -0.45 -2.26 115.64 109.08 2kh2 s THR 124 Ca 0.31 -0.55 -0.11 0.00 -1.18 0.00 0.00 61.69 60.16 2kh2 s THR 124 Cb -0.08 -0.44 -0.05 0.00 1.34 0.00 0.00 72.50 73.28 2kh2 s THR 124 CO 0.22 -0.09 0.99 -0.44 -0.54 0.00 0.00 174.62 174.76 2kh2 s SER 125 N -0.69 6.31 0.28 3.99 0.01 -1.26 0.47 113.70 122.80 2kh2 s SER 125 Ca -0.03 1.38 0.04 0.00 1.31 0.00 0.00 55.95 58.66 2kh2 s SER 125 Cb -0.05 -2.45 0.40 0.00 0.21 0.00 0.00 66.02 64.13 2kh2 s SER 125 CO 0.00 -0.78 1.69 1.56 0.41 0.00 0.00 173.24 176.12 2kh2 h GLN 126 N -0.01 0.36 -7.14 12.44 1.08 -1.96 -3.45 115.11 116.42 2kh2 h GLN 126 Ca -0.45 -0.16 -0.55 0.00 -1.45 0.00 0.00 58.65 56.04 2kh2 h GLN 126 Cb 1.19 -0.01 0.17 0.00 -0.05 0.00 0.00 27.48 28.78 2kh2 h GLN 126 CO 0.62 0.68 0.46 0.00 -0.95 0.00 0.00 178.83 179.64 2kh2 n ALA 127 N -2.48 0.77 -2.05 3.87 0.00 -1.26 -4.99 120.51 114.36 2kh2 n ALA 127 Ca -0.01 -0.11 -0.36 0.00 0.00 0.00 0.00 53.44 52.95 2kh2 n ALA 127 Cb 0.47 -2.30 -0.06 0.00 0.00 0.00 0.00 19.45 17.55 2kh2 n ALA 127 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2kh2 s GLU 128 N -3.63 4.31 -0.96 0.00 2.56 -1.26 -3.94 118.70 115.77 2kh2 s GLU 128 Ca 0.80 0.94 -0.01 0.00 0.00 0.00 0.00 54.97 56.70 2kh2 s GLU 128 Cb -0.35 -2.88 0.00 0.00 2.00 0.00 0.00 34.13 32.90 2kh2 s GLU 128 CO 0.44 0.38 0.07 -1.71 -0.56 0.00 0.00 175.26 173.88 2kh2 n ASN 129 N 0.72 -3.80 -4.89 -1.70 5.15 -1.14 -5.02 115.26 104.59 2kh2 n ASN 129 Ca -0.02 -0.04 -0.35 0.00 -0.60 0.00 0.00 54.58 53.57 2kh2 n ASN 129 Cb 0.51 -2.95 -0.06 0.00 -0.53 0.00 0.00 39.78 36.75 2kh2 n ASN 129 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2kh2 s MET 130 N -4.70 3.43 1.05 1.20 -1.94 -1.20 -4.87 119.30 112.28 2kh2 s MET 130 Ca 0.04 -0.22 -0.14 0.00 -1.71 0.00 0.00 55.69 53.66 2kh2 s MET 130 Cb -0.02 -3.14 0.22 0.00 2.01 0.00 0.00 34.83 33.90 2kh2 s MET 130 CO 0.04 0.73 1.10 -2.14 -0.01 0.00 0.00 175.02 174.74 2kh2 s PRO 131 N -1.42 -0.02 -0.12 2.03 0.02 -1.26 0.12 135.00 134.35 2kh2 s PRO 131 Ca 0.20 0.35 -0.05 0.00 0.02 0.00 0.00 61.00 61.53 2kh2 s PRO 131 Cb -0.12 -1.70 -0.04 0.00 0.02 0.00 0.00 34.50 32.66 2kh2 s PRO 131 CO 0.10 -3.00 0.05 0.08 -0.33 0.00 0.00 177.00 173.90 2kh2 s VAL 132 N -2.98 4.71 0.32 3.83 1.01 -0.34 -4.46 120.40 122.49 2kh2 s VAL 132 Ca 0.67 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.59 2kh2 s VAL 132 Cb -0.17 -3.04 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 2kh2 s VAL 132 CO 0.57 0.57 0.37 2.22 0.00 0.00 0.00 175.10 178.82 2kh2 n PHE 133 N 2.54 -1.08 -3.56 5.22 1.16 -0.96 -4.82 117.46 115.97 2kh2 n PHE 133 Ca -0.18 -2.44 -0.37 0.00 -1.87 0.00 0.00 57.45 52.59 2kh2 n PHE 133 Cb 0.54 0.40 -0.08 0.00 -1.61 0.00 0.00 39.48 38.72 2kh2 n PHE 133 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 2kh2 s LEU 134 N 0.00 4.16 0.02 5.98 2.96 -1.26 -0.49 118.68 130.05 2kh2 s LEU 134 Ca 0.33 0.33 0.08 0.00 -0.22 0.00 0.00 54.13 54.64 2kh2 s LEU 134 Cb 0.00 -2.28 -0.03 0.00 0.50 0.00 0.00 46.19 44.38 2kh2 s LEU 134 CO 0.23 0.04 -0.23 -0.83 -1.32 0.00 0.00 176.35 174.24 2kh2 s GLY 135 N 0.86 1.42 -0.00 7.98 0.00 0.86 -4.87 107.32 113.58 2kh2 s GLY 135 Ca 0.13 -1.19 0.20 0.00 0.00 0.00 0.00 44.72 43.86 2kh2 s GLY 135 CO 0.05 -1.05 1.48 0.61 0.00 0.00 0.00 173.10 174.19 2kh2 n GLY 136 N 1.92 2.56 3.18 0.20 0.00 -1.26 -0.39 105.19 111.40 2kh2 n GLY 136 Ca -0.17 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 2kh2 n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kh2 s THR 137 N -1.01 3.40 -0.27 2.61 2.01 -1.26 -4.85 115.64 116.27 2kh2 s THR 137 Ca 0.44 -1.64 -0.21 0.00 0.31 0.00 0.00 61.69 60.58 2kh2 s THR 137 Cb 0.23 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 69.60 2kh2 s THR 137 CO 0.30 -0.42 0.68 -0.75 -0.69 0.00 0.00 174.62 173.74 2kh2 s LYS 138 N 1.25 4.04 0.00 4.92 2.20 -1.26 -3.85 119.74 127.04 2kh2 s LYS 138 Ca 0.02 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 56.18 2kh2 s LYS 138 Cb -0.21 -3.68 0.00 0.00 -1.51 0.00 0.00 37.83 32.42 2kh2 s LYS 138 CO -0.01 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 174.88 2kh2 n GLY 139 N 4.18 0.55 0.00 5.54 0.00 -1.26 -5.06 105.19 109.14 2kh2 n GLY 139 Ca 0.01 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.12 1.47 0.06 -0.02 0.00 -1.25 -5.00 105.19 98.34 2kh2 n GLY 140 Ca 0.00 -1.60 -0.13 0.00 0.00 0.00 0.00 46.02 44.29 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 0.02 -6.91 1.61 7.50 -1.97 -3.45 115.11 111.91 2kh2 h GLN 141 Ca 0.00 -0.02 -0.52 0.00 0.50 0.00 0.00 58.65 58.62 2kh2 h GLN 141 Cb 0.00 0.00 0.06 0.00 0.05 0.00 0.00 27.48 27.60 2kh2 h GLN 141 CO 0.00 0.70 0.58 -0.51 -1.50 0.00 0.00 178.83 178.11 2kh2 s ASP 142 N -5.93 6.59 0.03 1.46 1.01 -1.26 -4.61 116.67 113.96 2kh2 s ASP 142 Ca -0.17 2.56 -0.30 0.00 0.71 0.00 0.00 52.55 55.34 2kh2 s ASP 142 Cb -0.00 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.24 2kh2 s ASP 142 CO 0.69 -0.64 1.23 -0.63 0.21 0.00 0.00 175.17 176.03 2kh2 s ILE 143 N -1.25 4.00 -0.90 0.77 1.01 0.18 -4.66 121.20 120.35 2kh2 s ILE 143 Ca 0.53 1.41 0.09 0.00 0.00 0.00 0.00 60.65 62.68 2kh2 s ILE 143 Cb -0.36 -3.91 0.03 0.00 0.01 0.00 0.00 42.46 38.23 2kh2 s ILE 143 CO 0.47 0.07 0.65 0.35 0.00 0.00 0.00 174.94 176.48 2kh2 n THR 144 N 4.17 0.00 -4.39 2.92 -2.24 -1.26 -1.34 114.28 112.14 2kh2 n THR 144 Ca 0.10 -0.45 -0.31 0.00 -2.27 0.00 0.00 64.05 61.12 2kh2 n THR 144 Cb 0.46 1.13 -0.10 0.00 -2.10 0.00 0.00 70.33 69.72 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 4.47 0.31 3.42 -4.77 -1.26 -4.33 116.67 113.49 2kh2 s ASP 145 Ca 0.08 -0.26 0.03 0.00 -3.30 0.00 0.00 52.55 49.10 2kh2 s ASP 145 Cb 0.07 -0.95 -0.04 0.00 -1.09 0.00 0.00 42.92 40.92 2kh2 s ASP 145 CO 0.17 0.24 0.16 -0.36 0.70 0.00 0.00 175.17 176.08 2kh2 s PHE 146 N -1.08 1.63 0.54 2.11 0.08 0.81 -3.88 117.98 118.19 2kh2 s PHE 146 Ca 0.19 -1.38 0.06 0.00 0.12 0.00 0.00 56.93 55.92 2kh2 s PHE 146 Cb -0.11 -0.88 0.04 0.00 -0.57 0.00 0.00 43.02 41.50 2kh2 s PHE 146 CO 0.10 -0.52 0.42 0.95 -0.10 0.00 0.00 175.22 176.07 2kh2 s THR 147 N -3.56 1.68 -0.12 0.64 -4.23 0.93 -1.02 115.64 109.96 2kh2 s THR 147 Ca 0.35 -1.47 -0.04 0.00 -1.18 0.00 0.00 61.69 59.35 2kh2 s THR 147 Cb 0.05 -2.15 0.05 0.00 1.34 0.00 0.00 72.50 71.79 2kh2 s THR 147 CO 0.18 0.00 0.10 -0.32 -0.54 0.00 0.00 174.62 174.04 2kh2 s MET 148 N -4.30 0.03 -0.25 3.99 1.75 -1.26 -4.13 119.30 115.13 2kh2 s MET 148 Ca 0.35 0.17 0.02 0.00 -1.25 0.00 0.00 55.69 54.99 2kh2 s MET 148 Cb -0.02 -1.16 0.06 0.00 2.84 0.00 0.00 34.83 36.54 2kh2 s MET 148 CO 0.22 -0.52 -0.10 -0.65 -0.65 0.00 0.00 175.02 173.33 2kh2 s GLN 149 N 2.19 2.08 0.22 4.11 1.11 -1.09 -4.97 119.66 123.30 2kh2 s GLN 149 Ca 0.04 -1.22 -0.30 0.00 0.01 0.00 0.00 55.36 53.88 2kh2 s GLN 149 Cb -0.14 -2.78 -0.08 0.00 -1.01 0.00 0.00 33.01 28.99 2kh2 s GLN 149 CO -0.07 -0.57 0.97 -0.06 0.01 0.00 0.00 175.29 175.58 2kh2 s PHE 150 N 1.20 3.89 0.47 0.91 0.08 -1.26 -0.99 117.98 122.26 2kh2 s PHE 150 Ca -0.08 1.85 0.05 0.00 0.12 0.00 0.00 56.93 58.88 2kh2 s PHE 150 Cb -0.19 -3.05 -0.03 0.00 -0.57 0.00 0.00 43.02 39.18 2kh2 s PHE 150 CO -0.06 0.23 0.15 0.14 -0.10 0.00 0.00 175.22 175.59 2kh2 s VAL 151 N -0.89 1.81 -0.30 -0.44 -7.23 -0.79 -4.98 120.40 107.58 2kh2 s VAL 151 Ca 0.43 -1.79 -0.03 0.00 -1.81 0.00 0.00 61.98 58.79 2kh2 s VAL 151 Cb -0.26 -2.60 0.08 0.00 0.56 0.00 0.00 36.38 34.16 2kh2 s VAL 151 CO 0.33 0.00 2.50 -1.54 -0.31 0.00 0.00 175.10 176.07 2kh2 n SER 152 N -1.31 6.21 0.00 4.85 3.41 -1.26 -4.76 113.62 120.76 2kh2 n SER 152 Ca -0.07 -2.98 0.00 0.00 -0.26 0.00 0.00 58.87 55.56 2kh2 n SER 152 Cb 0.66 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68