#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 -0.05 -5.29 0.00 0.13 -2.04 -3.45 132.00 121.30 2kh2 h PRO 2 Ca 0.00 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.49 2kh2 h PRO 2 Cb 0.00 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 30.92 2kh2 h PRO 2 CO 0.00 0.40 -0.68 0.54 -0.23 0.00 0.00 178.00 178.03 2kh2 s VAL 3 N -2.14 3.76 0.32 1.56 0.11 -1.26 -4.93 120.40 117.82 2kh2 s VAL 3 Ca -0.09 -0.40 -0.28 0.00 -2.93 0.00 0.00 61.98 58.27 2kh2 s VAL 3 Cb -0.01 -2.64 -0.09 0.00 -1.53 0.00 0.00 36.38 32.11 2kh2 s VAL 3 CO 0.34 0.49 1.12 -0.13 -3.33 0.00 0.00 175.10 173.59 2kh2 s ARG 4 N 0.41 4.47 0.08 1.54 0.52 -1.26 -4.92 118.95 119.79 2kh2 s ARG 4 Ca -0.05 1.80 -0.08 0.00 -0.52 0.00 0.00 55.73 56.88 2kh2 s ARG 4 Cb -0.14 -3.02 -0.01 0.00 0.52 0.00 0.00 34.95 32.30 2kh2 s ARG 4 CO 0.03 0.06 0.16 -1.12 0.02 0.00 0.00 175.30 174.46 2kh2 s SER 5 N -0.99 0.16 -0.02 0.23 0.01 -1.26 -0.72 113.70 111.11 2kh2 s SER 5 Ca 0.48 -0.68 -0.25 0.00 1.31 0.00 0.00 55.95 56.82 2kh2 s SER 5 Cb -0.31 0.32 0.05 0.00 0.21 0.00 0.00 66.02 66.29 2kh2 s SER 5 CO 0.40 -0.70 0.54 -1.48 0.41 0.00 0.00 173.24 172.40 2kh2 s LEU 6 N -2.82 -0.11 -0.08 2.44 2.34 -1.00 -4.98 118.68 114.47 2kh2 s LEU 6 Ca 0.05 0.44 0.02 0.00 0.06 0.00 0.00 54.13 54.70 2kh2 s LEU 6 Cb 0.05 2.09 -0.02 0.00 -0.56 0.00 0.00 46.19 47.75 2kh2 s LEU 6 CO -0.11 -0.58 -0.14 0.20 -1.06 0.00 0.00 176.35 174.67 2kh2 s ASN 7 N -1.35 4.01 0.19 1.48 0.01 -1.26 -0.12 114.94 117.90 2kh2 s ASN 7 Ca -0.11 -0.24 -0.17 0.00 -0.71 0.00 0.00 52.86 51.62 2kh2 s ASN 7 Cb -0.02 -1.11 0.03 0.00 0.41 0.00 0.00 41.25 40.56 2kh2 s ASN 7 CO 0.06 0.28 0.52 0.00 -1.51 0.00 0.00 177.10 176.45 2kh2 s THR 9 N -3.88 3.25 -0.07 0.00 -4.23 0.12 -0.42 115.64 110.41 2kh2 s THR 9 Ca 0.09 -1.27 0.05 0.00 -1.18 0.00 0.00 61.69 59.38 2kh2 s THR 9 Cb -0.01 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 2kh2 s THR 9 CO -0.03 0.14 -0.23 -0.76 -0.54 0.00 0.00 174.62 173.20 2kh2 s LEU 10 N -2.09 2.16 0.01 4.79 1.43 -1.26 -0.96 118.68 122.77 2kh2 s LEU 10 Ca 0.20 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2kh2 s LEU 10 Cb -0.11 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.69 2kh2 s LEU 10 CO 0.12 0.23 -0.05 -0.13 0.23 0.00 0.00 176.35 176.75 2kh2 s ARG 11 N -0.04 0.38 0.87 1.70 0.52 -1.11 -3.22 118.95 118.06 2kh2 s ARG 11 Ca -0.07 -0.39 -0.12 0.00 -0.52 0.00 0.00 55.73 54.63 2kh2 s ARG 11 Cb -0.15 -0.25 0.16 0.00 0.52 0.00 0.00 34.95 35.23 2kh2 s ARG 11 CO 0.05 0.06 1.21 0.16 0.02 0.00 0.00 175.30 176.80 2kh2 s ASP 12 N -0.74 3.66 0.00 0.23 1.47 0.14 0.10 116.67 121.54 2kh2 s ASP 12 Ca -0.04 0.21 0.20 0.00 1.18 0.00 0.00 52.55 54.09 2kh2 s ASP 12 Cb -0.05 -0.42 1.14 0.00 -0.34 0.00 0.00 42.92 43.25 2kh2 s ASP 12 CO -0.00 -2.37 1.58 -1.54 0.68 0.00 0.00 175.17 173.52 2kh2 n SER 13 N -3.46 0.00 -1.02 2.11 3.41 -1.26 -2.13 113.62 111.27 2kh2 n SER 13 Ca 0.14 -0.49 0.08 0.00 -0.26 0.00 0.00 58.87 58.34 2kh2 n SER 13 Cb 0.60 -0.06 0.25 0.00 -0.26 0.00 0.00 64.21 64.73 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 -1.06 2.95 -1.46 4.33 1.13 -1.26 -4.94 117.38 117.06 2kh2 n GLN 14 Ca 0.14 -2.42 -0.09 0.00 -1.94 0.00 0.00 57.00 52.68 2kh2 n GLN 14 Cb 0.09 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 28.91 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 0.91 -0.66 -3.59 -1.09 1.13 -0.90 -4.92 117.38 108.25 2kh2 n GLN 15 Ca 0.18 0.74 -0.37 0.00 -1.94 0.00 0.00 57.00 55.61 2kh2 n GLN 15 Cb 0.59 -4.66 -0.06 0.00 0.11 0.00 0.00 30.24 26.22 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 -3.14 3.80 0.23 -1.09 1.02 -1.26 -3.49 119.74 115.80 2kh2 s LYS 16 Ca 0.00 0.27 0.09 0.00 0.02 0.00 0.00 55.97 56.35 2kh2 s LYS 16 Cb 0.00 -3.19 -0.04 0.00 -0.52 0.00 0.00 37.83 34.08 2kh2 s LYS 16 CO 0.00 0.70 -0.05 -1.12 -0.92 0.00 0.00 175.35 173.96 2kh2 s SER 17 N -1.14 4.40 -0.16 2.83 0.01 0.14 -0.68 113.70 119.09 2kh2 s SER 17 Ca 0.23 -0.62 -0.21 0.00 1.31 0.00 0.00 55.95 56.65 2kh2 s SER 17 Cb -0.15 -0.78 -0.03 0.00 0.21 0.00 0.00 66.02 65.27 2kh2 s SER 17 CO 0.12 0.05 0.65 -0.76 0.41 0.00 0.00 173.24 173.71 2kh2 s LEU 18 N -3.28 4.19 0.15 2.44 1.43 -1.20 -1.49 118.68 120.93 2kh2 s LEU 18 Ca 0.28 0.93 0.08 0.00 -1.03 0.00 0.00 54.13 54.39 2kh2 s LEU 18 Cb -0.07 -2.94 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 2kh2 s LEU 18 CO 0.18 -0.23 -0.17 0.68 0.23 0.00 0.00 176.35 177.04 2kh2 s VAL 19 N 1.61 1.68 -0.46 -1.59 -7.23 0.57 -1.97 120.40 113.01 2kh2 s VAL 19 Ca 0.31 -1.87 -0.29 0.00 -1.81 0.00 0.00 61.98 58.32 2kh2 s VAL 19 Cb -0.16 -1.76 0.03 0.00 0.56 0.00 0.00 36.38 35.04 2kh2 s VAL 19 CO 0.12 -0.35 1.18 -0.04 -0.31 0.00 0.00 175.10 175.70 2kh2 s MET 20 N -2.78 3.71 0.00 4.82 -1.94 -1.26 -0.52 119.30 121.33 2kh2 s MET 20 Ca 0.14 0.63 0.00 0.00 -1.71 0.00 0.00 55.69 54.75 2kh2 s MET 20 Cb -0.05 -3.92 0.00 0.00 2.01 0.00 0.00 34.83 32.86 2kh2 s MET 20 CO 0.05 -1.40 0.10 0.45 -0.01 0.00 0.00 175.02 174.22 2kh2 n SER 21 N 7.98 0.00 -0.38 3.03 2.88 0.57 -4.92 113.62 122.78 2kh2 n SER 21 Ca 0.13 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.77 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 1.73 1.62 0.17 0.46 0.00 -1.22 -4.94 105.19 103.01 2kh2 n GLY 22 Ca 0.00 -1.96 0.02 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.64 1.61 0.13 -2.04 -3.31 132.00 127.75 2kh2 h PRO 23 Ca 0.00 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.81 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 0.46 -1.08 0.66 -0.23 0.00 0.00 178.00 177.80 2kh2 n TYR 24 N -3.80 1.51 -3.90 1.56 4.01 -1.26 -5.08 117.16 110.20 2kh2 n TYR 24 Ca -0.01 -2.33 -0.11 0.00 -0.16 0.00 0.00 57.90 55.29 2kh2 n TYR 24 Cb 0.51 -0.27 -0.11 0.00 -0.31 0.00 0.00 39.34 39.15 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 -3.62 0.30 -0.01 -0.72 2.12 -1.25 -4.28 118.70 111.23 2kh2 s GLU 25 Ca 0.31 -0.30 0.06 0.00 0.36 0.00 0.00 54.97 55.39 2kh2 s GLU 25 Cb 0.36 0.12 -0.01 0.00 0.26 0.00 0.00 34.13 34.86 2kh2 s GLU 25 CO -0.02 -0.06 -0.19 -0.51 -0.54 0.00 0.00 175.26 173.94 2kh2 s LEU 26 N -0.95 2.03 0.16 2.70 1.43 -1.26 -0.31 118.68 122.48 2kh2 s LEU 26 Ca -0.10 -0.34 0.09 0.00 -1.03 0.00 0.00 54.13 52.75 2kh2 s LEU 26 Cb -0.06 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 45.16 2kh2 s LEU 26 CO 0.00 0.23 -0.20 -0.54 0.23 0.00 0.00 176.35 176.07 2kh2 s LYS 27 N -0.43 1.30 -0.20 1.70 1.02 0.32 -1.47 119.74 121.99 2kh2 s LYS 27 Ca 0.07 -1.38 -0.02 0.00 0.02 0.00 0.00 55.97 54.66 2kh2 s LYS 27 Cb -0.07 -1.48 -0.00 0.00 -0.52 0.00 0.00 37.83 35.75 2kh2 s LYS 27 CO -0.01 0.32 -0.10 0.00 -0.92 0.00 0.00 175.35 174.64 2kh2 s ALA 28 N -1.74 2.65 0.06 5.17 0.00 0.89 -0.31 121.76 128.48 2kh2 s ALA 28 Ca 0.15 -1.16 -0.16 0.00 0.00 0.00 0.00 51.96 50.79 2kh2 s ALA 28 Cb -0.07 -1.51 0.03 0.00 0.00 0.00 0.00 23.12 21.57 2kh2 s ALA 28 CO 0.07 -0.34 0.36 -0.48 0.00 0.00 0.00 175.76 175.37 2kh2 s LEU 29 N 1.32 0.62 0.18 0.00 0.05 -0.55 -2.86 118.68 117.43 2kh2 s LEU 29 Ca 0.04 -0.14 -0.33 0.00 0.05 0.00 0.00 54.13 53.75 2kh2 s LEU 29 Cb -0.14 1.58 -0.13 0.00 -2.05 0.00 0.00 46.19 45.45 2kh2 s LEU 29 CO -0.05 -0.67 1.63 1.41 -0.55 0.00 0.00 176.35 178.12 2kh2 n HIS 30 N 0.42 2.45 -3.66 3.48 8.25 -1.26 0.26 115.22 125.16 2kh2 n HIS 30 Ca -0.18 0.18 -0.29 0.00 -0.26 0.00 0.00 57.72 57.17 2kh2 n HIS 30 Cb 0.60 -2.59 -0.15 0.00 1.12 0.00 0.00 29.99 28.97 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 1.02 1.46 0.00 2.41 2.96 -1.23 -4.83 118.68 120.47 2kh2 s LEU 31 Ca 0.77 -1.42 0.00 0.00 -0.22 0.00 0.00 54.13 53.26 2kh2 s LEU 31 Cb -0.62 -0.63 0.00 0.00 0.50 0.00 0.00 46.19 45.44 2kh2 s LEU 31 CO 0.36 -0.42 0.00 0.00 -1.32 0.00 0.00 176.35 174.97 2kh2 n GLN 32 N 5.03 2.37 0.00 1.98 6.02 -1.26 -4.68 117.38 126.83 2kh2 n GLN 32 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2kh2 n GLN 32 Cb 0.43 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.69 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 2.96 1.77 1.30 1.08 0.00 -1.26 -2.76 105.19 108.29 2kh2 n GLY 33 Ca 0.00 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.63 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 5.47 2.81 -0.19 1.61 -0.06 -1.26 -4.07 117.38 121.68 2kh2 n GLN 34 Ca 0.00 -2.62 0.10 0.00 -2.00 0.00 0.00 57.00 52.48 2kh2 n GLN 34 Cb 0.00 -1.56 0.20 0.00 -4.06 0.00 0.00 30.24 24.82 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 1.50 3.29 0.30 1.69 9.92 -1.13 -4.39 116.55 127.74 2kh2 n ASP 35 Ca 0.23 -1.94 0.18 0.00 -0.53 0.00 0.00 54.79 52.73 2kh2 n ASP 35 Cb 0.62 -0.25 0.94 0.00 -0.64 0.00 0.00 41.12 41.79 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 3.83 0.00 0.00 -1.24 4.05 -1.66 -2.39 114.93 117.53 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 0.89 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.69 2kh2 h MET 36 CO 0.00 0.03 0.00 0.39 0.23 0.00 0.00 176.91 177.56 2kh2 n GLU 37 N -3.36 0.78 -0.24 0.39 -0.58 -1.26 -2.90 120.64 113.47 2kh2 n GLU 37 Ca -0.02 0.00 0.09 0.00 -0.42 0.00 0.00 57.16 56.81 2kh2 n GLU 37 Cb 0.16 -1.12 0.25 0.00 -0.57 0.00 0.00 31.44 30.15 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 -0.62 2.18 -1.52 3.49 6.02 -0.90 -4.94 117.38 121.10 2kh2 n GLN 38 Ca 0.05 -1.83 -0.30 0.00 -0.01 0.00 0.00 57.00 54.91 2kh2 n GLN 38 Cb 0.02 -1.41 0.09 0.00 1.02 0.00 0.00 30.24 29.96 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 -1.38 2.01 -0.09 -1.09 -2.07 -1.14 -4.75 119.66 111.15 2kh2 s GLN 39 Ca 0.35 0.67 -0.06 0.00 -1.82 0.00 0.00 55.36 54.50 2kh2 s GLN 39 Cb 0.18 -1.91 -0.04 0.00 -1.09 0.00 0.00 33.01 30.16 2kh2 s GLN 39 CO 0.25 -1.68 0.15 0.08 -1.32 0.00 0.00 175.29 172.77 2kh2 s VAL 40 N -3.13 5.49 -0.19 3.63 1.01 -0.83 -5.00 120.40 121.38 2kh2 s VAL 40 Ca 0.61 0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.64 2kh2 s VAL 40 Cb -0.15 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 2kh2 s VAL 40 CO 0.54 0.55 0.04 -0.69 0.00 0.00 0.00 175.10 175.54 2kh2 s VAL 41 N -1.10 4.48 -0.12 2.92 1.01 -1.26 -4.47 120.40 121.85 2kh2 s VAL 41 Ca 0.18 -0.14 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 2kh2 s VAL 41 Cb -0.12 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 2kh2 s VAL 41 CO 0.08 0.44 0.05 -0.36 0.00 0.00 0.00 175.10 175.30 2kh2 s PHE 42 N 0.69 3.29 -0.21 5.22 0.08 0.44 -1.95 117.98 125.55 2kh2 s PHE 42 Ca 0.02 0.25 -0.14 0.00 0.12 0.00 0.00 56.93 57.17 2kh2 s PHE 42 Cb -0.14 -1.89 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 2kh2 s PHE 42 CO 0.02 0.47 0.33 0.45 -0.10 0.00 0.00 175.22 176.39 2kh2 s SER 43 N -0.65 6.35 -0.39 1.36 0.15 0.70 -1.53 113.70 119.69 2kh2 s SER 43 Ca 0.11 0.40 -0.16 0.00 0.70 0.00 0.00 55.95 57.01 2kh2 s SER 43 Cb -0.12 -2.20 0.01 0.00 -1.71 0.00 0.00 66.02 62.01 2kh2 s SER 43 CO 0.02 -0.04 0.37 -0.04 1.20 0.00 0.00 173.24 174.75 2kh2 s MET 44 N 1.24 3.19 -0.11 5.44 -1.94 0.84 -2.41 119.30 125.55 2kh2 s MET 44 Ca 0.16 -0.75 -0.19 0.00 -1.71 0.00 0.00 55.69 53.20 2kh2 s MET 44 Cb -0.14 -3.92 -0.04 0.00 2.01 0.00 0.00 34.83 32.73 2kh2 s MET 44 CO 0.07 -0.72 0.51 -1.12 -0.01 0.00 0.00 175.02 173.75 2kh2 s SER 45 N 1.75 6.73 -0.72 3.03 0.01 -0.96 -2.37 113.70 121.16 2kh2 s SER 45 Ca 0.09 0.87 -0.27 0.00 1.31 0.00 0.00 55.95 57.96 2kh2 s SER 45 Cb -0.18 -2.30 0.03 0.00 0.21 0.00 0.00 66.02 63.78 2kh2 s SER 45 CO 0.12 -0.01 1.30 -0.36 0.41 0.00 0.00 173.24 174.70 2kh2 s PHE 46 N 0.61 2.27 0.38 2.43 0.08 0.10 -0.53 117.98 123.32 2kh2 s PHE 46 Ca 0.28 0.02 0.05 0.00 0.12 0.00 0.00 56.93 57.39 2kh2 s PHE 46 Cb -0.16 -4.60 -0.00 0.00 -0.57 0.00 0.00 43.02 37.69 2kh2 s PHE 46 CO 0.11 -2.06 0.54 0.14 -0.10 0.00 0.00 175.22 173.86 2kh2 s VAL 47 N 5.84 3.94 -0.20 -0.44 -7.23 -1.17 -4.51 120.40 116.62 2kh2 s VAL 47 Ca 0.37 -0.85 -0.08 0.00 -1.81 0.00 0.00 61.98 59.61 2kh2 s VAL 47 Cb -0.08 -3.39 -0.04 0.00 0.56 0.00 0.00 36.38 33.43 2kh2 s VAL 47 CO 0.16 -0.19 0.09 -1.58 -0.31 0.00 0.00 175.10 173.27 2kh2 s GLN 48 N -4.31 3.97 0.00 4.82 2.00 -1.14 -4.75 119.66 120.25 2kh2 s GLN 48 Ca 0.47 -0.34 0.00 0.00 -2.00 0.00 0.00 55.36 53.49 2kh2 s GLN 48 Cb -0.10 -3.31 0.00 0.00 0.80 0.00 0.00 33.01 30.40 2kh2 s GLN 48 CO 0.33 0.17 0.00 0.41 -0.50 0.00 0.00 175.29 175.70 2kh2 n GLY 49 N 3.88 -1.94 2.46 2.59 0.00 -1.26 -4.92 105.19 106.00 2kh2 n GLY 49 Ca -0.16 0.54 -0.29 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.99 0.60 -1.14 1.61 2.56 -1.26 -5.07 118.70 115.00 2kh2 s GLU 50 Ca 0.00 -1.42 -0.21 0.00 0.00 0.00 0.00 54.97 53.34 2kh2 s GLU 50 Cb 0.00 -1.32 0.05 0.00 2.00 0.00 0.00 34.13 34.85 2kh2 s GLU 50 CO 0.00 -1.23 1.63 -2.00 -0.56 0.00 0.00 175.26 173.10 2kh2 s GLU 51 N 0.95 3.64 0.35 4.30 2.12 -1.26 -4.16 118.70 124.64 2kh2 s GLU 51 Ca 0.20 -1.46 0.05 0.00 0.36 0.00 0.00 54.97 54.12 2kh2 s GLU 51 Cb -0.20 -5.42 0.05 0.00 0.26 0.00 0.00 34.13 28.83 2kh2 s GLU 51 CO -0.01 -2.40 0.41 0.43 -0.54 0.00 0.00 175.26 173.15 2kh2 n SER 52 N 9.27 1.55 -0.05 -1.70 7.64 -0.93 -5.06 113.62 124.34 2kh2 n SER 52 Ca 0.41 -2.01 -0.21 0.00 1.01 0.00 0.00 58.87 58.07 2kh2 n SER 52 Cb 0.48 -0.18 -0.13 0.00 -1.01 0.00 0.00 64.21 63.37 2kh2 n SER 52 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2kh2 n ASN 53 N -2.36 2.05 0.04 6.43 2.85 -1.26 -4.48 115.26 118.52 2kh2 n ASN 53 Ca 0.06 0.20 -0.20 0.00 -0.11 0.00 0.00 54.58 54.53 2kh2 n ASN 53 Cb 0.37 -0.81 -0.14 0.00 1.24 0.00 0.00 39.78 40.44 2kh2 n ASN 53 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 2kh2 h ASP 54 N -0.19 0.44 -3.64 1.20 2.03 -1.92 -3.44 116.42 110.90 2kh2 h ASP 54 Ca -0.45 -0.79 -0.68 0.00 -0.73 0.00 0.00 57.03 54.38 2kh2 h ASP 54 Cb 1.86 -0.14 -0.19 0.00 -0.83 0.00 0.00 39.33 40.03 2kh2 h ASP 54 CO -0.03 1.68 -0.36 -0.54 -1.03 0.00 0.00 179.24 178.97 2kh2 s LYS 55 N -2.58 3.38 -0.22 4.15 1.02 -1.26 -0.70 119.74 123.53 2kh2 s LYS 55 Ca -0.16 -0.64 -0.04 0.00 0.02 0.00 0.00 55.97 55.15 2kh2 s LYS 55 Cb 0.06 -3.86 -0.01 0.00 -0.52 0.00 0.00 37.83 33.51 2kh2 s LYS 55 CO 0.82 -0.58 -0.04 0.42 -0.92 0.00 0.00 175.35 175.05 2kh2 s ILE 56 N 1.88 3.41 -0.40 2.17 -1.09 0.36 -2.19 121.20 125.34 2kh2 s ILE 56 Ca 0.09 -0.48 -0.27 0.00 -2.23 0.00 0.00 60.65 57.76 2kh2 s ILE 56 Cb -0.17 -2.55 0.02 0.00 -1.58 0.00 0.00 42.46 38.18 2kh2 s ILE 56 CO 0.11 0.42 1.00 -2.16 -1.23 0.00 0.00 174.94 173.08 2kh2 s PRO 57 N 1.46 3.79 0.05 2.79 0.04 -1.26 -0.14 135.00 141.72 2kh2 s PRO 57 Ca 0.06 0.57 -0.04 0.00 0.04 0.00 0.00 61.00 61.63 2kh2 s PRO 57 Cb -0.14 -3.84 -0.02 0.00 0.04 0.00 0.00 34.50 30.53 2kh2 s PRO 57 CO -0.03 -1.10 0.05 0.14 0.04 0.00 0.00 177.00 176.10 2kh2 s VAL 58 N 3.79 0.16 0.25 -0.36 -7.23 -0.40 -3.03 120.40 113.57 2kh2 s VAL 58 Ca 0.41 -1.35 -0.00 0.00 -1.81 0.00 0.00 61.98 59.23 2kh2 s VAL 58 Cb -0.10 -1.11 -0.04 0.00 0.56 0.00 0.00 36.38 35.69 2kh2 s VAL 58 CO 0.23 -0.74 0.44 0.00 -0.31 0.00 0.00 175.10 174.71 2kh2 s ALA 59 N -3.12 3.79 -0.24 1.32 0.00 0.31 -0.23 121.76 123.58 2kh2 s ALA 59 Ca -0.01 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.08 2kh2 s ALA 59 Cb 0.02 -2.02 0.07 0.00 0.00 0.00 0.00 23.12 21.19 2kh2 s ALA 59 CO -0.07 0.29 -0.01 -0.51 0.00 0.00 0.00 175.76 175.46 2kh2 s LEU 60 N -3.64 2.43 0.15 0.00 1.43 -1.25 -2.26 118.68 115.53 2kh2 s LEU 60 Ca 0.39 -1.24 0.04 0.00 -1.03 0.00 0.00 54.13 52.29 2kh2 s LEU 60 Cb -0.10 -1.07 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 2kh2 s LEU 60 CO 0.31 -0.28 -0.09 -0.83 0.23 0.00 0.00 176.35 175.68 2kh2 s GLY 61 N 1.47 1.07 0.22 -3.19 0.00 -1.01 -0.61 107.32 105.27 2kh2 s GLY 61 Ca -0.02 -1.50 -0.30 0.00 0.00 0.00 0.00 44.72 42.91 2kh2 s GLY 61 CO -0.09 -1.59 1.11 1.08 0.00 0.00 0.00 173.10 173.62 2kh2 s LEU 62 N -3.17 4.51 0.39 0.66 1.02 0.59 -0.21 118.68 122.47 2kh2 s LEU 62 Ca 0.17 2.18 -0.27 0.00 0.02 0.00 0.00 54.13 56.23 2kh2 s LEU 62 Cb 0.03 -3.61 -0.10 0.00 0.02 0.00 0.00 46.19 42.52 2kh2 s LEU 62 CO 0.01 -0.21 1.40 1.17 0.02 0.00 0.00 176.35 178.73 2kh2 n LYS 63 N 1.93 2.34 -2.14 1.70 4.81 -0.82 -2.47 118.16 123.51 2kh2 n LYS 63 Ca 0.01 0.82 -0.09 0.00 -0.87 0.00 0.00 58.31 58.18 2kh2 n LYS 63 Cb 0.45 -2.54 -0.01 0.00 0.02 0.00 0.00 35.03 32.95 2kh2 n LYS 63 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 2kh2 n GLU 64 N 0.25 -2.09 -4.40 1.64 0.28 -1.26 -4.91 120.64 110.15 2kh2 n GLU 64 Ca 0.04 0.48 -0.23 0.00 -0.16 0.00 0.00 57.16 57.29 2kh2 n GLU 64 Cb 0.39 -4.95 -0.08 0.00 1.43 0.00 0.00 31.44 28.23 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 -4.43 1.89 -0.16 3.44 1.02 -1.03 -5.05 119.74 115.42 2kh2 s LYS 65 Ca 0.00 -2.14 0.17 0.00 0.02 0.00 0.00 55.97 54.03 2kh2 s LYS 65 Cb 0.00 -0.10 0.40 0.00 -0.52 0.00 0.00 37.83 37.61 2kh2 s LYS 65 CO 0.00 -0.60 1.27 0.27 -0.92 0.00 0.00 175.35 175.37 2kh2 n ASN 66 N -1.54 2.92 -4.60 2.83 6.94 -1.26 -4.78 115.26 115.77 2kh2 n ASN 66 Ca 0.01 -3.13 -0.39 0.00 -0.02 0.00 0.00 54.58 51.05 2kh2 n ASN 66 Cb 0.63 -0.49 -0.10 0.00 -2.36 0.00 0.00 39.78 37.46 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 -2.90 4.03 0.10 -4.53 1.43 -1.26 -1.97 118.68 113.58 2kh2 s LEU 67 Ca 0.37 0.16 0.09 0.00 -1.03 0.00 0.00 54.13 53.73 2kh2 s LEU 67 Cb 0.31 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 2kh2 s LEU 67 CO 0.05 -0.12 -0.24 -0.31 0.23 0.00 0.00 176.35 175.95 2kh2 s TYR 68 N 1.93 2.08 -0.15 0.29 1.51 -0.37 -0.30 117.35 122.33 2kh2 s TYR 68 Ca 0.12 -0.40 -0.29 0.00 -1.01 0.00 0.00 57.07 55.49 2kh2 s TYR 68 Cb -0.16 -1.15 -0.03 0.00 -0.11 0.00 0.00 41.96 40.51 2kh2 s TYR 68 CO 0.10 0.24 1.43 -0.51 -1.11 0.00 0.00 175.55 175.70 2kh2 s LEU 69 N -1.83 4.16 -0.07 -1.29 1.43 0.22 -0.33 118.68 120.97 2kh2 s LEU 69 Ca 0.10 1.79 0.03 0.00 -1.03 0.00 0.00 54.13 55.03 2kh2 s LEU 69 Cb -0.10 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 2kh2 s LEU 69 CO 0.05 -0.90 -0.17 -0.55 0.23 0.00 0.00 176.35 175.00 2kh2 s SER 70 N 2.74 3.72 -0.32 2.29 0.15 0.90 -4.43 113.70 118.75 2kh2 s SER 70 Ca 0.62 -0.33 -0.07 0.00 0.70 0.00 0.00 55.95 56.87 2kh2 s SER 70 Cb -0.25 -1.06 0.02 0.00 -1.71 0.00 0.00 66.02 63.02 2kh2 s SER 70 CO 0.22 0.26 0.11 0.00 1.20 0.00 0.00 173.24 175.02 2kh2 s VAL 72 N 1.48 0.24 -0.27 0.00 -7.23 -0.68 -4.69 120.40 109.26 2kh2 s VAL 72 Ca 0.01 -1.98 -0.17 0.00 -1.81 0.00 0.00 61.98 58.04 2kh2 s VAL 72 Cb -0.18 -2.39 -0.03 0.00 0.56 0.00 0.00 36.38 34.34 2kh2 s VAL 72 CO 0.03 -0.15 0.45 -0.76 -0.31 0.00 0.00 175.10 174.36 2kh2 s LEU 73 N -3.18 4.07 -0.13 1.32 1.43 -1.26 -0.11 118.68 120.83 2kh2 s LEU 73 Ca 0.34 0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 53.80 2kh2 s LEU 73 Cb 0.07 -2.55 0.03 0.00 0.03 0.00 0.00 46.19 43.78 2kh2 s LEU 73 CO 0.09 -0.26 -0.07 -0.54 0.23 0.00 0.00 176.35 175.81 2kh2 s LYS 74 N 2.21 1.48 -1.07 1.70 1.02 -0.22 -4.76 119.74 120.10 2kh2 s LYS 74 Ca 0.18 -0.33 -0.02 0.00 0.02 0.00 0.00 55.97 55.82 2kh2 s LYS 74 Cb -0.16 -1.71 0.00 0.00 -0.52 0.00 0.00 37.83 35.44 2kh2 s LYS 74 CO 0.10 -0.32 0.90 -3.47 -0.92 0.00 0.00 175.35 171.64 2kh2 n ASP 75 N 4.93 -3.11 -2.34 2.83 4.64 -1.26 -2.50 116.55 119.73 2kh2 n ASP 75 Ca -0.12 -0.51 -0.15 0.00 -1.38 0.00 0.00 54.79 52.63 2kh2 n ASP 75 Cb 0.49 -4.44 -0.01 0.00 -1.04 0.00 0.00 41.12 36.12 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 -2.69 -4.50 -3.77 1.67 9.92 -1.26 -4.97 116.55 110.95 2kh2 n ASP 76 Ca -0.17 0.15 -0.14 0.00 -0.53 0.00 0.00 54.79 54.10 2kh2 n ASP 76 Cb 0.62 -3.82 -0.15 0.00 -0.64 0.00 0.00 41.12 37.13 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 -4.89 0.05 0.05 -1.24 2.47 -1.04 -5.12 119.74 110.02 2kh2 s LYS 77 Ca 0.00 0.27 -0.30 0.00 -1.56 0.00 0.00 55.97 54.38 2kh2 s LYS 77 Cb 0.00 -0.17 -0.09 0.00 -1.46 0.00 0.00 37.83 36.11 2kh2 s LYS 77 CO 0.00 -0.14 1.92 -2.14 0.16 0.00 0.00 175.35 175.15 2kh2 s PRO 78 N 0.96 4.14 0.03 4.03 0.02 -1.26 -1.06 135.00 141.86 2kh2 s PRO 78 Ca -0.08 2.58 0.04 0.00 0.02 0.00 0.00 61.00 63.57 2kh2 s PRO 78 Cb -0.10 -4.04 -0.02 0.00 0.02 0.00 0.00 34.50 30.36 2kh2 s PRO 78 CO -0.04 -0.93 -0.12 0.99 -0.33 0.00 0.00 177.00 176.58 2kh2 s THR 79 N 4.09 0.91 0.05 0.99 2.01 0.85 -4.77 115.64 119.78 2kh2 s THR 79 Ca 0.86 -0.87 -0.09 0.00 0.31 0.00 0.00 61.69 61.90 2kh2 s THR 79 Cb -0.43 -0.84 -0.05 0.00 0.01 0.00 0.00 72.50 71.19 2kh2 s THR 79 CO 0.40 -0.02 0.36 -0.22 -0.69 0.00 0.00 174.62 174.44 2kh2 s LEU 80 N -1.01 4.36 0.31 4.42 2.96 -1.26 -1.69 118.68 126.77 2kh2 s LEU 80 Ca -0.00 0.71 -0.16 0.00 -0.22 0.00 0.00 54.13 54.47 2kh2 s LEU 80 Cb -0.07 -2.87 0.02 0.00 0.50 0.00 0.00 46.19 43.77 2kh2 s LEU 80 CO 0.01 0.20 0.66 0.00 -1.32 0.00 0.00 176.35 175.90 2kh2 s GLN 81 N -1.84 1.88 -0.31 1.98 -2.07 -0.12 -4.93 119.66 114.26 2kh2 s GLN 81 Ca 0.31 -1.26 -0.09 0.00 -1.82 0.00 0.00 55.36 52.50 2kh2 s GLN 81 Cb -0.14 0.57 -0.00 0.00 -1.09 0.00 0.00 33.01 32.35 2kh2 s GLN 81 CO 0.17 -0.85 0.13 -0.51 -1.32 0.00 0.00 175.29 172.92 2kh2 s LEU 82 N -3.02 4.03 -0.18 2.60 2.01 -1.26 -0.07 118.68 122.79 2kh2 s LEU 82 Ca 0.17 -0.57 -0.08 0.00 0.01 0.00 0.00 54.13 53.66 2kh2 s LEU 82 Cb -0.04 -1.97 -0.04 0.00 0.01 0.00 0.00 46.19 44.15 2kh2 s LEU 82 CO 0.10 -0.19 0.08 -0.70 1.01 0.00 0.00 176.35 176.65 2kh2 s GLU 83 N 1.58 3.99 -0.53 1.70 2.12 0.55 -4.88 118.70 123.23 2kh2 s GLU 83 Ca 0.04 -0.30 -0.21 0.00 0.36 0.00 0.00 54.97 54.86 2kh2 s GLU 83 Cb -0.17 -3.26 0.06 0.00 0.26 0.00 0.00 34.13 31.02 2kh2 s GLU 83 CO 0.05 0.31 0.73 -1.12 -0.54 0.00 0.00 175.26 174.69 2kh2 s SER 84 N 0.28 6.24 0.37 -1.70 0.01 -1.26 -1.23 113.70 116.41 2kh2 s SER 84 Ca 0.05 -0.82 0.08 0.00 1.31 0.00 0.00 55.95 56.56 2kh2 s SER 84 Cb -0.12 -2.33 -0.03 0.00 0.21 0.00 0.00 66.02 63.75 2kh2 s SER 84 CO -0.00 -1.02 0.30 0.68 0.41 0.00 0.00 173.24 173.60 2kh2 s VAL 85 N 3.04 3.10 -0.13 3.43 -7.23 -0.83 -5.04 120.40 116.74 2kh2 s VAL 85 Ca 0.19 -1.41 -0.30 0.00 -1.81 0.00 0.00 61.98 58.65 2kh2 s VAL 85 Cb -0.18 -3.08 -0.08 0.00 0.56 0.00 0.00 36.38 33.60 2kh2 s VAL 85 CO 0.13 -0.10 2.10 -0.67 -0.31 0.00 0.00 175.10 176.25 2kh2 n ASP 86 N -1.41 3.50 0.04 4.85 4.64 -1.26 -4.83 116.55 122.09 2kh2 n ASP 86 Ca 0.00 0.54 0.07 0.00 -1.38 0.00 0.00 54.79 54.03 2kh2 n ASP 86 Cb 0.61 -1.50 0.32 0.00 -1.04 0.00 0.00 41.12 39.51 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 8.06 0.05 0.03 -0.67 -0.04 -1.26 -1.66 135.00 139.51 2kh2 n PRO 87 Ca 0.27 0.35 0.11 0.00 -0.04 0.00 0.00 63.50 64.19 2kh2 n PRO 87 Cb 0.40 -1.62 -0.08 0.00 -0.04 0.00 0.00 33.50 32.16 2kh2 n PRO 87 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2kh2 n LYS 88 N -1.72 0.53 -0.06 0.54 2.85 -1.26 -4.15 118.16 114.89 2kh2 n LYS 88 Ca 0.02 -0.06 0.06 0.00 -1.05 0.00 0.00 58.31 57.29 2kh2 n LYS 88 Cb 0.15 -1.62 0.09 0.00 -0.65 0.00 0.00 35.03 32.99 2kh2 n LYS 88 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2kh2 n ASN 89 N -2.27 2.32 -4.06 -5.58 3.02 -0.89 -4.98 115.26 102.81 2kh2 n ASN 89 Ca -0.01 -1.66 -0.17 0.00 -0.03 0.00 0.00 54.58 52.72 2kh2 n ASN 89 Cb 0.52 -0.08 -0.13 0.00 -0.61 0.00 0.00 39.78 39.48 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 -1.00 0.83 0.12 3.10 1.51 -0.67 -4.54 117.35 116.71 2kh2 s TYR 90 Ca 0.17 -0.33 -0.01 0.00 -1.01 0.00 0.00 57.07 55.89 2kh2 s TYR 90 Cb 0.11 -0.50 0.03 0.00 -0.11 0.00 0.00 41.96 41.48 2kh2 s TYR 90 CO 0.16 -0.02 0.17 -0.35 -1.11 0.00 0.00 175.55 174.40 2kh2 n PRO 91 N 2.06 0.10 -3.87 -1.71 -0.04 -1.26 -4.71 135.00 125.56 2kh2 n PRO 91 Ca -0.18 -0.32 -0.09 0.00 -0.04 0.00 0.00 63.50 62.86 2kh2 n PRO 91 Cb 0.56 -0.15 -0.05 0.00 -0.04 0.00 0.00 33.50 33.81 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 -3.14 1.29 0.06 0.54 -2.85 -1.26 -5.07 119.74 109.31 2kh2 s LYS 92 Ca 0.10 -1.06 -0.22 0.00 -1.00 0.00 0.00 55.97 53.80 2kh2 s LYS 92 Cb -0.00 0.45 -0.13 0.00 -2.06 0.00 0.00 37.83 36.08 2kh2 s LYS 92 CO 0.07 -0.52 1.52 -0.22 0.10 0.00 0.00 175.35 176.30 2kh2 h LYS 93 N 2.37 0.21 -3.71 1.78 3.64 -1.92 -3.35 116.57 115.59 2kh2 h LYS 93 Ca -0.30 -0.06 -0.77 0.00 -1.27 0.00 0.00 60.65 58.25 2kh2 h LYS 93 Cb 1.24 -0.02 -0.28 0.00 -0.41 0.00 0.00 32.23 32.76 2kh2 h LYS 93 CO 0.42 0.41 0.07 0.21 -2.27 0.00 0.00 179.45 178.29 2kh2 s LYS 94 N -5.13 3.52 0.85 1.90 2.47 -1.26 -2.89 119.74 119.20 2kh2 s LYS 94 Ca -0.14 -2.66 -0.11 0.00 -1.56 0.00 0.00 55.97 51.50 2kh2 s LYS 94 Cb 0.06 -4.31 0.15 0.00 -1.46 0.00 0.00 37.83 32.27 2kh2 s LYS 94 CO 0.70 -1.26 1.19 -1.64 0.16 0.00 0.00 175.35 174.50 2kh2 s MET 95 N -0.22 1.28 0.49 4.03 -1.94 -1.26 -5.05 119.30 116.64 2kh2 s MET 95 Ca 0.21 -0.44 -0.20 0.00 -1.71 0.00 0.00 55.69 53.55 2kh2 s MET 95 Cb -0.12 -2.00 -0.08 0.00 2.01 0.00 0.00 34.83 34.64 2kh2 s MET 95 CO -0.08 -1.93 1.05 -1.21 -0.01 0.00 0.00 175.02 172.85 2kh2 s GLU 96 N -5.60 3.74 0.60 2.03 8.01 -1.26 -4.92 118.70 121.28 2kh2 s GLU 96 Ca 0.69 1.41 0.30 0.00 0.01 0.00 0.00 54.97 57.37 2kh2 s GLU 96 Cb -0.06 -2.09 1.77 0.00 -4.31 0.00 0.00 34.13 29.44 2kh2 s GLU 96 CO 0.49 -0.49 2.18 -0.22 0.01 0.00 0.00 175.26 177.23 2kh2 h LYS 97 N 1.52 0.00 0.00 1.61 1.63 -1.96 0.52 116.57 119.88 2kh2 h LYS 97 Ca -0.50 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 2kh2 h LYS 97 Cb 1.23 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 2kh2 h LYS 97 CO 0.59 0.00 0.00 2.89 -3.45 0.00 0.00 179.45 179.48 2kh2 n ARG 98 N -3.75 0.31 -0.01 1.90 1.85 -1.26 -2.92 116.66 112.78 2kh2 n ARG 98 Ca -0.01 0.01 0.03 0.00 -1.00 0.00 0.00 57.85 56.89 2kh2 n ARG 98 Cb 0.21 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.15 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 -1.34 0.02 -3.44 2.89 3.72 0.15 -1.29 117.46 118.18 2kh2 n PHE 99 Ca 0.12 -0.04 -0.39 0.00 -0.05 0.00 0.00 57.45 57.09 2kh2 n PHE 99 Cb 0.26 -0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.70 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 -0.57 5.21 0.08 -4.37 1.01 -1.08 -3.79 120.40 116.90 2kh2 s VAL 100 Ca 0.08 0.47 0.06 0.00 0.00 0.00 0.00 61.98 62.59 2kh2 s VAL 100 Cb 0.05 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 2kh2 s VAL 100 CO 0.08 0.19 -0.06 -0.36 0.00 0.00 0.00 175.10 174.94 2kh2 s PHE 101 N 1.96 2.84 -0.51 5.22 0.40 0.68 -1.88 117.98 126.68 2kh2 s PHE 101 Ca 0.13 -0.10 -0.13 0.00 -0.60 0.00 0.00 56.93 56.23 2kh2 s PHE 101 Cb -0.16 -1.49 0.12 0.00 0.51 0.00 0.00 43.02 42.00 2kh2 s PHE 101 CO 0.10 0.43 0.43 -0.80 0.70 0.00 0.00 175.22 176.08 2kh2 s ASN 102 N -2.12 5.97 -0.61 1.36 0.02 0.23 -1.27 114.94 118.52 2kh2 s ASN 102 Ca 0.22 -1.84 -0.28 0.00 -1.02 0.00 0.00 52.86 49.95 2kh2 s ASN 102 Cb -0.11 -2.12 0.03 0.00 0.02 0.00 0.00 41.25 39.06 2kh2 s ASN 102 CO 0.14 -0.78 1.27 -0.75 0.02 0.00 0.00 177.10 177.00 2kh2 s LYS 103 N 1.49 3.38 -0.01 -0.60 2.20 0.80 -1.05 119.74 125.96 2kh2 s LYS 103 Ca 0.04 0.18 -0.19 0.00 -0.36 0.00 0.00 55.97 55.64 2kh2 s LYS 103 Cb -0.28 -4.08 -0.05 0.00 -1.51 0.00 0.00 37.83 31.90 2kh2 s LYS 103 CO 0.01 -1.86 0.55 0.42 -0.36 0.00 0.00 175.35 174.12 2kh2 s ILE 104 N 5.42 4.93 -0.47 5.43 1.01 0.11 -0.48 121.20 137.15 2kh2 s ILE 104 Ca 0.43 1.15 0.06 0.00 0.00 0.00 0.00 60.65 62.30 2kh2 s ILE 104 Cb -0.08 -3.88 0.22 0.00 0.01 0.00 0.00 42.46 38.73 2kh2 s ILE 104 CO 0.23 0.45 0.52 -0.62 0.00 0.00 0.00 174.94 175.51 2kh2 n GLU 105 N 2.58 1.01 -0.08 2.79 1.02 0.12 -0.19 120.64 127.89 2kh2 n GLU 105 Ca -0.08 -3.58 -0.15 0.00 -0.02 0.00 0.00 57.16 53.33 2kh2 n GLU 105 Cb 0.51 -1.60 -0.11 0.00 -0.02 0.00 0.00 31.44 30.23 2kh2 n GLU 105 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 2kh2 h ILE 106 N 3.03 1.25 0.00 -3.67 3.07 -1.84 -3.44 117.51 115.91 2kh2 h ILE 106 Ca 0.15 -2.12 0.00 0.00 1.55 0.00 0.00 64.86 64.44 2kh2 h ILE 106 Cb 0.84 2.54 0.00 0.00 -0.27 0.00 0.00 36.82 39.92 2kh2 h ILE 106 CO 0.53 0.42 0.00 -0.46 -1.05 0.00 0.00 178.15 177.59 2kh2 n ASN 107 N -4.56 0.00 0.01 2.16 0.23 -1.26 -5.01 115.26 106.83 2kh2 n ASN 107 Ca -0.17 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 53.98 2kh2 n ASN 107 Cb 0.51 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.07 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 0.19 -4.90 0.53 5.03 -1.26 -4.92 115.26 109.93 2kh2 n ASN 108 Ca 0.00 0.07 -0.32 0.00 0.87 0.00 0.00 54.58 55.21 2kh2 n ASN 108 Cb 0.00 1.63 -0.05 0.00 -1.02 0.00 0.00 39.78 40.34 2kh2 n ASN 108 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2kh2 s LYS 109 N -3.45 3.56 -0.06 3.52 -0.14 -1.26 -4.98 119.74 116.91 2kh2 s LYS 109 Ca -0.06 -0.19 -0.03 0.00 -1.36 0.00 0.00 55.97 54.32 2kh2 s LYS 109 Cb 0.13 -2.94 -0.04 0.00 -1.68 0.00 0.00 37.83 33.30 2kh2 s LYS 109 CO 0.88 0.54 0.10 -0.51 -0.76 0.00 0.00 175.35 175.60 2kh2 s LEU 110 N -2.47 4.06 0.09 3.17 1.43 -0.31 -4.36 118.68 120.29 2kh2 s LEU 110 Ca 0.37 0.29 0.06 0.00 -1.03 0.00 0.00 54.13 53.82 2kh2 s LEU 110 Cb -0.13 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2kh2 s LEU 110 CO 0.24 0.34 -0.06 -1.61 0.23 0.00 0.00 176.35 175.50 2kh2 s GLU 111 N -1.32 2.32 -0.36 1.70 2.02 0.74 -0.10 118.70 123.70 2kh2 s GLU 111 Ca 0.18 -0.93 0.02 0.00 0.02 0.00 0.00 54.97 54.27 2kh2 s GLU 111 Cb -0.12 -2.41 0.11 0.00 0.10 0.00 0.00 34.13 31.81 2kh2 s GLU 111 CO 0.08 0.53 0.11 -0.06 0.02 0.00 0.00 175.26 175.94 2kh2 s PHE 112 N -1.24 2.84 0.29 1.61 0.08 -1.26 0.06 117.98 120.37 2kh2 s PHE 112 Ca 0.23 -2.55 -0.02 0.00 0.12 0.00 0.00 56.93 54.71 2kh2 s PHE 112 Cb -0.11 -2.41 -0.04 0.00 -0.57 0.00 0.00 43.02 39.88 2kh2 s PHE 112 CO 0.15 -0.89 0.52 -2.00 -0.10 0.00 0.00 175.22 172.90 2kh2 s GLU 113 N 0.96 3.55 -0.11 0.44 2.12 -0.22 -1.06 118.70 124.38 2kh2 s GLU 113 Ca 0.12 -0.20 -0.12 0.00 0.36 0.00 0.00 54.97 55.13 2kh2 s GLU 113 Cb -0.20 -2.69 -0.05 0.00 0.26 0.00 0.00 34.13 31.45 2kh2 s GLU 113 CO -0.12 0.22 0.27 0.45 -0.54 0.00 0.00 175.26 175.54 2kh2 s SER 114 N -3.52 6.51 0.21 -1.70 0.15 -0.18 0.77 113.70 115.93 2kh2 s SER 114 Ca 0.41 0.60 0.01 0.00 0.70 0.00 0.00 55.95 57.67 2kh2 s SER 114 Cb -0.10 -2.16 0.15 0.00 -1.71 0.00 0.00 66.02 62.20 2kh2 s SER 114 CO 0.32 0.25 1.50 0.00 1.20 0.00 0.00 173.24 176.52 2kh2 h ALA 115 N 5.70 0.73 -0.04 5.45 0.00 -1.60 -3.03 119.26 126.47 2kh2 h ALA 115 Ca -0.48 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 53.75 2kh2 h ALA 115 Cb 1.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2kh2 h ALA 115 CO 0.67 0.73 -0.55 0.37 0.00 0.00 0.00 179.25 180.47 2kh2 h GLN 116 N 0.27 0.12 -3.29 0.00 5.75 -1.76 -3.39 115.11 112.81 2kh2 h GLN 116 Ca -0.01 -0.08 -0.60 0.00 -0.15 0.00 0.00 58.65 57.81 2kh2 h GLN 116 Cb 1.17 0.01 -0.40 0.00 1.07 0.00 0.00 27.48 29.33 2kh2 h GLN 116 CO 0.11 0.64 -0.74 -0.06 -2.65 0.00 0.00 178.83 176.13 2kh2 s PHE 117 N -3.82 2.00 0.41 3.99 0.08 -1.15 -5.09 117.98 114.40 2kh2 s PHE 117 Ca -0.03 -2.23 -0.26 0.00 0.12 0.00 0.00 56.93 54.53 2kh2 s PHE 117 Cb 0.13 -1.89 -0.09 0.00 -0.57 0.00 0.00 43.02 40.60 2kh2 s PHE 117 CO 0.77 -0.83 1.37 -2.14 -0.10 0.00 0.00 175.22 174.29 2kh2 s PRO 118 N 0.82 3.91 0.00 0.24 0.02 -1.21 -2.37 135.00 136.41 2kh2 s PRO 118 Ca 0.15 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.46 2kh2 s PRO 118 Cb -0.22 -2.77 0.00 0.00 0.02 0.00 0.00 34.50 31.54 2kh2 s PRO 118 CO -0.09 -0.59 0.00 -1.71 -0.33 0.00 0.00 177.00 174.29 2kh2 n ASN 119 N 0.10 -1.32 -4.35 2.53 5.15 -1.26 -4.99 115.26 111.11 2kh2 n ASN 119 Ca 0.04 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.66 2kh2 n ASN 119 Cb 0.42 -0.62 -0.14 0.00 -0.53 0.00 0.00 39.78 38.91 2kh2 n ASN 119 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 2kh2 s TRP 120 N -2.88 2.99 0.30 1.20 0.52 -1.00 -4.36 118.94 115.71 2kh2 s TRP 120 Ca 0.00 -0.79 0.11 0.00 0.02 0.00 0.00 56.10 55.44 2kh2 s TRP 120 Cb 0.00 -2.14 -0.05 0.00 -1.15 0.00 0.00 33.47 30.13 2kh2 s TRP 120 CO 0.00 -0.49 -0.11 0.71 0.02 0.00 0.00 176.95 177.08 2kh2 s TYR 121 N 1.50 2.43 -0.32 -1.98 1.51 0.11 -1.01 117.35 119.59 2kh2 s TYR 121 Ca 0.06 -0.35 -0.29 0.00 -1.01 0.00 0.00 57.07 55.48 2kh2 s TYR 121 Cb -0.14 -1.18 -0.01 0.00 -0.11 0.00 0.00 41.96 40.52 2kh2 s TYR 121 CO -0.01 0.64 1.66 0.42 -1.11 0.00 0.00 175.55 177.14 2kh2 s ILE 122 N -2.49 3.64 0.18 2.71 1.01 -0.22 -0.57 121.20 125.45 2kh2 s ILE 122 Ca 0.31 0.67 0.08 0.00 0.00 0.00 0.00 60.65 61.71 2kh2 s ILE 122 Cb -0.03 -3.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 2kh2 s ILE 122 CO 0.17 -0.47 -0.03 -0.44 0.00 0.00 0.00 174.94 174.17 2kh2 s SER 123 N 5.08 4.61 -0.00 3.58 0.01 0.50 -4.52 113.70 122.96 2kh2 s SER 123 Ca 0.73 -0.45 -0.01 0.00 1.31 0.00 0.00 55.95 57.53 2kh2 s SER 123 Cb -0.21 -0.93 -0.00 0.00 0.21 0.00 0.00 66.02 65.09 2kh2 s SER 123 CO 0.32 0.09 0.01 0.42 0.41 0.00 0.00 173.24 174.50 2kh2 s THR 124 N -1.72 0.02 0.69 1.44 -4.23 -0.78 -2.10 115.64 108.96 2kh2 s THR 124 Ca 0.27 -0.13 -0.11 0.00 -1.18 0.00 0.00 61.69 60.53 2kh2 s THR 124 Cb -0.09 -0.07 0.00 0.00 1.34 0.00 0.00 72.50 73.68 2kh2 s THR 124 CO 0.18 -0.07 1.07 -0.44 -0.54 0.00 0.00 174.62 174.82 2kh2 s SER 125 N -0.21 5.54 0.20 3.99 0.01 -1.26 0.09 113.70 122.06 2kh2 s SER 125 Ca -0.02 1.29 0.01 0.00 1.31 0.00 0.00 55.95 58.54 2kh2 s SER 125 Cb -0.02 -2.17 0.14 0.00 0.21 0.00 0.00 66.02 64.19 2kh2 s SER 125 CO -0.00 -1.30 1.49 1.56 0.41 0.00 0.00 173.24 175.40 2kh2 h GLN 126 N -0.62 0.36 -6.83 12.44 1.08 -1.98 -3.46 115.11 116.11 2kh2 h GLN 126 Ca -0.45 -0.27 -0.57 0.00 -1.45 0.00 0.00 58.65 55.92 2kh2 h GLN 126 Cb 1.23 0.05 0.15 0.00 -0.05 0.00 0.00 27.48 28.86 2kh2 h GLN 126 CO 0.62 0.89 0.26 0.00 -0.95 0.00 0.00 178.83 179.65 2kh2 n ALA 127 N -2.50 0.57 -1.78 3.87 0.00 -1.26 -4.95 120.51 114.47 2kh2 n ALA 127 Ca -0.03 0.11 -0.37 0.00 0.00 0.00 0.00 53.44 53.14 2kh2 n ALA 127 Cb 0.66 -2.17 -0.05 0.00 0.00 0.00 0.00 19.45 17.89 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 -2.54 4.43 -0.92 0.00 2.56 -1.26 -3.73 118.70 117.24 2kh2 s GLU 128 Ca 0.70 1.50 -0.02 0.00 0.00 0.00 0.00 54.97 57.15 2kh2 s GLU 128 Cb -0.46 -2.78 0.00 0.00 2.00 0.00 0.00 34.13 32.89 2kh2 s GLU 128 CO 0.51 0.10 0.21 -1.71 -0.56 0.00 0.00 175.26 173.81 2kh2 n ASN 129 N 0.45 -3.97 -4.77 -1.70 5.15 -1.14 -5.02 115.26 104.25 2kh2 n ASN 129 Ca 0.03 -0.10 -0.36 0.00 -0.60 0.00 0.00 54.58 53.55 2kh2 n ASN 129 Cb 0.49 -2.99 -0.07 0.00 -0.53 0.00 0.00 39.78 36.67 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 -4.95 3.85 1.19 1.20 -1.94 -1.15 -4.85 119.30 112.66 2kh2 s MET 130 Ca 0.10 -0.21 -0.15 0.00 -1.71 0.00 0.00 55.69 53.72 2kh2 s MET 130 Cb -0.05 -3.29 0.29 0.00 2.01 0.00 0.00 34.83 33.79 2kh2 s MET 130 CO 0.13 0.49 1.03 -2.14 -0.01 0.00 0.00 175.02 174.52 2kh2 s PRO 131 N -0.19 -1.14 -0.22 2.03 0.02 -1.26 -0.08 135.00 134.17 2kh2 s PRO 131 Ca 0.10 0.50 -0.10 0.00 0.02 0.00 0.00 61.00 61.52 2kh2 s PRO 131 Cb -0.12 -1.56 -0.05 0.00 0.02 0.00 0.00 34.50 32.80 2kh2 s PRO 131 CO 0.01 -3.78 0.15 0.08 -0.33 0.00 0.00 177.00 173.12 2kh2 s VAL 132 N -2.59 5.38 0.35 3.83 1.01 -0.54 -4.54 120.40 123.30 2kh2 s VAL 132 Ca 0.68 0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.91 2kh2 s VAL 132 Cb -0.20 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 2kh2 s VAL 132 CO 0.61 0.39 0.21 0.72 0.00 0.00 0.00 175.10 177.04 2kh2 s PHE 133 N 0.69 1.72 -0.22 5.22 -0.12 -0.89 -4.89 117.98 119.49 2kh2 s PHE 133 Ca 0.08 -1.50 -0.11 0.00 -0.05 0.00 0.00 56.93 55.34 2kh2 s PHE 133 Cb -0.12 -0.86 -0.05 0.00 -0.63 0.00 0.00 43.02 41.36 2kh2 s PHE 133 CO 0.01 -0.65 0.19 -1.17 -0.05 0.00 0.00 175.22 173.56 2kh2 s LEU 134 N -3.44 4.16 0.13 -1.99 2.96 -1.26 -0.37 118.68 118.87 2kh2 s LEU 134 Ca 0.35 0.23 0.07 0.00 -0.22 0.00 0.00 54.13 54.56 2kh2 s LEU 134 Cb 0.03 -2.17 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 2kh2 s LEU 134 CO 0.22 0.09 -0.16 -0.83 -1.32 0.00 0.00 176.35 174.35 2kh2 s GLY 135 N 0.78 1.18 0.00 7.98 0.00 0.27 -4.87 107.32 112.66 2kh2 s GLY 135 Ca 0.10 -1.34 0.10 0.00 0.00 0.00 0.00 44.72 43.58 2kh2 s GLY 135 CO 0.03 -1.39 1.22 0.61 0.00 0.00 0.00 173.10 173.56 2kh2 n GLY 136 N 0.52 2.65 3.13 0.20 0.00 -1.26 0.06 105.19 110.49 2kh2 n GLY 136 Ca -0.15 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 2kh2 n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kh2 s THR 137 N -0.99 4.46 0.05 2.61 -4.23 -1.26 -4.85 115.64 111.42 2kh2 s THR 137 Ca 0.21 -3.74 -0.30 0.00 -1.18 0.00 0.00 61.69 56.68 2kh2 s THR 137 Cb 0.11 -3.77 -0.05 0.00 1.34 0.00 0.00 72.50 70.13 2kh2 s THR 137 CO 0.15 -1.08 1.18 -0.75 -0.54 0.00 0.00 174.62 173.57 2kh2 s LYS 138 N -1.21 4.44 0.00 3.99 2.20 -1.26 -2.92 119.74 124.98 2kh2 s LYS 138 Ca 0.27 1.72 0.00 0.00 -0.36 0.00 0.00 55.97 57.60 2kh2 s LYS 138 Cb -0.09 -3.38 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 2kh2 s LYS 138 CO -0.11 -0.25 0.00 0.41 -0.36 0.00 0.00 175.35 175.04 2kh2 n GLY 139 N 3.19 0.54 0.00 5.54 0.00 -1.26 -5.04 105.19 108.16 2kh2 n GLY 139 Ca 0.09 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.78 1.91 0.17 -0.02 0.00 -1.15 -5.01 105.19 98.32 2kh2 n GLY 140 Ca 0.00 -1.78 -0.15 0.00 0.00 0.00 0.00 46.02 44.09 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 0.52 -6.74 1.61 7.50 -1.97 -3.44 115.11 112.60 2kh2 h GLN 141 Ca 0.00 -0.38 -0.51 0.00 0.50 0.00 0.00 58.65 58.26 2kh2 h GLN 141 Cb 0.00 0.06 0.01 0.00 0.05 0.00 0.00 27.48 27.60 2kh2 h GLN 141 CO 0.00 1.00 0.47 -0.51 -1.50 0.00 0.00 178.83 178.29 2kh2 s ASP 142 N -6.57 7.30 -0.14 1.46 1.01 -1.26 -4.54 116.67 113.92 2kh2 s ASP 142 Ca -0.13 2.17 -0.29 0.00 0.71 0.00 0.00 52.55 55.01 2kh2 s ASP 142 Cb 0.06 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.35 2kh2 s ASP 142 CO 0.82 -0.15 1.36 -0.63 0.21 0.00 0.00 175.17 176.77 2kh2 s ILE 143 N -0.76 4.11 -1.37 0.77 1.01 0.11 -4.53 121.20 120.54 2kh2 s ILE 143 Ca 0.46 1.34 0.14 0.00 0.00 0.00 0.00 60.65 62.59 2kh2 s ILE 143 Cb -0.30 -3.87 0.29 0.00 0.01 0.00 0.00 42.46 38.59 2kh2 s ILE 143 CO 0.38 -0.12 1.19 0.35 0.00 0.00 0.00 174.94 176.74 2kh2 n THR 144 N 5.39 0.65 -4.63 2.92 -2.24 -1.26 -1.87 114.28 113.24 2kh2 n THR 144 Ca 0.15 -0.82 -0.30 0.00 -2.27 0.00 0.00 64.05 60.81 2kh2 n THR 144 Cb 0.44 0.78 -0.14 0.00 -2.10 0.00 0.00 70.33 69.32 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 -1.06 3.26 0.21 3.42 -4.77 -1.26 -4.32 116.67 112.15 2kh2 s ASP 145 Ca 0.25 -0.67 0.00 0.00 -3.30 0.00 0.00 52.55 48.82 2kh2 s ASP 145 Cb 0.14 -0.26 -0.04 0.00 -1.09 0.00 0.00 42.92 41.67 2kh2 s ASP 145 CO 0.19 0.22 0.10 -0.36 0.70 0.00 0.00 175.17 176.02 2kh2 s PHE 146 N -0.94 1.28 -0.07 2.11 0.08 0.86 -4.21 117.98 117.09 2kh2 s PHE 146 Ca 0.13 -1.26 0.02 0.00 0.12 0.00 0.00 56.93 55.94 2kh2 s PHE 146 Cb -0.10 -0.69 -0.02 0.00 -0.57 0.00 0.00 43.02 41.63 2kh2 s PHE 146 CO 0.04 -0.48 -0.13 0.95 -0.10 0.00 0.00 175.22 175.51 2kh2 s THR 147 N -3.95 3.16 -0.27 0.64 -4.23 0.12 -1.17 115.64 109.94 2kh2 s THR 147 Ca 0.36 -0.67 -0.11 0.00 -1.18 0.00 0.00 61.69 60.10 2kh2 s THR 147 Cb 0.07 -2.27 -0.05 0.00 1.34 0.00 0.00 72.50 71.60 2kh2 s THR 147 CO 0.11 0.57 0.17 -0.32 -0.54 0.00 0.00 174.62 174.62 2kh2 s MET 148 N -0.46 3.94 -0.30 3.99 1.75 -1.26 -2.75 119.30 124.21 2kh2 s MET 148 Ca 0.06 -0.33 0.02 0.00 -1.25 0.00 0.00 55.69 54.19 2kh2 s MET 148 Cb -0.12 -3.60 0.07 0.00 2.84 0.00 0.00 34.83 34.02 2kh2 s MET 148 CO 0.02 -0.13 -0.03 -0.65 -0.65 0.00 0.00 175.02 173.57 2kh2 s GLN 149 N 1.61 2.09 0.12 4.11 1.11 -0.13 -4.96 119.66 123.61 2kh2 s GLN 149 Ca 0.07 -1.48 -0.31 0.00 0.01 0.00 0.00 55.36 53.65 2kh2 s GLN 149 Cb -0.15 -3.07 -0.07 0.00 -1.01 0.00 0.00 33.01 28.71 2kh2 s GLN 149 CO 0.09 -0.70 1.26 0.12 0.01 0.00 0.00 175.29 176.07 2kh2 s PHE 150 N 1.09 3.37 0.50 0.91 2.19 -1.26 0.14 117.98 124.92 2kh2 s PHE 150 Ca -0.03 1.23 0.06 0.00 0.33 0.00 0.00 56.93 58.52 2kh2 s PHE 150 Cb -0.20 -3.51 0.01 0.00 -1.31 0.00 0.00 43.02 38.02 2kh2 s PHE 150 CO -0.05 -1.60 0.32 0.14 1.83 0.00 0.00 175.22 175.86 2kh2 s VAL 151 N 0.72 1.82 -1.25 3.12 -7.23 -1.17 -4.93 120.40 111.49 2kh2 s VAL 151 Ca 0.59 -1.57 -0.12 0.00 -1.81 0.00 0.00 61.98 59.07 2kh2 s VAL 151 Cb -0.33 -2.39 0.17 0.00 0.56 0.00 0.00 36.38 34.39 2kh2 s VAL 151 CO 0.32 0.00 1.66 -1.20 -0.31 0.00 0.00 175.10 175.57 2kh2 n SER 152 N -1.60 5.15 0.00 4.85 7.64 -1.26 -4.87 113.62 123.54 2kh2 n SER 152 Ca -0.03 -3.04 0.00 0.00 1.01 0.00 0.00 58.87 56.81 2kh2 n SER 152 Cb 0.64 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 2kh2 n SER 152 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83