#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 -3.42 3.44 0.24 -1.26 -4.79 118.33 112.54 1g7k n VAL 7 Ca 0.00 0.00 -0.44 0.00 -2.04 0.00 0.00 64.34 61.86 1g7k n VAL 7 Cb 0.00 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.29 1g7k n VAL 7 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1g7k s ILE 8 N 0.00 5.18 0.74 1.34 1.01 -1.26 -4.92 121.20 123.29 1g7k s ILE 8 Ca 0.00 -0.99 -0.08 0.00 0.00 0.00 0.00 60.65 59.59 1g7k s ILE 8 Cb 0.00 -4.04 0.08 0.00 0.01 0.00 0.00 42.46 38.50 1g7k s ILE 8 CO 0.00 -0.51 1.06 -0.54 0.00 0.00 0.00 174.94 174.96 1g7k s LYS 9 N 1.64 2.01 0.57 2.79 -0.14 -1.26 -4.97 119.74 120.38 1g7k s LYS 9 Ca 0.04 -0.25 0.31 0.00 -1.36 0.00 0.00 55.97 54.71 1g7k s LYS 9 Cb -0.23 -2.12 1.70 0.00 -1.68 0.00 0.00 37.83 35.51 1g7k s LYS 9 CO 0.07 -1.40 2.17 0.93 -0.76 0.00 0.00 175.35 176.37 1g7k h GLU 10 N -0.75 0.00 -5.15 1.68 5.08 -1.97 -3.42 114.58 110.04 1g7k h GLU 10 Ca -0.44 0.00 -0.40 0.00 -1.00 0.00 0.00 59.36 57.52 1g7k h GLU 10 Cb 1.31 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.42 1g7k h GLU 10 CO 0.59 0.06 -0.66 0.12 -1.00 0.00 0.00 179.01 178.11 1g7k s PHE 11 N -4.32 1.61 0.20 4.33 5.36 -1.26 -3.97 117.98 119.93 1g7k s PHE 11 Ca -0.04 -0.88 -0.01 0.00 -0.96 0.00 0.00 56.93 55.05 1g7k s PHE 11 Cb 0.14 -0.93 -0.04 0.00 -0.34 0.00 0.00 43.02 41.85 1g7k s PHE 11 CO 0.55 0.02 0.12 1.03 -1.46 0.00 0.00 175.22 175.48 1g7k s ARG 13 N -3.84 1.21 0.07 10.12 0.52 -1.26 -4.99 118.95 120.79 1g7k s ARG 13 Ca 0.28 -1.63 -0.15 0.00 -0.52 0.00 0.00 55.73 53.70 1g7k s ARG 13 Cb 0.05 0.22 0.03 0.00 0.52 0.00 0.00 34.95 35.77 1g7k s ARG 13 CO 0.09 -0.38 0.35 -0.59 0.02 0.00 0.00 175.30 174.80 1g7k s PHE 14 N -4.12 -0.16 -0.07 -0.53 -0.12 -0.04 -2.38 117.98 110.57 1g7k s PHE 14 Ca 0.38 -0.03 0.05 0.00 -0.05 0.00 0.00 56.93 57.28 1g7k s PHE 14 Cb 0.07 0.17 -0.01 0.00 -0.63 0.00 0.00 43.02 42.62 1g7k s PHE 14 CO 0.12 -0.59 -0.23 0.15 -0.05 0.00 0.00 175.22 174.62 1g7k s LYS 15 N -3.04 2.53 0.03 1.99 1.02 0.02 -1.31 119.74 120.97 1g7k s LYS 15 Ca -0.02 -0.83 0.03 0.00 0.02 0.00 0.00 55.97 55.18 1g7k s LYS 15 Cb 0.01 -2.07 -0.02 0.00 -0.52 0.00 0.00 37.83 35.23 1g7k s LYS 15 CO -0.06 0.29 -0.10 0.54 -0.92 0.00 0.00 175.35 175.09 1g7k s VAL 16 N 0.05 0.74 0.32 3.17 0.11 -0.54 -0.09 120.40 124.16 1g7k s VAL 16 Ca -0.09 -0.88 -0.02 0.00 -2.93 0.00 0.00 61.98 58.07 1g7k s VAL 16 Cb -0.15 -0.71 -0.01 0.00 -1.53 0.00 0.00 36.38 33.98 1g7k s VAL 16 CO 0.05 -0.14 0.41 0.00 -3.33 0.00 0.00 175.10 172.09 1g7k s ARG 17 N -1.13 1.79 -0.30 1.54 1.70 -0.95 0.05 118.95 121.66 1g7k s ARG 17 Ca -0.03 -1.74 -0.14 0.00 -0.47 0.00 0.00 55.73 53.35 1g7k s ARG 17 Cb -0.08 0.41 0.14 0.00 -0.57 0.00 0.00 34.95 34.86 1g7k s ARG 17 CO 0.01 -0.72 0.86 -1.21 -1.08 0.00 0.00 175.30 173.16 1g7k s GLU 19 N -3.31 0.44 0.22 3.89 2.02 -0.55 -0.47 118.70 120.93 1g7k s GLU 19 Ca 0.32 0.97 -0.04 0.00 0.02 0.00 0.00 54.97 56.24 1g7k s GLU 19 Cb 0.01 0.44 -0.03 0.00 0.10 0.00 0.00 34.13 34.65 1g7k s GLU 19 CO 0.20 -0.13 0.24 0.20 0.02 0.00 0.00 175.26 175.78 1g7k s GLY 20 N 2.24 1.20 -0.14 -1.39 0.00 -0.12 -1.17 107.32 107.94 1g7k s GLY 20 Ca -0.06 -1.47 -0.07 0.00 0.00 0.00 0.00 44.72 43.12 1g7k s GLY 20 CO -0.18 -1.18 0.32 -1.59 0.00 0.00 0.00 173.10 170.48 1g7k s THR 21 N -4.09 -0.07 -0.11 0.90 2.01 -0.57 -0.90 115.64 112.80 1g7k s THR 21 Ca 0.34 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.47 1g7k s THR 21 Cb 0.05 -0.48 0.03 0.00 0.01 0.00 0.00 72.50 72.10 1g7k s THR 21 CO 0.12 0.06 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.35 1g7k s VAL 22 N 1.43 0.90 -1.47 3.82 1.01 -0.57 -0.56 120.40 124.97 1g7k s VAL 22 Ca -0.09 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 1g7k s VAL 22 Cb -0.10 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.35 1g7k s VAL 22 CO -0.10 0.34 0.42 0.59 0.00 0.00 0.00 175.10 176.35 1g7k n ASN 23 N 4.98 -0.58 0.00 3.32 4.13 -0.13 -0.33 115.26 126.65 1g7k n ASN 23 Ca -0.11 -1.04 0.00 0.00 1.68 0.00 0.00 54.58 55.11 1g7k n ASN 23 Cb 0.50 -2.83 0.00 0.00 -1.54 0.00 0.00 39.78 35.91 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 -1.98 2.75 3.56 7.41 0.00 -1.26 -4.99 105.19 110.69 1g7k n GLY 24 Ca -0.26 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.50 3.05 0.25 1.61 5.04 0.55 -5.04 115.29 118.26 1g7k s HIS 25 Ca 0.00 0.35 -0.26 0.00 -1.54 0.00 0.00 55.06 53.61 1g7k s HIS 25 Cb 0.00 -3.52 -0.09 0.00 0.04 0.00 0.00 32.58 29.01 1g7k s HIS 25 CO 0.00 -0.86 0.87 -1.21 -2.34 0.00 0.00 174.74 171.21 1g7k s GLU 26 N 3.18 4.59 0.18 2.88 2.02 -1.26 -1.51 118.70 128.78 1g7k s GLU 26 Ca 0.30 1.26 -0.18 0.00 0.02 0.00 0.00 54.97 56.37 1g7k s GLU 26 Cb -0.13 -3.02 0.03 0.00 0.10 0.00 0.00 34.13 31.12 1g7k s GLU 26 CO 0.20 0.42 0.52 -0.59 0.02 0.00 0.00 175.26 175.83 1g7k s PHE 27 N -1.40 -0.18 0.01 1.61 -0.12 -0.08 -4.19 117.98 113.62 1g7k s PHE 27 Ca 0.44 -0.15 0.01 0.00 -0.05 0.00 0.00 56.93 57.18 1g7k s PHE 27 Cb -0.21 0.40 -0.01 0.00 -0.63 0.00 0.00 43.02 42.58 1g7k s PHE 27 CO 0.26 -0.89 -0.04 -1.21 -0.05 0.00 0.00 175.22 173.29 1g7k s GLU 28 N -3.85 0.28 0.00 1.99 2.02 0.39 -0.95 118.70 118.58 1g7k s GLU 28 Ca 0.07 -0.26 0.00 0.00 0.02 0.00 0.00 54.97 54.80 1g7k s GLU 28 Cb -0.01 -0.19 -0.00 0.00 0.10 0.00 0.00 34.13 34.03 1g7k s GLU 28 CO -0.05 0.04 -0.01 0.42 0.02 0.00 0.00 175.26 175.69 1g7k s ILE 29 N -0.44 0.04 0.03 -1.63 1.01 -1.26 -0.60 121.20 118.34 1g7k s ILE 29 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.48 1g7k s ILE 29 Cb -0.04 -0.07 -0.02 0.00 0.01 0.00 0.00 42.46 42.34 1g7k s ILE 29 CO -0.00 -0.06 -0.03 -1.83 0.00 0.00 0.00 174.94 173.01 1g7k s GLU 30 N -0.21 0.38 0.07 2.79 -1.05 -0.52 -4.35 118.70 115.82 1g7k s GLU 30 Ca -0.02 -0.73 -0.09 0.00 -0.15 0.00 0.00 54.97 53.98 1g7k s GLU 30 Cb -0.01 0.09 0.03 0.00 -0.44 0.00 0.00 34.13 33.80 1g7k s GLU 30 CO -0.00 -0.05 0.43 0.41 0.95 0.00 0.00 175.26 176.99 1g7k n GLY 31 N 1.32 0.96 3.11 -3.83 0.00 0.11 -1.32 105.19 105.54 1g7k n GLY 31 Ca -0.22 -1.00 -0.11 0.00 0.00 0.00 0.00 46.02 44.68 1g7k n GLY 31 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1g7k s GLU 32 N -2.02 0.47 0.19 1.61 2.02 -0.74 -1.47 118.70 118.76 1g7k s GLU 32 Ca 0.10 -0.30 0.00 0.00 0.02 0.00 0.00 54.97 54.78 1g7k s GLU 32 Cb -0.01 0.20 0.00 0.00 0.10 0.00 0.00 34.13 34.42 1g7k s GLU 32 CO 0.02 -0.11 0.25 0.41 0.02 0.00 0.00 175.26 175.85 1g7k n GLY 33 N 1.62 2.73 3.69 -1.39 0.00 -0.43 -0.60 105.19 110.81 1g7k n GLY 33 Ca -0.21 -1.57 -0.04 0.00 0.00 0.00 0.00 46.02 44.19 1g7k n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1g7k s GLU 34 N -2.51 1.06 0.00 1.61 -1.05 -0.12 -0.86 118.70 116.84 1g7k s GLU 34 Ca 0.17 -0.55 0.00 0.00 -0.15 0.00 0.00 54.97 54.45 1g7k s GLU 34 Cb -0.00 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.08 1g7k s GLU 34 CO 0.12 -0.48 0.00 0.41 0.95 0.00 0.00 175.26 176.26 1g7k n GLY 35 N -0.42 -1.26 2.98 -3.83 0.00 -1.26 -0.31 105.19 101.08 1g7k n GLY 35 Ca -0.07 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.48 1.83 0.46 1.61 1.81 0.34 -4.27 118.95 120.25 1g7k s ARG 36 Ca 0.00 -2.38 0.24 0.00 -1.72 0.00 0.00 55.73 51.87 1g7k s ARG 36 Cb 0.00 -3.30 1.25 0.00 -0.45 0.00 0.00 34.95 32.45 1g7k s ARG 36 CO 0.00 -1.06 1.82 -1.35 -0.68 0.00 0.00 175.30 174.04 1g7k h PRO 37 N 6.87 0.24 -0.00 3.54 0.11 -1.79 0.18 132.00 141.15 1g7k h PRO 37 Ca -0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1g7k h PRO 37 Cb 0.93 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1g7k h PRO 37 CO 0.64 0.16 -0.27 0.66 -0.21 0.00 0.00 178.00 178.97 1g7k n TYR 38 N -4.45 0.00 0.37 0.65 4.02 -1.26 -3.85 117.16 112.64 1g7k n TYR 38 Ca 0.22 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 58.18 1g7k n TYR 38 Cb 0.91 -0.22 -0.09 0.00 -0.02 0.00 0.00 39.34 39.91 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 -1.10 1.60 -2.57 -0.72 1.02 0.51 -4.69 120.64 114.69 1g7k n GLU 39 Ca 0.10 -0.06 -0.06 0.00 -0.02 0.00 0.00 57.16 57.13 1g7k n GLU 39 Cb 0.33 -1.23 0.01 0.00 -0.02 0.00 0.00 31.44 30.53 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 1.48 0.47 2.96 0.62 0.00 -0.52 -4.69 105.19 105.50 1g7k n GLY 40 Ca 0.00 -0.52 -0.19 0.00 0.00 0.00 0.00 46.02 45.32 1g7k n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1g7k s HIS 41 N -2.83 0.71 0.02 1.61 3.76 -1.21 -0.22 115.29 117.13 1g7k s HIS 41 Ca 0.10 -0.16 -0.28 0.00 -0.15 0.00 0.00 55.06 54.56 1g7k s HIS 41 Cb -0.04 -0.54 0.07 0.00 1.11 0.00 0.00 32.58 33.18 1g7k s HIS 41 CO 0.12 -0.09 0.66 0.54 -0.85 0.00 0.00 174.74 175.13 1g7k s ASN 42 N 0.28 -0.62 0.18 1.40 4.22 -0.83 -0.50 114.94 119.06 1g7k s ASN 42 Ca -0.04 0.47 0.05 0.00 -2.14 0.00 0.00 52.86 51.20 1g7k s ASN 42 Cb -0.08 0.56 -0.05 0.00 1.28 0.00 0.00 41.25 42.96 1g7k s ASN 42 CO 0.00 -0.73 -0.08 0.42 -2.04 0.00 0.00 177.10 174.67 1g7k s THR 43 N -2.06 1.26 -0.05 0.54 -4.23 0.57 -0.79 115.64 110.89 1g7k s THR 43 Ca -0.07 -2.08 -0.17 0.00 -1.18 0.00 0.00 61.69 58.19 1g7k s THR 43 Cb -0.00 -2.02 0.03 0.00 1.34 0.00 0.00 72.50 71.85 1g7k s THR 43 CO 0.02 -0.60 0.39 0.54 -0.54 0.00 0.00 174.62 174.43 1g7k s VAL 44 N -3.27 0.04 -0.11 2.29 0.11 -0.51 -0.95 120.40 118.00 1g7k s VAL 44 Ca 0.21 -0.31 0.02 0.00 -2.93 0.00 0.00 61.98 58.97 1g7k s VAL 44 Cb 0.03 -0.67 0.02 0.00 -1.53 0.00 0.00 36.38 34.22 1g7k s VAL 44 CO 0.04 -0.17 -0.15 -0.75 -3.33 0.00 0.00 175.10 170.74 1g7k s LYS 45 N -1.01 2.16 0.16 1.54 2.20 0.23 0.27 119.74 125.28 1g7k s LYS 45 Ca -0.11 -0.54 0.09 0.00 -0.36 0.00 0.00 55.97 55.06 1g7k s LYS 45 Cb -0.04 -1.86 -0.04 0.00 -1.51 0.00 0.00 37.83 34.38 1g7k s LYS 45 CO 0.04 -0.08 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.31 1g7k s LEU 46 N 1.05 2.87 -0.05 5.43 2.01 0.20 -1.80 118.68 128.38 1g7k s LEU 46 Ca -0.05 -0.58 0.01 0.00 0.01 0.00 0.00 54.13 53.52 1g7k s LEU 46 Cb -0.15 -1.61 0.02 0.00 0.01 0.00 0.00 46.19 44.47 1g7k s LEU 46 CO -0.02 0.13 -0.07 -0.54 1.01 0.00 0.00 176.35 176.86 1g7k s LYS 47 N -2.58 1.09 -0.35 1.70 -0.14 -0.44 -1.36 119.74 117.67 1g7k s LYS 47 Ca 0.22 -0.19 -0.29 0.00 -1.36 0.00 0.00 55.97 54.36 1g7k s LYS 47 Cb -0.09 -1.03 0.01 0.00 -1.68 0.00 0.00 37.83 35.04 1g7k s LYS 47 CO 0.13 -0.07 1.18 0.08 -0.76 0.00 0.00 175.35 175.92 1g7k s VAL 48 N 0.92 4.29 -0.22 3.17 1.01 -0.30 -1.44 120.40 127.83 1g7k s VAL 48 Ca -0.11 1.43 0.22 0.00 0.00 0.00 0.00 61.98 63.53 1g7k s VAL 48 Cb -0.15 -4.36 -0.11 0.00 0.00 0.00 0.00 36.38 31.76 1g7k s VAL 48 CO 0.01 -0.61 0.88 0.35 0.00 0.00 0.00 175.10 175.72 1g7k n THR 49 N 6.27 0.38 -3.62 3.92 -2.24 0.23 -4.85 114.28 114.36 1g7k n THR 49 Ca 0.13 -0.50 -0.15 0.00 -2.27 0.00 0.00 64.05 61.26 1g7k n THR 49 Cb 0.47 -0.17 -0.07 0.00 -2.10 0.00 0.00 70.33 68.46 1g7k n THR 49 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1g7k s LYS 50 N -3.39 0.84 0.00 -0.78 2.20 -0.84 -4.87 119.74 112.90 1g7k s LYS 50 Ca -0.02 0.53 0.00 0.00 -0.36 0.00 0.00 55.97 56.12 1g7k s LYS 50 Cb 0.11 0.40 0.00 0.00 -1.51 0.00 0.00 37.83 36.83 1g7k s LYS 50 CO 0.83 -0.18 0.00 0.41 -0.36 0.00 0.00 175.35 176.04 1g7k n GLY 51 N 1.93 0.62 0.00 5.54 0.00 -1.26 -0.46 105.19 111.55 1g7k n GLY 51 Ca -0.16 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1g7k n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g7k n GLY 52 N -2.66 0.00 3.03 -0.02 0.00 -1.26 -3.99 105.19 100.29 1g7k n GLY 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1g7k n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1g7k n PRO 53 N 0.00 -0.58 -2.11 1.61 -0.04 -1.26 -4.76 135.00 127.85 1g7k n PRO 53 Ca 0.00 0.88 -0.41 0.00 -0.04 0.00 0.00 63.50 63.94 1g7k n PRO 53 Cb 0.00 -0.88 -0.02 0.00 -0.04 0.00 0.00 33.50 32.56 1g7k n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1g7k s LEU 54 N -0.63 4.42 -0.14 1.53 1.43 -1.26 -4.90 118.68 119.13 1g7k s LEU 54 Ca 0.00 2.65 0.03 0.00 -1.03 0.00 0.00 54.13 55.78 1g7k s LEU 54 Cb 0.00 -3.64 0.28 0.00 0.03 0.00 0.00 46.19 42.86 1g7k s LEU 54 CO 0.00 -0.56 1.21 -0.81 0.23 0.00 0.00 176.35 176.42 1g7k n PRO 55 N 1.31 1.90 -4.08 1.29 -0.04 -1.26 -4.90 135.00 129.22 1g7k n PRO 55 Ca 0.02 -1.19 -0.10 0.00 -0.04 0.00 0.00 63.50 62.19 1g7k n PRO 55 Cb 0.42 -1.59 -0.07 0.00 -0.04 0.00 0.00 33.50 32.21 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 -1.44 0.68 0.13 0.54 -0.12 -1.26 -4.73 117.98 111.78 1g7k s PHE 56 Ca 0.22 -0.99 -0.31 0.00 -0.05 0.00 0.00 56.93 55.80 1g7k s PHE 56 Cb 0.18 -0.12 -0.11 0.00 -0.63 0.00 0.00 43.02 42.34 1g7k s PHE 56 CO 0.05 -0.84 1.83 0.00 -0.05 0.00 0.00 175.22 176.21 1g7k s ALA 57 N -4.07 3.78 0.45 1.99 0.00 0.33 -4.87 121.76 119.37 1g7k s ALA 57 Ca 0.29 1.47 0.11 0.00 0.00 0.00 0.00 51.96 53.83 1g7k s ALA 57 Cb 0.03 -3.76 1.01 0.00 0.00 0.00 0.00 23.12 20.40 1g7k s ALA 57 CO 0.10 -1.21 2.07 2.35 0.00 0.00 0.00 175.76 179.06 1g7k h TRP 58 N 8.49 0.25 -1.10 0.00 2.91 -1.96 -2.76 115.95 121.79 1g7k h TRP 58 Ca -0.46 -0.00 0.31 0.00 1.13 0.00 0.00 58.89 59.87 1g7k h TRP 58 Cb 1.22 -0.08 -0.06 0.00 -0.51 0.00 0.00 29.16 29.72 1g7k h TRP 58 CO 0.78 0.20 0.76 -0.44 -1.03 0.00 0.00 178.44 178.71 1g7k h ASP 59 N 0.27 0.17 0.54 2.65 3.32 -1.95 0.93 116.42 122.35 1g7k h ASP 59 Ca 0.07 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 1g7k h ASP 59 Cb 0.04 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1g7k h ASP 59 CO -0.01 0.03 -0.09 0.16 -1.72 0.00 0.00 179.24 177.61 1g7k h ILE 60 N 0.15 0.33 0.03 0.35 3.07 -1.89 -3.21 117.51 116.34 1g7k h ILE 60 Ca 0.56 -0.52 -0.32 0.00 1.55 0.00 0.00 64.86 66.13 1g7k h ILE 60 Cb 1.92 1.39 -0.05 0.00 -0.27 0.00 0.00 36.82 39.81 1g7k h ILE 60 CO -0.12 0.08 -1.90 0.18 -1.05 0.00 0.00 178.15 175.34 1g7k n LEU 61 N -3.38 1.24 -0.33 0.16 4.77 0.31 -4.56 117.00 115.20 1g7k n LEU 61 Ca -0.01 0.29 0.16 0.00 -0.03 0.00 0.00 56.01 56.41 1g7k n LEU 61 Cb 0.25 -0.12 0.31 0.00 -2.33 0.00 0.00 43.42 41.53 1g7k n LEU 61 CO 0.28 0.53 0.83 0.77 -1.33 0.00 0.00 177.39 178.47 1g7k h SER 62 N 0.02 -0.39 0.00 -1.43 4.64 -1.54 0.22 113.55 115.08 1g7k h SER 62 Ca -0.37 0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1g7k h SER 62 Cb 2.05 0.45 0.00 0.00 -0.31 0.00 0.00 62.40 64.59 1g7k h SER 62 CO 0.07 -0.34 0.00 -2.65 -0.87 0.00 0.00 176.83 173.03 1g7k n PRO 63 N -5.45 0.81 0.00 4.77 -0.02 -1.26 -2.69 135.00 131.16 1g7k n PRO 63 Ca 0.24 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.83 1g7k n PRO 63 Cb 0.79 -1.39 0.08 0.00 -0.02 0.00 0.00 33.50 32.96 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 -0.89 0.18 -1.10 -0.52 1.13 0.79 -4.80 117.38 112.16 1g7k n GLN 64 Ca 0.15 -0.13 -0.23 0.00 -1.94 0.00 0.00 57.00 54.85 1g7k n GLN 64 Cb 0.07 -1.50 0.03 0.00 0.11 0.00 0.00 30.24 28.96 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 -1.29 1.94 0.00 1.08 3.01 -1.09 -5.00 117.46 116.10 1g7k n PHE 65 Ca 0.06 -2.20 0.00 0.00 1.01 0.00 0.00 57.45 56.32 1g7k n PHE 65 Cb 0.35 -1.13 0.00 0.00 -0.01 0.00 0.00 39.48 38.69 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 0.14 0.00 0.00 4.37 2.88 -1.26 -5.05 113.62 114.70 1g7k n SER 69 Ca 0.40 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 58.02 1g7k n SER 69 Cb 0.58 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 64.49 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 0.42 0.09 -1.46 4.76 -1.26 -2.55 118.16 118.17 1g7k n LYS 70 Ca 0.00 0.04 0.12 0.00 -2.87 0.00 0.00 58.31 55.60 1g7k n LYS 70 Cb 0.00 -1.50 0.45 0.00 -1.84 0.00 0.00 35.03 32.14 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 -1.08 0.64 1.62 -0.18 3.14 -1.26 -2.56 118.33 118.65 1g7k n VAL 71 Ca 0.11 -0.03 0.15 0.00 -2.96 0.00 0.00 64.34 61.60 1g7k n VAL 71 Cb 0.07 -0.81 0.66 0.00 -1.06 0.00 0.00 33.84 32.70 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 -2.11 0.00 -2.06 1.45 4.02 -1.06 -4.76 117.16 112.65 1g7k n TYR 72 Ca 0.04 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.51 1g7k n TYR 72 Cb 0.33 -0.04 -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 -2.12 3.24 -0.06 -0.72 1.01 -1.06 -2.59 120.40 118.09 1g7k s VAL 73 Ca 0.38 0.74 -0.30 0.00 0.00 0.00 0.00 61.98 62.80 1g7k s VAL 73 Cb 0.21 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1g7k s VAL 73 CO 0.38 0.01 1.18 -0.75 0.00 0.00 0.00 175.10 175.93 1g7k s LYS 74 N 2.15 4.36 0.04 2.72 2.20 -0.87 -4.77 119.74 125.56 1g7k s LYS 74 Ca 0.69 1.64 0.09 0.00 -0.36 0.00 0.00 55.97 58.03 1g7k s LYS 74 Cb -0.37 -3.56 -0.03 0.00 -1.51 0.00 0.00 37.83 32.36 1g7k s LYS 74 CO 0.30 -0.44 -0.26 -1.01 -0.36 0.00 0.00 175.35 173.58 1g7k s HIS 75 N 2.22 2.28 0.45 4.03 3.76 -1.26 0.10 115.29 126.87 1g7k s HIS 75 Ca 0.55 -0.41 -0.22 0.00 -0.15 0.00 0.00 55.06 54.83 1g7k s HIS 75 Cb -0.24 -1.38 -0.09 0.00 1.11 0.00 0.00 32.58 31.98 1g7k s HIS 75 CO 0.21 0.10 1.02 -2.14 -0.85 0.00 0.00 174.74 173.09 1g7k s PRO 76 N -1.14 4.00 0.59 8.40 0.01 -1.26 -4.91 135.00 140.69 1g7k s PRO 76 Ca 0.11 1.37 0.29 0.00 0.01 0.00 0.00 61.00 62.78 1g7k s PRO 76 Cb -0.10 -2.26 1.46 0.00 0.01 0.00 0.00 34.50 33.61 1g7k s PRO 76 CO 0.02 -0.26 1.88 0.00 0.01 0.00 0.00 177.00 178.65 1g7k h ALA 77 N 1.95 2.20 -0.07 -1.55 0.00 -2.00 0.14 119.26 119.93 1g7k h ALA 77 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1g7k h ALA 77 Cb 1.21 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1g7k h ALA 77 CO 0.60 -0.75 0.00 -0.40 0.00 0.00 0.00 179.25 178.70 1g7k n ASP 78 N -3.70 0.85 -4.05 0.00 5.75 -1.26 -4.66 116.55 109.48 1g7k n ASP 78 Ca 0.09 -1.53 -0.31 0.00 -0.01 0.00 0.00 54.79 53.02 1g7k n ASP 78 Cb 0.70 -0.05 -0.16 0.00 -1.03 0.00 0.00 41.12 40.58 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 -1.91 1.85 0.17 2.12 1.01 0.48 -5.06 121.20 119.86 1g7k s ILE 79 Ca 0.32 -1.05 -0.34 0.00 0.00 0.00 0.00 60.65 59.58 1g7k s ILE 79 Cb 0.16 -1.83 -0.14 0.00 0.01 0.00 0.00 42.46 40.65 1g7k s ILE 79 CO 0.25 0.28 1.45 -2.65 0.00 0.00 0.00 174.94 174.28 1g7k n PRO 80 N 4.63 1.83 -2.80 2.79 -0.02 -1.26 -4.59 135.00 135.58 1g7k n PRO 80 Ca -0.17 0.66 -0.43 0.00 -2.02 0.00 0.00 63.50 61.54 1g7k n PRO 80 Cb 0.47 -2.35 0.01 0.00 -0.02 0.00 0.00 33.50 31.61 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 2.80 5.88 -0.34 2.55 -0.08 -1.26 -4.49 116.55 121.62 1g7k n ASP 81 Ca 0.16 -3.27 0.08 0.00 -1.51 0.00 0.00 54.79 50.24 1g7k n ASP 81 Cb 0.27 -1.36 0.18 0.00 2.34 0.00 0.00 41.12 42.55 1g7k n ASP 81 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1g7k h TYR 82 N 5.67 -0.35 -0.46 -0.67 3.20 -1.90 -0.00 116.97 122.46 1g7k h TYR 82 Ca 0.27 0.08 -0.05 0.00 3.14 0.00 0.00 58.73 62.17 1g7k h TYR 82 Cb 0.64 0.30 -0.02 0.00 1.54 0.00 0.00 36.73 39.20 1g7k h TYR 82 CO 1.08 -0.41 0.08 0.87 -1.64 0.00 0.00 178.16 178.14 1g7k h LYS 83 N 0.01 0.76 -0.26 1.82 1.57 -1.91 -2.02 116.57 116.54 1g7k h LYS 83 Ca 0.50 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 59.05 1g7k h LYS 83 Cb 0.86 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 1g7k h LYS 83 CO -0.95 0.78 0.05 0.87 -0.57 0.00 0.00 179.45 179.62 1g7k h LYS 84 N 0.63 0.43 -0.00 3.15 1.57 -1.45 -2.93 116.57 117.97 1g7k h LYS 84 Ca 0.14 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1g7k h LYS 84 Cb 0.38 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 1g7k h LYS 84 CO 0.01 0.55 0.00 -0.07 -0.57 0.00 0.00 179.45 179.37 1g7k h LEU 85 N 0.24 0.00 -1.87 2.94 3.38 -0.95 -2.16 115.31 116.90 1g7k h LEU 85 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1g7k h LEU 85 Cb 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1g7k h LEU 85 CO 0.00 0.00 -0.01 0.77 0.09 0.00 0.00 178.44 179.30 1g7k h SER 86 N 0.00 0.00 -4.33 -0.43 4.64 -1.16 -3.44 113.55 108.82 1g7k h SER 86 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1g7k h SER 86 Cb 0.01 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.17 1g7k h SER 86 CO -0.00 0.01 0.40 -0.36 -0.87 0.00 0.00 176.83 176.01 1g7k s PHE 87 N -3.81 3.42 -0.01 4.77 0.40 -0.81 -0.85 117.98 121.08 1g7k s PHE 87 Ca -0.01 1.36 0.29 0.00 -0.60 0.00 0.00 56.93 57.97 1g7k s PHE 87 Cb 0.10 -2.79 1.02 0.00 0.51 0.00 0.00 43.02 41.86 1g7k s PHE 87 CO 0.51 -0.87 1.86 -1.00 0.70 0.00 0.00 175.22 176.42 1g7k h PRO 88 N -0.34 0.00 0.02 0.24 0.13 -1.88 -3.45 132.00 126.73 1g7k h PRO 88 Ca -0.44 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.71 1g7k h PRO 88 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1g7k h PRO 88 CO 0.60 0.06 -0.17 0.93 -0.23 0.00 0.00 178.00 179.19 1g7k h GLU 89 N 0.00 -0.28 0.00 0.86 3.07 -1.91 -3.32 114.58 113.00 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 0.69 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 1g7k h GLU 89 CO 0.01 -0.19 0.00 0.41 -1.40 0.00 0.00 179.01 177.84 1g7k n GLY 90 N -1.30 -0.83 3.53 -3.84 0.00 -0.03 -4.45 105.19 98.26 1g7k n GLY 90 Ca -0.05 -2.14 -0.09 0.00 0.00 0.00 0.00 46.02 43.73 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 0.02 0.22 1.61 -0.12 -0.88 -1.06 117.98 117.78 1g7k s PHE 91 Ca 0.00 -0.38 0.10 0.00 -0.05 0.00 0.00 56.93 56.60 1g7k s PHE 91 Cb 0.00 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.67 1g7k s PHE 91 CO 0.00 -0.93 -0.08 0.15 -0.05 0.00 0.00 175.22 174.31 1g7k s LYS 92 N -3.91 2.08 -0.01 1.99 1.02 -1.26 -0.99 119.74 118.65 1g7k s LYS 92 Ca 0.12 -1.40 -0.03 0.00 0.02 0.00 0.00 55.97 54.69 1g7k s LYS 92 Cb -0.01 -2.10 -0.00 0.00 -0.52 0.00 0.00 37.83 35.20 1g7k s LYS 92 CO 0.00 0.39 0.05 1.67 -0.92 0.00 0.00 175.35 176.55 1g7k s TRP 93 N -2.03 0.04 0.13 3.18 1.48 -0.79 -4.48 118.94 116.46 1g7k s TRP 93 Ca 0.28 -0.07 0.05 0.00 -1.06 0.00 0.00 56.10 55.29 1g7k s TRP 93 Cb -0.07 -0.05 -0.04 0.00 -1.16 0.00 0.00 33.47 32.15 1g7k s TRP 93 CO 0.17 -0.12 -0.11 -1.21 -4.06 0.00 0.00 176.95 171.61 1g7k s GLU 94 N -0.63 0.99 -0.10 3.25 2.02 -0.06 -0.22 118.70 123.95 1g7k s GLU 94 Ca -0.07 -1.31 -0.29 0.00 0.02 0.00 0.00 54.97 53.32 1g7k s GLU 94 Cb -0.04 -0.67 0.07 0.00 0.10 0.00 0.00 34.13 33.59 1g7k s GLU 94 CO 0.00 0.10 0.68 0.50 0.02 0.00 0.00 175.26 176.56 1g7k s ARG 95 N -3.19 0.99 0.15 1.61 3.52 0.00 -0.79 118.95 121.24 1g7k s ARG 95 Ca 0.11 0.43 0.00 0.00 -0.13 0.00 0.00 55.73 56.14 1g7k s ARG 95 Cb -0.01 0.47 -0.00 0.00 -1.56 0.00 0.00 34.95 33.85 1g7k s ARG 95 CO 0.01 -0.27 0.00 0.28 -0.81 0.00 0.00 175.30 174.52 1g7k n VAL 96 N 1.37 0.00 -3.24 7.11 0.31 0.27 0.27 118.33 124.42 1g7k n VAL 96 Ca -0.18 -0.70 0.04 0.00 -0.01 0.00 0.00 64.34 63.49 1g7k n VAL 96 Cb 0.56 0.15 -0.02 0.00 -0.91 0.00 0.00 33.84 33.62 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 -1.81 -0.82 0.10 4.52 0.01 0.93 -0.45 114.94 117.41 1g7k s ASN 98 Ca 0.00 0.67 -0.23 0.00 -0.71 0.00 0.00 52.86 52.59 1g7k s ASN 98 Cb 0.00 1.75 -0.07 0.00 0.41 0.00 0.00 41.25 43.34 1g7k s ASN 98 CO 0.00 -0.15 0.71 -0.36 -1.51 0.00 0.00 177.10 175.79 1g7k s PHE 99 N 2.81 3.82 0.62 2.20 0.40 -0.54 -1.08 117.98 126.23 1g7k s PHE 99 Ca 0.05 1.47 0.32 0.00 -0.60 0.00 0.00 56.93 58.17 1g7k s PHE 99 Cb -0.11 -2.70 1.75 0.00 0.51 0.00 0.00 43.02 42.47 1g7k s PHE 99 CO -0.16 0.46 2.07 1.05 0.70 0.00 0.00 175.22 179.34 1g7k h GLU 100 N 4.82 0.00 -0.62 0.44 4.11 -1.57 -0.29 114.58 121.48 1g7k h GLU 100 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1g7k h GLU 100 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1g7k h GLU 100 CO 0.67 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.35 1g7k n ASP 101 N -3.43 5.35 0.00 3.06 3.85 -1.26 -4.94 116.55 119.18 1g7k n ASP 101 Ca 0.01 -2.74 0.00 0.00 -0.71 0.00 0.00 54.79 51.35 1g7k n ASP 101 Cb 0.34 -0.65 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 0.82 2.77 3.74 6.12 0.00 -0.12 -4.69 105.19 113.84 1g7k n GLY 102 Ca 0.27 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 1g7k n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1g7k s GLY 103 N -2.68 2.89 -0.00 -0.02 0.00 -1.10 -4.76 107.32 101.63 1g7k s GLY 103 Ca 0.00 1.32 0.01 0.00 0.00 0.00 0.00 44.72 46.05 1g7k s GLY 103 CO 0.00 1.82 -0.03 0.14 0.00 0.00 0.00 173.10 175.03 1g7k s VAL 104 N -1.32 0.25 -0.03 1.40 1.01 0.71 -1.46 120.40 120.96 1g7k s VAL 104 Ca 0.75 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.61 1g7k s VAL 104 Cb -0.40 -0.22 0.01 0.00 0.00 0.00 0.00 36.38 35.77 1g7k s VAL 104 CO 0.46 0.07 -0.06 -0.69 0.00 0.00 0.00 175.10 174.89 1g7k s VAL 105 N -0.04 0.59 0.05 2.92 1.01 -1.26 -0.21 120.40 123.45 1g7k s VAL 105 Ca 0.01 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 61.85 1g7k s VAL 105 Cb -0.02 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1g7k s VAL 105 CO -0.00 0.21 -0.21 0.42 0.00 0.00 0.00 175.10 175.51 1g7k s THR 106 N 0.47 2.55 0.01 3.92 -4.23 -0.40 -4.14 115.64 113.82 1g7k s THR 106 Ca -0.06 -1.31 0.02 0.00 -1.18 0.00 0.00 61.69 59.15 1g7k s THR 106 Cb -0.10 -2.06 -0.01 0.00 1.34 0.00 0.00 72.50 71.67 1g7k s THR 106 CO 0.00 0.32 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.66 1g7k s VAL 107 N -0.91 0.39 -0.04 2.29 1.01 0.14 -1.97 120.40 121.32 1g7k s VAL 107 Ca 0.14 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1g7k s VAL 107 Cb -0.10 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 35.92 1g7k s VAL 107 CO 0.04 -0.07 -0.04 0.28 0.00 0.00 0.00 175.10 175.32 1g7k s THR 108 N -0.53 0.47 0.05 3.92 -1.32 -0.73 -0.82 115.64 116.68 1g7k s THR 108 Ca -0.02 -0.09 -0.02 0.00 -1.21 0.00 0.00 61.69 60.35 1g7k s THR 108 Cb -0.04 -0.50 -0.03 0.00 -1.51 0.00 0.00 72.50 70.41 1g7k s THR 108 CO -0.00 0.21 -0.01 0.00 -2.21 0.00 0.00 174.62 172.61 1g7k s GLN 109 N 0.89 0.58 -0.07 7.08 1.03 0.70 -0.74 119.66 129.13 1g7k s GLN 109 Ca -0.11 -1.09 0.02 0.00 0.04 0.00 0.00 55.36 54.22 1g7k s GLN 109 Cb -0.14 0.20 0.01 0.00 0.03 0.00 0.00 33.01 33.11 1g7k s GLN 109 CO -0.00 -0.11 -0.13 0.34 -2.54 0.00 0.00 175.29 172.84 1g7k s ASP 110 N -2.66 1.91 -0.16 12.60 2.15 0.27 -1.89 116.67 128.88 1g7k s ASP 110 Ca 0.03 -0.32 0.02 0.00 0.43 0.00 0.00 52.55 52.70 1g7k s ASP 110 Cb 0.05 -0.87 0.02 0.00 -0.30 0.00 0.00 42.92 41.81 1g7k s ASP 110 CO -0.08 0.05 -0.20 -0.44 -0.17 0.00 0.00 175.17 174.32 1g7k s SER 111 N 0.60 3.06 0.35 -0.34 0.01 -0.16 -0.94 113.70 116.28 1g7k s SER 111 Ca -0.15 -0.61 0.04 0.00 1.31 0.00 0.00 55.95 56.54 1g7k s SER 111 Cb -0.16 -1.43 -0.03 0.00 0.21 0.00 0.00 66.02 64.61 1g7k s SER 111 CO 0.04 0.03 0.16 -0.94 0.41 0.00 0.00 173.24 172.94 1g7k s SER 112 N 1.09 2.10 -0.11 2.44 1.04 0.36 -2.07 113.70 118.55 1g7k s SER 112 Ca -0.01 -1.62 0.00 0.00 0.48 0.00 0.00 55.95 54.81 1g7k s SER 112 Cb -0.14 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.43 1g7k s SER 112 CO -0.08 -0.91 -0.10 -0.22 0.98 0.00 0.00 173.24 172.92 1g7k s LEU 113 N -3.47 1.38 -0.23 2.42 2.96 -1.25 0.51 118.68 121.00 1g7k s LEU 113 Ca 0.32 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 1g7k s LEU 113 Cb 0.04 -0.90 0.06 0.00 0.50 0.00 0.00 46.19 45.89 1g7k s LEU 113 CO 0.17 -0.07 -0.05 -1.58 -1.32 0.00 0.00 176.35 173.50 1g7k s GLN 114 N 1.43 1.57 -1.35 1.98 0.74 0.12 -4.81 119.66 119.35 1g7k s GLN 114 Ca 0.00 -0.94 -0.05 0.00 0.05 0.00 0.00 55.36 54.43 1g7k s GLN 114 Cb -0.13 -2.54 0.00 0.00 1.10 0.00 0.00 33.01 31.44 1g7k s GLN 114 CO -0.06 -0.59 0.50 -0.25 -0.55 0.00 0.00 175.29 174.34 1g7k n ASP 115 N 4.70 -1.38 0.00 6.67 8.00 -1.26 -1.10 116.55 132.18 1g7k n ASP 115 Ca -0.12 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.36 1g7k n ASP 115 Cb 0.44 -3.06 0.00 0.00 -0.02 0.00 0.00 41.12 38.48 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 -1.93 1.58 3.28 0.44 0.00 -1.26 -5.00 105.19 102.29 1g7k n GLY 116 Ca -0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 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 0.44 3.65 -0.20 0.00 2.99 -1.00 0.14 117.98 124.00 1g7k s PHE 118 Ca -0.13 1.74 0.01 0.00 0.00 0.00 0.00 56.93 58.54 1g7k s PHE 118 Cb -0.17 -3.22 0.02 0.00 0.00 0.00 0.00 43.02 39.65 1g7k s PHE 118 CO 0.06 -0.36 -0.17 0.42 -0.00 0.00 0.00 175.22 175.17 1g7k s ILE 119 N -1.18 2.23 -0.13 0.64 -1.09 0.18 -0.80 121.20 121.06 1g7k s ILE 119 Ca 0.44 -0.99 -0.01 0.00 -2.23 0.00 0.00 60.65 57.85 1g7k s ILE 119 Cb -0.31 -2.00 -0.02 0.00 -1.58 0.00 0.00 42.46 38.55 1g7k s ILE 119 CO 0.39 0.44 -0.07 -0.31 -1.23 0.00 0.00 174.94 174.16 1g7k s TYR 120 N 1.28 2.94 -0.12 3.97 2.02 0.87 -0.49 117.35 127.82 1g7k s TYR 120 Ca 0.03 -0.31 0.00 0.00 -0.37 0.00 0.00 57.07 56.42 1g7k s TYR 120 Cb -0.14 -1.86 0.02 0.00 -0.40 0.00 0.00 41.96 39.58 1g7k s TYR 120 CO -0.11 0.01 -0.10 0.15 -1.57 0.00 0.00 175.55 173.93 1g7k s LYS 121 N 0.06 1.78 -0.02 -0.62 1.02 -0.12 -2.24 119.74 119.60 1g7k s LYS 121 Ca -0.02 -0.36 0.07 0.00 0.02 0.00 0.00 55.97 55.68 1g7k s LYS 121 Cb -0.14 -1.73 -0.02 0.00 -0.52 0.00 0.00 37.83 35.43 1g7k s LYS 121 CO 0.03 -0.23 -0.22 0.08 -0.92 0.00 0.00 175.35 174.09 1g7k s VAL 122 N 1.54 1.75 -0.07 3.17 1.01 0.38 -0.57 120.40 127.63 1g7k s VAL 122 Ca 0.03 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.12 1g7k s VAL 122 Cb -0.13 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 1g7k s VAL 122 CO -0.08 0.50 -0.24 -0.54 0.00 0.00 0.00 175.10 174.74 1g7k s LYS 123 N -0.45 2.56 -0.03 2.72 1.02 0.08 -1.48 119.74 124.16 1g7k s LYS 123 Ca 0.07 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.21 1g7k s LYS 123 Cb -0.09 -2.10 0.03 0.00 -0.52 0.00 0.00 37.83 35.14 1g7k s LYS 123 CO -0.00 0.31 -0.00 0.12 -0.92 0.00 0.00 175.35 174.85 1g7k s PHE 124 N 0.01 0.35 -0.11 3.18 5.36 -0.32 -1.77 117.98 124.69 1g7k s PHE 124 Ca -0.08 -0.02 -0.01 0.00 -0.96 0.00 0.00 56.93 55.87 1g7k s PHE 124 Cb -0.15 -0.44 0.03 0.00 -0.34 0.00 0.00 43.02 42.12 1g7k s PHE 124 CO 0.05 -0.14 -0.07 0.42 -1.46 0.00 0.00 175.22 174.02 1g7k s ILE 125 N 1.06 0.95 -0.08 3.12 1.01 -0.83 -1.52 121.20 124.91 1g7k s ILE 125 Ca -0.09 -0.24 0.04 0.00 0.00 0.00 0.00 60.65 60.35 1g7k s ILE 125 Cb -0.14 -0.99 0.00 0.00 0.01 0.00 0.00 42.46 41.35 1g7k s ILE 125 CO -0.02 0.36 -0.21 -0.83 0.00 0.00 0.00 174.94 174.24 1g7k s GLY 126 N 1.73 1.18 0.20 6.18 0.00 0.28 -1.28 107.32 115.62 1g7k s GLY 126 Ca 0.05 -0.84 -0.01 0.00 0.00 0.00 0.00 44.72 43.92 1g7k s GLY 126 CO -0.08 -0.29 0.12 -1.34 0.00 0.00 0.00 173.10 171.51 1g7k s VAL 127 N 0.30 0.09 -1.54 1.40 -7.23 0.70 -0.95 120.40 113.18 1g7k s VAL 127 Ca -0.14 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.03 1g7k s VAL 127 Cb -0.16 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.30 1g7k s VAL 127 CO 0.07 -0.05 0.00 -3.20 -0.31 0.00 0.00 175.10 171.61 1g7k n ASN 128 N -0.28 -5.17 -4.72 4.85 5.15 -1.26 -0.21 115.26 113.62 1g7k n ASN 128 Ca 0.01 0.02 -0.40 0.00 -0.60 0.00 0.00 54.58 53.61 1g7k n ASN 128 Cb 0.66 -4.24 -0.05 0.00 -0.53 0.00 0.00 39.78 35.62 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 -2.86 3.59 0.22 1.20 0.40 -1.26 -2.72 117.98 116.54 1g7k s PHE 129 Ca 0.00 1.23 -0.32 0.00 -0.60 0.00 0.00 56.93 57.25 1g7k s PHE 129 Cb 0.00 -2.78 -0.12 0.00 0.51 0.00 0.00 43.02 40.64 1g7k s PHE 129 CO 0.00 0.12 1.67 -2.14 0.70 0.00 0.00 175.22 175.57 1g7k s PRO 130 N 0.69 4.14 0.57 0.24 0.02 -1.26 -4.87 135.00 134.53 1g7k s PRO 130 Ca 0.36 2.56 0.27 0.00 0.02 0.00 0.00 61.00 64.22 1g7k s PRO 130 Cb -0.18 -3.08 1.54 0.00 0.02 0.00 0.00 34.50 32.81 1g7k s PRO 130 CO 0.18 -0.71 2.06 0.66 -0.33 0.00 0.00 177.00 178.86 1g7k h SER 131 N 6.45 0.00 -0.63 2.53 4.64 -2.01 -0.41 113.55 124.11 1g7k h SER 131 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1g7k h SER 131 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1g7k h SER 131 CO 0.92 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.98 1g7k n ASP 132 N -3.98 3.74 -4.71 4.97 5.68 -1.26 -4.41 116.55 116.58 1g7k n ASP 132 Ca 0.04 -2.03 -0.26 0.00 -0.50 0.00 0.00 54.79 52.04 1g7k n ASP 132 Cb 0.41 -0.43 0.10 0.00 -1.14 0.00 0.00 41.12 40.06 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 -1.00 1.72 0.54 6.12 0.00 -0.17 -4.83 107.32 109.70 1g7k s GLY 133 Ca 0.43 -1.13 0.25 0.00 0.00 0.00 0.00 44.72 44.27 1g7k s GLY 133 CO 0.28 -0.61 2.03 -0.56 0.00 0.00 0.00 173.10 174.25 1g7k h PRO 134 N -0.83 0.00 -0.26 2.90 0.13 -1.94 0.39 132.00 132.39 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 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1g7k h PRO 134 CO 0.52 0.00 0.00 0.28 -0.23 0.00 0.00 178.00 178.57 1g7k n VAL 135 N -4.26 0.00 0.00 1.56 0.31 -1.26 -0.78 118.33 113.89 1g7k n VAL 135 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1g7k n VAL 135 Cb 0.48 -0.19 0.00 0.00 -0.91 0.00 0.00 33.84 33.21 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 -0.31 0.00 -3.66 5.55 1.13 0.13 -0.51 117.38 119.70 1g7k n GLN 137 Ca 0.00 0.00 -0.23 0.00 -1.94 0.00 0.00 57.00 54.83 1g7k n GLN 137 Cb 0.06 0.00 0.04 0.00 0.11 0.00 0.00 30.24 30.45 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 -3.71 -0.31 -1.09 5.02 -0.78 -4.90 118.16 112.40 1g7k n LYS 138 Ca 0.00 0.60 0.10 0.00 -2.02 0.00 0.00 58.31 56.99 1g7k n LYS 138 Cb 0.00 -4.99 0.27 0.00 -0.02 0.00 0.00 35.03 30.29 1g7k n LYS 138 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1g7k n LYS 139 N -4.14 2.74 0.00 1.97 5.02 0.04 -4.98 118.16 118.81 1g7k n LYS 139 Ca -0.23 -2.47 0.00 0.00 -2.02 0.00 0.00 58.31 53.59 1g7k n LYS 139 Cb 0.65 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 1g7k n LYS 139 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1g7k n THR 140 N 1.32 0.00 -0.96 -0.18 -2.24 -1.26 -0.02 114.28 110.95 1g7k n THR 140 Ca 0.21 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.63 1g7k n THR 140 Cb 0.57 -1.30 0.06 0.00 -2.10 0.00 0.00 70.33 67.55 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 -3.77 3.89 3.38 0.00 -1.26 -4.77 105.19 107.66 1g7k n GLY 142 Ca 0.00 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.11 3.47 0.62 1.61 0.52 -1.26 -1.43 118.94 120.36 1g7k s TRP 143 Ca 0.46 0.75 -0.11 0.00 0.02 0.00 0.00 56.10 57.23 1g7k s TRP 143 Cb -0.21 -2.19 -0.04 0.00 -1.15 0.00 0.00 33.47 29.88 1g7k s TRP 143 CO 0.77 0.13 1.02 -1.21 0.02 0.00 0.00 176.95 177.69 1g7k s GLU 144 N -3.50 3.58 0.71 4.98 0.41 -0.64 -4.84 118.70 119.41 1g7k s GLU 144 Ca 0.46 0.72 -0.15 0.00 -0.41 0.00 0.00 54.97 55.59 1g7k s GLU 144 Cb -0.11 -2.09 0.03 0.00 -1.78 0.00 0.00 34.13 30.18 1g7k s GLU 144 CO 0.29 -0.57 1.21 0.00 -0.49 0.00 0.00 175.26 175.70 1g7k s ALA 145 N -3.17 2.19 0.32 5.21 0.00 -1.26 -4.79 121.76 120.26 1g7k s ALA 145 Ca 0.55 0.89 0.04 0.00 0.00 0.00 0.00 51.96 53.44 1g7k s ALA 145 Cb -0.11 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 1g7k s ALA 145 CO 0.54 -1.77 0.19 -1.54 0.00 0.00 0.00 175.76 173.18 1g7k s SER 146 N -2.00 1.72 -0.12 0.00 1.04 0.16 -4.96 113.70 109.54 1g7k s SER 146 Ca 0.75 -1.63 -0.04 0.00 0.48 0.00 0.00 55.95 55.51 1g7k s SER 146 Cb -0.29 0.46 0.06 0.00 0.10 0.00 0.00 66.02 66.34 1g7k s SER 146 CO 0.44 -0.94 0.14 -0.89 0.98 0.00 0.00 173.24 172.96 1g7k s THR 147 N -3.52 -0.21 -0.03 2.02 2.01 -1.26 -1.33 115.64 113.32 1g7k s THR 147 Ca 0.35 0.14 -0.14 0.00 0.31 0.00 0.00 61.69 62.35 1g7k s THR 147 Cb 0.04 -0.42 -0.05 0.00 0.01 0.00 0.00 72.50 72.07 1g7k s THR 147 CO 0.20 -0.03 0.37 -0.70 -0.69 0.00 0.00 174.62 173.76 1g7k s GLU 148 N 2.24 3.89 -0.32 4.92 2.12 0.06 -4.49 118.70 127.12 1g7k s GLU 148 Ca 0.04 0.31 -0.12 0.00 0.36 0.00 0.00 54.97 55.57 1g7k s GLU 148 Cb -0.14 -3.24 -0.02 0.00 0.26 0.00 0.00 34.13 30.99 1g7k s GLU 148 CO -0.07 0.65 0.21 0.50 -0.54 0.00 0.00 175.26 176.01 1g7k s ARG 149 N -0.88 3.53 0.18 4.30 3.00 0.36 -1.59 118.95 127.86 1g7k s ARG 149 Ca 0.22 -0.61 0.08 0.00 -1.00 0.00 0.00 55.73 54.43 1g7k s ARG 149 Cb -0.16 -3.73 -0.04 0.00 0.00 0.00 0.00 34.95 31.02 1g7k s ARG 149 CO 0.11 -0.40 -0.07 -0.51 0.00 0.00 0.00 175.30 174.43 1g7k s LEU 150 N 1.71 3.06 -0.07 -0.88 1.02 0.10 -0.76 118.68 122.86 1g7k s LEU 150 Ca 0.06 -0.52 -0.30 0.00 0.02 0.00 0.00 54.13 53.39 1g7k s LEU 150 Cb -0.17 -1.74 0.10 0.00 0.02 0.00 0.00 46.19 44.40 1g7k s LEU 150 CO 0.10 0.10 0.87 -0.72 0.02 0.00 0.00 176.35 176.72 1g7k s TYR 151 N -1.69 -0.45 0.30 0.29 -0.85 -0.29 -1.16 117.35 113.50 1g7k s TYR 151 Ca 0.25 0.63 -0.27 0.00 -0.52 0.00 0.00 57.07 57.16 1g7k s TYR 151 Cb -0.09 0.47 -0.09 0.00 0.38 0.00 0.00 41.96 42.62 1g7k s TYR 151 CO 0.16 -0.49 0.97 -1.25 -1.52 0.00 0.00 175.55 173.42 1g7k s PRO 152 N -1.79 4.63 -0.28 -3.49 0.04 -1.26 -1.27 135.00 131.57 1g7k s PRO 152 Ca -0.02 1.44 -0.19 0.00 0.04 0.00 0.00 61.00 62.28 1g7k s PRO 152 Cb -0.01 -2.96 0.11 0.00 0.04 0.00 0.00 34.50 31.69 1g7k s PRO 152 CO 0.00 0.30 0.87 0.50 0.04 0.00 0.00 177.00 178.71 1g7k s ARG 153 N -1.78 0.55 -1.58 4.56 6.06 0.12 -4.92 118.95 121.96 1g7k s ARG 153 Ca 0.48 0.86 -0.03 0.00 -2.50 0.00 0.00 55.73 54.53 1g7k s ARG 153 Cb -0.23 0.16 0.01 0.00 0.06 0.00 0.00 34.95 34.95 1g7k s ARG 153 CO 0.28 -0.10 0.36 -3.47 -2.50 0.00 0.00 175.30 169.88 1g7k n ASP 154 N 3.52 -5.75 0.00 -2.12 2.03 -1.26 -1.46 116.55 111.51 1g7k n ASP 154 Ca -0.17 -0.17 0.00 0.00 0.52 0.00 0.00 54.79 54.96 1g7k n ASP 154 Cb 0.57 -4.71 0.00 0.00 -0.72 0.00 0.00 41.12 36.26 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 -1.29 0.73 3.23 0.27 0.00 -1.26 -4.98 105.19 101.89 1g7k n GLY 155 Ca -0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1g7k n GLY 155 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1g7k n VAL 156 N -2.23 0.00 -4.11 1.61 0.24 -0.54 -4.95 118.33 108.35 1g7k n VAL 156 Ca 0.00 -2.27 -0.34 0.00 -2.04 0.00 0.00 64.34 59.69 1g7k n VAL 156 Cb 0.02 0.76 -0.10 0.00 -1.47 0.00 0.00 33.84 33.05 1g7k n VAL 156 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1g7k s LEU 157 N 0.00 3.71 0.13 1.34 2.96 -0.84 -0.70 118.68 125.28 1g7k s LEU 157 Ca 0.17 0.07 0.08 0.00 -0.22 0.00 0.00 54.13 54.23 1g7k s LEU 157 Cb 0.01 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 1g7k s LEU 157 CO 0.12 0.21 -0.19 -0.54 -1.32 0.00 0.00 176.35 174.62 1g7k s LYS 158 N 0.17 1.18 -0.02 1.98 1.02 -0.40 -0.16 119.74 123.51 1g7k s LYS 158 Ca 0.03 -1.28 -0.20 0.00 0.02 0.00 0.00 55.97 54.54 1g7k s LYS 158 Cb -0.13 -1.32 0.04 0.00 -0.52 0.00 0.00 37.83 35.90 1g7k s LYS 158 CO 0.01 0.28 0.43 0.20 -0.92 0.00 0.00 175.35 175.35 1g7k s GLY 159 N -2.31 -0.29 0.06 -3.33 0.00 -0.64 -1.14 107.32 99.67 1g7k s GLY 159 Ca 0.11 0.61 0.04 0.00 0.00 0.00 0.00 44.72 45.48 1g7k s GLY 159 CO 0.05 0.36 -0.11 -0.54 0.00 0.00 0.00 173.10 172.86 1g7k s GLU 160 N -1.40 0.67 -0.02 2.90 8.01 0.06 -0.51 118.70 128.41 1g7k s GLU 160 Ca -0.12 -0.86 -0.06 0.00 0.01 0.00 0.00 54.97 53.94 1g7k s GLU 160 Cb -0.03 -0.53 0.00 0.00 -4.31 0.00 0.00 34.13 29.26 1g7k s GLU 160 CO 0.05 0.11 0.12 0.42 0.01 0.00 0.00 175.26 175.98 1g7k s ILE 161 N -1.39 0.05 -0.46 -1.63 1.01 -0.42 -0.49 121.20 117.87 1g7k s ILE 161 Ca -0.06 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.08 1g7k s ILE 161 Cb -0.10 -0.32 0.11 0.00 0.01 0.00 0.00 42.46 42.16 1g7k s ILE 161 CO 0.01 -0.23 0.33 -1.00 0.00 0.00 0.00 174.94 174.06 1g7k s HIS 162 N -0.77 3.38 0.50 3.97 3.76 -1.26 -0.69 115.29 124.18 1g7k s HIS 162 Ca -0.09 -1.69 0.08 0.00 -0.15 0.00 0.00 55.06 53.21 1g7k s HIS 162 Cb -0.05 -3.35 0.04 0.00 1.11 0.00 0.00 32.58 30.33 1g7k s HIS 162 CO 0.01 -0.95 0.59 0.15 -0.85 0.00 0.00 174.74 173.69 1g7k s LYS 163 N 1.41 2.48 -0.24 1.40 1.02 0.82 -4.80 119.74 121.82 1g7k s LYS 163 Ca 0.05 -1.58 -0.21 0.00 0.02 0.00 0.00 55.97 54.24 1g7k s LYS 163 Cb -0.25 -2.53 0.06 0.00 -0.52 0.00 0.00 37.83 34.59 1g7k s LYS 163 CO 0.01 -0.54 0.64 0.00 -0.92 0.00 0.00 175.35 174.54 1g7k s ALA 164 N -2.56 -1.61 -0.14 5.17 0.00 -1.26 -1.87 121.76 119.48 1g7k s ALA 164 Ca 0.53 1.87 -0.05 0.00 0.00 0.00 0.00 51.96 54.31 1g7k s ALA 164 Cb -0.06 -1.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 1g7k s ALA 164 CO 0.32 -0.31 0.05 -0.51 0.00 0.00 0.00 175.76 175.31 1g7k s LEU 165 N 0.51 3.79 0.19 0.00 1.43 0.38 -1.61 118.68 123.36 1g7k s LEU 165 Ca -0.01 0.14 -0.30 0.00 -1.03 0.00 0.00 54.13 52.93 1g7k s LEU 165 Cb -0.05 -1.92 -0.08 0.00 0.03 0.00 0.00 46.19 44.17 1g7k s LEU 165 CO -0.02 0.27 1.18 -0.54 0.23 0.00 0.00 176.35 177.48 1g7k s LYS 166 N -0.22 4.50 -0.04 1.70 1.02 -0.51 -0.05 119.74 126.14 1g7k s LYS 166 Ca 0.07 1.86 -0.13 0.00 0.02 0.00 0.00 55.97 57.79 1g7k s LYS 166 Cb -0.12 -3.24 -0.05 0.00 -0.52 0.00 0.00 37.83 33.89 1g7k s LYS 166 CO 0.02 -0.07 0.35 -0.51 -0.92 0.00 0.00 175.35 174.22 1g7k s LEU 167 N -0.27 4.44 0.17 3.17 2.01 -0.55 -4.42 118.68 123.22 1g7k s LEU 167 Ca 0.52 0.84 -0.14 0.00 0.01 0.00 0.00 54.13 55.36 1g7k s LEU 167 Cb -0.32 -2.48 0.13 0.00 0.01 0.00 0.00 46.19 43.53 1g7k s LEU 167 CO 0.37 0.31 1.76 0.11 1.01 0.00 0.00 176.35 179.90 1g7k h LYS 168 N 4.98 0.35 -0.10 1.70 1.57 -0.74 0.29 116.57 124.62 1g7k h LYS 168 Ca -0.51 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1g7k h LYS 168 Cb 1.22 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1g7k h LYS 168 CO 0.62 0.23 0.00 -0.25 -0.57 0.00 0.00 179.45 179.49 1g7k n ASP 169 N -4.98 0.10 0.00 0.86 8.00 -1.26 -4.95 116.55 114.32 1g7k n ASP 169 Ca 0.04 -1.58 0.00 0.00 0.71 0.00 0.00 54.79 53.95 1g7k n ASP 169 Cb 0.16 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 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 0.27 -0.63 1.94 0.44 0.00 0.10 -5.10 105.19 102.20 1g7k n GLY 170 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.44 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 -0.22 -1.79 3.14 -0.02 0.00 -1.26 -4.50 105.19 100.54 1g7k n GLY 171 Ca 0.00 -1.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.02 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 0.00 0.87 -0.25 1.61 3.76 -1.26 -1.49 115.29 118.53 1g7k s HIS 172 Ca 0.00 -0.71 0.02 0.00 -0.15 0.00 0.00 55.06 54.22 1g7k s HIS 172 Cb 0.00 -0.50 0.05 0.00 1.11 0.00 0.00 32.58 33.24 1g7k s HIS 172 CO 0.00 -0.09 -0.11 -0.47 -0.85 0.00 0.00 174.74 173.22 1g7k s TYR 173 N -2.58 3.21 0.20 1.40 5.04 0.93 -4.89 117.35 120.65 1g7k s TYR 173 Ca 0.03 -2.21 -0.30 0.00 -2.44 0.00 0.00 57.07 52.15 1g7k s TYR 173 Cb -0.02 -1.94 -0.08 0.00 0.35 0.00 0.00 41.96 40.27 1g7k s TYR 173 CO -0.02 -0.86 0.96 -0.51 -1.34 0.00 0.00 175.55 173.78 1g7k s LEU 174 N 1.14 4.59 -0.03 6.97 1.43 -1.26 -0.47 118.68 131.05 1g7k s LEU 174 Ca -0.07 1.91 -0.01 0.00 -1.03 0.00 0.00 54.13 54.93 1g7k s LEU 174 Cb -0.19 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.45 1g7k s LEU 174 CO -0.06 0.06 0.07 -0.69 0.23 0.00 0.00 176.35 175.96 1g7k s VAL 175 N -0.75 -0.04 -0.20 -1.59 1.01 -0.78 -1.48 120.40 116.58 1g7k s VAL 175 Ca 0.43 0.14 -0.07 0.00 0.00 0.00 0.00 61.98 62.48 1g7k s VAL 175 Cb -0.25 -0.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 1g7k s VAL 175 CO 0.32 0.06 0.05 -0.70 0.00 0.00 0.00 175.10 174.83 1g7k s GLU 176 N 0.76 3.86 -0.10 2.72 2.12 -0.24 -0.13 118.70 127.70 1g7k s GLU 176 Ca -0.06 -0.40 -0.03 0.00 0.36 0.00 0.00 54.97 54.84 1g7k s GLU 176 Cb -0.08 -3.21 -0.03 0.00 0.26 0.00 0.00 34.13 31.06 1g7k s GLU 176 CO -0.03 0.15 0.02 -0.06 -0.54 0.00 0.00 175.26 174.81 1g7k s PHE 177 N 0.69 3.22 -0.16 5.30 0.40 0.13 -0.05 117.98 127.52 1g7k s PHE 177 Ca 0.03 0.22 -0.01 0.00 -0.60 0.00 0.00 56.93 56.57 1g7k s PHE 177 Cb -0.13 -1.83 0.05 0.00 0.51 0.00 0.00 43.02 41.62 1g7k s PHE 177 CO 0.02 0.48 -0.01 0.15 0.70 0.00 0.00 175.22 176.56 1g7k s LYS 178 N -0.82 1.02 0.16 0.44 1.02 0.40 -1.30 119.74 120.65 1g7k s LYS 178 Ca 0.13 -0.40 0.11 0.00 0.02 0.00 0.00 55.97 55.83 1g7k s LYS 178 Cb -0.12 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.26 1g7k s LYS 178 CO 0.02 -0.49 -0.23 -1.12 -0.92 0.00 0.00 175.35 172.61 1g7k s SER 179 N 1.76 3.52 -0.08 2.83 0.01 0.34 -0.56 113.70 121.52 1g7k s SER 179 Ca 0.00 -0.77 0.00 0.00 1.31 0.00 0.00 55.95 56.50 1g7k s SER 179 Cb -0.16 -0.32 0.02 0.00 0.21 0.00 0.00 66.02 65.78 1g7k s SER 179 CO -0.07 0.15 -0.06 -0.63 0.41 0.00 0.00 173.24 173.03 1g7k s ILE 180 N -1.41 0.79 0.47 1.44 1.09 0.03 -1.63 121.20 121.97 1g7k s ILE 180 Ca 0.19 -0.19 0.06 0.00 -1.10 0.00 0.00 60.65 59.61 1g7k s ILE 180 Cb -0.09 -0.82 -0.02 0.00 -1.06 0.00 0.00 42.46 40.47 1g7k s ILE 180 CO 0.09 0.31 0.24 -0.31 -0.10 0.00 0.00 174.94 175.17 1g7k s TYR 181 N 1.42 2.21 -0.11 3.97 1.51 0.77 -0.89 117.35 126.23 1g7k s TYR 181 Ca -0.02 -0.71 -0.10 0.00 -1.01 0.00 0.00 57.07 55.23 1g7k s TYR 181 Cb -0.13 -1.91 0.03 0.00 -0.11 0.00 0.00 41.96 39.83 1g7k s TYR 181 CO -0.04 -0.03 0.30 0.00 -1.11 0.00 0.00 175.55 174.67 1g7k s ALA 183 N -2.68 -0.74 0.20 3.71 0.00 -1.26 -1.99 121.76 118.99 1g7k s ALA 183 Ca 0.34 0.85 0.33 0.00 0.00 0.00 0.00 51.96 53.48 1g7k s ALA 183 Cb 0.01 -0.49 1.43 0.00 0.00 0.00 0.00 23.12 24.07 1g7k s ALA 183 CO 0.20 -0.14 2.01 0.87 0.00 0.00 0.00 175.76 178.70 1g7k h LYS 184 N 5.68 0.00 -4.59 0.00 1.57 -1.40 -3.41 116.57 114.41 1g7k h LYS 184 Ca -0.26 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.07 1g7k h LYS 184 Cb 1.19 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 33.18 1g7k h LYS 184 CO 0.32 0.04 -0.79 -1.59 -0.57 0.00 0.00 179.45 176.86 1g7k s LYS 185 N -3.76 1.09 -0.88 3.15 -2.85 -1.26 -5.06 119.74 110.17 1g7k s LYS 185 Ca 0.00 -0.32 -0.27 0.00 -1.00 0.00 0.00 55.97 54.38 1g7k s LYS 185 Cb 0.10 -1.00 -0.24 0.00 -2.06 0.00 0.00 37.83 34.63 1g7k s LYS 185 CO 0.55 0.10 1.98 -0.35 0.10 0.00 0.00 175.35 177.72 1g7k n PRO 186 N 3.40 0.39 -2.47 1.78 -0.04 -1.26 -4.87 135.00 131.93 1g7k n PRO 186 Ca -0.19 -1.71 -0.24 0.00 -0.04 0.00 0.00 63.50 61.32 1g7k n PRO 186 Cb 0.54 -3.60 0.11 0.00 -0.04 0.00 0.00 33.50 30.51 1g7k n PRO 186 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1g7k s VAL 187 N 13.90 2.18 0.14 0.52 -7.23 -1.26 -5.00 120.40 123.64 1g7k s VAL 187 Ca 0.76 -0.49 -0.31 0.00 -1.81 0.00 0.00 61.98 60.12 1g7k s VAL 187 Cb 0.00 -2.68 -0.11 0.00 0.56 0.00 0.00 36.38 34.15 1g7k s VAL 187 CO 0.21 0.00 1.83 1.67 -0.31 0.00 0.00 175.10 178.50 1g7k n GLN 188 N -2.92 2.80 -3.59 4.82 7.27 -1.26 -5.00 117.38 119.50 1g7k n GLN 188 Ca 0.14 1.02 -0.30 0.00 0.07 0.00 0.00 57.00 57.93 1g7k n GLN 188 Cb 0.60 -2.91 -0.04 0.00 2.41 0.00 0.00 30.24 30.30 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 2.54 4.21 0.75 1.69 1.43 -1.26 -4.11 118.68 123.93 1g7k s LEU 189 Ca 0.81 0.60 -0.04 0.00 -1.03 0.00 0.00 54.13 54.47 1g7k s LEU 189 Cb -0.48 -3.36 0.12 0.00 0.03 0.00 0.00 46.19 42.51 1g7k s LEU 189 CO 0.37 -0.02 1.04 -2.16 0.23 0.00 0.00 176.35 175.80 1g7k s PRO 190 N -2.98 1.63 0.00 1.29 0.04 -1.26 -4.83 135.00 128.89 1g7k s PRO 190 Ca 0.42 -0.82 0.00 0.00 0.04 0.00 0.00 61.00 60.63 1g7k s PRO 190 Cb -0.12 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1g7k s PRO 190 CO 0.26 -1.54 0.00 0.41 0.04 0.00 0.00 177.00 176.17 1g7k n GLY 191 N -2.98 1.77 3.74 0.56 0.00 -1.26 -4.21 105.19 102.80 1g7k n GLY 191 Ca 0.13 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 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 2.56 3.07 0.24 1.61 5.04 -1.26 -4.43 117.35 124.19 1g7k s TYR 192 Ca 0.00 0.95 -0.21 0.00 -2.44 0.00 0.00 57.07 55.38 1g7k s TYR 192 Cb 0.00 -3.81 0.07 0.00 0.35 0.00 0.00 41.96 38.57 1g7k s TYR 192 CO 0.00 -2.72 0.95 1.52 -1.34 0.00 0.00 175.55 173.96 1g7k s TYR 193 N 0.36 0.05 0.16 4.97 -0.85 -0.31 -4.91 117.35 116.82 1g7k s TYR 193 Ca 0.62 -0.52 0.09 0.00 -0.52 0.00 0.00 57.07 56.73 1g7k s TYR 193 Cb -0.41 0.73 -0.04 0.00 0.38 0.00 0.00 41.96 42.62 1g7k s TYR 193 CO 0.39 -1.10 -0.18 0.71 -1.52 0.00 0.00 175.55 173.84 1g7k s TYR 194 N -2.40 1.83 -0.09 -3.49 1.51 -0.45 0.03 117.35 114.29 1g7k s TYR 194 Ca 0.19 -0.47 -0.01 0.00 -1.01 0.00 0.00 57.07 55.77 1g7k s TYR 194 Cb -0.03 -0.91 0.03 0.00 -0.11 0.00 0.00 41.96 40.93 1g7k s TYR 194 CO 0.07 0.33 -0.04 0.14 -1.11 0.00 0.00 175.55 174.94 1g7k s VAL 195 N -2.03 0.71 0.02 0.71 -7.23 -0.62 -0.18 120.40 111.78 1g7k s VAL 195 Ca 0.16 -0.10 -0.17 0.00 -1.81 0.00 0.00 61.98 60.06 1g7k s VAL 195 Cb -0.06 -0.79 -0.06 0.00 0.56 0.00 0.00 36.38 36.03 1g7k s VAL 195 CO 0.07 0.31 0.48 -1.81 -0.31 0.00 0.00 175.10 173.84 1g7k s ASP 196 N 1.78 6.90 0.03 4.85 1.01 -0.48 -0.76 116.67 130.01 1g7k s ASP 196 Ca 0.04 1.07 -0.03 0.00 0.71 0.00 0.00 52.55 54.34 1g7k s ASP 196 Cb -0.13 -2.30 -0.02 0.00 1.01 0.00 0.00 42.92 41.49 1g7k s ASP 196 CO -0.06 0.27 0.03 -0.44 0.21 0.00 0.00 175.17 175.17 1g7k s SER 197 N -0.90 0.27 -0.27 0.27 0.01 -0.44 -1.60 113.70 111.04 1g7k s SER 197 Ca 0.26 -0.62 -0.00 0.00 1.31 0.00 0.00 55.95 56.89 1g7k s SER 197 Cb -0.18 0.18 0.15 0.00 0.21 0.00 0.00 66.02 66.38 1g7k s SER 197 CO 0.15 -0.46 0.41 -0.75 0.41 0.00 0.00 173.24 173.01 1g7k s LYS 198 N -2.50 0.40 -0.22 12.44 2.20 -0.26 -0.66 119.74 131.14 1g7k s LYS 198 Ca -0.06 0.41 -0.07 0.00 -0.36 0.00 0.00 55.97 55.89 1g7k s LYS 198 Cb -0.02 -0.31 -0.03 0.00 -1.51 0.00 0.00 37.83 35.96 1g7k s LYS 198 CO -0.04 -0.81 0.05 -1.17 -0.36 0.00 0.00 175.35 173.02 1g7k s LEU 199 N 2.58 3.52 0.02 5.43 0.20 -1.26 -1.77 118.68 127.39 1g7k s LEU 199 Ca 0.12 -0.11 0.07 0.00 0.69 0.00 0.00 54.13 54.90 1g7k s LEU 199 Cb -0.14 -1.91 -0.02 0.00 -0.43 0.00 0.00 46.19 43.68 1g7k s LEU 199 CO -0.22 0.06 -0.22 -1.81 -0.29 0.00 0.00 176.35 173.86 1g7k s ASP 200 N 1.07 2.60 -0.45 3.68 1.01 -0.09 -4.49 116.67 120.01 1g7k s ASP 200 Ca 0.04 -0.47 -0.26 0.00 0.71 0.00 0.00 52.55 52.56 1g7k s ASP 200 Cb -0.14 -0.25 0.03 0.00 1.01 0.00 0.00 42.92 43.56 1g7k s ASP 200 CO 0.03 0.22 0.95 -0.63 0.21 0.00 0.00 175.17 175.95 1g7k s ILE 201 N -0.67 4.46 -0.10 0.77 -1.09 -1.26 -0.87 121.20 122.43 1g7k s ILE 201 Ca 0.08 0.89 0.14 0.00 -2.23 0.00 0.00 60.65 59.54 1g7k s ILE 201 Cb -0.09 -4.44 -0.06 0.00 -1.58 0.00 0.00 42.46 36.29 1g7k s ILE 201 CO 0.01 -0.80 1.15 0.71 -1.23 0.00 0.00 174.94 174.78 1g7k h THR 202 N 6.05 0.85 -2.37 2.92 1.35 -1.48 -3.48 112.91 116.74 1g7k h THR 202 Ca -0.24 -2.33 -0.03 0.00 -0.55 0.00 0.00 66.41 63.27 1g7k h THR 202 Cb 1.07 2.34 -0.16 0.00 -1.73 0.00 0.00 68.15 69.67 1g7k h THR 202 CO 1.03 0.48 0.23 -0.94 -0.25 0.00 0.00 175.52 176.07 1g7k s SER 203 N -6.23 -0.60 -0.19 5.36 1.04 -1.18 -4.99 113.70 106.92 1g7k s SER 203 Ca 0.01 0.39 -0.29 0.00 0.48 0.00 0.00 55.95 56.54 1g7k s SER 203 Cb 0.08 0.54 0.13 0.00 0.10 0.00 0.00 66.02 66.88 1g7k s SER 203 CO 0.78 -0.73 1.02 -1.38 0.98 0.00 0.00 173.24 173.91 1g7k s HIS 204 N -2.26 -0.37 0.77 5.02 -0.00 -1.26 -1.23 115.29 115.96 1g7k s HIS 204 Ca -0.05 0.69 -0.08 0.00 -0.00 0.00 0.00 55.06 55.61 1g7k s HIS 204 Cb -0.00 0.44 0.10 0.00 -0.00 0.00 0.00 32.58 33.11 1g7k s HIS 204 CO -0.00 -0.31 1.09 0.54 -0.00 0.00 0.00 174.74 176.06 1g7k s ASN 205 N -0.87 4.39 0.22 7.38 2.20 -0.84 -4.94 114.94 122.47 1g7k s ASN 205 Ca -0.01 0.36 -0.12 0.00 -0.94 0.00 0.00 52.86 52.15 1g7k s ASN 205 Cb -0.01 -0.84 0.28 0.00 -2.00 0.00 0.00 41.25 38.68 1g7k s ASN 205 CO -0.00 -1.89 1.62 -0.08 -2.94 0.00 0.00 177.10 173.81 1g7k h GLU 206 N -0.85 0.01 -0.59 3.55 4.22 -2.02 -2.16 114.58 116.74 1g7k h GLU 206 Ca -0.44 -0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.00 1g7k h GLU 206 Cb 1.30 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1g7k h GLU 206 CO 0.54 0.01 0.00 -0.40 -2.18 0.00 0.00 179.01 176.98 1g7k n ASP 207 N -5.44 3.16 -2.26 1.04 3.85 -1.26 -4.94 116.55 110.70 1g7k n ASP 207 Ca 0.09 -2.00 -0.19 0.00 -0.71 0.00 0.00 54.79 51.98 1g7k n ASP 207 Cb 0.36 -0.39 -0.00 0.00 -1.35 0.00 0.00 41.12 39.74 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 1.23 -1.05 0.59 2.11 4.02 -0.81 -4.46 117.16 118.77 1g7k n TYR 208 Ca 0.20 0.08 0.12 0.00 -0.01 0.00 0.00 57.90 58.29 1g7k n TYR 208 Cb 0.50 -3.78 0.10 0.00 -0.02 0.00 0.00 39.34 36.13 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 -4.09 0.24 -3.91 -0.72 -2.24 -1.26 -4.76 114.28 97.55 1g7k n THR 209 Ca -0.20 -0.25 -0.23 0.00 -2.27 0.00 0.00 64.05 61.10 1g7k n THR 209 Cb 0.66 0.06 -0.17 0.00 -2.10 0.00 0.00 70.33 68.78 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 -3.18 0.52 -0.05 2.28 1.01 -1.26 -1.15 121.20 119.37 1g7k s ILE 210 Ca 0.05 -0.01 -0.08 0.00 0.00 0.00 0.00 60.65 60.61 1g7k s ILE 210 Cb 0.14 -0.62 0.02 0.00 0.01 0.00 0.00 42.46 42.01 1g7k s ILE 210 CO 0.76 0.27 0.21 -0.69 0.00 0.00 0.00 174.94 175.48 1g7k s VAL 211 N 1.62 0.03 0.02 2.92 1.01 -0.46 -2.00 120.40 123.55 1g7k s VAL 211 Ca 0.00 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 61.82 1g7k s VAL 211 Cb -0.13 -0.37 -0.02 0.00 0.00 0.00 0.00 36.38 35.86 1g7k s VAL 211 CO -0.04 -0.13 -0.21 -1.61 0.00 0.00 0.00 175.10 173.11 1g7k s GLU 212 N -0.43 1.53 0.17 2.72 2.02 -0.36 0.58 118.70 124.92 1g7k s GLU 212 Ca -0.05 -0.87 0.04 0.00 0.02 0.00 0.00 54.97 54.11 1g7k s GLU 212 Cb -0.04 -1.58 -0.05 0.00 0.10 0.00 0.00 34.13 32.57 1g7k s GLU 212 CO 0.01 0.42 -0.06 -0.65 0.02 0.00 0.00 175.26 174.99 1g7k s GLN 213 N -0.89 1.12 -0.03 1.61 -0.21 0.14 -1.22 119.66 120.18 1g7k s GLN 213 Ca 0.08 -1.51 0.01 0.00 0.02 0.00 0.00 55.36 53.97 1g7k s GLN 213 Cb -0.09 -0.55 0.01 0.00 1.00 0.00 0.00 33.01 33.39 1g7k s GLN 213 CO 0.01 0.00 -0.05 -0.47 -2.12 0.00 0.00 175.29 172.66 1g7k s TYR 214 N -3.41 0.64 -0.03 0.91 5.04 -0.05 -1.42 117.35 119.03 1g7k s TYR 214 Ca 0.20 -0.15 0.03 0.00 -2.44 0.00 0.00 57.07 54.71 1g7k s TYR 214 Cb 0.04 -0.53 0.00 0.00 0.35 0.00 0.00 41.96 41.82 1g7k s TYR 214 CO 0.02 -0.12 -0.10 -2.00 -1.34 0.00 0.00 175.55 172.02 1g7k s GLU 215 N 0.53 1.00 -0.13 4.97 2.12 0.03 -0.91 118.70 126.31 1g7k s GLU 215 Ca -0.07 -0.32 0.02 0.00 0.36 0.00 0.00 54.97 54.96 1g7k s GLU 215 Cb -0.10 -0.93 -0.00 0.00 0.26 0.00 0.00 34.13 33.35 1g7k s GLU 215 CO -0.00 0.12 -0.18 0.50 -0.54 0.00 0.00 175.26 175.16 1g7k s ARG 216 N 0.17 3.18 -0.16 4.30 3.52 -0.73 -1.97 118.95 127.26 1g7k s ARG 216 Ca -0.03 -0.79 -0.12 0.00 -0.13 0.00 0.00 55.73 54.67 1g7k s ARG 216 Cb -0.08 -2.50 0.05 0.00 -1.56 0.00 0.00 34.95 30.85 1g7k s ARG 216 CO 0.01 0.11 0.41 -0.08 -0.81 0.00 0.00 175.30 174.94 1g7k s THR 217 N 0.55 -0.01 -0.08 4.11 -1.32 0.69 -1.10 115.64 118.48 1g7k s THR 217 Ca -0.11 0.05 -0.06 0.00 -1.21 0.00 0.00 61.69 60.36 1g7k s THR 217 Cb -0.16 -0.59 0.02 0.00 -1.51 0.00 0.00 72.50 70.26 1g7k s THR 217 CO 0.04 0.02 0.20 -1.61 -2.21 0.00 0.00 174.62 171.06 1g7k s GLU 218 N 0.85 0.21 0.32 7.08 2.02 -0.63 -2.05 118.70 126.51 1g7k s GLU 218 Ca -0.05 0.32 -0.09 0.00 0.02 0.00 0.00 54.97 55.16 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 -0.07 -0.06 0.65 0.20 0.02 0.00 0.00 175.26 176.01 1g7k s GLY 219 N 0.35 2.04 0.05 -1.39 0.00 0.29 -1.38 107.32 107.27 1g7k s GLY 219 Ca -0.02 -0.29 -0.28 0.00 0.00 0.00 0.00 44.72 44.13 1g7k s GLY 219 CO -0.01 -0.13 1.08 1.09 0.00 0.00 0.00 173.10 175.12 1g7k s ARG 220 N -3.42 0.82 0.58 2.90 1.70 0.75 -4.41 118.95 117.86 1g7k s ARG 220 Ca 0.49 -0.43 -0.08 0.00 -0.47 0.00 0.00 55.73 55.24 1g7k s ARG 220 Cb -0.11 0.29 -0.02 0.00 -0.57 0.00 0.00 34.95 34.54 1g7k s ARG 220 CO 0.27 -0.37 0.93 -1.01 -1.08 0.00 0.00 175.30 174.03 1g7k s HIS 221 N -2.91 3.50 0.57 5.89 3.76 -1.26 -1.35 115.29 123.49 1g7k s HIS 221 Ca 0.12 0.97 -0.20 0.00 -0.15 0.00 0.00 55.06 55.80 1g7k s HIS 221 Cb 0.01 -2.62 -0.05 0.00 1.11 0.00 0.00 32.58 31.04 1g7k s HIS 221 CO -0.02 -0.63 1.20 1.58 -0.85 0.00 0.00 174.74 176.03 1g7k n HIS 222 N -2.58 1.71 0.19 1.40 -0.00 -1.26 -4.85 115.22 109.83 1g7k n HIS 222 Ca 0.04 0.44 0.07 0.00 0.46 0.00 0.00 57.72 58.73 1g7k n HIS 222 Cb 0.55 -2.27 0.57 0.00 -0.12 0.00 0.00 29.99 28.73 1g7k n HIS 222 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 1g7k h LEU 223 N 0.99 0.13 -0.67 0.27 4.07 -2.04 -2.47 115.31 115.58 1g7k h LEU 223 Ca -0.50 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.46 1g7k h LEU 223 Cb 1.33 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 43.04 1g7k h LEU 223 CO 0.54 0.10 0.00 0.49 -1.08 0.00 0.00 178.44 178.50 1g7k n PHE 224 N -4.51 0.21 1.18 1.13 3.72 -1.26 -5.32 117.46 112.61 1g7k n PHE 224 Ca -0.01 -0.11 0.13 0.00 -0.05 0.00 0.00 57.45 57.41 1g7k n PHE 224 Cb 0.09 0.00 0.25 0.00 -0.94 0.00 0.00 39.48 38.88 1g7k n PHE 224 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99