#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g7k n VAL 7 N 0.00 0.00 -3.50 3.44 0.31 -1.26 -4.80 118.33 112.52 1g7k n VAL 7 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 1g7k n VAL 7 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 1g7k n VAL 7 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1g7k s ILE 8 N 0.00 4.68 0.68 2.52 1.01 -1.26 -4.99 121.20 123.83 1g7k s ILE 8 Ca 0.00 -1.28 -0.08 0.00 0.00 0.00 0.00 60.65 59.29 1g7k s ILE 8 Cb 0.00 -3.84 0.04 0.00 0.01 0.00 0.00 42.46 38.66 1g7k s ILE 8 CO 0.00 -0.56 1.01 -0.54 0.00 0.00 0.00 174.94 174.85 1g7k s LYS 9 N 1.52 2.55 0.53 2.79 1.02 -1.26 -4.96 119.74 121.93 1g7k s LYS 9 Ca 0.04 0.02 0.21 0.00 0.02 0.00 0.00 55.97 56.25 1g7k s LYS 9 Cb -0.24 -2.15 1.35 0.00 -0.52 0.00 0.00 37.83 36.27 1g7k s LYS 9 CO 0.04 -1.05 2.08 0.93 -0.92 0.00 0.00 175.35 176.43 1g7k h GLU 10 N -0.52 0.00 -5.73 1.68 5.08 -1.97 -3.42 114.58 109.70 1g7k h GLU 10 Ca -0.45 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.39 1g7k h GLU 10 Cb 1.28 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.39 1g7k h GLU 10 CO 0.62 0.00 -0.71 0.12 -1.00 0.00 0.00 179.01 178.04 1g7k s PHE 11 N -5.02 2.01 0.14 4.33 5.36 -1.26 -4.03 117.98 119.51 1g7k s PHE 11 Ca -0.05 -0.56 -0.12 0.00 -0.96 0.00 0.00 56.93 55.24 1g7k s PHE 11 Cb 0.18 -1.02 0.01 0.00 -0.34 0.00 0.00 43.02 41.85 1g7k s PHE 11 CO 0.69 0.44 0.33 1.03 -1.46 0.00 0.00 175.22 176.25 1g7k s ARG 13 N -3.64 1.09 0.04 10.12 0.52 -1.26 -5.03 118.95 120.79 1g7k s ARG 13 Ca 0.28 -0.94 -0.12 0.00 -0.52 0.00 0.00 55.73 54.42 1g7k s ARG 13 Cb 0.00 0.42 0.01 0.00 0.52 0.00 0.00 34.95 35.90 1g7k s ARG 13 CO 0.12 -0.41 0.26 -0.59 0.02 0.00 0.00 175.30 174.70 1g7k s PHE 14 N -3.88 -0.05 -0.04 -0.53 -0.12 0.79 -1.49 117.98 112.67 1g7k s PHE 14 Ca 0.09 -0.11 0.07 0.00 -0.05 0.00 0.00 56.93 56.92 1g7k s PHE 14 Cb 0.03 0.05 -0.02 0.00 -0.63 0.00 0.00 43.02 42.45 1g7k s PHE 14 CO -0.07 -0.48 -0.24 0.15 -0.05 0.00 0.00 175.22 174.53 1g7k s LYS 15 N -2.54 2.34 0.02 1.99 -0.14 -0.15 -0.47 119.74 120.79 1g7k s LYS 15 Ca -0.05 -0.90 0.02 0.00 -1.36 0.00 0.00 55.97 53.68 1g7k s LYS 15 Cb -0.01 -2.13 -0.02 0.00 -1.68 0.00 0.00 37.83 34.00 1g7k s LYS 15 CO -0.03 0.49 -0.06 0.54 -0.76 0.00 0.00 175.35 175.53 1g7k s VAL 16 N -0.42 0.40 0.33 3.17 0.11 -0.07 -0.67 120.40 123.25 1g7k s VAL 16 Ca 0.04 -0.75 0.05 0.00 -2.93 0.00 0.00 61.98 58.40 1g7k s VAL 16 Cb -0.12 -0.44 -0.02 0.00 -1.53 0.00 0.00 36.38 34.27 1g7k s VAL 16 CO 0.01 -0.24 0.32 -0.13 -3.33 0.00 0.00 175.10 171.73 1g7k s ARG 17 N -1.06 1.79 -0.30 1.54 0.52 -0.73 0.17 118.95 120.88 1g7k s ARG 17 Ca -0.07 -1.97 -0.11 0.00 -0.52 0.00 0.00 55.73 53.06 1g7k s ARG 17 Cb -0.07 0.35 0.17 0.00 0.52 0.00 0.00 34.95 35.91 1g7k s ARG 17 CO 0.00 -0.68 0.87 -1.21 0.02 0.00 0.00 175.30 174.30 1g7k s GLU 19 N -3.36 0.37 0.26 3.54 2.02 -0.29 -0.22 118.70 121.02 1g7k s GLU 19 Ca 0.39 0.82 0.01 0.00 0.02 0.00 0.00 54.97 56.21 1g7k s GLU 19 Cb 0.02 0.48 -0.04 0.00 0.10 0.00 0.00 34.13 34.68 1g7k s GLU 19 CO 0.26 -0.24 0.13 0.20 0.02 0.00 0.00 175.26 175.63 1g7k s GLY 20 N 2.72 1.78 -0.09 -1.39 0.00 0.29 -1.71 107.32 108.92 1g7k s GLY 20 Ca 0.02 -1.80 -0.05 0.00 0.00 0.00 0.00 44.72 42.90 1g7k s GLY 20 CO -0.17 -1.54 0.21 -1.59 0.00 0.00 0.00 173.10 170.01 1g7k s THR 21 N -3.80 -0.04 -0.11 0.90 2.01 -0.37 -1.44 115.64 112.79 1g7k s THR 21 Ca 0.38 0.15 -0.00 0.00 0.31 0.00 0.00 61.69 62.52 1g7k s THR 21 Cb 0.07 -0.32 0.02 0.00 0.01 0.00 0.00 72.50 72.28 1g7k s THR 21 CO 0.15 0.06 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.37 1g7k s VAL 22 N 1.14 1.01 -1.58 3.82 1.01 -0.67 0.24 120.40 125.37 1g7k s VAL 22 Ca -0.09 -0.28 -0.16 0.00 0.00 0.00 0.00 61.98 61.45 1g7k s VAL 22 Cb -0.10 -1.03 0.13 0.00 0.00 0.00 0.00 36.38 35.39 1g7k s VAL 22 CO -0.07 0.36 0.75 0.59 0.00 0.00 0.00 175.10 176.73 1g7k n ASN 23 N 4.91 -3.58 0.00 3.32 4.13 0.28 -0.26 115.26 124.06 1g7k n ASN 23 Ca -0.13 -0.84 0.00 0.00 1.68 0.00 0.00 54.58 55.30 1g7k n ASN 23 Cb 0.50 -2.92 0.00 0.00 -1.54 0.00 0.00 39.78 35.82 1g7k n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1g7k n GLY 24 N -1.37 1.58 3.56 7.41 0.00 -1.26 -5.01 105.19 110.10 1g7k n GLY 24 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1g7k n GLY 24 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1g7k s HIS 25 N -3.14 3.12 0.23 1.61 5.04 0.63 -5.05 115.29 117.74 1g7k s HIS 25 Ca 0.00 0.32 -0.30 0.00 -1.54 0.00 0.00 55.06 53.54 1g7k s HIS 25 Cb 0.00 -3.24 -0.09 0.00 0.04 0.00 0.00 32.58 29.29 1g7k s HIS 25 CO 0.00 -0.70 0.93 -2.00 -2.34 0.00 0.00 174.74 170.63 1g7k s GLU 26 N 2.82 4.83 0.16 2.88 2.12 -1.26 -1.67 118.70 128.58 1g7k s GLU 26 Ca 0.26 1.46 -0.20 0.00 0.36 0.00 0.00 54.97 56.85 1g7k s GLU 26 Cb -0.14 -3.28 0.05 0.00 0.26 0.00 0.00 34.13 31.02 1g7k s GLU 26 CO 0.16 0.51 0.53 -0.59 -0.54 0.00 0.00 175.26 175.33 1g7k s PHE 27 N -1.11 -0.35 0.00 5.30 -0.12 -0.52 -4.25 117.98 116.94 1g7k s PHE 27 Ca 0.41 0.07 0.01 0.00 -0.05 0.00 0.00 56.93 57.37 1g7k s PHE 27 Cb -0.26 0.45 -0.00 0.00 -0.63 0.00 0.00 43.02 42.58 1g7k s PHE 27 CO 0.31 -0.83 -0.03 -1.21 -0.05 0.00 0.00 175.22 173.41 1g7k s GLU 28 N -3.80 0.21 0.01 1.99 2.02 -0.58 -0.55 118.70 117.99 1g7k s GLU 28 Ca 0.03 -0.13 0.01 0.00 0.02 0.00 0.00 54.97 54.90 1g7k s GLU 28 Cb -0.00 -0.17 -0.01 0.00 0.10 0.00 0.00 34.13 34.05 1g7k s GLU 28 CO -0.10 0.04 -0.03 0.42 0.02 0.00 0.00 175.26 175.62 1g7k s ILE 29 N -0.17 0.18 0.06 -1.63 1.01 -1.26 0.03 121.20 119.42 1g7k s ILE 29 Ca -0.00 -0.28 0.05 0.00 0.00 0.00 0.00 60.65 60.42 1g7k s ILE 29 Cb -0.02 -0.20 -0.03 0.00 0.01 0.00 0.00 42.46 42.23 1g7k s ILE 29 CO -0.00 -0.07 -0.15 -1.61 0.00 0.00 0.00 174.94 173.11 1g7k s GLU 30 N -0.37 0.93 0.27 2.79 2.02 0.01 -4.28 118.70 120.07 1g7k s GLU 30 Ca -0.02 -0.88 -0.20 0.00 0.02 0.00 0.00 54.97 53.88 1g7k s GLU 30 Cb -0.03 -0.97 0.05 0.00 0.10 0.00 0.00 34.13 33.28 1g7k s GLU 30 CO -0.00 0.23 0.85 0.20 0.02 0.00 0.00 175.26 176.55 1g7k s GLY 31 N -1.45 0.05 0.01 -1.39 0.00 0.13 -1.05 107.32 103.62 1g7k s GLY 31 Ca 0.01 -0.35 0.00 0.00 0.00 0.00 0.00 44.72 44.38 1g7k s GLY 31 CO 0.02 0.25 -0.03 -1.83 0.00 0.00 0.00 173.10 171.52 1g7k s GLU 32 N -3.01 0.24 0.34 2.90 -1.05 -0.73 -0.90 118.70 116.49 1g7k s GLU 32 Ca 0.14 -0.42 -0.00 0.00 -0.15 0.00 0.00 54.97 54.54 1g7k s GLU 32 Cb -0.04 0.02 -0.00 0.00 -0.44 0.00 0.00 34.13 33.67 1g7k s GLU 32 CO 0.07 -0.02 0.43 0.20 0.95 0.00 0.00 175.26 176.89 1g7k s GLY 33 N -0.97 1.69 0.21 -3.83 0.00 0.38 -0.50 107.32 104.31 1g7k s GLY 33 Ca -0.10 -1.65 -0.23 0.00 0.00 0.00 0.00 44.72 42.75 1g7k s GLY 33 CO -0.01 -1.11 0.75 -1.83 0.00 0.00 0.00 173.10 170.90 1g7k s GLU 34 N -3.13 1.51 0.00 2.90 -1.05 -0.86 -0.15 118.70 117.93 1g7k s GLU 34 Ca 0.33 -0.77 0.00 0.00 -0.15 0.00 0.00 54.97 54.37 1g7k s GLU 34 Cb 0.00 0.56 0.00 0.00 -0.44 0.00 0.00 34.13 34.25 1g7k s GLU 34 CO 0.22 -0.69 0.00 0.41 0.95 0.00 0.00 175.26 176.15 1g7k n GLY 35 N -0.43 -1.57 2.99 -3.83 0.00 -1.26 -0.75 105.19 100.34 1g7k n GLY 35 Ca -0.08 -1.05 -0.31 0.00 0.00 0.00 0.00 46.02 44.58 1g7k n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g7k s ARG 36 N -1.41 1.76 0.54 1.61 1.81 -0.19 -4.47 118.95 118.59 1g7k s ARG 36 Ca 0.00 -2.24 0.30 0.00 -1.72 0.00 0.00 55.73 52.07 1g7k s ARG 36 Cb 0.00 -3.29 1.47 0.00 -0.45 0.00 0.00 34.95 32.68 1g7k s ARG 36 CO 0.00 -1.03 1.91 -1.35 -0.68 0.00 0.00 175.30 174.15 1g7k h PRO 37 N 7.09 0.00 -0.01 3.54 0.11 -1.80 0.22 132.00 141.15 1g7k h PRO 37 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1g7k h PRO 37 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1g7k h PRO 37 CO 0.61 0.00 -0.33 0.66 -0.21 0.00 0.00 178.00 178.73 1g7k n TYR 38 N -4.24 0.00 0.59 0.65 4.02 -1.26 -3.92 117.16 113.00 1g7k n TYR 38 Ca 0.16 0.00 0.06 0.00 -0.01 0.00 0.00 57.90 58.11 1g7k n TYR 38 Cb 0.87 -0.08 -0.04 0.00 -0.02 0.00 0.00 39.34 40.07 1g7k n TYR 38 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1g7k n GLU 39 N -0.41 2.44 -2.28 -0.72 1.02 0.67 -4.78 120.64 116.58 1g7k n GLU 39 Ca 0.11 -0.29 -0.05 0.00 -0.02 0.00 0.00 57.16 56.91 1g7k n GLU 39 Cb 0.39 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.68 1g7k n GLU 39 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1g7k n GLY 40 N 1.19 0.29 2.97 0.62 0.00 -0.59 -4.78 105.19 104.89 1g7k n GLY 40 Ca 0.04 -0.62 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 1g7k n GLY 40 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1g7k s HIS 41 N -2.48 0.09 0.03 1.61 -3.43 -1.21 -0.25 115.29 109.66 1g7k s HIS 41 Ca 0.04 -0.18 -0.28 0.00 -0.80 0.00 0.00 55.06 53.84 1g7k s HIS 41 Cb -0.02 -0.08 0.07 0.00 -1.43 0.00 0.00 32.58 31.13 1g7k s HIS 41 CO 0.05 -0.13 0.66 0.54 -2.00 0.00 0.00 174.74 173.86 1g7k s ASN 42 N -0.77 -0.61 0.23 7.38 4.22 -0.43 -1.03 114.94 123.93 1g7k s ASN 42 Ca -0.08 0.41 0.05 0.00 -2.14 0.00 0.00 52.86 51.10 1g7k s ASN 42 Cb -0.05 0.56 -0.05 0.00 1.28 0.00 0.00 41.25 42.98 1g7k s ASN 42 CO -0.00 -0.75 -0.05 0.42 -2.04 0.00 0.00 177.10 174.67 1g7k s THR 43 N -2.26 1.33 -0.16 0.54 -4.23 0.07 0.06 115.64 111.00 1g7k s THR 43 Ca -0.06 -2.09 -0.28 0.00 -1.18 0.00 0.00 61.69 58.08 1g7k s THR 43 Cb -0.00 -2.26 0.07 0.00 1.34 0.00 0.00 72.50 71.65 1g7k s THR 43 CO 0.00 -0.42 0.72 0.54 -0.54 0.00 0.00 174.62 174.93 1g7k s VAL 44 N -3.22 0.00 -0.10 2.29 0.11 -0.24 -2.02 120.40 117.23 1g7k s VAL 44 Ca 0.26 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.34 1g7k s VAL 44 Cb 0.04 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.88 1g7k s VAL 44 CO 0.08 0.00 -0.21 -0.75 -3.33 0.00 0.00 175.10 170.89 1g7k s LYS 45 N -0.47 3.01 0.14 1.54 2.20 0.35 -0.33 119.74 126.18 1g7k s LYS 45 Ca -0.05 -0.82 0.09 0.00 -0.36 0.00 0.00 55.97 54.83 1g7k s LYS 45 Cb -0.02 -2.37 -0.04 0.00 -1.51 0.00 0.00 37.83 33.89 1g7k s LYS 45 CO 0.05 0.25 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.61 1g7k s LEU 46 N 0.18 2.71 -0.04 5.43 2.01 0.42 -1.77 118.68 127.63 1g7k s LEU 46 Ca -0.12 -0.61 -0.01 0.00 0.01 0.00 0.00 54.13 53.39 1g7k s LEU 46 Cb -0.16 -1.51 0.03 0.00 0.01 0.00 0.00 46.19 44.57 1g7k s LEU 46 CO 0.07 0.15 0.07 -0.54 1.01 0.00 0.00 176.35 177.11 1g7k s LYS 47 N -2.37 -0.02 -0.44 1.70 3.01 -0.21 -0.81 119.74 120.61 1g7k s LYS 47 Ca 0.20 0.30 -0.29 0.00 -1.01 0.00 0.00 55.97 55.17 1g7k s LYS 47 Cb -0.10 -0.30 0.02 0.00 -1.01 0.00 0.00 37.83 36.45 1g7k s LYS 47 CO 0.11 -0.22 1.19 0.08 0.51 0.00 0.00 175.35 177.02 1g7k s VAL 48 N 1.47 4.19 -0.60 3.17 1.01 -0.23 -0.81 120.40 128.60 1g7k s VAL 48 Ca -0.05 1.24 0.23 0.00 0.00 0.00 0.00 61.98 63.40 1g7k s VAL 48 Cb -0.12 -4.48 -0.12 0.00 0.00 0.00 0.00 36.38 31.65 1g7k s VAL 48 CO -0.04 -0.87 1.02 0.35 0.00 0.00 0.00 175.10 175.56 1g7k n THR 49 N 6.72 0.17 -3.70 3.92 -2.24 0.10 -4.78 114.28 114.48 1g7k n THR 49 Ca 0.13 -0.25 -0.14 0.00 -2.27 0.00 0.00 64.05 61.53 1g7k n THR 49 Cb 0.48 0.21 -0.09 0.00 -2.10 0.00 0.00 70.33 68.83 1g7k n THR 49 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1g7k s LYS 50 N -3.20 0.60 0.00 -0.78 1.02 -1.02 -4.91 119.74 111.45 1g7k s LYS 50 Ca 0.03 0.65 0.00 0.00 0.02 0.00 0.00 55.97 56.68 1g7k s LYS 50 Cb 0.14 0.29 0.00 0.00 -0.52 0.00 0.00 37.83 37.75 1g7k s LYS 50 CO 0.80 -0.08 0.00 0.41 -0.92 0.00 0.00 175.35 175.56 1g7k n GLY 51 N 2.70 0.47 3.92 -3.33 0.00 -1.26 -1.53 105.19 106.15 1g7k n GLY 51 Ca -0.14 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.20 1g7k n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1g7k s GLY 52 N -2.37 1.71 0.52 -0.02 0.00 -1.26 -3.84 107.32 102.05 1g7k s GLY 52 Ca 0.00 -0.70 -0.18 0.00 0.00 0.00 0.00 44.72 43.84 1g7k s GLY 52 CO 0.00 -0.61 1.02 2.56 0.00 0.00 0.00 173.10 176.07 1g7k s PRO 53 N -3.73 3.74 0.41 2.90 0.04 -1.26 -5.10 135.00 131.99 1g7k s PRO 53 Ca 0.42 1.19 -0.26 0.00 0.04 0.00 0.00 61.00 62.39 1g7k s PRO 53 Cb -0.10 -2.10 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 1g7k s PRO 53 CO 0.32 -0.46 1.26 -0.51 0.04 0.00 0.00 177.00 177.65 1g7k s LEU 54 N -3.89 4.20 -0.11 -3.56 1.43 -1.25 -4.92 118.68 110.59 1g7k s LEU 54 Ca 0.64 2.56 0.06 0.00 -1.03 0.00 0.00 54.13 56.36 1g7k s LEU 54 Cb -0.14 -3.94 0.37 0.00 0.03 0.00 0.00 46.19 42.51 1g7k s LEU 54 CO 0.27 -0.81 1.06 -0.81 0.23 0.00 0.00 176.35 176.29 1g7k n PRO 55 N 0.10 2.75 -4.03 1.29 -0.04 -1.26 -4.90 135.00 128.91 1g7k n PRO 55 Ca 0.04 -1.41 -0.10 0.00 -0.04 0.00 0.00 63.50 61.99 1g7k n PRO 55 Cb 0.44 -1.85 -0.07 0.00 -0.04 0.00 0.00 33.50 31.99 1g7k n PRO 55 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1g7k s PHE 56 N -1.79 0.55 0.09 0.54 -0.12 -1.26 -4.75 117.98 111.25 1g7k s PHE 56 Ca 0.24 -0.88 -0.33 0.00 -0.05 0.00 0.00 56.93 55.91 1g7k s PHE 56 Cb 0.19 -0.08 -0.12 0.00 -0.63 0.00 0.00 43.02 42.38 1g7k s PHE 56 CO 0.07 -0.80 1.77 0.00 -0.05 0.00 0.00 175.22 176.21 1g7k n ALA 57 N -0.29 1.71 -0.21 1.99 0.00 -0.25 -4.88 120.51 118.58 1g7k n ALA 57 Ca -0.03 0.35 0.08 0.00 0.00 0.00 0.00 53.44 53.83 1g7k n ALA 57 Cb 0.63 -2.50 0.35 0.00 0.00 0.00 0.00 19.45 17.93 1g7k n ALA 57 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1g7k h TRP 58 N 7.91 0.79 -1.24 0.00 2.91 -1.96 -3.03 115.95 121.34 1g7k h TRP 58 Ca -0.46 0.02 0.36 0.00 1.13 0.00 0.00 58.89 59.94 1g7k h TRP 58 Cb 1.24 -0.26 -0.10 0.00 -0.51 0.00 0.00 29.16 29.54 1g7k h TRP 58 CO 0.76 0.39 0.82 -0.44 -1.03 0.00 0.00 178.44 178.94 1g7k h ASP 59 N 0.75 0.26 0.86 2.65 3.32 -1.95 0.31 116.42 122.62 1g7k h ASP 59 Ca 0.35 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1g7k h ASP 59 Cb 0.38 0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1g7k h ASP 59 CO -0.13 -0.04 0.00 0.16 -1.72 0.00 0.00 179.24 177.52 1g7k h ILE 60 N 0.18 0.00 0.01 0.35 3.07 -1.93 -2.97 117.51 116.21 1g7k h ILE 60 Ca 0.70 -0.40 -0.33 0.00 1.55 0.00 0.00 64.86 66.38 1g7k h ILE 60 Cb 2.20 1.32 -0.06 0.00 -0.27 0.00 0.00 36.82 40.02 1g7k h ILE 60 CO -0.27 0.00 -1.99 0.18 -1.05 0.00 0.00 178.15 175.02 1g7k n LEU 61 N -2.87 0.68 -0.33 0.16 4.77 0.08 -4.57 117.00 114.91 1g7k n LEU 61 Ca 0.01 0.24 0.08 0.00 -0.03 0.00 0.00 56.01 56.31 1g7k n LEU 61 Cb 0.27 0.21 0.18 0.00 -2.33 0.00 0.00 43.42 41.75 1g7k n LEU 61 CO 0.25 0.46 0.72 0.77 -1.33 0.00 0.00 177.39 178.26 1g7k h SER 62 N 0.00 -0.72 0.00 -1.43 4.64 -1.34 -0.02 113.55 114.68 1g7k h SER 62 Ca -0.40 0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1g7k h SER 62 Cb 2.10 0.54 0.00 0.00 -0.31 0.00 0.00 62.40 64.73 1g7k h SER 62 CO 0.06 -0.32 0.00 -2.65 -0.87 0.00 0.00 176.83 173.05 1g7k n PRO 63 N -5.55 0.73 0.00 4.77 -0.02 -1.26 -2.92 135.00 130.75 1g7k n PRO 63 Ca 0.17 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.77 1g7k n PRO 63 Cb 0.56 -1.44 0.12 0.00 -0.02 0.00 0.00 33.50 32.73 1g7k n PRO 63 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1g7k n GLN 64 N -0.94 1.13 -0.54 -0.52 1.13 -0.02 -4.81 117.38 112.80 1g7k n GLN 64 Ca 0.15 -0.86 -0.07 0.00 -1.94 0.00 0.00 57.00 54.28 1g7k n GLN 64 Cb 0.07 -1.48 0.12 0.00 0.11 0.00 0.00 30.24 29.06 1g7k n GLN 64 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1g7k n PHE 65 N -0.18 1.34 0.00 1.08 3.01 -1.15 -5.00 117.46 116.55 1g7k n PHE 65 Ca 0.10 -0.91 0.00 0.00 1.01 0.00 0.00 57.45 57.66 1g7k n PHE 65 Cb 0.43 -0.50 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 1g7k n PHE 65 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1g7k n SER 69 N -0.11 0.00 0.00 4.37 2.88 -1.26 -5.03 113.62 114.47 1g7k n SER 69 Ca 0.24 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.82 1g7k n SER 69 Cb 0.96 0.00 0.24 0.00 -0.75 0.00 0.00 64.21 64.65 1g7k n SER 69 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1g7k n LYS 70 N 0.00 0.19 0.06 -1.46 4.76 -1.26 -1.86 118.16 118.59 1g7k n LYS 70 Ca 0.00 0.12 0.11 0.00 -2.87 0.00 0.00 58.31 55.67 1g7k n LYS 70 Cb 0.00 -1.50 0.46 0.00 -1.84 0.00 0.00 35.03 32.15 1g7k n LYS 70 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 1g7k n VAL 71 N -1.16 0.60 0.76 -0.18 3.14 -1.26 -2.66 118.33 117.57 1g7k n VAL 71 Ca 0.05 0.05 0.08 0.00 -2.96 0.00 0.00 64.34 61.57 1g7k n VAL 71 Cb 0.05 -0.81 0.24 0.00 -1.06 0.00 0.00 33.84 32.26 1g7k n VAL 71 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1g7k n TYR 72 N -1.86 0.47 -2.49 1.45 4.02 -0.78 -4.73 117.16 113.25 1g7k n TYR 72 Ca 0.05 -0.24 -0.42 0.00 -0.01 0.00 0.00 57.90 57.28 1g7k n TYR 72 Cb 0.29 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.58 1g7k n TYR 72 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1g7k s VAL 73 N -1.53 4.18 -0.13 -0.72 1.01 -1.09 -3.21 120.40 118.91 1g7k s VAL 73 Ca 0.31 1.59 -0.29 0.00 0.00 0.00 0.00 61.98 63.58 1g7k s VAL 73 Cb 0.16 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1g7k s VAL 73 CO 0.22 0.14 1.18 -0.75 0.00 0.00 0.00 175.10 175.89 1g7k s LYS 74 N 0.91 4.30 -0.04 2.72 2.20 -0.98 -4.79 119.74 124.06 1g7k s LYS 74 Ca 0.56 1.59 0.06 0.00 -0.36 0.00 0.00 55.97 57.83 1g7k s LYS 74 Cb -0.28 -3.65 -0.02 0.00 -1.51 0.00 0.00 37.83 32.37 1g7k s LYS 74 CO 0.30 -0.57 -0.23 -1.01 -0.36 0.00 0.00 175.35 173.48 1g7k s HIS 75 N 2.87 2.44 0.71 4.03 3.76 -1.26 -0.53 115.29 127.31 1g7k s HIS 75 Ca 0.53 -0.45 -0.14 0.00 -0.15 0.00 0.00 55.06 54.85 1g7k s HIS 75 Cb -0.21 -1.56 0.02 0.00 1.11 0.00 0.00 32.58 31.94 1g7k s HIS 75 CO 0.16 -0.04 1.12 -1.25 -0.85 0.00 0.00 174.74 173.88 1g7k s PRO 76 N -0.51 2.51 0.54 8.40 0.04 -1.26 -4.91 135.00 139.82 1g7k s PRO 76 Ca 0.07 1.37 0.22 0.00 0.04 0.00 0.00 61.00 62.70 1g7k s PRO 76 Cb -0.11 -1.92 1.44 0.00 0.04 0.00 0.00 34.50 33.95 1g7k s PRO 76 CO 0.01 -1.47 2.13 0.00 0.04 0.00 0.00 177.00 177.70 1g7k h ALA 77 N -0.39 2.00 -0.12 8.56 0.00 -1.99 -2.03 119.26 125.28 1g7k h ALA 77 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1g7k h ALA 77 Cb 1.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1g7k h ALA 77 CO 0.52 -0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.20 1g7k n ASP 78 N -4.30 0.82 -3.99 0.00 5.75 -1.26 -4.62 116.55 108.95 1g7k n ASP 78 Ca 0.00 -1.81 -0.31 0.00 -0.01 0.00 0.00 54.79 52.67 1g7k n ASP 78 Cb 0.22 -0.08 -0.15 0.00 -1.03 0.00 0.00 41.12 40.08 1g7k n ASP 78 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1g7k s ILE 79 N -1.84 1.79 0.07 2.12 1.01 -0.77 -5.04 121.20 118.55 1g7k s ILE 79 Ca 0.19 -1.42 -0.37 0.00 0.00 0.00 0.00 60.65 59.05 1g7k s ILE 79 Cb 0.10 -2.01 -0.17 0.00 0.01 0.00 0.00 42.46 40.38 1g7k s ILE 79 CO 0.14 -0.10 1.30 -2.65 0.00 0.00 0.00 174.94 173.64 1g7k n PRO 80 N 4.57 0.98 -2.57 2.79 -0.02 -1.26 -4.64 135.00 134.83 1g7k n PRO 80 Ca -0.12 0.35 -0.42 0.00 -2.02 0.00 0.00 63.50 61.29 1g7k n PRO 80 Cb 0.43 -1.97 0.01 0.00 -0.02 0.00 0.00 33.50 31.94 1g7k n PRO 80 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1g7k n ASP 81 N 2.39 5.89 -0.37 2.55 -0.08 -1.26 -4.48 116.55 121.20 1g7k n ASP 81 Ca 0.19 -3.26 -0.00 0.00 -1.51 0.00 0.00 54.79 50.21 1g7k n ASP 81 Cb 0.17 -1.38 0.05 0.00 2.34 0.00 0.00 41.12 42.30 1g7k n ASP 81 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1g7k n TYR 82 N 2.57 0.05 -0.26 -0.67 9.36 -1.26 -0.70 117.16 126.25 1g7k n TYR 82 Ca 0.36 1.19 -0.03 0.00 3.32 0.00 0.00 57.90 62.74 1g7k n TYR 82 Cb 0.34 -0.88 0.08 0.00 -0.63 0.00 0.00 39.34 38.25 1g7k n TYR 82 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 1g7k h LYS 83 N 0.00 0.90 -0.32 2.98 1.57 -1.91 -1.98 116.57 117.82 1g7k h LYS 83 Ca 0.35 -0.05 -0.16 0.00 -1.87 0.00 0.00 60.65 58.92 1g7k h LYS 83 Cb 0.59 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1g7k h LYS 83 CO -0.96 0.60 -0.42 0.87 -0.57 0.00 0.00 179.45 178.96 1g7k h LYS 84 N 0.93 0.79 0.00 3.15 1.57 -1.36 -2.95 116.57 118.70 1g7k h LYS 84 Ca 0.29 -0.43 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 1g7k h LYS 84 Cb -0.01 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1g7k h LYS 84 CO -0.10 1.06 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.70 1g7k h LEU 85 N 0.64 0.00 -1.16 2.94 3.38 -0.52 -3.00 115.31 117.58 1g7k h LEU 85 Ca 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1g7k h LEU 85 Cb 0.99 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 1g7k h LEU 85 CO 0.09 0.07 -0.14 0.77 0.09 0.00 0.00 178.44 179.32 1g7k h SER 86 N 0.00 0.00 -4.25 -0.43 4.64 -1.18 -3.45 113.55 108.87 1g7k h SER 86 Ca -0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 1g7k h SER 86 Cb 0.30 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.46 1g7k h SER 86 CO 0.01 0.14 0.37 -0.36 -0.87 0.00 0.00 176.83 176.12 1g7k s PHE 87 N -3.63 3.04 -0.20 4.77 0.40 -1.14 -0.53 117.98 120.70 1g7k s PHE 87 Ca 0.01 1.48 0.29 0.00 -0.60 0.00 0.00 56.93 58.10 1g7k s PHE 87 Cb 0.10 -2.95 1.02 0.00 0.51 0.00 0.00 43.02 41.69 1g7k s PHE 87 CO 0.61 -1.16 1.83 -1.00 0.70 0.00 0.00 175.22 176.21 1g7k h PRO 88 N -0.04 0.00 -0.04 0.24 0.13 -1.90 -3.44 132.00 126.94 1g7k h PRO 88 Ca -0.46 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.71 1g7k h PRO 88 Cb 1.22 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 1g7k h PRO 88 CO 0.57 0.00 -0.26 0.93 -0.23 0.00 0.00 178.00 179.02 1g7k h GLU 89 N 0.00 -0.36 0.00 0.86 3.07 -1.89 -3.34 114.58 112.92 1g7k h GLU 89 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1g7k h GLU 89 Cb 0.62 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1g7k h GLU 89 CO 0.00 -0.24 0.00 0.41 -1.40 0.00 0.00 179.01 177.78 1g7k n GLY 90 N -1.37 -1.40 3.56 -3.84 0.00 0.31 -4.56 105.19 97.89 1g7k n GLY 90 Ca -0.04 -2.08 -0.09 0.00 0.00 0.00 0.00 46.02 43.81 1g7k n GLY 90 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1g7k s PHE 91 N 0.00 0.17 0.24 1.61 -0.12 -0.83 -0.70 117.98 118.35 1g7k s PHE 91 Ca 0.00 -0.53 0.11 0.00 -0.05 0.00 0.00 56.93 56.46 1g7k s PHE 91 Cb 0.00 0.27 -0.05 0.00 -0.63 0.00 0.00 43.02 42.61 1g7k s PHE 91 CO 0.00 -0.96 -0.16 0.15 -0.05 0.00 0.00 175.22 174.20 1g7k s LYS 92 N -3.96 1.80 -0.01 1.99 1.02 -1.26 -0.45 119.74 118.86 1g7k s LYS 92 Ca 0.17 -1.59 -0.06 0.00 0.02 0.00 0.00 55.97 54.51 1g7k s LYS 92 Cb -0.01 -1.90 0.00 0.00 -0.52 0.00 0.00 37.83 35.40 1g7k s LYS 92 CO 0.04 0.37 0.12 1.67 -0.92 0.00 0.00 175.35 176.63 1g7k s TRP 93 N -2.18 0.01 0.13 3.18 1.48 -0.60 -4.44 118.94 116.51 1g7k s TRP 93 Ca 0.27 -0.02 0.04 0.00 -1.06 0.00 0.00 56.10 55.33 1g7k s TRP 93 Cb -0.06 -0.03 -0.04 0.00 -1.16 0.00 0.00 33.47 32.17 1g7k s TRP 93 CO 0.15 -0.21 -0.10 -1.83 -4.06 0.00 0.00 176.95 170.90 1g7k s GLU 94 N -0.96 0.97 0.02 3.25 -1.05 0.48 -0.71 118.70 120.70 1g7k s GLU 94 Ca -0.10 -1.36 -0.28 0.00 -0.15 0.00 0.00 54.97 53.08 1g7k s GLU 94 Cb -0.06 -0.55 0.07 0.00 -0.44 0.00 0.00 34.13 33.15 1g7k s GLU 94 CO 0.01 0.07 0.64 0.50 0.95 0.00 0.00 175.26 177.43 1g7k s ARG 95 N -3.49 1.12 0.00 -4.83 3.52 -0.22 -1.03 118.95 114.01 1g7k s ARG 95 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 55.73 55.73 1g7k s ARG 95 Cb 0.01 0.52 0.00 0.00 -1.56 0.00 0.00 34.95 33.93 1g7k s ARG 95 CO -0.00 -0.40 0.00 0.28 -0.81 0.00 0.00 175.30 174.36 1g7k n VAL 96 N 0.49 0.00 -3.15 7.11 0.31 -0.10 0.39 118.33 123.38 1g7k n VAL 96 Ca -0.18 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.20 1g7k n VAL 96 Cb 0.60 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.51 1g7k n VAL 96 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1g7k s ASN 98 N -0.91 -0.52 0.15 4.52 0.01 -0.21 -1.46 114.94 116.52 1g7k s ASN 98 Ca 0.00 0.32 -0.18 0.00 -0.71 0.00 0.00 52.86 52.28 1g7k s ASN 98 Cb 0.00 1.43 -0.07 0.00 0.41 0.00 0.00 41.25 43.02 1g7k s ASN 98 CO 0.00 -0.10 0.63 -0.36 -1.51 0.00 0.00 177.10 175.76 1g7k s PHE 99 N 2.95 3.69 0.61 2.20 0.40 0.35 -1.13 117.98 127.05 1g7k s PHE 99 Ca 0.01 1.26 0.31 0.00 -0.60 0.00 0.00 56.93 57.92 1g7k s PHE 99 Cb -0.10 -2.51 1.80 0.00 0.51 0.00 0.00 43.02 42.71 1g7k s PHE 99 CO -0.12 0.44 2.16 1.05 0.70 0.00 0.00 175.22 179.45 1g7k h GLU 100 N 3.81 0.00 -0.64 0.44 4.11 -1.41 -1.28 114.58 119.61 1g7k h GLU 100 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 1g7k h GLU 100 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1g7k h GLU 100 CO 0.65 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.33 1g7k n ASP 101 N -3.64 4.28 0.00 3.06 3.85 -1.26 -4.90 116.55 117.94 1g7k n ASP 101 Ca -0.00 -2.43 0.00 0.00 -0.71 0.00 0.00 54.79 51.65 1g7k n ASP 101 Cb 0.24 -0.55 0.00 0.00 -1.35 0.00 0.00 41.12 39.46 1g7k n ASP 101 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1g7k n GLY 102 N 0.99 2.41 3.74 6.12 0.00 -0.48 -4.71 105.19 113.26 1g7k n GLY 102 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1g7k n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g7k n GLY 103 N -1.78 0.85 2.81 -0.02 0.00 -1.21 -4.78 105.19 101.06 1g7k n GLY 103 Ca 0.00 0.17 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 1g7k n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g7k s VAL 104 N -1.21 -0.05 0.01 1.61 1.01 -0.21 -0.49 120.40 121.07 1g7k s VAL 104 Ca 0.62 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.83 1g7k s VAL 104 Cb -0.46 -0.08 -0.02 0.00 0.00 0.00 0.00 36.38 35.82 1g7k s VAL 104 CO 0.57 0.07 -0.17 -0.69 0.00 0.00 0.00 175.10 174.88 1g7k s VAL 105 N 0.86 1.31 -0.05 2.92 1.01 -1.26 -0.53 120.40 124.66 1g7k s VAL 105 Ca -0.07 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.12 1g7k s VAL 105 Cb -0.10 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.16 1g7k s VAL 105 CO -0.03 0.28 -0.16 0.28 0.00 0.00 0.00 175.10 175.47 1g7k s THR 106 N -0.53 1.34 0.00 3.92 -1.32 -0.72 -4.21 115.64 114.12 1g7k s THR 106 Ca 0.06 -0.65 0.05 0.00 -1.21 0.00 0.00 61.69 59.94 1g7k s THR 106 Cb -0.07 -1.17 -0.02 0.00 -1.51 0.00 0.00 72.50 69.74 1g7k s THR 106 CO 0.00 0.39 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.95 1g7k s VAL 107 N 0.21 1.31 -0.04 5.08 1.01 0.16 -1.77 120.40 126.36 1g7k s VAL 107 Ca -0.07 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.13 1g7k s VAL 107 Cb -0.12 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1g7k s VAL 107 CO 0.03 0.30 -0.07 0.28 0.00 0.00 0.00 175.10 175.63 1g7k s THR 108 N -0.49 0.72 0.03 3.92 -1.32 -0.49 -1.06 115.64 116.94 1g7k s THR 108 Ca 0.06 -0.27 -0.04 0.00 -1.21 0.00 0.00 61.69 60.23 1g7k s THR 108 Cb -0.07 -0.68 -0.01 0.00 -1.51 0.00 0.00 72.50 70.23 1g7k s THR 108 CO -0.00 0.25 0.05 -1.58 -2.21 0.00 0.00 174.62 171.13 1g7k s GLN 109 N 0.58 0.49 -0.08 7.08 -0.44 0.11 -0.62 119.66 126.78 1g7k s GLN 109 Ca -0.09 -0.70 0.02 0.00 -2.50 0.00 0.00 55.36 52.09 1g7k s GLN 109 Cb -0.12 0.19 0.01 0.00 -1.64 0.00 0.00 33.01 31.45 1g7k s GLN 109 CO 0.01 -0.11 -0.13 0.34 0.50 0.00 0.00 175.29 175.90 1g7k s ASP 110 N -1.88 2.01 -0.20 6.67 2.15 -0.45 -1.56 116.67 123.41 1g7k s ASP 110 Ca -0.09 -0.34 -0.01 0.00 0.43 0.00 0.00 52.55 52.54 1g7k s ASP 110 Cb -0.04 -0.92 0.01 0.00 -0.30 0.00 0.00 42.92 41.67 1g7k s ASP 110 CO -0.03 0.03 -0.13 -0.44 -0.17 0.00 0.00 175.17 174.44 1g7k s SER 111 N 0.75 3.67 0.39 -0.34 0.01 0.40 -1.55 113.70 117.02 1g7k s SER 111 Ca -0.13 -0.54 0.04 0.00 1.31 0.00 0.00 55.95 56.64 1g7k s SER 111 Cb -0.16 -1.60 -0.03 0.00 0.21 0.00 0.00 66.02 64.45 1g7k s SER 111 CO 0.03 -0.01 0.15 -0.94 0.41 0.00 0.00 173.24 172.87 1g7k s SER 112 N 1.38 2.51 -0.10 2.44 1.04 -0.01 -1.97 113.70 118.98 1g7k s SER 112 Ca 0.05 -1.66 0.01 0.00 0.48 0.00 0.00 55.95 54.83 1g7k s SER 112 Cb -0.14 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.48 1g7k s SER 112 CO -0.09 -0.93 -0.13 -0.22 0.98 0.00 0.00 173.24 172.85 1g7k s LEU 113 N -3.55 1.59 -0.17 2.42 2.96 -1.25 0.26 118.68 120.94 1g7k s LEU 113 Ca 0.27 -0.37 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 1g7k s LEU 113 Cb 0.03 -0.96 0.04 0.00 0.50 0.00 0.00 46.19 45.80 1g7k s LEU 113 CO 0.16 -0.01 -0.05 -1.58 -1.32 0.00 0.00 176.35 173.56 1g7k s GLN 114 N 1.04 1.39 -1.32 1.98 0.74 0.12 -4.83 119.66 118.78 1g7k s GLN 114 Ca -0.06 -0.52 -0.12 0.00 0.05 0.00 0.00 55.36 54.71 1g7k s GLN 114 Cb -0.15 -2.01 0.01 0.00 1.10 0.00 0.00 33.01 31.96 1g7k s GLN 114 CO -0.01 -0.44 0.52 -0.25 -0.55 0.00 0.00 175.29 174.55 1g7k n ASP 115 N 4.88 -2.20 0.00 6.67 8.00 -1.26 -0.88 116.55 131.76 1g7k n ASP 115 Ca -0.12 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.29 1g7k n ASP 115 Cb 0.48 -2.73 0.00 0.00 -0.02 0.00 0.00 41.12 38.85 1g7k n ASP 115 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1g7k n GLY 116 N -1.99 0.52 3.31 0.44 0.00 -1.26 -5.00 105.19 101.21 1g7k n GLY 116 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 1g7k n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g7k s PHE 118 N -0.42 3.67 -0.17 0.00 2.99 -0.56 0.12 117.98 123.61 1g7k s PHE 118 Ca 0.04 1.77 0.01 0.00 0.00 0.00 0.00 56.93 58.76 1g7k s PHE 118 Cb -0.12 -3.07 0.02 0.00 0.00 0.00 0.00 43.02 39.85 1g7k s PHE 118 CO 0.01 -0.07 -0.19 0.42 -0.00 0.00 0.00 175.22 175.38 1g7k s ILE 119 N -1.38 1.99 -0.16 0.64 -1.09 0.14 -0.98 121.20 120.36 1g7k s ILE 119 Ca 0.48 -0.90 0.00 0.00 -2.23 0.00 0.00 60.65 58.00 1g7k s ILE 119 Cb -0.25 -1.80 -0.00 0.00 -1.58 0.00 0.00 42.46 38.83 1g7k s ILE 119 CO 0.31 0.53 -0.15 -0.31 -1.23 0.00 0.00 174.94 174.09 1g7k s TYR 120 N 1.27 2.79 -0.16 3.97 2.02 0.16 -0.83 117.35 126.57 1g7k s TYR 120 Ca 0.04 -1.06 0.02 0.00 -0.37 0.00 0.00 57.07 55.69 1g7k s TYR 120 Cb -0.13 -1.90 0.01 0.00 -0.40 0.00 0.00 41.96 39.55 1g7k s TYR 120 CO -0.12 -0.49 -0.21 0.21 -1.57 0.00 0.00 175.55 173.38 1g7k s LYS 121 N 0.85 2.96 0.05 -0.62 2.36 -0.60 -1.77 119.74 122.98 1g7k s LYS 121 Ca -0.05 -0.83 0.09 0.00 -2.55 0.00 0.00 55.97 52.63 1g7k s LYS 121 Cb -0.15 -2.46 -0.03 0.00 -1.05 0.00 0.00 37.83 34.14 1g7k s LYS 121 CO -0.01 -0.10 -0.24 0.08 1.55 0.00 0.00 175.35 176.63 1g7k s VAL 122 N 1.03 1.95 -0.05 4.02 1.01 0.70 -1.34 120.40 127.72 1g7k s VAL 122 Ca -0.02 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 60.65 1g7k s VAL 122 Cb -0.14 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.56 1g7k s VAL 122 CO -0.07 0.27 -0.14 -0.54 0.00 0.00 0.00 175.10 174.63 1g7k s LYS 123 N -1.28 1.59 -0.03 2.72 1.02 0.20 -1.13 119.74 122.83 1g7k s LYS 123 Ca 0.10 -0.47 0.01 0.00 0.02 0.00 0.00 55.97 55.62 1g7k s LYS 123 Cb -0.10 -1.36 0.02 0.00 -0.52 0.00 0.00 37.83 35.87 1g7k s LYS 123 CO 0.02 0.13 -0.01 0.12 -0.92 0.00 0.00 175.35 174.69 1g7k s PHE 124 N 0.31 0.39 -0.17 3.18 5.36 -0.70 -1.40 117.98 124.95 1g7k s PHE 124 Ca -0.08 -0.05 -0.01 0.00 -0.96 0.00 0.00 56.93 55.83 1g7k s PHE 124 Cb -0.13 -0.41 0.05 0.00 -0.34 0.00 0.00 43.02 42.19 1g7k s PHE 124 CO 0.02 -0.11 -0.02 0.42 -1.46 0.00 0.00 175.22 174.07 1g7k s ILE 125 N 0.77 0.90 -0.14 3.12 1.01 -0.73 -1.23 121.20 124.90 1g7k s ILE 125 Ca -0.08 -0.57 -0.00 0.00 0.00 0.00 0.00 60.65 59.99 1g7k s ILE 125 Cb -0.11 -1.17 -0.01 0.00 0.01 0.00 0.00 42.46 41.17 1g7k s ILE 125 CO -0.01 0.03 -0.13 -0.83 0.00 0.00 0.00 174.94 174.01 1g7k s GLY 126 N 1.71 1.54 0.20 6.18 0.00 0.14 -1.76 107.32 115.32 1g7k s GLY 126 Ca 0.00 -0.93 0.01 0.00 0.00 0.00 0.00 44.72 43.80 1g7k s GLY 126 CO -0.07 -0.11 0.06 -1.34 0.00 0.00 0.00 173.10 171.64 1g7k s VAL 127 N 0.51 0.44 -1.39 1.40 -7.23 0.31 -0.56 120.40 113.89 1g7k s VAL 127 Ca -0.09 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 1g7k s VAL 127 Cb -0.16 -2.32 0.00 0.00 0.56 0.00 0.00 36.38 34.46 1g7k s VAL 127 CO 0.04 -0.26 0.00 -3.20 -0.31 0.00 0.00 175.10 171.37 1g7k n ASN 128 N -0.29 -4.61 -4.70 4.85 5.15 -1.26 -1.05 115.26 113.36 1g7k n ASN 128 Ca -0.03 0.13 -0.41 0.00 -0.60 0.00 0.00 54.58 53.68 1g7k n ASN 128 Cb 0.65 -3.62 -0.04 0.00 -0.53 0.00 0.00 39.78 36.23 1g7k n ASN 128 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1g7k s PHE 129 N -2.67 3.54 0.30 1.20 0.40 -1.26 -3.31 117.98 116.18 1g7k s PHE 129 Ca 0.00 1.31 -0.30 0.00 -0.60 0.00 0.00 56.93 57.34 1g7k s PHE 129 Cb 0.00 -2.92 -0.12 0.00 0.51 0.00 0.00 43.02 40.50 1g7k s PHE 129 CO 0.00 -0.03 1.60 -2.30 0.70 0.00 0.00 175.22 175.18 1g7k n PRO 130 N 4.26 2.71 -0.01 0.24 -0.02 -1.26 -4.85 135.00 136.07 1g7k n PRO 130 Ca 0.02 0.96 0.19 0.00 -2.02 0.00 0.00 63.50 62.65 1g7k n PRO 130 Cb 0.50 -2.75 0.66 0.00 -0.02 0.00 0.00 33.50 31.90 1g7k n PRO 130 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1g7k h SER 131 N 4.72 0.05 -0.50 2.55 4.64 -2.01 0.11 113.55 123.10 1g7k h SER 131 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1g7k h SER 131 Cb 1.22 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1g7k h SER 131 CO 0.79 0.03 0.00 -0.90 -0.87 0.00 0.00 176.83 175.87 1g7k n ASP 132 N -4.40 4.40 -4.49 4.97 5.68 -1.26 -4.48 116.55 116.98 1g7k n ASP 132 Ca 0.10 -2.57 -0.28 0.00 -0.50 0.00 0.00 54.79 51.54 1g7k n ASP 132 Cb 0.58 -0.53 0.14 0.00 -1.14 0.00 0.00 41.12 40.16 1g7k n ASP 132 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1g7k s GLY 133 N -1.16 1.73 0.46 6.12 0.00 0.36 -4.79 107.32 110.04 1g7k s GLY 133 Ca 0.45 -1.17 0.20 0.00 0.00 0.00 0.00 44.72 44.20 1g7k s GLY 133 CO 0.18 -0.54 1.96 -0.56 0.00 0.00 0.00 173.10 174.15 1g7k h PRO 134 N -1.17 0.00 -0.29 2.90 0.13 -1.94 0.47 132.00 132.09 1g7k h PRO 134 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1g7k h PRO 134 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1g7k h PRO 134 CO 0.46 0.21 0.00 0.28 -0.23 0.00 0.00 178.00 178.73 1g7k n VAL 135 N -3.90 0.00 0.00 1.56 0.31 -1.26 -1.38 118.33 113.66 1g7k n VAL 135 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1g7k n VAL 135 Cb 0.30 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.99 1g7k n VAL 135 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1g7k n GLN 137 N -0.21 0.00 -3.77 5.55 1.13 0.16 -1.10 117.38 119.15 1g7k n GLN 137 Ca 0.00 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 54.81 1g7k n GLN 137 Cb 0.07 0.00 0.04 0.00 0.11 0.00 0.00 30.24 30.46 1g7k n GLN 137 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1g7k n LYS 138 N 0.00 -5.60 -0.62 -1.09 5.02 -0.58 -4.88 118.16 110.40 1g7k n LYS 138 Ca 0.00 0.65 0.09 0.00 -2.02 0.00 0.00 58.31 57.03 1g7k n LYS 138 Cb 0.00 -5.43 0.36 0.00 -0.02 0.00 0.00 35.03 29.95 1g7k n LYS 138 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1g7k n LYS 139 N -4.52 3.76 0.00 1.97 2.85 -0.48 -4.97 118.16 116.77 1g7k n LYS 139 Ca -0.12 -2.90 0.00 0.00 -1.05 0.00 0.00 58.31 54.24 1g7k n LYS 139 Cb 0.60 -1.90 0.00 0.00 -0.65 0.00 0.00 35.03 33.08 1g7k n LYS 139 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1g7k n THR 140 N 1.12 0.00 -0.12 0.58 -2.24 -1.26 -1.30 114.28 111.05 1g7k n THR 140 Ca 0.26 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.99 1g7k n THR 140 Cb 0.90 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 1g7k n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1g7k n GLY 142 N 5.00 -0.57 3.90 3.38 0.00 -1.26 -4.79 105.19 110.85 1g7k n GLY 142 Ca 0.00 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1g7k n GLY 142 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1g7k s TRP 143 N -0.25 3.47 0.59 1.61 0.52 -1.26 -0.49 118.94 123.13 1g7k s TRP 143 Ca 0.05 0.57 -0.10 0.00 0.02 0.00 0.00 56.10 56.64 1g7k s TRP 143 Cb -0.02 -2.02 -0.04 0.00 -1.15 0.00 0.00 33.47 30.24 1g7k s TRP 143 CO 0.10 0.36 0.97 -1.21 0.02 0.00 0.00 176.95 177.19 1g7k s GLU 144 N -2.95 3.57 0.49 4.98 0.41 -0.25 -4.84 118.70 120.10 1g7k s GLU 144 Ca 0.42 0.61 -0.24 0.00 -0.41 0.00 0.00 54.97 55.36 1g7k s GLU 144 Cb -0.12 -2.15 -0.07 0.00 -1.78 0.00 0.00 34.13 30.02 1g7k s GLU 144 CO 0.26 -0.49 1.34 0.00 -0.49 0.00 0.00 175.26 175.87 1g7k s ALA 145 N -3.08 3.02 0.26 5.21 0.00 -1.26 -4.79 121.76 121.13 1g7k s ALA 145 Ca 0.53 1.29 0.03 0.00 0.00 0.00 0.00 51.96 53.81 1g7k s ALA 145 Cb -0.11 -3.53 -0.06 0.00 0.00 0.00 0.00 23.12 19.42 1g7k s ALA 145 CO 0.52 -1.13 0.03 -1.54 0.00 0.00 0.00 175.76 173.64 1g7k s SER 146 N -0.86 1.87 -0.13 0.00 1.04 0.93 -4.97 113.70 111.57 1g7k s SER 146 Ca 0.65 -1.29 -0.01 0.00 0.48 0.00 0.00 55.95 55.78 1g7k s SER 146 Cb -0.39 0.01 0.04 0.00 0.10 0.00 0.00 66.02 65.78 1g7k s SER 146 CO 0.48 -0.58 -0.02 -0.89 0.98 0.00 0.00 173.24 173.21 1g7k s THR 147 N -3.45 0.75 -0.04 2.02 2.01 -1.26 0.00 115.64 115.67 1g7k s THR 147 Ca 0.33 -0.31 -0.13 0.00 0.31 0.00 0.00 61.69 61.88 1g7k s THR 147 Cb 0.07 -0.95 -0.05 0.00 0.01 0.00 0.00 72.50 71.58 1g7k s THR 147 CO 0.12 0.15 0.35 -0.70 -0.69 0.00 0.00 174.62 173.85 1g7k s GLU 148 N 1.80 3.88 -0.38 4.92 2.12 -0.04 -4.48 118.70 126.52 1g7k s GLU 148 Ca 0.03 0.28 -0.13 0.00 0.36 0.00 0.00 54.97 55.51 1g7k s GLU 148 Cb -0.14 -3.25 0.02 0.00 0.26 0.00 0.00 34.13 31.02 1g7k s GLU 148 CO -0.07 0.64 0.25 0.50 -0.54 0.00 0.00 175.26 176.03 1g7k s ARG 149 N -0.82 2.96 0.18 4.30 3.00 -0.02 -1.21 118.95 127.33 1g7k s ARG 149 Ca 0.21 -1.01 0.06 0.00 -1.00 0.00 0.00 55.73 53.99 1g7k s ARG 149 Cb -0.15 -3.84 -0.04 0.00 0.00 0.00 0.00 34.95 30.92 1g7k s ARG 149 CO 0.10 -0.69 0.11 -0.51 0.00 0.00 0.00 175.30 174.31 1g7k s LEU 150 N 1.62 3.67 -0.09 -0.88 1.02 0.39 -1.63 118.68 122.78 1g7k s LEU 150 Ca 0.04 -0.22 -0.30 0.00 0.02 0.00 0.00 54.13 53.66 1g7k s LEU 150 Cb -0.19 -2.28 0.10 0.00 0.02 0.00 0.00 46.19 43.85 1g7k s LEU 150 CO 0.08 0.06 0.86 -0.72 0.02 0.00 0.00 176.35 176.65 1g7k s TYR 151 N -1.81 -0.47 0.25 0.29 -0.85 -0.15 -1.36 117.35 113.25 1g7k s TYR 151 Ca 0.30 0.74 -0.30 0.00 -0.52 0.00 0.00 57.07 57.30 1g7k s TYR 151 Cb -0.09 0.45 -0.09 0.00 0.38 0.00 0.00 41.96 42.60 1g7k s TYR 151 CO 0.22 -0.48 0.97 -1.25 -1.52 0.00 0.00 175.55 173.49 1g7k s PRO 152 N -1.46 4.81 -0.27 -3.49 0.04 -1.26 -1.29 135.00 132.07 1g7k s PRO 152 Ca -0.04 1.53 -0.23 0.00 0.04 0.00 0.00 61.00 62.30 1g7k s PRO 152 Cb -0.00 -3.24 0.08 0.00 0.04 0.00 0.00 34.50 31.38 1g7k s PRO 152 CO 0.03 0.46 0.76 0.50 0.04 0.00 0.00 177.00 178.78 1g7k s ARG 153 N -1.27 0.76 -1.36 4.56 6.06 0.69 -4.92 118.95 123.47 1g7k s ARG 153 Ca 0.42 0.99 -0.06 0.00 -2.50 0.00 0.00 55.73 54.58 1g7k s ARG 153 Cb -0.27 0.33 0.04 0.00 0.06 0.00 0.00 34.95 35.11 1g7k s ARG 153 CO 0.33 -0.10 0.44 -3.47 -2.50 0.00 0.00 175.30 170.00 1g7k n ASP 154 N 3.00 -4.61 0.00 -2.12 2.03 -1.26 -0.81 116.55 112.78 1g7k n ASP 154 Ca -0.15 -0.26 0.00 0.00 0.52 0.00 0.00 54.79 54.90 1g7k n ASP 154 Cb 0.56 -3.79 0.00 0.00 -0.72 0.00 0.00 41.12 37.17 1g7k n ASP 154 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1g7k n GLY 155 N -1.23 0.58 3.45 0.27 0.00 -1.26 -4.99 105.19 102.00 1g7k n GLY 155 Ca -0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.70 1g7k n GLY 155 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1g7k s VAL 156 N -2.50 0.32 -0.18 1.61 -7.23 0.01 -4.95 120.40 107.48 1g7k s VAL 156 Ca 0.00 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.10 1g7k s VAL 156 Cb 0.00 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 1g7k s VAL 156 CO 0.00 0.00 0.06 -0.22 -0.31 0.00 0.00 175.10 174.63 1g7k s LEU 157 N -3.55 3.77 0.19 1.32 2.96 -0.84 -0.22 118.68 122.31 1g7k s LEU 157 Ca 0.28 0.06 0.09 0.00 -0.22 0.00 0.00 54.13 54.34 1g7k s LEU 157 Cb 0.01 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 1g7k s LEU 157 CO 0.20 0.16 -0.18 -0.54 -1.32 0.00 0.00 176.35 174.67 1g7k s LYS 158 N 0.43 1.34 -0.05 1.98 1.02 -0.41 -0.47 119.74 123.56 1g7k s LYS 158 Ca 0.03 -1.49 -0.26 0.00 0.02 0.00 0.00 55.97 54.26 1g7k s LYS 158 Cb -0.13 -1.34 0.06 0.00 -0.52 0.00 0.00 37.83 35.90 1g7k s LYS 158 CO 0.01 0.26 0.58 0.20 -0.92 0.00 0.00 175.35 175.48 1g7k s GLY 159 N -2.92 -0.47 0.07 -3.33 0.00 -0.92 -0.97 107.32 98.78 1g7k s GLY 159 Ca 0.19 1.10 0.05 0.00 0.00 0.00 0.00 44.72 46.06 1g7k s GLY 159 CO 0.08 0.79 -0.14 -0.54 0.00 0.00 0.00 173.10 173.29 1g7k s GLU 160 N -1.12 0.79 -0.01 2.90 8.01 -0.65 -0.51 118.70 128.12 1g7k s GLU 160 Ca -0.11 -0.93 -0.03 0.00 0.01 0.00 0.00 54.97 53.91 1g7k s GLU 160 Cb -0.02 -0.78 -0.00 0.00 -4.31 0.00 0.00 34.13 29.02 1g7k s GLU 160 CO 0.08 0.17 0.06 0.42 0.01 0.00 0.00 175.26 176.00 1g7k s ILE 161 N -1.27 0.05 -0.49 -1.63 1.01 -0.17 -0.84 121.20 117.86 1g7k s ILE 161 Ca -0.03 -0.42 -0.11 0.00 0.00 0.00 0.00 60.65 60.09 1g7k s ILE 161 Cb -0.10 -0.23 0.12 0.00 0.01 0.00 0.00 42.46 42.26 1g7k s ILE 161 CO 0.02 -0.23 0.38 -1.00 0.00 0.00 0.00 174.94 174.11 1g7k s HIS 162 N -0.72 3.38 0.40 3.97 3.76 -1.26 -0.06 115.29 124.76 1g7k s HIS 162 Ca -0.08 -1.72 0.08 0.00 -0.15 0.00 0.00 55.06 53.19 1g7k s HIS 162 Cb -0.05 -3.56 -0.02 0.00 1.11 0.00 0.00 32.58 30.06 1g7k s HIS 162 CO 0.00 -1.00 0.35 0.15 -0.85 0.00 0.00 174.74 173.39 1g7k s LYS 163 N 1.42 2.56 -0.19 1.40 1.02 0.09 -4.78 119.74 121.27 1g7k s LYS 163 Ca 0.05 -1.49 -0.15 0.00 0.02 0.00 0.00 55.97 54.39 1g7k s LYS 163 Cb -0.27 -2.39 0.05 0.00 -0.52 0.00 0.00 37.83 34.70 1g7k s LYS 163 CO 0.00 -0.12 0.49 0.00 -0.92 0.00 0.00 175.35 174.80 1g7k s ALA 164 N -2.44 -1.22 -0.16 5.17 0.00 -1.26 -1.96 121.76 119.89 1g7k s ALA 164 Ca 0.46 1.48 -0.08 0.00 0.00 0.00 0.00 51.96 53.82 1g7k s ALA 164 Cb -0.04 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 1g7k s ALA 164 CO 0.27 -0.25 0.11 -0.51 0.00 0.00 0.00 175.76 175.39 1g7k s LEU 165 N 0.56 4.16 0.04 0.00 1.43 -0.19 -1.09 118.68 123.58 1g7k s LEU 165 Ca -0.02 0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 53.06 1g7k s LEU 165 Cb -0.04 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1g7k s LEU 165 CO -0.03 0.28 1.06 -0.54 0.23 0.00 0.00 176.35 177.35 1g7k s LYS 166 N -0.23 4.52 -0.04 1.70 1.02 0.36 -0.88 119.74 126.20 1g7k s LYS 166 Ca 0.10 1.56 -0.20 0.00 0.02 0.00 0.00 55.97 57.45 1g7k s LYS 166 Cb -0.12 -3.41 -0.05 0.00 -0.52 0.00 0.00 37.83 33.74 1g7k s LYS 166 CO 0.01 -0.10 0.58 -0.51 -0.92 0.00 0.00 175.35 174.41 1g7k s LEU 167 N 0.91 4.38 0.22 3.17 1.02 -0.66 -4.40 118.68 123.32 1g7k s LEU 167 Ca 0.54 1.09 -0.09 0.00 0.02 0.00 0.00 54.13 55.69 1g7k s LEU 167 Cb -0.24 -2.89 0.33 0.00 0.02 0.00 0.00 46.19 43.40 1g7k s LEU 167 CO 0.29 0.06 1.70 0.11 0.02 0.00 0.00 176.35 178.52 1g7k h LYS 168 N 5.99 0.25 0.00 1.70 1.57 -1.50 0.44 116.57 125.01 1g7k h LYS 168 Ca -0.44 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1g7k h LYS 168 Cb 1.20 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1g7k h LYS 168 CO 0.71 0.16 0.00 -0.25 -0.57 0.00 0.00 179.45 179.51 1g7k n ASP 169 N -5.14 0.00 0.00 0.86 8.00 -1.26 -4.96 116.55 114.04 1g7k n ASP 169 Ca 0.10 -1.57 0.00 0.00 0.71 0.00 0.00 54.79 54.03 1g7k n ASP 169 Cb 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.45 1g7k n ASP 169 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1g7k n GLY 170 N 0.66 1.74 0.75 0.44 0.00 0.16 -5.12 105.19 103.82 1g7k n GLY 170 Ca 0.09 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1g7k n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g7k n GLY 171 N 1.67 -2.95 3.27 -0.02 0.00 -1.26 -4.62 105.19 101.28 1g7k n GLY 171 Ca 0.00 -1.95 -0.18 0.00 0.00 0.00 0.00 46.02 43.89 1g7k n GLY 171 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1g7k s HIS 172 N -0.55 1.47 -0.29 1.61 3.76 -1.26 -1.65 115.29 118.38 1g7k s HIS 172 Ca 0.00 -0.59 -0.00 0.00 -0.15 0.00 0.00 55.06 54.32 1g7k s HIS 172 Cb 0.00 -0.74 0.05 0.00 1.11 0.00 0.00 32.58 33.00 1g7k s HIS 172 CO 0.00 0.19 -0.03 -0.47 -0.85 0.00 0.00 174.74 173.58 1g7k s TYR 173 N -2.49 3.25 0.17 1.40 5.04 -0.06 -4.91 117.35 119.75 1g7k s TYR 173 Ca 0.13 -1.98 -0.27 0.00 -2.44 0.00 0.00 57.07 52.51 1g7k s TYR 173 Cb -0.03 -2.05 -0.08 0.00 0.35 0.00 0.00 41.96 40.15 1g7k s TYR 173 CO 0.04 -0.82 0.83 -0.51 -1.34 0.00 0.00 175.55 173.75 1g7k s LEU 174 N 1.21 4.59 -0.04 6.97 1.43 -1.26 -1.02 118.68 130.55 1g7k s LEU 174 Ca -0.06 1.72 -0.01 0.00 -1.03 0.00 0.00 54.13 54.74 1g7k s LEU 174 Cb -0.20 -3.40 0.03 0.00 0.03 0.00 0.00 46.19 42.66 1g7k s LEU 174 CO -0.02 0.15 0.07 -0.69 0.23 0.00 0.00 176.35 176.09 1g7k s VAL 175 N -0.94 -0.09 -0.15 -1.59 1.01 -0.83 -1.10 120.40 116.72 1g7k s VAL 175 Ca 0.38 0.28 -0.10 0.00 0.00 0.00 0.00 61.98 62.55 1g7k s VAL 175 Cb -0.24 -0.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.95 1g7k s VAL 175 CO 0.28 0.12 0.17 -0.70 0.00 0.00 0.00 175.10 174.96 1g7k s GLU 176 N 1.48 3.87 -0.04 2.72 2.12 -0.28 -0.73 118.70 127.83 1g7k s GLU 176 Ca -0.04 -0.11 0.01 0.00 0.36 0.00 0.00 54.97 55.19 1g7k s GLU 176 Cb -0.12 -3.31 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 1g7k s GLU 176 CO -0.04 0.52 -0.04 -0.06 -0.54 0.00 0.00 175.26 175.10 1g7k s PHE 177 N -0.29 3.01 -0.16 5.30 0.40 0.92 -1.05 117.98 126.11 1g7k s PHE 177 Ca 0.13 0.07 -0.02 0.00 -0.60 0.00 0.00 56.93 56.51 1g7k s PHE 177 Cb -0.12 -1.70 0.05 0.00 0.51 0.00 0.00 43.02 41.76 1g7k s PHE 177 CO 0.02 0.40 0.01 0.15 0.70 0.00 0.00 175.22 176.50 1g7k s LYS 178 N -1.11 0.80 0.22 0.44 1.02 -0.54 -1.00 119.74 119.57 1g7k s LYS 178 Ca 0.15 -0.32 0.10 0.00 0.02 0.00 0.00 55.97 55.93 1g7k s LYS 178 Cb -0.11 -1.82 -0.04 0.00 -0.52 0.00 0.00 37.83 35.33 1g7k s LYS 178 CO 0.05 -0.52 -0.14 -1.12 -0.92 0.00 0.00 175.35 172.70 1g7k s SER 179 N 1.84 3.93 -0.04 2.83 0.01 0.33 -0.92 113.70 121.68 1g7k s SER 179 Ca 0.01 -0.76 -0.01 0.00 1.31 0.00 0.00 55.95 56.50 1g7k s SER 179 Cb -0.16 -0.52 0.03 0.00 0.21 0.00 0.00 66.02 65.58 1g7k s SER 179 CO -0.07 0.08 0.02 -0.63 0.41 0.00 0.00 173.24 173.05 1g7k s ILE 180 N -1.96 0.13 0.45 1.44 1.09 -0.20 -2.17 121.20 119.97 1g7k s ILE 180 Ca 0.26 0.19 0.07 0.00 -1.10 0.00 0.00 60.65 60.07 1g7k s ILE 180 Cb -0.07 -0.28 -0.02 0.00 -1.06 0.00 0.00 42.46 41.02 1g7k s ILE 180 CO 0.14 0.17 0.26 -0.31 -0.10 0.00 0.00 174.94 175.11 1g7k s TYR 181 N 1.53 2.38 0.02 3.97 1.51 0.38 -0.39 117.35 126.75 1g7k s TYR 181 Ca -0.03 -0.64 0.01 0.00 -1.01 0.00 0.00 57.07 55.40 1g7k s TYR 181 Cb -0.13 -1.97 -0.02 0.00 -0.11 0.00 0.00 41.96 39.73 1g7k s TYR 181 CO -0.03 -0.01 -0.05 0.00 -1.11 0.00 0.00 175.55 174.34 1g7k s ALA 183 N -2.63 0.37 -2.12 3.71 0.00 -1.26 -1.98 121.76 117.85 1g7k s ALA 183 Ca 0.39 -0.55 0.30 0.00 0.00 0.00 0.00 51.96 52.10 1g7k s ALA 183 Cb 0.01 0.04 1.65 0.00 0.00 0.00 0.00 23.12 24.83 1g7k s ALA 183 CO 0.22 -0.04 2.08 1.63 0.00 0.00 0.00 175.76 179.66 1g7k n LYS 184 N 1.91 1.16 -3.75 0.00 5.02 0.13 -4.75 118.16 117.88 1g7k n LYS 184 Ca -0.20 -0.24 -0.12 0.00 -2.02 0.00 0.00 58.31 55.73 1g7k n LYS 184 Cb 0.56 -1.48 -0.07 0.00 -0.02 0.00 0.00 35.03 34.01 1g7k n LYS 184 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1g7k s LYS 185 N -2.00 0.79 0.15 1.97 -2.85 -1.26 -5.00 119.74 111.55 1g7k s LYS 185 Ca 0.44 -0.43 -0.31 0.00 -1.00 0.00 0.00 55.97 54.67 1g7k s LYS 185 Cb 0.21 0.34 -0.11 0.00 -2.06 0.00 0.00 37.83 36.22 1g7k s LYS 185 CO 0.35 -0.25 1.78 -2.14 0.10 0.00 0.00 175.35 175.19 1g7k s PRO 186 N -2.29 4.14 0.03 1.78 0.02 -1.26 -4.94 135.00 132.46 1g7k s PRO 186 Ca -0.07 2.58 -0.01 0.00 0.02 0.00 0.00 61.00 63.53 1g7k s PRO 186 Cb -0.02 -3.40 -0.02 0.00 0.02 0.00 0.00 34.50 31.08 1g7k s PRO 186 CO -0.02 -0.80 -0.01 0.14 -0.33 0.00 0.00 177.00 175.99 1g7k s VAL 187 N 2.14 0.13 0.23 3.83 -7.23 -1.26 -5.04 120.40 113.20 1g7k s VAL 187 Ca 0.78 -1.07 -0.32 0.00 -1.81 0.00 0.00 61.98 59.57 1g7k s VAL 187 Cb -0.47 -0.55 -0.12 0.00 0.56 0.00 0.00 36.38 35.80 1g7k s VAL 187 CO 0.35 -0.59 1.61 1.67 -0.31 0.00 0.00 175.10 177.83 1g7k n GLN 188 N 1.26 2.55 -3.95 4.82 7.27 -1.26 -4.97 117.38 123.09 1g7k n GLN 188 Ca -0.22 0.91 -0.28 0.00 0.07 0.00 0.00 57.00 57.49 1g7k n GLN 188 Cb 0.56 -2.70 -0.04 0.00 2.41 0.00 0.00 30.24 30.48 1g7k n GLN 188 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1g7k s LEU 189 N 0.42 4.30 0.80 1.69 1.43 -1.26 -4.27 118.68 121.80 1g7k s LEU 189 Ca 0.71 0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 53.94 1g7k s LEU 189 Cb -0.55 -2.89 0.16 0.00 0.03 0.00 0.00 46.19 42.94 1g7k s LEU 189 CO 0.41 0.09 1.11 -2.16 0.23 0.00 0.00 176.35 176.03 1g7k s PRO 190 N -2.99 1.29 0.00 1.29 0.04 -1.26 -4.84 135.00 128.54 1g7k s PRO 190 Ca 0.34 -0.95 0.00 0.00 0.04 0.00 0.00 61.00 60.43 1g7k s PRO 190 Cb -0.12 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.24 1g7k s PRO 190 CO 0.28 -1.79 0.00 0.41 0.04 0.00 0.00 177.00 175.94 1g7k n GLY 191 N -3.14 1.71 3.72 0.56 0.00 -1.26 -4.18 105.19 102.59 1g7k n GLY 191 Ca 0.16 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.77 1g7k n GLY 191 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1g7k s TYR 192 N 1.95 2.99 0.33 1.61 5.04 -1.26 -4.45 117.35 123.56 1g7k s TYR 192 Ca 0.00 0.54 -0.15 0.00 -2.44 0.00 0.00 57.07 55.02 1g7k s TYR 192 Cb 0.00 -4.01 0.06 0.00 0.35 0.00 0.00 41.96 38.36 1g7k s TYR 192 CO 0.00 -3.74 0.78 2.48 -1.34 0.00 0.00 175.55 173.74 1g7k n TYR 193 N 3.84 -2.10 -4.25 4.97 0.18 -0.46 -4.92 117.16 114.42 1g7k n TYR 193 Ca 0.14 -1.63 -0.19 0.00 1.88 0.00 0.00 57.90 58.10 1g7k n TYR 193 Cb 0.37 0.81 -0.11 0.00 -0.38 0.00 0.00 39.34 40.03 1g7k n TYR 193 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 1g7k s TYR 194 N -2.56 1.46 -0.10 -3.48 1.51 0.01 -0.46 117.35 113.73 1g7k s TYR 194 Ca 0.16 -0.53 -0.01 0.00 -1.01 0.00 0.00 57.07 55.69 1g7k s TYR 194 Cb -0.04 -0.77 0.03 0.00 -0.11 0.00 0.00 41.96 41.07 1g7k s TYR 194 CO 0.10 0.17 -0.05 0.08 -1.11 0.00 0.00 175.55 174.74 1g7k s VAL 195 N -2.00 0.82 0.07 0.71 1.01 -0.35 0.00 120.40 120.67 1g7k s VAL 195 Ca 0.09 -0.18 -0.13 0.00 0.00 0.00 0.00 61.98 61.76 1g7k s VAL 195 Cb -0.06 -0.90 -0.06 0.00 0.00 0.00 0.00 36.38 35.36 1g7k s VAL 195 CO 0.03 0.31 0.45 -1.81 0.00 0.00 0.00 175.10 174.08 1g7k s ASP 196 N 1.79 6.75 0.02 3.32 1.01 0.06 -0.86 116.67 128.76 1g7k s ASP 196 Ca 0.05 0.92 -0.07 0.00 0.71 0.00 0.00 52.55 54.17 1g7k s ASP 196 Cb -0.13 -2.23 -0.00 0.00 1.01 0.00 0.00 42.92 41.57 1g7k s ASP 196 CO -0.07 0.20 0.12 -0.44 0.21 0.00 0.00 175.17 175.19 1g7k s SER 197 N -1.55 0.09 -0.22 0.27 0.01 0.10 -1.00 113.70 111.40 1g7k s SER 197 Ca 0.32 -0.35 -0.03 0.00 1.31 0.00 0.00 55.95 57.20 1g7k s SER 197 Cb -0.15 0.22 0.11 0.00 0.21 0.00 0.00 66.02 66.41 1g7k s SER 197 CO 0.17 -0.43 0.28 -0.75 0.41 0.00 0.00 173.24 172.91 1g7k s LYS 198 N -1.93 0.25 -0.21 12.44 2.20 -0.44 -0.05 119.74 132.01 1g7k s LYS 198 Ca -0.11 0.27 -0.05 0.00 -0.36 0.00 0.00 55.97 55.72 1g7k s LYS 198 Cb -0.05 -0.93 -0.02 0.00 -1.51 0.00 0.00 37.83 35.32 1g7k s LYS 198 CO -0.01 -0.69 0.00 -1.17 -0.36 0.00 0.00 175.35 173.12 1g7k s LEU 199 N 2.40 3.25 0.02 5.43 0.20 -1.26 -1.69 118.68 127.02 1g7k s LEU 199 Ca 0.09 -0.22 0.08 0.00 0.69 0.00 0.00 54.13 54.77 1g7k s LEU 199 Cb -0.15 -1.83 -0.02 0.00 -0.43 0.00 0.00 46.19 43.75 1g7k s LEU 199 CO -0.15 0.04 -0.24 -1.81 -0.29 0.00 0.00 176.35 173.90 1g7k s ASP 200 N 1.12 2.88 -0.30 3.68 1.01 0.10 -4.56 116.67 120.61 1g7k s ASP 200 Ca 0.03 -0.51 -0.24 0.00 0.71 0.00 0.00 52.55 52.53 1g7k s ASP 200 Cb -0.14 -0.28 0.00 0.00 1.01 0.00 0.00 42.92 43.51 1g7k s ASP 200 CO 0.01 0.25 0.82 -0.63 0.21 0.00 0.00 175.17 175.83 1g7k s ILE 201 N -0.71 4.78 -0.37 0.77 -1.09 -1.26 -0.24 121.20 123.09 1g7k s ILE 201 Ca 0.10 1.28 0.23 0.00 -2.23 0.00 0.00 60.65 60.02 1g7k s ILE 201 Cb -0.09 -4.16 -0.12 0.00 -1.58 0.00 0.00 42.46 36.51 1g7k s ILE 201 CO 0.01 -0.24 0.93 0.35 -1.23 0.00 0.00 174.94 174.75 1g7k n THR 202 N 5.52 0.30 -3.56 2.92 -2.24 0.13 -4.95 114.28 112.40 1g7k n THR 202 Ca 0.05 -0.40 -0.06 0.00 -2.27 0.00 0.00 64.05 61.37 1g7k n THR 202 Cb 0.48 -0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 68.66 1g7k n THR 202 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1g7k s SER 203 N -4.54 -0.22 -0.22 3.42 1.04 -1.14 -4.97 113.70 107.06 1g7k s SER 203 Ca -0.00 0.01 -0.32 0.00 0.48 0.00 0.00 55.95 56.13 1g7k s SER 203 Cb 0.13 0.23 0.16 0.00 0.10 0.00 0.00 66.02 66.63 1g7k s SER 203 CO 0.82 -0.36 1.22 -1.38 0.98 0.00 0.00 173.24 174.51 1g7k s HIS 204 N -2.58 -0.15 0.77 5.02 -0.00 -1.26 -0.86 115.29 116.23 1g7k s HIS 204 Ca 0.07 0.20 -0.10 0.00 -0.00 0.00 0.00 55.06 55.24 1g7k s HIS 204 Cb -0.01 0.49 0.07 0.00 -0.00 0.00 0.00 32.58 33.13 1g7k s HIS 204 CO -0.06 -0.17 1.12 0.54 -0.00 0.00 0.00 174.74 176.17 1g7k s ASN 205 N -1.45 4.62 0.29 7.38 4.22 -0.78 -4.94 114.94 124.28 1g7k s ASN 205 Ca 0.07 0.65 0.02 0.00 -2.14 0.00 0.00 52.86 51.46 1g7k s ASN 205 Cb -0.01 -1.21 0.57 0.00 1.28 0.00 0.00 41.25 41.89 1g7k s ASN 205 CO -0.05 -1.79 1.85 -0.33 -2.04 0.00 0.00 177.10 174.75 1g7k h GLU 206 N -0.88 0.95 -0.57 3.55 4.39 -2.02 -2.44 114.58 117.57 1g7k h GLU 206 Ca -0.45 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.19 1g7k h GLU 206 Cb 1.32 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1g7k h GLU 206 CO 0.64 0.63 0.00 -0.40 -1.16 0.00 0.00 179.01 178.72 1g7k n ASP 207 N -4.59 3.58 -3.10 1.42 3.85 -1.26 -4.95 116.55 111.50 1g7k n ASP 207 Ca 0.18 -1.99 -0.19 0.00 -0.71 0.00 0.00 54.79 52.08 1g7k n ASP 207 Cb 0.34 -0.37 0.07 0.00 -1.35 0.00 0.00 41.12 39.81 1g7k n ASP 207 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 1g7k n TYR 208 N 1.49 -2.35 0.82 2.11 4.02 -0.92 -4.49 117.16 117.85 1g7k n TYR 208 Ca 0.22 0.85 0.10 0.00 -0.01 0.00 0.00 57.90 59.06 1g7k n TYR 208 Cb 0.59 -4.44 -0.09 0.00 -0.02 0.00 0.00 39.34 35.39 1g7k n TYR 208 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1g7k n THR 209 N -4.46 0.02 -3.80 -0.72 -2.24 -1.26 -4.77 114.28 97.04 1g7k n THR 209 Ca -0.03 -0.09 -0.25 0.00 -2.27 0.00 0.00 64.05 61.41 1g7k n THR 209 Cb 0.57 0.73 -0.17 0.00 -2.10 0.00 0.00 70.33 69.35 1g7k n THR 209 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1g7k s ILE 210 N -3.09 0.56 0.02 2.28 1.01 -1.26 -1.06 121.20 119.65 1g7k s ILE 210 Ca 0.06 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.61 1g7k s ILE 210 Cb 0.16 -0.75 -0.01 0.00 0.01 0.00 0.00 42.46 41.86 1g7k s ILE 210 CO 0.86 0.19 -0.05 -0.69 0.00 0.00 0.00 174.94 175.25 1g7k s VAL 211 N 1.89 0.32 -0.07 2.92 1.01 0.01 -1.87 120.40 124.62 1g7k s VAL 211 Ca 0.04 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.40 1g7k s VAL 211 Cb -0.13 -0.37 -0.00 0.00 0.00 0.00 0.00 36.38 35.88 1g7k s VAL 211 CO -0.06 -0.23 -0.20 -0.70 0.00 0.00 0.00 175.10 173.91 1g7k s GLU 212 N -0.95 2.29 0.12 2.72 2.12 -0.04 0.16 118.70 125.12 1g7k s GLU 212 Ca -0.07 -0.72 0.06 0.00 0.36 0.00 0.00 54.97 54.60 1g7k s GLU 212 Cb -0.07 -1.87 -0.04 0.00 0.26 0.00 0.00 34.13 32.42 1g7k s GLU 212 CO -0.00 0.22 -0.14 -0.65 -0.54 0.00 0.00 175.26 174.15 1g7k s GLN 213 N 0.19 1.02 -0.04 4.30 -0.21 0.55 0.22 119.66 125.69 1g7k s GLN 213 Ca -0.10 -1.25 0.03 0.00 0.02 0.00 0.00 55.36 54.06 1g7k s GLN 213 Cb -0.15 -0.88 0.00 0.00 1.00 0.00 0.00 33.01 32.99 1g7k s GLN 213 CO 0.05 0.17 -0.11 -0.47 -2.12 0.00 0.00 175.29 172.80 1g7k s TYR 214 N -2.21 1.20 -0.02 0.91 5.04 0.67 -1.08 117.35 121.87 1g7k s TYR 214 Ca 0.09 -0.34 0.01 0.00 -2.44 0.00 0.00 57.07 54.39 1g7k s TYR 214 Cb -0.04 -0.85 0.01 0.00 0.35 0.00 0.00 41.96 41.42 1g7k s TYR 214 CO 0.03 -0.15 -0.04 -2.00 -1.34 0.00 0.00 175.55 172.06 1g7k s GLU 215 N 0.27 0.45 -0.12 4.97 2.12 0.11 0.02 118.70 126.52 1g7k s GLU 215 Ca -0.05 -0.10 0.01 0.00 0.36 0.00 0.00 54.97 55.19 1g7k s GLU 215 Cb -0.11 -0.48 -0.01 0.00 0.26 0.00 0.00 34.13 33.79 1g7k s GLU 215 CO 0.01 0.01 -0.16 0.50 -0.54 0.00 0.00 175.26 175.09 1g7k s ARG 216 N 0.34 3.24 -0.14 4.30 3.52 -0.68 -1.31 118.95 128.21 1g7k s ARG 216 Ca -0.04 -0.74 -0.10 0.00 -0.13 0.00 0.00 55.73 54.72 1g7k s ARG 216 Cb -0.07 -2.53 0.04 0.00 -1.56 0.00 0.00 34.95 30.84 1g7k s ARG 216 CO -0.00 0.23 0.36 -0.08 -0.81 0.00 0.00 175.30 174.99 1g7k s THR 217 N 0.27 -0.01 -0.10 4.11 -1.32 0.66 -1.32 115.64 117.92 1g7k s THR 217 Ca -0.11 0.05 -0.08 0.00 -1.21 0.00 0.00 61.69 60.34 1g7k s THR 217 Cb -0.16 -0.52 0.03 0.00 -1.51 0.00 0.00 72.50 70.35 1g7k s THR 217 CO 0.06 0.02 0.27 -1.61 -2.21 0.00 0.00 174.62 171.15 1g7k s GLU 218 N 0.74 0.28 0.23 7.08 2.02 -0.17 -2.31 118.70 126.57 1g7k s GLU 218 Ca -0.04 0.44 -0.10 0.00 0.02 0.00 0.00 54.97 55.28 1g7k s GLU 218 Cb -0.06 0.06 -0.07 0.00 0.10 0.00 0.00 34.13 34.16 1g7k s GLU 218 CO -0.05 -0.08 0.56 0.20 0.02 0.00 0.00 175.26 175.91 1g7k s GLY 219 N 0.53 2.30 0.23 -1.39 0.00 0.31 -0.76 107.32 108.54 1g7k s GLY 219 Ca -0.03 -0.24 -0.22 0.00 0.00 0.00 0.00 44.72 44.22 1g7k s GLY 219 CO -0.03 -0.09 0.81 1.09 0.00 0.00 0.00 173.10 174.89 1g7k s ARG 220 N -2.76 1.57 0.62 2.90 1.70 0.10 -4.34 118.95 118.74 1g7k s ARG 220 Ca 0.47 -0.87 -0.06 0.00 -0.47 0.00 0.00 55.73 54.80 1g7k s ARG 220 Cb -0.11 0.53 0.02 0.00 -0.57 0.00 0.00 34.95 34.82 1g7k s ARG 220 CO 0.21 -0.72 0.93 -1.01 -1.08 0.00 0.00 175.30 173.63 1g7k s HIS 221 N -3.66 3.18 0.51 5.89 3.76 -1.26 -0.81 115.29 122.89 1g7k s HIS 221 Ca 0.12 0.61 -0.23 0.00 -0.15 0.00 0.00 55.06 55.41 1g7k s HIS 221 Cb -0.04 -2.85 -0.06 0.00 1.11 0.00 0.00 32.58 30.73 1g7k s HIS 221 CO 0.05 -0.97 1.38 -1.58 -0.85 0.00 0.00 174.74 172.77 1g7k s HIS 222 N -3.06 2.35 0.59 1.40 2.46 -1.26 -4.82 115.29 112.94 1g7k s HIS 222 Ca 0.55 1.34 0.30 0.00 0.47 0.00 0.00 55.06 57.72 1g7k s HIS 222 Cb -0.11 -3.83 1.82 0.00 -0.13 0.00 0.00 32.58 30.33 1g7k s HIS 222 CO 0.45 -2.89 2.25 -0.07 -2.47 0.00 0.00 174.74 172.02 1g7k h LEU 223 N 1.76 0.00 -0.02 8.88 4.07 -2.04 -2.73 115.31 125.23 1g7k h LEU 223 Ca -0.51 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.45 1g7k h LEU 223 Cb 1.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.03 1g7k h LEU 223 CO 0.59 0.00 -0.05 0.49 -1.08 0.00 0.00 178.44 178.39 1g7k n PHE 224 N -3.84 0.00 1.90 1.13 3.72 -1.26 -5.32 117.46 113.79 1g7k n PHE 224 Ca -0.03 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.53 1g7k n PHE 224 Cb 0.09 -0.38 0.86 0.00 -0.94 0.00 0.00 39.48 39.11 1g7k n PHE 224 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99