#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d9k n SER 3 N 0.00 -1.17 0.00 1.61 2.88 -1.26 -5.07 113.62 110.62 1d9k n SER 3 Ca 0.00 -1.76 0.00 0.00 -1.33 0.00 0.00 58.87 55.78 1d9k n SER 3 Cb 0.00 0.86 0.00 0.00 -0.75 0.00 0.00 64.21 64.32 1d9k n SER 3 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1d9k n GLU 4 N -0.54 0.00 0.00 -1.46 -0.00 -1.26 -5.16 120.64 112.22 1d9k n GLU 4 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.97 1d9k n GLU 4 Cb 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 32.12 1d9k n GLU 4 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1d9k n ARG 5 N -2.25 0.00 -4.72 3.44 0.63 -1.26 -5.18 116.66 107.32 1d9k n ARG 5 Ca 0.00 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.63 1d9k n ARG 5 Cb 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 32.77 1d9k n ARG 5 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1d9k s HIS 6 N 0.00 2.40 -0.06 -0.14 3.76 -1.26 -5.10 115.29 114.90 1d9k s HIS 6 Ca 0.00 -0.35 0.02 0.00 -0.15 0.00 0.00 55.06 54.58 1d9k s HIS 6 Cb 0.00 -1.39 0.01 0.00 1.11 0.00 0.00 32.58 32.31 1d9k s HIS 6 CO 0.00 0.21 -0.11 -0.06 -0.85 0.00 0.00 174.74 173.93 1d9k s PHE 7 N -0.90 1.30 0.13 1.40 0.08 -1.26 -5.09 117.98 113.65 1d9k s PHE 7 Ca 0.13 -0.45 0.10 0.00 0.12 0.00 0.00 56.93 56.84 1d9k s PHE 7 Cb -0.10 -0.97 -0.04 0.00 -0.57 0.00 0.00 43.02 41.34 1d9k s PHE 7 CO 0.04 -0.24 -0.24 0.14 -0.10 0.00 0.00 175.22 174.83 1d9k s VAL 8 N 0.62 2.47 -0.04 -0.44 -7.23 -1.26 -5.01 120.40 109.51 1d9k s VAL 8 Ca -0.12 -1.70 0.02 0.00 -1.81 0.00 0.00 61.98 58.37 1d9k s VAL 8 Cb -0.15 -2.12 0.01 0.00 0.56 0.00 0.00 36.38 34.69 1d9k s VAL 8 CO 0.03 0.07 -0.10 -2.28 -0.31 0.00 0.00 175.10 172.51 1d9k s HIS 9 N -1.15 1.12 -0.03 2.82 2.46 -1.26 0.21 115.29 119.46 1d9k s HIS 9 Ca 0.16 -0.34 0.07 0.00 0.47 0.00 0.00 55.06 55.42 1d9k s HIS 9 Cb -0.10 -0.83 -0.02 0.00 -0.13 0.00 0.00 32.58 31.50 1d9k s HIS 9 CO 0.08 -0.18 -0.24 -0.65 -2.47 0.00 0.00 174.74 171.28 1d9k s GLN 10 N 0.49 2.24 -0.35 2.88 -0.21 -0.25 -4.98 119.66 119.49 1d9k s GLN 10 Ca -0.09 -0.89 0.03 0.00 0.02 0.00 0.00 55.36 54.43 1d9k s GLN 10 Cb -0.12 -2.11 0.10 0.00 1.00 0.00 0.00 33.01 31.87 1d9k s GLN 10 CO 0.02 0.54 0.07 0.12 -2.12 0.00 0.00 175.29 173.92 1d9k s PHE 11 N -0.56 3.69 -0.48 0.91 5.36 -1.26 -0.72 117.98 124.91 1d9k s PHE 11 Ca 0.08 -2.83 -0.10 0.00 -0.96 0.00 0.00 56.93 53.12 1d9k s PHE 11 Cb -0.11 -2.90 0.12 0.00 -0.34 0.00 0.00 43.02 39.79 1d9k s PHE 11 CO -0.00 -0.95 0.37 -0.65 -1.46 0.00 0.00 175.22 172.53 1d9k s GLN 12 N 0.97 2.57 -0.35 10.12 -0.21 0.17 -4.94 119.66 127.99 1d9k s GLN 12 Ca 0.09 -1.75 -0.17 0.00 0.02 0.00 0.00 55.36 53.55 1d9k s GLN 12 Cb -0.20 -3.99 -0.01 0.00 1.00 0.00 0.00 33.01 29.82 1d9k s GLN 12 CO -0.07 -1.21 0.46 -1.25 -2.12 0.00 0.00 175.29 171.10 1d9k s PRO 13 N 1.40 3.60 -0.18 2.91 0.04 -1.26 0.22 135.00 141.73 1d9k s PRO 13 Ca 0.05 -0.25 0.01 0.00 0.04 0.00 0.00 61.00 60.85 1d9k s PRO 13 Cb -0.27 -3.81 0.02 0.00 0.04 0.00 0.00 34.50 30.48 1d9k s PRO 13 CO 0.00 -0.60 -0.18 -0.06 0.04 0.00 0.00 177.00 176.20 1d9k s PHE 14 N 2.25 2.80 -0.18 0.56 0.08 0.92 -4.96 117.98 119.45 1d9k s PHE 14 Ca 0.16 -1.58 -0.08 0.00 0.12 0.00 0.00 56.93 55.55 1d9k s PHE 14 Cb -0.16 -1.94 -0.04 0.00 -0.57 0.00 0.00 43.02 40.31 1d9k s PHE 14 CO 0.13 -0.79 0.09 0.00 -0.10 0.00 0.00 175.22 174.55 1d9k s TYR 16 N 0.23 2.31 -0.84 0.00 2.02 0.30 -4.95 117.35 116.41 1d9k s TYR 16 Ca 0.06 -1.31 0.01 0.00 -0.37 0.00 0.00 57.07 55.46 1d9k s TYR 16 Cb -0.12 -1.67 0.24 0.00 -0.40 0.00 0.00 41.96 40.01 1d9k s TYR 16 CO -0.00 -0.69 0.87 1.19 -1.57 0.00 0.00 175.55 175.35 1d9k n PHE 17 N 4.69 3.63 -2.05 2.71 3.72 -1.26 -0.64 117.46 128.26 1d9k n PHE 17 Ca -0.18 -3.88 -0.27 0.00 -0.05 0.00 0.00 57.45 53.07 1d9k n PHE 17 Cb 0.50 -0.95 -0.05 0.00 -0.94 0.00 0.00 39.48 38.04 1d9k n PHE 17 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1d9k s THR 18 N -1.96 3.46 0.00 4.37 2.01 0.24 -3.60 115.64 120.16 1d9k s THR 18 Ca 0.31 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.88 1d9k s THR 18 Cb 0.02 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.45 1d9k s THR 18 CO -0.06 -0.95 0.00 -3.20 -0.69 0.00 0.00 174.62 169.72 1d9k n ASN 19 N 14.01 -1.94 -0.22 3.53 5.15 -1.26 -3.65 115.26 130.87 1d9k n ASN 19 Ca 0.41 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.39 1d9k n ASN 19 Cb 0.47 -0.97 0.00 0.00 -0.53 0.00 0.00 39.78 38.75 1d9k n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1d9k n GLY 20 N -0.42 0.17 0.11 8.20 0.00 -1.24 -2.21 105.19 109.81 1d9k n GLY 20 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1d9k n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1d9k n THR 21 N -0.45 0.00 -0.05 2.61 -2.24 -1.26 -3.23 114.28 109.66 1d9k n THR 21 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 1d9k n THR 21 Cb 0.00 -0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 67.97 1d9k n THR 21 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1d9k h GLN 22 N 0.07 0.30 -4.14 -0.78 4.15 -1.74 -3.40 115.11 109.58 1d9k h GLN 22 Ca 0.00 -0.10 -0.61 0.00 0.77 0.00 0.00 58.65 58.71 1d9k h GLN 22 Cb 0.08 -0.02 -0.39 0.00 0.21 0.00 0.00 27.48 27.35 1d9k h GLN 22 CO 0.00 0.54 -0.76 0.50 -1.93 0.00 0.00 178.83 177.18 1d9k s ARG 23 N -4.90 1.25 -0.09 1.69 3.52 -1.20 -5.07 118.95 114.15 1d9k s ARG 23 Ca -0.14 -1.21 0.04 0.00 -0.13 0.00 0.00 55.73 54.29 1d9k s ARG 23 Cb 0.06 -2.53 -0.01 0.00 -1.56 0.00 0.00 34.95 30.92 1d9k s ARG 23 CO 0.72 -0.81 -0.22 0.42 -0.81 0.00 0.00 175.30 174.61 1d9k s ILE 24 N 1.37 2.30 -0.14 4.11 1.01 -1.24 -0.60 121.20 128.01 1d9k s ILE 24 Ca 0.04 -0.95 -0.00 0.00 0.00 0.00 0.00 60.65 59.73 1d9k s ILE 24 Cb -0.18 -1.89 0.03 0.00 0.01 0.00 0.00 42.46 40.43 1d9k s ILE 24 CO -0.13 0.56 -0.07 -0.60 0.00 0.00 0.00 174.94 174.70 1d9k s ARG 25 N 0.15 1.51 -0.17 2.79 3.52 0.19 -4.94 118.95 122.00 1d9k s ARG 25 Ca -0.12 -0.39 -0.13 0.00 -0.13 0.00 0.00 55.73 54.96 1d9k s ARG 25 Cb -0.16 -1.81 -0.05 0.00 -1.56 0.00 0.00 34.95 31.37 1d9k s ARG 25 CO 0.06 -0.35 0.27 -1.17 -0.81 0.00 0.00 175.30 173.31 1d9k s LEU 26 N 1.67 4.23 -0.08 -0.88 2.96 -1.26 -0.54 118.68 124.78 1d9k s LEU 26 Ca 0.03 0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 54.40 1d9k s LEU 26 Cb -0.14 -2.33 0.02 0.00 0.50 0.00 0.00 46.19 44.24 1d9k s LEU 26 CO -0.08 0.10 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.31 1d9k s VAL 27 N 0.49 0.80 -0.14 1.68 1.01 0.37 -0.25 120.40 124.36 1d9k s VAL 27 Ca 0.15 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.96 1d9k s VAL 27 Cb -0.13 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.42 1d9k s VAL 27 CO 0.03 0.32 -0.19 -0.63 0.00 0.00 0.00 175.10 174.63 1d9k s ILE 28 N 1.48 2.37 -0.16 2.22 1.01 0.28 0.31 121.20 128.71 1d9k s ILE 28 Ca -0.01 -0.88 -0.03 0.00 0.00 0.00 0.00 60.65 59.74 1d9k s ILE 28 Cb -0.13 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1d9k s ILE 28 CO -0.04 0.53 -0.06 -0.13 0.00 0.00 0.00 174.94 175.24 1d9k s ARG 29 N 0.75 3.56 -0.28 2.79 0.52 0.58 0.70 118.95 127.56 1d9k s ARG 29 Ca -0.08 -0.58 -0.07 0.00 -0.52 0.00 0.00 55.73 54.49 1d9k s ARG 29 Cb -0.16 -2.85 0.00 0.00 0.52 0.00 0.00 34.95 32.47 1d9k s ARG 29 CO 0.00 0.18 0.07 0.71 0.02 0.00 0.00 175.30 176.28 1d9k s TYR 30 N 0.50 3.13 0.11 -0.53 1.51 -0.48 0.41 117.35 122.00 1d9k s TYR 30 Ca -0.05 -0.91 0.10 0.00 -1.01 0.00 0.00 57.07 55.20 1d9k s TYR 30 Cb -0.15 -2.24 -0.04 0.00 -0.11 0.00 0.00 41.96 39.43 1d9k s TYR 30 CO 0.03 -0.55 -0.25 0.42 -1.11 0.00 0.00 175.55 174.10 1d9k s ILE 31 N 1.51 2.04 -0.31 2.71 1.09 0.10 -1.97 121.20 126.38 1d9k s ILE 31 Ca 0.03 -1.65 0.01 0.00 -1.10 0.00 0.00 60.65 57.94 1d9k s ILE 31 Cb -0.17 -1.82 0.07 0.00 -1.06 0.00 0.00 42.46 39.49 1d9k s ILE 31 CO 0.02 0.05 -0.01 -0.47 -0.10 0.00 0.00 174.94 174.43 1d9k s TYR 32 N -1.08 3.43 0.00 3.97 6.14 -0.61 -1.09 117.35 128.10 1d9k s TYR 32 Ca 0.11 -2.39 0.00 0.00 0.64 0.00 0.00 57.07 55.43 1d9k s TYR 32 Cb -0.10 -2.36 0.00 0.00 0.42 0.00 0.00 41.96 39.92 1d9k s TYR 32 CO 0.05 -0.89 0.00 0.09 0.64 0.00 0.00 175.55 175.44 1d9k n ASN 33 N 4.45 0.00 0.00 4.32 3.02 0.13 -1.13 115.26 126.05 1d9k n ASN 33 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 1d9k n ASN 33 Cb 0.42 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 1d9k n ASN 33 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1d9k n ARG 34 N -0.59 0.00 -2.36 3.52 5.12 -1.26 -4.91 116.66 116.18 1d9k n ARG 34 Ca 0.00 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.51 1d9k n ARG 34 Cb 0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.27 1d9k n ARG 34 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1d9k s GLU 35 N 0.00 3.13 -0.18 5.56 2.12 -0.29 -4.96 118.70 124.08 1d9k s GLU 35 Ca 0.00 0.30 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 1d9k s GLU 35 Cb 0.00 -4.19 -0.03 0.00 0.26 0.00 0.00 34.13 30.17 1d9k s GLU 35 CO 0.00 -2.16 1.55 -2.00 -0.54 0.00 0.00 175.26 172.11 1d9k s GLU 36 N 5.89 3.95 -0.10 4.30 2.12 -1.26 -1.57 118.70 132.02 1d9k s GLU 36 Ca 0.51 1.74 -0.05 0.00 0.36 0.00 0.00 54.97 57.53 1d9k s GLU 36 Cb -0.10 -3.97 -0.26 0.00 0.26 0.00 0.00 34.13 30.05 1d9k s GLU 36 CO 0.21 -1.10 0.43 0.10 -0.54 0.00 0.00 175.26 174.36 1d9k h TYR 37 N 10.00 0.45 -3.35 5.30 -0.00 -1.76 -3.36 116.97 124.25 1d9k h TYR 37 Ca -0.33 -0.33 -0.15 0.00 -0.00 0.00 0.00 58.73 57.92 1d9k h TYR 37 Cb 1.15 -0.02 -0.22 0.00 -0.00 0.00 0.00 36.73 37.64 1d9k h TYR 37 CO 0.89 1.69 -0.45 0.54 -0.00 0.00 0.00 178.16 180.82 1d9k s VAL 38 N -2.57 0.05 0.16 -0.90 0.11 -1.23 -0.05 120.40 115.98 1d9k s VAL 38 Ca -0.20 -0.44 -0.15 0.00 -2.93 0.00 0.00 61.98 58.26 1d9k s VAL 38 Cb 0.07 -0.42 0.02 0.00 -1.53 0.00 0.00 36.38 34.52 1d9k s VAL 38 CO 0.78 -0.24 0.44 0.00 -3.33 0.00 0.00 175.10 172.75 1d9k s ARG 39 N -0.90 1.23 0.07 1.54 3.03 0.82 -1.38 118.95 123.35 1d9k s ARG 39 Ca -0.10 -0.86 0.08 0.00 2.03 0.00 0.00 55.73 56.87 1d9k s ARG 39 Cb -0.05 0.48 -0.03 0.00 -1.03 0.00 0.00 34.95 34.32 1d9k s ARG 39 CO 0.02 -0.50 -0.21 0.12 -1.13 0.00 0.00 175.30 173.60 1d9k s PHE 40 N -3.86 1.79 -0.18 5.89 5.36 0.22 -0.98 117.98 126.22 1d9k s PHE 40 Ca 0.08 -0.39 -0.08 0.00 -0.96 0.00 0.00 56.93 55.58 1d9k s PHE 40 Cb 0.01 -1.03 0.07 0.00 -0.34 0.00 0.00 43.02 41.73 1d9k s PHE 40 CO -0.06 0.14 0.41 0.34 -1.46 0.00 0.00 175.22 174.59 1d9k s ASP 41 N -1.46 -0.41 0.26 6.13 2.15 -1.25 0.99 116.67 123.07 1d9k s ASP 41 Ca 0.07 0.93 -0.10 0.00 0.43 0.00 0.00 52.55 53.88 1d9k s ASP 41 Cb -0.09 0.99 0.39 0.00 -0.30 0.00 0.00 42.92 43.90 1d9k s ASP 41 CO 0.03 -0.21 1.57 0.77 -0.17 0.00 0.00 175.17 177.16 1d9k h SER 42 N 7.53 -0.92 -0.36 -0.34 4.64 -0.96 0.64 113.55 123.78 1d9k h SER 42 Ca -0.28 0.28 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1d9k h SER 42 Cb 1.16 0.59 -0.07 0.00 -0.31 0.00 0.00 62.40 63.76 1d9k h SER 42 CO 0.23 -0.30 -0.48 0.44 -0.87 0.00 0.00 176.83 175.84 1d9k h ASP 43 N -0.01 -1.61 -0.98 4.97 5.19 -1.94 0.32 116.42 122.36 1d9k h ASP 43 Ca 0.43 0.21 0.33 0.00 -0.62 0.00 0.00 57.03 57.37 1d9k h ASP 43 Cb 0.66 0.66 -0.16 0.00 0.18 0.00 0.00 39.33 40.67 1d9k h ASP 43 CO -0.94 -0.35 0.48 0.58 -3.12 0.00 0.00 179.24 175.89 1d9k h VAL 44 N -0.34 0.22 0.00 -1.35 2.07 -1.29 -3.44 116.25 112.12 1d9k h VAL 44 Ca 0.06 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1d9k h VAL 44 Cb 0.51 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1d9k h VAL 44 CO -0.52 0.04 0.00 0.61 0.02 0.00 0.00 177.57 177.72 1d9k n GLY 45 N -1.31 0.62 0.00 2.17 0.00 0.11 -4.99 105.19 101.79 1d9k n GLY 45 Ca 0.31 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1d9k n GLY 45 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1d9k n GLU 46 N -2.68 -3.02 -2.85 1.61 0.28 -1.26 -5.06 120.64 107.65 1d9k n GLU 46 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.68 1d9k n GLU 46 Cb 0.00 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 32.82 1d9k n GLU 46 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1d9k s TYR 47 N -2.05 3.39 -0.17 -1.84 2.02 -1.26 -3.84 117.35 113.60 1d9k s TYR 47 Ca 0.00 1.33 -0.11 0.00 -0.37 0.00 0.00 57.07 57.93 1d9k s TYR 47 Cb 0.00 -2.65 0.05 0.00 -0.40 0.00 0.00 41.96 38.97 1d9k s TYR 47 CO 0.00 -0.09 0.41 1.03 -1.57 0.00 0.00 175.55 175.33 1d9k s ARG 48 N -3.42 0.42 -0.54 -0.62 1.81 -0.15 -4.93 118.95 111.51 1d9k s ARG 48 Ca 0.57 0.73 -0.20 0.00 -1.72 0.00 0.00 55.73 55.11 1d9k s ARG 48 Cb -0.10 0.04 0.07 0.00 -0.45 0.00 0.00 34.95 34.51 1d9k s ARG 48 CO 0.22 -0.13 0.69 0.00 -0.68 0.00 0.00 175.30 175.40 1d9k s ALA 49 N 1.10 3.36 0.04 2.13 0.00 -1.26 -0.13 121.76 126.99 1d9k s ALA 49 Ca -0.07 -1.82 -0.20 0.00 0.00 0.00 0.00 51.96 49.87 1d9k s ALA 49 Cb -0.07 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.50 1d9k s ALA 49 CO -0.09 -2.17 1.30 -0.39 0.00 0.00 0.00 175.76 174.41 1d9k h VAL 50 N 5.90 0.00 -3.70 0.00 -1.51 -0.74 -3.43 116.25 112.77 1d9k h VAL 50 Ca -0.28 0.00 -0.45 0.00 -1.23 0.00 0.00 66.70 64.74 1d9k h VAL 50 Cb 1.09 0.00 0.15 0.00 -2.13 0.00 0.00 31.29 30.40 1d9k h VAL 50 CO 1.02 0.00 0.38 0.42 -1.23 0.00 0.00 177.57 178.16 1d9k s THR 51 N -4.55 2.01 0.19 7.19 -4.23 -0.82 -4.98 115.64 110.44 1d9k s THR 51 Ca -0.10 -0.09 0.01 0.00 -1.18 0.00 0.00 61.69 60.33 1d9k s THR 51 Cb 0.02 -2.92 -0.10 0.00 1.34 0.00 0.00 72.50 70.84 1d9k s THR 51 CO 0.32 0.00 1.45 -0.08 -0.54 0.00 0.00 174.62 175.77 1d9k h GLU 52 N -1.51 0.32 -0.61 3.99 4.81 -1.85 -3.07 114.58 116.66 1d9k h GLU 52 Ca -0.43 -0.27 0.13 0.00 -0.13 0.00 0.00 59.36 58.66 1d9k h GLU 52 Cb 1.23 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.64 1d9k h GLU 52 CO 0.37 0.92 0.42 -0.07 -0.73 0.00 0.00 179.01 179.92 1d9k h LEU 53 N 0.21 0.27 -0.25 1.64 3.38 -1.94 -0.02 115.31 118.60 1d9k h LEU 53 Ca -0.03 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 1d9k h LEU 53 Cb 1.31 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1d9k h LEU 53 CO 0.12 0.15 -0.71 1.23 0.09 0.00 0.00 178.44 179.33 1d9k h GLY 54 N 0.29 0.00 -0.60 0.83 0.00 -1.61 -3.37 103.07 98.62 1d9k h GLY 54 Ca 0.29 0.00 0.15 0.00 0.00 0.00 0.00 47.33 47.77 1d9k h GLY 54 CO -0.07 0.00 -0.04 -2.13 0.00 0.00 0.00 176.54 174.30 1d9k n ARG 55 N -3.41 -0.05 0.00 4.80 0.63 -0.02 -1.07 116.66 117.54 1d9k n ARG 55 Ca 0.00 0.90 0.00 0.00 -0.92 0.00 0.00 57.85 57.84 1d9k n ARG 55 Cb 0.77 -1.41 0.00 0.00 0.45 0.00 0.00 32.46 32.27 1d9k n ARG 55 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1d9k n PRO 56 N -4.83 0.00 -0.35 -0.14 -0.02 -1.26 -3.63 135.00 124.78 1d9k n PRO 56 Ca 0.13 0.37 0.10 0.00 -2.02 0.00 0.00 63.50 62.07 1d9k n PRO 56 Cb 0.41 -1.21 0.20 0.00 -0.02 0.00 0.00 33.50 32.88 1d9k n PRO 56 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1d9k n ASP 57 N -1.60 -0.25 0.00 2.55 8.00 -0.99 -3.35 116.55 120.90 1d9k n ASP 57 Ca 0.00 1.69 0.00 0.00 0.71 0.00 0.00 54.79 57.19 1d9k n ASP 57 Cb 0.00 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.54 1d9k n ASP 57 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1d9k n ALA 58 N -3.43 0.00 -0.21 2.24 0.00 -0.23 -0.63 120.51 118.25 1d9k n ALA 58 Ca 0.19 0.00 0.30 0.00 0.00 0.00 0.00 53.44 53.93 1d9k n ALA 58 Cb 0.61 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.79 1d9k n ALA 58 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1d9k h GLU 59 N 0.00 0.00 0.69 0.00 -0.00 -1.68 -0.94 114.58 112.65 1d9k h GLU 59 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 59.36 59.33 1d9k h GLU 59 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1d9k h GLU 59 CO 0.00 0.00 -0.35 -0.92 -0.00 0.00 0.00 179.01 177.74 1d9k h TYR 60 N 0.00 -0.92 -0.23 2.06 3.20 -1.14 -2.21 116.97 117.73 1d9k h TYR 60 Ca 0.45 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.31 1d9k h TYR 60 Cb 1.87 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 40.44 1d9k h TYR 60 CO 0.00 -0.56 0.15 -1.49 -1.64 0.00 0.00 178.16 174.62 1d9k h TRP 61 N -0.96 0.29 -0.98 -3.82 6.55 0.43 -2.88 115.95 114.58 1d9k h TRP 61 Ca -0.09 0.01 0.28 0.00 0.95 0.00 0.00 58.89 60.03 1d9k h TRP 61 Cb 0.75 -0.10 -0.14 0.00 -0.86 0.00 0.00 29.16 28.81 1d9k h TRP 61 CO -0.04 0.18 0.54 -0.91 -1.05 0.00 0.00 178.44 177.15 1d9k h ASN 62 N 0.31 0.52 -1.08 -3.49 2.35 -1.19 -0.99 115.58 112.00 1d9k h ASN 62 Ca 0.08 0.17 -0.65 0.00 -0.55 0.00 0.00 56.30 55.35 1d9k h ASN 62 Cb -0.03 0.11 -0.27 0.00 0.05 0.00 0.00 38.32 38.18 1d9k h ASN 62 CO -0.02 -0.03 0.84 2.29 -1.65 0.00 0.00 177.43 178.86 1d9k n LYS 63 N -5.00 2.59 0.00 0.81 2.85 -0.84 -4.22 118.16 114.34 1d9k n LYS 63 Ca 0.28 -3.11 0.00 0.00 -1.05 0.00 0.00 58.31 54.44 1d9k n LYS 63 Cb 0.84 -2.21 0.00 0.00 -0.65 0.00 0.00 35.03 33.01 1d9k n LYS 63 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1d9k n GLN 64 N -0.68 0.00 0.00 -1.58 6.02 -0.48 -4.95 117.38 115.72 1d9k n GLN 64 Ca 0.58 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 1d9k n GLN 64 Cb 0.59 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.85 1d9k n GLN 64 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1d9k n TYR 67 N -0.51 0.00 0.04 1.08 4.01 -0.62 -3.70 117.16 117.46 1d9k n TYR 67 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 1d9k n TYR 67 Cb 0.00 -0.01 -0.08 0.00 -0.31 0.00 0.00 39.34 38.94 1d9k n TYR 67 CO 0.00 0.00 0.00 1.37 -0.46 0.00 0.00 176.86 177.77 1d9k h LEU 68 N 0.05 -0.15 0.03 7.72 8.10 -1.65 -2.45 115.31 126.96 1d9k h LEU 68 Ca 0.00 -0.40 0.01 0.00 0.11 0.00 0.00 57.88 57.59 1d9k h LEU 68 Cb 0.03 0.04 -0.01 0.00 -0.44 0.00 0.00 40.66 40.28 1d9k h LEU 68 CO 0.00 0.40 -0.05 -0.33 -4.11 0.00 0.00 178.44 174.35 1d9k h GLU 69 N -0.78 -0.10 0.00 0.17 5.08 -1.87 0.12 114.58 117.20 1d9k h GLU 69 Ca -0.02 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1d9k h GLU 69 Cb 0.54 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1d9k h GLU 69 CO 0.03 -0.07 0.12 0.00 -1.00 0.00 0.00 179.01 178.10 1d9k h ARG 70 N -0.11 0.00 0.00 2.33 2.47 -1.77 -2.13 114.38 115.17 1d9k h ARG 70 Ca 0.01 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1d9k h ARG 70 Cb 0.12 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.44 1d9k h ARG 70 CO -0.04 0.00 -0.01 1.15 0.56 0.00 0.00 179.97 181.63 1d9k h THR 71 N 0.00 0.45 -0.98 2.04 2.02 -0.49 -3.32 112.91 112.63 1d9k h THR 71 Ca 0.00 -1.34 0.16 0.00 0.77 0.00 0.00 66.41 66.00 1d9k h THR 71 Cb 0.25 0.85 -0.10 0.00 -1.74 0.00 0.00 68.15 67.41 1d9k h THR 71 CO 0.00 0.15 0.59 0.03 0.37 0.00 0.00 175.52 176.67 1d9k h ARG 72 N -1.00 0.80 -0.99 6.66 3.08 -0.84 0.11 114.38 122.21 1d9k h ARG 72 Ca -0.00 -0.05 0.20 0.00 0.07 0.00 0.00 59.98 60.20 1d9k h ARG 72 Cb 0.26 -0.18 -0.10 0.00 0.08 0.00 0.00 29.97 30.03 1d9k h ARG 72 CO -0.00 0.53 0.62 0.00 -1.07 0.00 0.00 179.97 180.05 1d9k h ALA 73 N 1.60 1.85 -0.33 0.04 0.00 -1.54 0.40 119.26 121.27 1d9k h ALA 73 Ca 0.53 0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.61 1d9k h ALA 73 Cb 0.72 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1d9k h ALA 73 CO -0.34 -0.21 0.44 0.93 0.00 0.00 0.00 179.25 180.07 1d9k h GLU 74 N 0.65 0.00 -0.44 0.00 5.08 -0.86 0.83 114.58 119.83 1d9k h GLU 74 Ca 0.56 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 59.01 1d9k h GLU 74 Cb 1.03 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.19 1d9k h GLU 74 CO -0.33 0.00 -0.28 1.25 -1.00 0.00 0.00 179.01 178.65 1d9k h LEU 75 N 0.00 -0.93 0.02 1.33 5.85 -0.30 0.67 115.31 121.94 1d9k h LEU 75 Ca 0.16 0.19 -0.27 0.00 0.84 0.00 0.00 57.88 58.79 1d9k h LEU 75 Cb 1.03 0.47 -0.04 0.00 0.37 0.00 0.00 40.66 42.49 1d9k h LEU 75 CO -0.00 -0.29 -1.47 0.47 -0.34 0.00 0.00 178.44 176.82 1d9k n ASP 76 N -5.41 1.90 0.19 1.25 8.00 -0.37 0.08 116.55 122.20 1d9k n ASP 76 Ca 0.02 0.38 0.18 0.00 0.71 0.00 0.00 54.79 56.09 1d9k n ASP 76 Cb 0.33 -0.94 0.82 0.00 -0.02 0.00 0.00 41.12 41.31 1d9k n ASP 76 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1d9k h THR 77 N -0.85 0.33 0.00 -3.53 1.35 -0.86 -0.29 112.91 109.05 1d9k h THR 77 Ca -0.39 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1d9k h THR 77 Cb 1.43 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 1d9k h THR 77 CO -0.19 0.00 0.00 0.52 -0.25 0.00 0.00 175.52 175.60 1d9k n VAL 78 N -3.58 0.00 0.00 6.82 0.31 0.22 -4.70 118.33 117.40 1d9k n VAL 78 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1d9k n VAL 78 Cb 0.43 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.83 1d9k n VAL 78 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1d9k n ARG 80 N -0.43 0.00 -0.36 0.00 0.63 0.11 -1.30 116.66 115.31 1d9k n ARG 80 Ca 0.00 0.40 0.05 0.00 -0.92 0.00 0.00 57.85 57.37 1d9k n ARG 80 Cb 0.00 -0.78 0.12 0.00 0.45 0.00 0.00 32.46 32.25 1d9k n ARG 80 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 1d9k h HIS 81 N 0.00 -0.63 0.32 -0.14 2.76 -1.12 -0.01 115.15 116.33 1d9k h HIS 81 Ca 0.00 0.09 -0.00 0.00 -2.20 0.00 0.00 60.37 58.26 1d9k h HIS 81 Cb 0.00 0.43 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 1d9k h HIS 81 CO -0.04 -0.42 -0.32 -0.91 -1.30 0.00 0.00 177.93 174.94 1d9k h ASN 82 N -0.00 -0.86 0.04 3.26 4.21 -0.16 0.52 115.58 122.58 1d9k h ASN 82 Ca 0.45 0.08 0.00 0.00 1.21 0.00 0.00 56.30 58.04 1d9k h ASN 82 Cb 0.70 0.29 -0.01 0.00 -1.12 0.00 0.00 38.32 38.18 1d9k h ASN 82 CO -1.01 -0.45 -0.12 0.22 -1.29 0.00 0.00 177.43 174.77 1d9k h TYR 83 N -0.67 -0.35 -0.89 1.19 5.03 0.18 0.48 116.97 121.93 1d9k h TYR 83 Ca -0.02 0.01 0.22 0.00 2.58 0.00 0.00 58.73 61.53 1d9k h TYR 83 Cb 0.61 0.15 -0.06 0.00 1.55 0.00 0.00 36.73 38.98 1d9k h TYR 83 CO -0.19 -0.14 0.61 0.93 -1.32 0.00 0.00 178.16 178.05 1d9k h GLU 84 N -0.18 0.24 -0.01 1.82 5.08 -1.03 -1.21 114.58 119.29 1d9k h GLU 84 Ca -0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1d9k h GLU 84 Cb 0.18 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1d9k h GLU 84 CO -0.06 0.16 -0.10 1.63 -1.00 0.00 0.00 179.01 179.64 1d9k n LYS 84 N -4.43 1.79 0.06 2.33 4.76 0.17 -4.64 118.16 118.20 1d9k n LYS 84 Ca 0.19 -0.57 0.00 0.00 -2.87 0.00 0.00 58.31 55.06 1d9k n LYS 84 Cb 0.80 -1.00 0.00 0.00 -1.84 0.00 0.00 35.03 32.99 1d9k n LYS 84 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1d9k n THR 85 N -0.18 0.48 -0.01 -0.18 -2.24 0.16 -4.79 114.28 107.53 1d9k n THR 85 Ca 0.03 0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.87 1d9k n THR 85 Cb 0.14 -1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 67.23 1d9k n THR 85 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1d9k h GLU 86 N 0.00 -0.11 -0.33 -0.78 3.07 -0.97 -3.21 114.58 112.25 1d9k h GLU 86 Ca 0.00 0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.90 1d9k h GLU 86 Cb 0.18 0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.07 1d9k h GLU 86 CO 0.00 -0.07 -0.23 1.15 -1.40 0.00 0.00 179.01 178.46 1d9k h THR 87 N -0.11 0.00 -0.19 1.13 2.02 -1.49 -1.13 112.91 113.13 1d9k h THR 87 Ca 0.08 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.15 1d9k h THR 87 Cb 0.24 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.59 1d9k h THR 87 CO -0.20 0.00 0.14 -0.81 0.37 0.00 0.00 175.52 175.02 1d9k n PRO 88 N -3.85 1.27 0.00 6.66 -0.04 -1.21 -2.44 135.00 135.38 1d9k n PRO 88 Ca 0.00 -0.60 0.00 0.00 -0.04 0.00 0.00 63.50 62.86 1d9k n PRO 88 Cb 0.11 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 1d9k n PRO 88 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1d9k n THR 89 N 0.47 0.00 0.30 0.52 -2.24 -0.74 -4.82 114.28 107.76 1d9k n THR 89 Ca 0.12 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.74 1d9k n THR 89 Cb 0.66 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.81 1d9k n THR 89 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1d9k h SER 90 N 0.00 -0.62 0.03 3.42 4.64 -1.65 0.47 113.55 119.84 1d9k h SER 90 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1d9k h SER 90 Cb 0.00 0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1d9k h SER 90 CO 0.00 -0.36 0.00 -0.07 -0.87 0.00 0.00 176.83 175.53 1d9k h LEU 91 N -0.86 0.00 0.09 5.97 3.38 -1.34 -1.62 115.31 120.93 1d9k h LEU 91 Ca -0.07 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.52 1d9k h LEU 91 Cb 0.61 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 1d9k h LEU 91 CO 0.12 0.00 -2.13 -1.14 0.09 0.00 0.00 178.44 175.38 1d9k n ARG 92 N -2.36 0.73 -1.66 1.13 0.63 -0.84 -4.93 116.66 109.36 1d9k n ARG 92 Ca -0.02 0.23 -0.48 0.00 -0.92 0.00 0.00 57.85 56.66 1d9k n ARG 92 Cb 0.04 -1.66 -0.05 0.00 0.45 0.00 0.00 32.46 31.25 1d9k n ARG 92 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1d9k n ARG 93 N -3.40 1.96 -3.36 -0.14 0.63 0.16 -4.96 116.66 107.54 1d9k n ARG 93 Ca -0.36 0.71 -0.08 0.00 -0.92 0.00 0.00 57.85 57.21 1d9k n ARG 93 Cb 1.03 -2.48 -0.07 0.00 0.45 0.00 0.00 32.46 31.39 1d9k n ARG 93 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1d9k s LEU 94 N 1.87 -0.72 -0.25 6.15 1.43 -1.26 -4.57 118.68 121.33 1d9k s LEU 94 Ca 0.85 0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 54.29 1d9k s LEU 94 Cb -0.74 1.26 0.01 0.00 0.03 0.00 0.00 46.19 46.75 1d9k s LEU 94 CO 0.44 -0.29 -0.02 -1.61 0.23 0.00 0.00 176.35 175.10 1d9k s GLU 95 N 2.59 3.05 0.07 1.70 8.01 -0.83 -4.92 118.70 128.37 1d9k s GLU 95 Ca 0.12 -0.85 -0.30 0.00 0.01 0.00 0.00 54.97 53.95 1d9k s GLU 95 Cb -0.15 -3.08 -0.09 0.00 -4.31 0.00 0.00 34.13 26.49 1d9k s GLU 95 CO -0.16 -0.35 1.88 -0.65 0.01 0.00 0.00 175.26 175.98 1d9k s GLN 96 N 1.41 4.14 0.00 1.61 -0.21 -1.26 -1.65 119.66 123.71 1d9k s GLN 96 Ca 0.02 2.57 0.00 0.00 0.02 0.00 0.00 55.36 57.98 1d9k s GLN 96 Cb -0.16 -3.87 0.00 0.00 1.00 0.00 0.00 33.01 29.98 1d9k s GLN 96 CO -0.03 -0.89 0.00 -0.35 -2.12 0.00 0.00 175.29 171.91 1d9k n PRO 97 N 6.57 0.29 -3.58 2.91 -0.04 -1.26 -4.82 135.00 135.08 1d9k n PRO 97 Ca 0.19 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.44 1d9k n PRO 97 Cb 0.40 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.71 1d9k n PRO 97 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1d9k s SER 98 N -1.43 1.61 -0.03 3.54 0.01 -1.01 -4.93 113.70 111.46 1d9k s SER 98 Ca 0.00 -0.25 -0.14 0.00 1.31 0.00 0.00 55.95 56.87 1d9k s SER 98 Cb 0.00 0.11 -0.05 0.00 0.21 0.00 0.00 66.02 66.29 1d9k s SER 98 CO 0.00 -0.32 0.36 -0.69 0.41 0.00 0.00 173.24 173.01 1d9k s VAL 99 N 2.24 5.12 -0.29 3.43 1.01 -1.26 -1.45 120.40 129.20 1d9k s VAL 99 Ca 0.04 0.73 0.05 0.00 0.00 0.00 0.00 61.98 62.81 1d9k s VAL 99 Cb -0.15 -3.66 0.19 0.00 0.00 0.00 0.00 36.38 32.76 1d9k s VAL 99 CO -0.09 0.57 0.56 0.68 0.00 0.00 0.00 175.10 176.82 1d9k s VAL 100 N -0.98 -0.93 0.32 2.92 -7.23 -0.31 -5.04 120.40 109.15 1d9k s VAL 100 Ca 0.22 -0.05 -0.29 0.00 -1.81 0.00 0.00 61.98 60.05 1d9k s VAL 100 Cb -0.16 -1.00 -0.10 0.00 0.56 0.00 0.00 36.38 35.69 1d9k s VAL 100 CO 0.12 -0.05 1.22 -0.63 -0.31 0.00 0.00 175.10 175.44 1d9k s ILE 101 N 2.78 3.03 0.25 -0.62 1.01 -1.18 -3.86 121.20 122.61 1d9k s ILE 101 Ca 0.10 1.03 0.04 0.00 0.00 0.00 0.00 60.65 61.82 1d9k s ILE 101 Cb -0.11 -3.65 -0.01 0.00 0.01 0.00 0.00 42.46 38.70 1d9k s ILE 101 CO -0.26 0.24 0.14 -1.54 0.00 0.00 0.00 174.94 173.51 1d9k n SER 102 N 0.89 0.35 -3.97 3.58 3.41 0.05 -4.91 113.62 113.02 1d9k n SER 102 Ca -0.00 -2.48 -0.24 0.00 -0.26 0.00 0.00 58.87 55.89 1d9k n SER 102 Cb 0.43 0.91 -0.17 0.00 -0.26 0.00 0.00 64.21 65.13 1d9k n SER 102 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1d9k s LEU 103 N 0.00 1.47 0.00 1.04 2.01 -1.26 -1.36 118.68 120.58 1d9k s LEU 103 Ca 0.20 -0.26 0.00 0.00 0.01 0.00 0.00 54.13 54.08 1d9k s LEU 103 Cb 0.01 -0.75 0.00 0.00 0.01 0.00 0.00 46.19 45.46 1d9k s LEU 103 CO 0.14 -0.02 0.00 -1.20 1.01 0.00 0.00 176.35 176.29 1d9k n SER 104 N 4.11 0.00 -4.56 2.29 7.64 0.96 -4.33 113.62 119.73 1d9k n SER 104 Ca -0.21 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.33 1d9k n SER 104 Cb 0.51 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.67 1d9k n SER 104 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d9k s ARG 105 N 0.00 2.74 -0.23 1.43 3.03 -1.26 -4.87 118.95 119.79 1d9k s ARG 105 Ca 0.00 -0.02 -0.28 0.00 2.03 0.00 0.00 55.73 57.46 1d9k s ARG 105 Cb 0.00 -4.75 -0.05 0.00 -1.03 0.00 0.00 34.95 29.12 1d9k s ARG 105 CO 0.00 -2.91 2.13 0.99 -1.13 0.00 0.00 175.30 174.38 1d9k s THR 106 N 8.83 3.10 0.22 4.99 2.01 -1.26 -4.38 115.64 129.15 1d9k s THR 106 Ca 0.64 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.74 1d9k s THR 106 Cb -0.08 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.30 1d9k s THR 106 CO 0.08 -0.08 0.00 -0.62 -0.69 0.00 0.00 174.62 173.31 1d9k n GLU 107 N 8.66 -1.62 0.00 4.92 -0.58 -1.26 -5.05 120.64 125.71 1d9k n GLU 107 Ca 0.28 1.14 0.00 0.00 -0.42 0.00 0.00 57.16 58.16 1d9k n GLU 107 Cb 0.45 -1.96 0.00 0.00 -0.57 0.00 0.00 31.44 29.37 1d9k n GLU 107 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1d9k n ALA 108 N -2.30 0.00 -2.91 0.62 0.00 -1.26 -4.87 120.51 109.79 1d9k n ALA 108 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 1d9k n ALA 108 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1d9k n ALA 108 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1d9k n LEU 109 N 0.00 -6.88 0.00 0.00 -0.00 -1.26 -4.46 117.00 104.40 1d9k n LEU 109 Ca 0.00 0.11 0.00 0.00 -0.00 0.00 0.00 56.01 56.12 1d9k n LEU 109 Cb 0.00 -3.21 0.00 0.00 -0.00 0.00 0.00 43.42 40.21 1d9k n LEU 109 CO 0.00 -1.43 0.00 0.59 -0.00 0.00 0.00 177.39 176.55 1d9k n ASN 110 N -1.28 -0.04 -0.50 1.96 3.02 -0.90 -5.00 115.26 112.51 1d9k n ASN 110 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 1d9k n ASN 110 Cb 0.48 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 1d9k n ASN 110 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1d9k n HIS 111 N -1.19 -0.08 -1.91 3.10 8.25 -1.26 -4.94 115.22 117.19 1d9k n HIS 111 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 1d9k n HIS 111 Cb 0.02 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.10 1d9k n HIS 111 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1d9k s HIS 112 N -2.23 1.76 0.27 4.41 3.76 -1.26 -3.60 115.29 118.41 1d9k s HIS 112 Ca 0.00 0.06 -0.03 0.00 -0.15 0.00 0.00 55.06 54.94 1d9k s HIS 112 Cb 0.00 -4.01 -0.02 0.00 1.11 0.00 0.00 32.58 29.66 1d9k s HIS 112 CO 0.00 -4.25 0.33 -0.80 -0.85 0.00 0.00 174.74 169.17 1d9k s ASN 113 N 3.92 0.52 -0.28 1.40 0.01 0.83 -4.81 114.94 116.53 1d9k s ASN 113 Ca 0.78 -1.36 -0.21 0.00 -0.71 0.00 0.00 52.86 51.36 1d9k s ASN 113 Cb -0.35 0.53 0.09 0.00 0.41 0.00 0.00 41.25 41.93 1d9k s ASN 113 CO 0.33 -1.07 0.80 -0.89 -1.51 0.00 0.00 177.10 174.76 1d9k s THR 114 N -3.73 0.00 0.51 1.60 2.01 -1.25 0.87 115.64 115.65 1d9k s THR 114 Ca 0.33 0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.41 1d9k s THR 114 Cb 0.02 -1.00 0.04 0.00 0.01 0.00 0.00 72.50 71.57 1d9k s THR 114 CO 0.16 0.00 0.55 -0.76 -0.69 0.00 0.00 174.62 173.88 1d9k s LEU 115 N 0.87 3.11 -0.28 4.42 1.43 0.85 0.32 118.68 129.39 1d9k s LEU 115 Ca -0.04 -0.90 0.00 0.00 -1.03 0.00 0.00 54.13 52.16 1d9k s LEU 115 Cb -0.05 -1.71 0.14 0.00 0.03 0.00 0.00 46.19 44.61 1d9k s LEU 115 CO -0.09 -1.05 0.34 -0.69 0.23 0.00 0.00 176.35 175.09 1d9k s VAL 116 N -2.62 -0.50 0.28 -1.59 1.01 -0.46 -0.50 120.40 116.02 1d9k s VAL 116 Ca 0.49 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1d9k s VAL 116 Cb -0.05 -0.96 0.28 0.00 0.00 0.00 0.00 36.38 35.65 1d9k s VAL 116 CO 0.30 -0.37 1.86 0.00 0.00 0.00 0.00 175.10 176.89 1d9k n SER 118 N -4.57 -3.98 -4.41 0.00 2.88 -1.25 -1.16 113.62 101.13 1d9k n SER 118 Ca 0.18 1.26 -0.38 0.00 -1.33 0.00 0.00 58.87 58.60 1d9k n SER 118 Cb 0.30 -4.57 -0.12 0.00 -0.75 0.00 0.00 64.21 59.07 1d9k n SER 118 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1d9k s VAL 119 N -0.90 4.36 0.48 2.46 1.01 0.05 -2.60 120.40 125.26 1d9k s VAL 119 Ca -0.15 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 61.41 1d9k s VAL 119 Cb 0.01 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 33.19 1d9k s VAL 119 CO 0.64 0.09 0.51 0.42 0.00 0.00 0.00 175.10 176.76 1d9k s THR 120 N 1.57 2.40 0.00 3.92 -4.23 -0.53 0.13 115.64 118.91 1d9k s THR 120 Ca 0.04 -1.23 0.00 0.00 -1.18 0.00 0.00 61.69 59.32 1d9k s THR 120 Cb -0.17 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.03 1d9k s THR 120 CO 0.05 0.00 0.00 0.47 -0.54 0.00 0.00 174.62 174.60 1d9k n ASP 121 N -1.80 0.00 -3.96 3.99 8.00 0.12 -2.40 116.55 120.50 1d9k n ASP 121 Ca 0.06 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.41 1d9k n ASP 121 Cb 0.62 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.58 1d9k n ASP 121 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1d9k s PHE 122 N 0.00 0.45 -0.02 1.24 -0.71 -0.22 -4.15 117.98 114.57 1d9k s PHE 122 Ca 0.00 -0.11 0.03 0.00 -1.04 0.00 0.00 56.93 55.81 1d9k s PHE 122 Cb 0.00 -0.29 -0.00 0.00 -1.21 0.00 0.00 43.02 41.52 1d9k s PHE 122 CO 0.00 -0.01 -0.10 -0.47 -1.34 0.00 0.00 175.22 173.30 1d9k s TYR 123 N -0.19 0.95 0.00 3.49 6.14 -0.66 -1.84 117.35 125.24 1d9k s TYR 123 Ca 0.01 -0.22 0.00 0.00 0.64 0.00 0.00 57.07 57.50 1d9k s TYR 123 Cb -0.02 -0.66 0.00 0.00 0.42 0.00 0.00 41.96 41.70 1d9k s TYR 123 CO -0.00 -0.08 0.00 -0.35 0.64 0.00 0.00 175.55 175.76 1d9k n PRO 124 N 3.15 0.37 0.00 4.97 -0.04 -1.26 -1.96 135.00 140.23 1d9k n PRO 124 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1d9k n PRO 124 Cb 0.55 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.01 1d9k n PRO 124 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d9k n ALA 125 N -3.00 0.00 -1.00 0.55 0.00 -1.26 -4.81 120.51 110.99 1d9k n ALA 125 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1d9k n ALA 125 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1d9k n ALA 125 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1d9k n LYS 126 N 0.00 -0.36 -3.84 0.00 4.81 -1.26 -4.95 118.16 112.56 1d9k n LYS 126 Ca 0.00 0.36 -0.12 0.00 -0.87 0.00 0.00 58.31 57.69 1d9k n LYS 126 Cb 0.00 -0.26 -0.10 0.00 0.02 0.00 0.00 35.03 34.69 1d9k n LYS 126 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1d9k s ILE 127 N -0.04 0.05 -0.43 3.15 2.07 -1.26 -4.60 121.20 120.15 1d9k s ILE 127 Ca 0.00 -0.45 0.03 0.00 -1.41 0.00 0.00 60.65 58.82 1d9k s ILE 127 Cb 0.00 -0.40 0.12 0.00 0.13 0.00 0.00 42.46 42.31 1d9k s ILE 127 CO 0.00 -0.25 0.20 -0.54 -1.91 0.00 0.00 174.94 172.44 1d9k s LYS 128 N -0.91 1.44 -0.32 3.50 1.02 0.46 -4.99 119.74 119.95 1d9k s LYS 128 Ca -0.10 -2.04 -0.08 0.00 0.02 0.00 0.00 55.97 53.78 1d9k s LYS 128 Cb -0.05 -2.71 0.02 0.00 -0.52 0.00 0.00 37.83 34.56 1d9k s LYS 128 CO 0.01 -1.09 0.11 0.08 -0.92 0.00 0.00 175.35 173.55 1d9k s VAL 129 N 0.42 4.08 0.39 3.17 1.01 -1.24 0.20 120.40 128.44 1d9k s VAL 129 Ca 0.15 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.42 1d9k s VAL 129 Cb -0.23 -3.18 -0.07 0.00 0.00 0.00 0.00 36.38 32.90 1d9k s VAL 129 CO -0.05 -0.03 0.02 -0.13 0.00 0.00 0.00 175.10 174.92 1d9k s ARG 130 N 1.50 2.00 -0.13 2.72 3.00 0.14 -4.89 118.95 123.28 1d9k s ARG 130 Ca 0.02 -1.98 -0.05 0.00 0.00 0.00 0.00 55.73 53.72 1d9k s ARG 130 Cb -0.18 -1.76 -0.04 0.00 0.00 0.00 0.00 34.95 32.98 1d9k s ARG 130 CO 0.04 -0.00 0.05 -1.58 0.00 0.00 0.00 175.30 173.80 1d9k s TRP 131 N -2.64 3.27 -0.17 -0.53 0.52 -1.26 0.22 118.94 118.34 1d9k s TRP 131 Ca 0.36 0.18 -0.01 0.00 0.02 0.00 0.00 56.10 56.64 1d9k s TRP 131 Cb 0.06 -1.93 -0.01 0.00 -1.15 0.00 0.00 33.47 30.45 1d9k s TRP 131 CO 0.19 0.38 -0.12 -0.06 0.02 0.00 0.00 176.95 177.36 1d9k s PHE 132 N -0.39 2.85 -0.47 -1.98 2.99 0.50 -2.21 117.98 119.27 1d9k s PHE 132 Ca 0.09 -0.94 0.01 0.00 0.00 0.00 0.00 56.93 56.09 1d9k s PHE 132 Cb -0.12 -1.95 0.12 0.00 0.00 0.00 0.00 43.02 41.08 1d9k s PHE 132 CO 0.02 -0.44 0.22 0.50 -0.00 0.00 0.00 175.22 175.52 1d9k s ARG 133 N 0.92 1.95 -0.50 0.44 3.52 -0.50 0.14 118.95 124.92 1d9k s ARG 133 Ca -0.02 -2.25 -0.03 0.00 -0.13 0.00 0.00 55.73 53.30 1d9k s ARG 133 Cb -0.15 -3.42 -0.03 0.00 -1.56 0.00 0.00 34.95 29.79 1d9k s ARG 133 CO -0.01 -1.07 0.44 0.09 -0.81 0.00 0.00 175.30 173.95 1d9k n ASN 134 N 3.78 -4.36 -3.68 -2.12 3.02 0.12 -3.17 115.26 108.85 1d9k n ASN 134 Ca 0.04 -0.31 -0.27 0.00 -0.03 0.00 0.00 54.58 54.01 1d9k n ASN 134 Cb 0.38 -2.86 -0.03 0.00 -0.61 0.00 0.00 39.78 36.66 1d9k n ASN 134 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1d9k n GLY 135 N -1.37 -0.46 2.69 7.41 0.00 -1.26 -4.89 105.19 107.32 1d9k n GLY 135 Ca -0.03 0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1d9k n GLY 135 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1d9k s GLN 136 N -6.33 0.21 -0.05 1.61 -1.52 -1.19 -5.12 119.66 107.27 1d9k s GLN 136 Ca 0.51 -0.07 -0.35 0.00 -1.95 0.00 0.00 55.36 53.49 1d9k s GLN 136 Cb -0.28 -1.13 -0.13 0.00 -0.22 0.00 0.00 33.01 31.25 1d9k s GLN 136 CO 0.63 -0.83 1.75 -1.91 -0.25 0.00 0.00 175.29 174.68 1d9k n GLU 137 N 5.30 1.92 -4.27 2.91 0.00 -1.26 -1.40 120.64 123.84 1d9k n GLU 137 Ca -0.05 0.70 -0.34 0.00 0.00 0.00 0.00 57.16 57.47 1d9k n GLU 137 Cb 0.47 -2.49 -0.13 0.00 0.00 0.00 0.00 31.44 29.29 1d9k n GLU 137 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 1d9k s GLU 138 N 3.03 3.57 0.00 5.31 0.41 -0.94 -4.90 118.70 125.18 1d9k s GLU 138 Ca 0.90 -0.56 0.05 0.00 -0.41 0.00 0.00 54.97 54.95 1d9k s GLU 138 Cb -0.77 -2.95 0.13 0.00 -1.78 0.00 0.00 34.13 28.76 1d9k s GLU 138 CO 0.51 0.10 1.06 0.25 -0.49 0.00 0.00 175.26 176.69 1d9k n THR 139 N 3.95 0.88 0.00 3.63 -2.24 -1.26 -4.52 114.28 114.71 1d9k n THR 139 Ca -0.17 -0.94 0.00 0.00 -2.27 0.00 0.00 64.05 60.67 1d9k n THR 139 Cb 0.52 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 1d9k n THR 139 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1d9k n VAL 140 N 0.02 0.00 -0.40 2.28 0.31 -1.26 -4.47 118.33 114.80 1d9k n VAL 140 Ca 0.05 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.35 1d9k n VAL 140 Cb 0.31 -0.58 -0.04 0.00 -0.91 0.00 0.00 33.84 32.61 1d9k n VAL 140 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1d9k n GLY 141 N 2.52 1.86 3.03 2.92 0.00 -1.26 -4.70 105.19 109.55 1d9k n GLY 141 Ca 0.00 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1d9k n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d9k s VAL 142 N 1.24 1.71 -0.17 1.61 1.01 -1.26 0.15 120.40 124.69 1d9k s VAL 142 Ca 0.15 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.26 1d9k s VAL 142 Cb 0.07 -1.67 0.03 0.00 0.00 0.00 0.00 36.38 34.81 1d9k s VAL 142 CO 0.00 0.33 -0.13 -0.94 0.00 0.00 0.00 175.10 174.36 1d9k s SER 143 N 1.40 2.96 -0.09 3.32 1.04 -0.23 -5.00 113.70 117.09 1d9k s SER 143 Ca 0.02 -0.64 0.02 0.00 0.48 0.00 0.00 55.95 55.82 1d9k s SER 143 Cb -0.15 -1.20 -0.02 0.00 0.10 0.00 0.00 66.02 64.75 1d9k s SER 143 CO -0.10 -0.09 -0.13 -0.55 0.98 0.00 0.00 173.24 173.35 1d9k s SER 144 N 1.45 4.08 1.08 7.02 0.15 -1.26 -0.06 113.70 126.16 1d9k s SER 144 Ca 0.03 -0.24 -0.15 0.00 0.70 0.00 0.00 55.95 56.29 1d9k s SER 144 Cb -0.14 -1.23 0.23 0.00 -1.71 0.00 0.00 66.02 63.17 1d9k s SER 144 CO -0.10 0.26 1.10 0.42 1.20 0.00 0.00 173.24 176.12 1d9k s THR 145 N -0.23 1.86 0.81 6.45 -4.23 -1.08 -5.02 115.64 114.20 1d9k s THR 145 Ca 0.01 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 60.40 1d9k s THR 145 Cb -0.13 -2.49 0.08 0.00 1.34 0.00 0.00 72.50 71.30 1d9k s THR 145 CO 0.03 0.00 1.18 -1.10 -0.54 0.00 0.00 174.62 174.19 1d9k s GLN 146 N -5.12 1.95 -0.02 3.99 -0.21 -1.26 -4.84 119.66 114.14 1d9k s GLN 146 Ca 0.68 0.10 -0.30 0.00 0.02 0.00 0.00 55.36 55.86 1d9k s GLN 146 Cb -0.15 -1.95 -0.05 0.00 1.00 0.00 0.00 33.01 31.86 1d9k s GLN 146 CO 0.57 -1.61 1.39 -1.17 -2.12 0.00 0.00 175.29 172.35 1d9k s LEU 147 N -5.58 4.30 -0.31 2.90 2.96 -1.26 -4.69 118.68 117.00 1d9k s LEU 147 Ca 0.62 2.07 -0.17 0.00 -0.22 0.00 0.00 54.13 56.43 1d9k s LEU 147 Cb -0.11 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 1d9k s LEU 147 CO 0.49 -0.72 0.45 -0.63 -1.32 0.00 0.00 176.35 174.63 1d9k s ILE 148 N 2.53 5.09 -0.59 6.68 1.09 0.22 -4.96 121.20 131.26 1d9k s ILE 148 Ca 0.63 0.47 -0.27 0.00 -1.10 0.00 0.00 60.65 60.39 1d9k s ILE 148 Cb -0.30 -3.84 0.03 0.00 -1.06 0.00 0.00 42.46 37.29 1d9k s ILE 148 CO 0.25 -0.04 1.12 -0.60 -0.10 0.00 0.00 174.94 175.58 1d9k s ARG 149 N 2.24 3.41 0.38 2.79 3.52 -1.26 -1.52 118.95 128.51 1d9k s ARG 149 Ca 0.17 0.00 0.27 0.00 -0.13 0.00 0.00 55.73 56.04 1d9k s ARG 149 Cb -0.16 -4.05 1.37 0.00 -1.56 0.00 0.00 34.95 30.55 1d9k s ARG 149 CO 0.11 -1.68 1.82 -0.91 -0.81 0.00 0.00 175.30 173.83 1d9k h ASN 150 N 9.53 0.00 0.00 -2.12 2.35 -1.79 -3.46 115.58 120.09 1d9k h ASN 150 Ca -0.26 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1d9k h ASN 150 Cb 1.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.43 1d9k h ASN 150 CO 1.17 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 177.56 1d9k n GLY 151 N -0.92 1.46 0.95 2.83 0.00 -1.26 -4.73 105.19 103.52 1d9k n GLY 151 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1d9k n GLY 151 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1d9k n ASP 152 N 1.98 2.71 -0.11 1.61 5.75 -1.26 -4.72 116.55 122.51 1d9k n ASP 152 Ca 0.00 -1.94 -0.01 0.00 -0.01 0.00 0.00 54.79 52.83 1d9k n ASP 152 Cb 0.00 -0.48 -0.00 0.00 -1.03 0.00 0.00 41.12 39.60 1d9k n ASP 152 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1d9k n TRP 153 N 0.47 -0.02 -4.09 2.11 7.02 -1.26 -5.05 117.44 116.63 1d9k n TRP 153 Ca 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.44 1d9k n TRP 153 Cb 0.46 -0.83 -0.01 0.00 -2.42 0.00 0.00 31.31 28.51 1d9k n TRP 153 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1d9k n THR 154 N -3.26 0.00 -3.96 -0.99 -2.24 -1.26 -4.81 114.28 97.75 1d9k n THR 154 Ca -0.01 -0.33 -0.10 0.00 -2.27 0.00 0.00 64.05 61.34 1d9k n THR 154 Cb 0.18 0.10 -0.07 0.00 -2.10 0.00 0.00 70.33 68.43 1d9k n THR 154 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1d9k s PHE 155 N -1.55 0.41 -0.28 4.78 2.99 -0.77 -2.35 117.98 121.22 1d9k s PHE 155 Ca 0.02 -0.78 -0.23 0.00 0.00 0.00 0.00 56.93 55.94 1d9k s PHE 155 Cb 0.00 -0.08 0.10 0.00 0.00 0.00 0.00 43.02 43.04 1d9k s PHE 155 CO 0.01 -0.70 0.85 1.14 -0.00 0.00 0.00 175.22 176.52 1d9k s GLN 156 N -3.97 0.67 -0.24 0.44 -2.07 -0.58 0.16 119.66 114.08 1d9k s GLN 156 Ca 0.17 0.85 -0.08 0.00 -1.82 0.00 0.00 55.36 54.48 1d9k s GLN 156 Cb 0.04 0.30 0.11 0.00 -1.09 0.00 0.00 33.01 32.36 1d9k s GLN 156 CO -0.00 -0.09 0.52 0.54 -1.32 0.00 0.00 175.29 174.94 1d9k s VAL 157 N 0.53 -0.77 -0.16 3.63 0.11 0.34 -0.61 120.40 123.48 1d9k s VAL 157 Ca -0.01 0.09 -0.08 0.00 -2.93 0.00 0.00 61.98 59.06 1d9k s VAL 157 Cb -0.05 -0.81 -0.04 0.00 -1.53 0.00 0.00 36.38 33.95 1d9k s VAL 157 CO -0.05 0.04 0.11 -1.48 -3.33 0.00 0.00 175.10 170.39 1d9k s LEU 158 N 2.69 4.13 -0.17 2.54 0.05 -1.26 -0.77 118.68 125.90 1d9k s LEU 158 Ca -0.04 0.28 -0.05 0.00 0.05 0.00 0.00 54.13 54.37 1d9k s LEU 158 Cb -0.12 -2.03 -0.03 0.00 -2.05 0.00 0.00 46.19 41.96 1d9k s LEU 158 CO -0.15 0.28 0.00 -0.69 -0.55 0.00 0.00 176.35 175.24 1d9k s VAL 159 N -0.24 4.27 0.23 1.48 1.01 -1.26 -2.64 120.40 123.25 1d9k s VAL 159 Ca 0.10 -0.22 0.06 0.00 0.00 0.00 0.00 61.98 61.92 1d9k s VAL 159 Cb -0.12 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 1d9k s VAL 159 CO 0.01 0.48 0.20 -0.04 0.00 0.00 0.00 175.10 175.75 1d9k s MET 160 N 0.35 2.98 -0.22 2.72 -1.94 0.91 0.13 119.30 124.24 1d9k s MET 160 Ca -0.01 -0.98 -0.04 0.00 -1.71 0.00 0.00 55.69 52.95 1d9k s MET 160 Cb -0.13 -2.62 0.12 0.00 2.01 0.00 0.00 34.83 34.20 1d9k s MET 160 CO 0.02 0.42 0.38 -1.17 -0.01 0.00 0.00 175.02 174.66 1d9k s LEU 161 N -3.68 -0.61 0.15 -0.03 2.96 0.35 -1.07 118.68 116.74 1d9k s LEU 161 Ca 0.33 0.47 -0.30 0.00 -0.22 0.00 0.00 54.13 54.41 1d9k s LEU 161 Cb -0.08 1.15 -0.07 0.00 0.50 0.00 0.00 46.19 47.69 1d9k s LEU 161 CO 0.25 -0.28 1.06 -0.70 -1.32 0.00 0.00 176.35 175.36 1d9k s GLU 162 N 2.56 4.62 0.00 1.98 -6.30 0.12 -0.10 118.70 121.58 1d9k s GLU 162 Ca 0.08 1.64 0.00 0.00 -2.50 0.00 0.00 54.97 54.18 1d9k s GLU 162 Cb -0.14 -3.31 0.00 0.00 0.00 0.00 0.00 34.13 30.68 1d9k s GLU 162 CO -0.14 0.11 0.00 0.00 0.02 0.00 0.00 175.26 175.24 1d9k n MET 163 N 2.57 0.00 -3.88 4.30 0.00 0.25 -4.61 117.12 115.75 1d9k n MET 163 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 57.70 57.42 1d9k n MET 163 Cb 0.47 0.00 -0.15 0.00 0.00 0.00 0.00 33.22 33.54 1d9k n MET 163 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1d9k s THR 164 N -2.86 1.54 -0.72 3.17 -4.23 -1.25 -0.12 115.64 111.18 1d9k s THR 164 Ca 0.00 -1.73 -0.09 0.00 -1.18 0.00 0.00 61.69 58.69 1d9k s THR 164 Cb 0.00 -2.08 -0.23 0.00 1.34 0.00 0.00 72.50 71.53 1d9k s THR 164 CO 0.00 -0.53 1.88 -0.81 -0.54 0.00 0.00 174.62 174.61 1d9k n PRO 165 N 4.58 0.06 -4.49 3.99 -0.04 -1.24 -4.73 135.00 133.13 1d9k n PRO 165 Ca -0.02 -0.16 -0.34 0.00 -0.04 0.00 0.00 63.50 62.94 1d9k n PRO 165 Cb 0.42 -1.41 -0.11 0.00 -0.04 0.00 0.00 33.50 32.36 1d9k n PRO 165 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1d9k s ARG 166 N 6.75 3.16 0.34 0.54 0.52 -1.26 -2.13 118.95 126.86 1d9k s ARG 166 Ca 0.91 -0.51 -0.26 0.00 -0.52 0.00 0.00 55.73 55.36 1d9k s ARG 166 Cb -0.52 -2.75 -0.10 0.00 0.52 0.00 0.00 34.95 32.10 1d9k s ARG 166 CO 0.35 0.51 0.97 0.50 0.02 0.00 0.00 175.30 177.65 1d9k s ARG 167 N -0.37 4.51 0.00 3.54 3.00 -1.25 -3.13 118.95 125.25 1d9k s ARG 167 Ca 0.06 1.36 0.00 0.00 -1.00 0.00 0.00 55.73 56.15 1d9k s ARG 167 Cb -0.12 -2.75 0.00 0.00 0.00 0.00 0.00 34.95 32.08 1d9k s ARG 167 CO 0.02 0.20 0.00 0.41 0.00 0.00 0.00 175.30 175.94 1d9k n GLY 168 N 0.50 2.55 3.64 8.12 0.00 -1.24 -5.00 105.19 113.76 1d9k n GLY 168 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1d9k n GLY 168 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1d9k s GLU 169 N -0.40 4.10 0.15 1.61 2.12 -1.18 -5.01 118.70 120.10 1d9k s GLU 169 Ca 0.00 1.09 -0.30 0.00 0.36 0.00 0.00 54.97 56.12 1d9k s GLU 169 Cb 0.00 -3.71 -0.08 0.00 0.26 0.00 0.00 34.13 30.60 1d9k s GLU 169 CO 0.00 -0.81 1.30 0.08 -0.54 0.00 0.00 175.26 175.29 1d9k s VAL 170 N 3.46 3.42 -0.39 3.70 1.01 -1.26 -4.41 120.40 125.92 1d9k s VAL 170 Ca 0.44 1.10 0.01 0.00 0.00 0.00 0.00 61.98 63.53 1d9k s VAL 170 Cb -0.13 -3.70 0.13 0.00 0.00 0.00 0.00 36.38 32.67 1d9k s VAL 170 CO 0.13 0.13 0.20 -0.31 0.00 0.00 0.00 175.10 175.25 1d9k s TYR 171 N 0.51 1.67 0.24 5.22 2.02 -1.24 0.15 117.35 125.92 1d9k s TYR 171 Ca 0.59 -2.10 0.08 0.00 -0.37 0.00 0.00 57.07 55.26 1d9k s TYR 171 Cb -0.35 -1.66 -0.04 0.00 -0.40 0.00 0.00 41.96 39.51 1d9k s TYR 171 CO 0.34 -0.82 0.11 0.99 -1.57 0.00 0.00 175.55 174.61 1d9k s THR 172 N 0.81 4.08 -0.21 -0.71 2.01 0.37 0.10 115.64 122.08 1d9k s THR 172 Ca 0.16 -1.51 0.01 0.00 0.31 0.00 0.00 61.69 60.65 1d9k s THR 172 Cb -0.22 -3.17 0.05 0.00 0.01 0.00 0.00 72.50 69.17 1d9k s THR 172 CO -0.06 -0.30 -0.08 0.00 -0.69 0.00 0.00 174.62 173.50 1d9k s HIS 174 N 1.41 2.80 -0.57 0.00 2.46 0.60 -1.82 115.29 120.18 1d9k s HIS 174 Ca -0.03 -1.02 -0.22 0.00 0.47 0.00 0.00 55.06 54.25 1d9k s HIS 174 Cb -0.17 -4.47 0.06 0.00 -0.13 0.00 0.00 32.58 27.87 1d9k s HIS 174 CO -0.07 -1.71 0.85 0.08 -2.47 0.00 0.00 174.74 171.41 1d9k s VAL 175 N 3.89 4.53 -0.17 0.89 1.01 -1.20 0.23 120.40 129.59 1d9k s VAL 175 Ca 0.37 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 62.12 1d9k s VAL 175 Cb -0.04 -4.51 -0.04 0.00 0.00 0.00 0.00 36.38 31.80 1d9k s VAL 175 CO -0.07 -1.11 0.04 -0.70 0.00 0.00 0.00 175.10 173.26 1d9k s GLU 176 N 3.54 3.81 -0.14 2.72 2.12 0.13 -1.81 118.70 129.07 1d9k s GLU 176 Ca 0.23 -0.37 -0.29 0.00 0.36 0.00 0.00 54.97 54.90 1d9k s GLU 176 Cb -0.16 -3.12 0.09 0.00 0.26 0.00 0.00 34.13 31.20 1d9k s GLU 176 CO 0.14 0.33 0.80 -1.58 -0.54 0.00 0.00 175.26 174.41 1d9k s HIS 177 N 0.20 -0.59 -0.22 5.30 2.46 -1.26 -0.40 115.29 120.77 1d9k s HIS 177 Ca 0.03 1.15 0.28 0.00 0.47 0.00 0.00 55.06 56.99 1d9k s HIS 177 Cb -0.13 0.39 1.15 0.00 -0.13 0.00 0.00 32.58 33.86 1d9k s HIS 177 CO 0.01 -0.46 1.84 -1.35 -2.47 0.00 0.00 174.74 172.30 1d9k h PRO 178 N 3.37 0.00 -0.38 2.88 0.11 -1.93 -2.64 132.00 133.41 1d9k h PRO 178 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1d9k h PRO 178 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1d9k h PRO 178 CO 0.28 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.94 1d9k n SER 179 N -2.63 0.38 -3.68 -2.05 3.41 -1.26 -4.58 113.62 103.21 1d9k n SER 179 Ca 0.01 -1.49 -0.11 0.00 -0.26 0.00 0.00 58.87 57.03 1d9k n SER 179 Cb 0.27 -0.19 -0.09 0.00 -0.26 0.00 0.00 64.21 63.94 1d9k n SER 179 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 1d9k s LEU 180 N -0.49 -0.30 0.39 1.04 2.34 -1.00 -4.31 118.68 116.35 1d9k s LEU 180 Ca 0.00 1.13 0.09 0.00 0.06 0.00 0.00 54.13 55.41 1d9k s LEU 180 Cb 0.00 1.80 0.80 0.00 -0.56 0.00 0.00 46.19 48.24 1d9k s LEU 180 CO 0.00 -0.20 1.93 0.11 -1.06 0.00 0.00 176.35 177.13 1d9k h LYS 181 N 6.39 0.26 -2.56 1.48 1.57 -1.81 -3.42 116.57 118.47 1d9k h LYS 181 Ca -0.32 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.22 1d9k h LYS 181 Cb 1.19 -0.04 -0.31 0.00 0.08 0.00 0.00 32.23 33.15 1d9k h LYS 181 CO 0.21 0.37 -0.49 -1.12 -0.57 0.00 0.00 179.45 177.84 1d9k s SER 182 N -6.87 0.31 0.00 0.86 0.01 -1.26 -5.10 113.70 101.65 1d9k s SER 182 Ca -0.06 0.53 -0.07 0.00 1.31 0.00 0.00 55.95 57.67 1d9k s SER 182 Cb 0.16 0.89 -0.03 0.00 0.21 0.00 0.00 66.02 67.25 1d9k s SER 182 CO 0.73 -0.26 0.18 -2.65 0.41 0.00 0.00 173.24 171.65 1d9k n PRO 183 N 5.36 0.00 -3.18 12.44 -0.02 -1.26 -4.89 135.00 143.45 1d9k n PRO 183 Ca -0.06 0.00 -0.44 0.00 -2.02 0.00 0.00 63.50 60.98 1d9k n PRO 183 Cb 0.50 -0.25 -0.07 0.00 -0.02 0.00 0.00 33.50 33.66 1d9k n PRO 183 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1d9k s ILE 184 N -0.00 4.91 -0.05 4.25 1.01 -0.75 -4.88 121.20 125.69 1d9k s ILE 184 Ca 0.15 -0.47 -0.03 0.00 0.00 0.00 0.00 60.65 60.30 1d9k s ILE 184 Cb -0.21 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 37.96 1d9k s ILE 184 CO 0.09 -0.75 0.12 0.42 0.00 0.00 0.00 174.94 174.82 1d9k s THR 185 N 2.55 5.10 -0.12 2.92 -4.23 -1.26 -3.23 115.64 117.37 1d9k s THR 185 Ca 0.15 -0.15 0.02 0.00 -1.18 0.00 0.00 61.69 60.53 1d9k s THR 185 Cb -0.19 -3.30 -0.00 0.00 1.34 0.00 0.00 72.50 70.35 1d9k s THR 185 CO 0.12 0.45 -0.20 -0.69 -0.54 0.00 0.00 174.62 173.76 1d9k s VAL 186 N -1.15 2.38 -0.26 2.29 1.01 -0.76 -4.85 120.40 119.06 1d9k s VAL 186 Ca 0.21 -0.89 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 1d9k s VAL 186 Cb -0.12 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 1d9k s VAL 186 CO 0.11 0.54 0.18 -1.61 0.00 0.00 0.00 175.10 174.32 1d9k s GLU 187 N 0.51 4.02 0.00 2.72 2.02 -1.26 0.21 118.70 126.92 1d9k s GLU 187 Ca -0.13 -0.28 0.00 0.00 0.02 0.00 0.00 54.97 54.58 1d9k s GLU 187 Cb -0.17 -3.59 0.00 0.00 0.10 0.00 0.00 34.13 30.47 1d9k s GLU 187 CO 0.05 -0.05 0.00 1.87 0.02 0.00 0.00 175.26 177.15 1d9k n TRP 188 N 4.63 0.00 0.00 1.61 -0.00 0.11 -4.99 117.44 118.80 1d9k n TRP 188 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.36 1d9k n TRP 188 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.83 1d9k n TRP 188 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 177.69 175.56 1d9k n ARG 189 N 0.00 0.00 0.00 5.87 0.63 -1.26 -5.07 116.66 116.83 1d9k n ARG 189 Ca 0.00 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.97 1d9k n ARG 189 Cb 0.00 0.00 0.26 0.00 0.45 0.00 0.00 32.46 33.17 1d9k n ARG 189 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12