#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gjb s ILE 17 N 0.00 3.74 0.00 1.39 -1.09 -0.93 -3.83 121.20 120.47 1gjb s ILE 17 Ca 0.00 -0.43 0.00 0.00 -2.23 0.00 0.00 60.65 57.99 1gjb s ILE 17 Cb 0.00 -2.60 0.00 0.00 -1.58 0.00 0.00 42.46 38.28 1gjb s ILE 17 CO 0.00 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 174.84 1gjb n GLY 18 N 3.21 -1.55 0.00 6.18 0.00 -1.26 -2.91 105.19 108.87 1gjb n GLY 18 Ca -0.18 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1gjb n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gjb n GLY 19 N 0.00 -0.38 3.64 -0.02 0.00 -1.26 -4.80 105.19 102.37 1gjb n GLY 19 Ca 0.00 -1.83 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 1gjb n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gjb s GLU 20 N -1.11 1.99 0.05 1.61 8.01 0.18 -4.90 118.70 124.53 1gjb s GLU 20 Ca 0.00 -2.15 -0.01 0.00 0.01 0.00 0.00 54.97 52.81 1gjb s GLU 20 Cb 0.00 -1.60 -0.04 0.00 -4.31 0.00 0.00 34.13 28.18 1gjb s GLU 20 CO 0.00 -0.10 0.23 -0.06 0.01 0.00 0.00 175.26 175.33 1gjb s PHE 21 N -2.75 3.52 0.06 1.61 0.40 -1.26 -0.71 117.98 118.86 1gjb s PHE 21 Ca 0.30 0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.97 1gjb s PHE 21 Cb 0.09 -1.82 -0.01 0.00 0.51 0.00 0.00 43.02 41.79 1gjb s PHE 21 CO 0.16 0.59 0.05 0.25 0.70 0.00 0.00 175.22 176.96 1gjb n THR 22 N 0.45 0.00 -4.40 0.64 -2.24 0.56 -4.86 114.28 104.43 1gjb n THR 22 Ca -0.06 -0.46 -0.20 0.00 -2.27 0.00 0.00 64.05 61.06 1gjb n THR 22 Cb 0.52 0.22 -0.10 0.00 -2.10 0.00 0.00 70.33 68.86 1gjb n THR 22 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1gjb s THR 23 N -2.20 1.40 0.23 4.28 -4.23 -1.26 -4.18 115.64 109.67 1gjb s THR 23 Ca 0.07 -2.08 0.36 0.00 -1.18 0.00 0.00 61.69 58.86 1gjb s THR 23 Cb 0.00 -2.45 0.40 0.00 1.34 0.00 0.00 72.50 71.80 1gjb s THR 23 CO 0.05 -0.28 2.07 -0.29 -0.54 0.00 0.00 174.62 175.63 1gjb h ILE 24 N 2.32 0.02 0.00 2.99 6.09 -1.90 -1.86 117.51 125.18 1gjb h ILE 24 Ca -0.39 -0.41 0.00 0.00 -1.37 0.00 0.00 64.86 62.68 1gjb h ILE 24 Cb 1.23 1.40 0.00 0.00 0.47 0.00 0.00 36.82 39.93 1gjb h ILE 24 CO 0.67 0.01 0.00 -0.33 -3.07 0.00 0.00 178.15 175.42 1gjb h GLU 25 N 0.00 0.00 -0.01 2.19 3.07 -1.84 -0.25 114.58 117.74 1gjb h GLU 25 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1gjb h GLU 25 Cb 0.40 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1gjb h GLU 25 CO 0.00 0.00 -0.37 0.09 -1.40 0.00 0.00 179.01 177.33 1gjb n ASN 26 N -2.50 1.70 -2.84 1.42 3.02 -0.70 -4.44 115.26 110.93 1gjb n ASN 26 Ca -0.01 -1.31 -0.11 0.00 -0.03 0.00 0.00 54.58 53.12 1gjb n ASN 26 Cb 0.12 0.33 0.05 0.00 -0.61 0.00 0.00 39.78 39.67 1gjb n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gjb n GLN 27 N -0.19 1.08 0.00 3.52 1.13 -0.18 -4.99 117.38 117.74 1gjb n GLN 27 Ca 0.11 -2.68 0.01 0.00 -1.94 0.00 0.00 57.00 52.50 1gjb n GLN 27 Cb 0.43 -1.07 0.07 0.00 0.11 0.00 0.00 30.24 29.78 1gjb n GLN 27 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1gjb n PRO 28 N 0.02 0.04 0.00 -1.09 -0.04 -0.74 -0.44 135.00 132.74 1gjb n PRO 28 Ca 0.10 0.26 0.11 0.00 -0.04 0.00 0.00 63.50 63.93 1gjb n PRO 28 Cb 0.75 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.69 1gjb n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1gjb n TRP 29 N -1.29 0.00 -2.47 0.54 2.14 -1.17 -0.13 117.44 115.07 1gjb n TRP 29 Ca 0.01 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.18 1gjb n TRP 29 Cb 0.02 -0.04 -0.04 0.00 -0.81 0.00 0.00 31.31 30.44 1gjb n TRP 29 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 1gjb s PHE 30 N -2.89 3.55 0.11 -2.67 2.19 0.41 -1.13 117.98 117.56 1gjb s PHE 30 Ca 0.11 1.62 0.10 0.00 0.33 0.00 0.00 56.93 59.09 1gjb s PHE 30 Cb 0.17 -3.31 -0.04 0.00 -1.31 0.00 0.00 43.02 38.53 1gjb s PHE 30 CO 0.78 -0.69 -0.25 0.00 1.83 0.00 0.00 175.22 176.90 1gjb s ALA 31 N -0.69 2.16 -0.11 11.12 0.00 -1.13 -4.41 121.76 128.70 1gjb s ALA 31 Ca 0.47 -1.37 0.03 0.00 0.00 0.00 0.00 51.96 51.09 1gjb s ALA 31 Cb -0.31 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.47 1gjb s ALA 31 CO 0.38 0.48 -0.22 0.00 0.00 0.00 0.00 175.76 176.40 1gjb s ALA 32 N -1.07 2.25 -0.10 0.00 0.00 -0.26 -2.35 121.76 120.22 1gjb s ALA 32 Ca 0.11 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.09 1gjb s ALA 32 Cb -0.10 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.09 1gjb s ALA 32 CO 0.05 0.21 -0.11 0.42 0.00 0.00 0.00 175.76 176.34 1gjb s ILE 33 N 0.45 3.32 0.25 0.00 1.01 -0.41 -0.25 121.20 125.56 1gjb s ILE 33 Ca -0.15 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 59.95 1gjb s ILE 33 Cb -0.17 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.88 1gjb s ILE 33 CO 0.06 0.56 -0.03 -0.31 0.00 0.00 0.00 174.94 175.22 1gjb s TYR 34 N -0.21 1.70 0.04 3.97 2.02 0.02 -0.91 117.35 123.99 1gjb s TYR 34 Ca 0.01 -0.83 0.08 0.00 -0.37 0.00 0.00 57.07 55.97 1gjb s TYR 34 Cb -0.13 -0.98 -0.03 0.00 -0.40 0.00 0.00 41.96 40.43 1gjb s TYR 34 CO 0.03 0.09 -0.23 0.50 -1.57 0.00 0.00 175.55 174.37 1gjb s ARG 35 N -3.81 1.52 0.15 -0.62 3.52 0.46 -0.75 118.95 119.42 1gjb s ARG 35 Ca 0.28 -1.00 0.00 0.00 -0.13 0.00 0.00 55.73 54.89 1gjb s ARG 35 Cb 0.05 -1.66 -0.04 0.00 -1.56 0.00 0.00 34.95 31.74 1gjb s ARG 35 CO 0.10 0.42 0.31 1.03 -0.81 0.00 0.00 175.30 176.35 1gjb s ARG 36 N -1.21 3.48 0.23 5.12 0.52 0.04 -0.55 118.95 126.58 1gjb s ARG 36 Ca 0.09 -0.44 0.07 0.00 -0.52 0.00 0.00 55.73 54.93 1gjb s ARG 36 Cb -0.09 -2.93 -0.05 0.00 0.52 0.00 0.00 34.95 32.40 1gjb s ARG 36 CO 0.02 0.50 -0.12 -1.01 0.02 0.00 0.00 175.30 174.71 1gjb s HIS 37 N -1.73 1.80 -0.87 -0.53 3.76 0.82 -4.95 115.29 113.59 1gjb s HIS 37 Ca 0.36 -0.61 -0.19 0.00 -0.15 0.00 0.00 55.06 54.47 1gjb s HIS 37 Cb -0.12 -0.89 0.12 0.00 1.11 0.00 0.00 32.58 32.80 1gjb s HIS 37 CO 0.28 0.34 1.08 0.50 -0.85 0.00 0.00 174.74 176.09 1gjb s ARG 37 N -3.67 3.50 0.64 1.40 3.00 -1.26 -4.18 118.95 118.38 1gjb s ARG 37 Ca 0.25 -1.61 0.34 0.00 -1.00 0.00 0.00 55.73 53.71 1gjb s ARG 37 Cb 0.00 -4.78 1.89 0.00 0.00 0.00 0.00 34.95 32.06 1gjb s ARG 37 CO 0.09 -1.76 2.13 0.78 0.00 0.00 0.00 175.30 176.53 1gjb h GLY 37 N 10.51 0.00 -2.47 8.12 0.00 -2.03 -3.52 103.07 113.67 1gjb h GLY 37 Ca 0.07 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.91 1gjb h GLY 37 CO 1.11 0.00 -0.01 -1.35 0.00 0.00 0.00 176.54 176.29 1gjb s SER 37 N -5.18 6.34 -0.06 0.19 1.04 -1.26 -5.08 113.70 109.69 1gjb s SER 37 Ca -0.04 0.80 0.04 0.00 0.48 0.00 0.00 55.95 57.23 1gjb s SER 37 Cb 0.13 -2.19 0.00 0.00 0.10 0.00 0.00 66.02 64.06 1gjb s SER 37 CO 0.42 -0.41 -0.18 0.68 0.98 0.00 0.00 173.24 174.74 1gjb s VAL 38 N -2.46 1.52 0.20 5.02 -7.23 -1.26 -0.12 120.40 116.07 1gjb s VAL 38 Ca 0.45 -0.74 0.10 0.00 -1.81 0.00 0.00 61.98 59.99 1gjb s VAL 38 Cb -0.10 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.46 1gjb s VAL 38 CO 0.38 0.44 -0.20 0.42 -0.31 0.00 0.00 175.10 175.82 1gjb s THR 39 N 0.29 2.11 0.52 5.32 -4.23 0.29 -4.88 115.64 115.06 1gjb s THR 39 Ca -0.11 -2.05 -0.19 0.00 -1.18 0.00 0.00 61.69 58.16 1gjb s THR 39 Cb -0.14 -2.03 -0.07 0.00 1.34 0.00 0.00 72.50 71.60 1gjb s THR 39 CO 0.04 -0.27 1.05 -0.47 -0.54 0.00 0.00 174.62 174.43 1gjb s TYR 40 N -2.03 2.99 0.00 3.99 5.04 -1.26 -0.40 117.35 125.67 1gjb s TYR 40 Ca 0.20 1.55 0.00 0.00 -2.44 0.00 0.00 57.07 56.38 1gjb s TYR 40 Cb -0.06 -3.05 0.00 0.00 0.35 0.00 0.00 41.96 39.19 1gjb s TYR 40 CO 0.09 -0.94 0.00 0.28 -1.34 0.00 0.00 175.55 173.64 1gjb n VAL 41 N -1.31 0.00 -3.99 3.14 0.31 -0.08 -4.77 118.33 111.61 1gjb n VAL 41 Ca 0.09 0.02 -0.11 0.00 -0.01 0.00 0.00 64.34 64.34 1gjb n VAL 41 Cb 0.53 -0.85 -0.04 0.00 -0.91 0.00 0.00 33.84 32.57 1gjb n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1gjb n GLY 43 N -0.45 1.25 0.00 0.00 0.00 -0.89 -1.29 105.19 103.80 1gjb n GLY 43 Ca -0.02 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1gjb n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gjb n GLY 44 N -2.14 0.82 3.23 -0.02 0.00 -0.99 -3.91 105.19 102.17 1gjb n GLY 44 Ca 0.16 -0.79 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 1gjb n GLY 44 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gjb s SER 45 N -0.28 0.05 -0.21 1.61 0.01 -0.77 -2.83 113.70 111.27 1gjb s SER 45 Ca 0.00 -0.58 -0.10 0.00 1.31 0.00 0.00 55.95 56.59 1gjb s SER 45 Cb 0.00 0.37 -0.05 0.00 0.21 0.00 0.00 66.02 66.55 1gjb s SER 45 CO 0.00 -0.75 0.13 -0.22 0.41 0.00 0.00 173.24 172.81 1gjb s LEU 46 N -2.83 4.07 -0.25 2.44 2.96 -0.28 -0.89 118.68 123.90 1gjb s LEU 46 Ca 0.04 0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 54.09 1gjb s LEU 46 Cb 0.04 -2.06 -0.18 0.00 0.50 0.00 0.00 46.19 44.49 1gjb s LEU 46 CO -0.11 0.13 -0.17 0.23 -1.32 0.00 0.00 176.35 175.11 1gjb n MET 47 N 3.85 0.66 -4.01 1.98 2.81 -0.28 -0.82 117.12 121.32 1gjb n MET 47 Ca -0.16 0.18 -0.10 0.00 -1.81 0.00 0.00 57.70 55.81 1gjb n MET 47 Cb 0.52 -1.54 -0.06 0.00 -0.71 0.00 0.00 33.22 31.43 1gjb n MET 47 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1gjb s SER 48 N -6.67 -0.03 0.20 7.83 1.04 -1.20 -4.60 113.70 110.27 1gjb s SER 48 Ca -0.34 -0.96 -0.07 0.00 0.48 0.00 0.00 55.95 55.06 1gjb s SER 48 Cb 0.09 0.51 0.32 0.00 0.10 0.00 0.00 66.02 67.04 1gjb s SER 48 CO 0.61 -1.02 1.13 -2.65 0.98 0.00 0.00 173.24 172.29 1gjb n PRO 49 N -0.32 -0.08 -0.20 4.02 -0.02 -1.26 -1.63 135.00 135.52 1gjb n PRO 49 Ca -0.03 1.13 0.10 0.00 -2.02 0.00 0.00 63.50 62.68 1gjb n PRO 49 Cb 0.63 -1.68 0.20 0.00 -0.02 0.00 0.00 33.50 32.63 1gjb n PRO 49 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gjb s TRP 51 N -1.26 1.45 0.02 0.00 0.52 -0.65 -1.54 118.94 117.49 1gjb s TRP 51 Ca 0.35 -0.45 0.08 0.00 0.02 0.00 0.00 56.10 56.09 1gjb s TRP 51 Cb 0.20 -1.02 -0.03 0.00 -1.15 0.00 0.00 33.47 31.47 1gjb s TRP 51 CO 0.27 -0.19 -0.22 0.08 0.02 0.00 0.00 176.95 176.91 1gjb s VAL 52 N 0.30 2.43 -0.02 4.03 1.01 -0.33 -1.12 120.40 126.70 1gjb s VAL 52 Ca -0.08 -1.20 0.07 0.00 0.00 0.00 0.00 61.98 60.78 1gjb s VAL 52 Cb -0.12 -1.95 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 1gjb s VAL 52 CO 0.02 0.43 -0.24 -0.51 0.00 0.00 0.00 175.10 174.80 1gjb s ILE 53 N -0.80 2.26 0.00 2.22 2.07 -0.07 -1.18 121.20 125.70 1gjb s ILE 53 Ca 0.12 -1.05 0.00 0.00 -1.41 0.00 0.00 60.65 58.31 1gjb s ILE 53 Cb -0.10 -1.81 0.00 0.00 0.13 0.00 0.00 42.46 40.68 1gjb s ILE 53 CO 0.02 0.57 0.00 -0.24 -1.91 0.00 0.00 174.94 173.38 1gjb n SER 54 N 2.37 0.00 -4.38 4.50 2.88 -0.57 -1.84 113.62 116.57 1gjb n SER 54 Ca -0.16 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.04 1gjb n SER 54 Cb 0.51 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.84 1gjb n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gjb s ALA 55 N -1.61 2.80 0.34 -1.46 0.00 -1.26 -0.49 121.76 120.08 1gjb s ALA 55 Ca 0.00 -0.98 0.13 0.00 0.00 0.00 0.00 51.96 51.11 1gjb s ALA 55 Cb 0.00 -1.49 0.98 0.00 0.00 0.00 0.00 23.12 22.60 1gjb s ALA 55 CO 0.00 -0.02 1.73 1.15 0.00 0.00 0.00 175.76 178.62 1gjb h THR 56 N 5.45 0.49 0.00 0.00 2.02 -1.75 -0.59 112.91 118.54 1gjb h THR 56 Ca -0.33 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.68 1gjb h THR 56 Cb 1.19 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1gjb h THR 56 CO 0.59 0.09 0.00 1.12 0.37 0.00 0.00 175.52 177.69 1gjb h HIS 57 N 0.49 0.00 0.00 3.16 2.07 -1.91 -1.04 115.15 117.93 1gjb h HIS 57 Ca 0.65 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 58.08 1gjb h HIS 57 Cb 1.38 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.35 1gjb h HIS 57 CO -0.01 0.00 -0.43 0.00 -3.07 0.00 0.00 177.93 174.42 1gjb n PHE 59 N -3.54 0.00 -0.07 0.00 3.72 -0.49 -4.73 117.46 112.35 1gjb n PHE 59 Ca -0.00 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.33 1gjb n PHE 59 Cb 0.55 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.08 1gjb n PHE 59 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1gjb h ILE 60 N 0.12 0.55 0.00 4.37 1.08 -1.34 -2.38 117.51 119.91 1gjb h ILE 60 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1gjb h ILE 60 Cb 0.29 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 34.59 1gjb h ILE 60 CO 0.00 0.00 0.00 0.44 -0.69 0.00 0.00 178.15 177.90 1gjb h ASP 60 N -0.11 0.00 -1.56 1.72 3.45 -1.85 -3.37 116.42 114.69 1gjb h ASP 60 Ca 0.15 0.00 -0.44 0.00 0.43 0.00 0.00 57.03 57.17 1gjb h ASP 60 Cb 0.34 0.00 -0.30 0.00 -0.56 0.00 0.00 39.33 38.81 1gjb h ASP 60 CO -0.36 0.00 -0.86 0.00 -1.57 0.00 0.00 179.24 176.46 1gjb n TYR 60 N -3.01 -1.65 0.08 4.55 4.19 -0.97 -5.03 117.16 115.32 1gjb n TYR 60 Ca 0.01 -2.79 0.00 0.00 3.31 0.00 0.00 57.90 58.42 1gjb n TYR 60 Cb 0.30 0.49 0.00 0.00 0.49 0.00 0.00 39.34 40.62 1gjb n TYR 60 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 1gjb n PRO 60 N 2.11 0.82 -3.04 2.98 -0.04 -0.94 -4.72 135.00 132.17 1gjb n PRO 60 Ca 0.21 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.22 1gjb n PRO 60 Cb 0.54 -1.09 -0.01 0.00 -0.04 0.00 0.00 33.50 32.90 1gjb n PRO 60 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1gjb s LYS 61 N 0.29 3.89 0.44 0.54 -0.14 -1.26 -4.90 119.74 118.59 1gjb s LYS 61 Ca 0.00 -2.39 0.27 0.00 -1.36 0.00 0.00 55.97 52.49 1gjb s LYS 61 Cb 0.00 -4.87 1.33 0.00 -1.68 0.00 0.00 37.83 32.61 1gjb s LYS 61 CO 0.00 -1.64 1.70 1.57 -0.76 0.00 0.00 175.35 176.22 1gjb h LYS 62 N 7.71 0.19 0.00 1.68 2.10 -1.93 0.40 116.57 126.71 1gjb h LYS 62 Ca 0.22 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.86 1gjb h LYS 62 Cb 0.94 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.23 1gjb h LYS 62 CO 1.11 0.12 0.00 0.93 -2.00 0.00 0.00 179.45 179.61 1gjb h GLU 62 N 0.19 0.00 -0.64 0.07 3.07 -1.91 -2.52 114.58 112.85 1gjb h GLU 62 Ca 0.71 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.57 1gjb h GLU 62 Cb 2.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.09 1gjb h GLU 62 CO -0.31 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.05 1gjb n ASP 63 N -2.68 3.94 -4.55 1.42 9.92 0.13 -4.92 116.55 119.80 1gjb n ASP 63 Ca -0.01 -2.26 -0.31 0.00 -0.53 0.00 0.00 54.79 51.68 1gjb n ASP 63 Cb 0.13 -0.50 -0.11 0.00 -0.64 0.00 0.00 41.12 40.00 1gjb n ASP 63 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1gjb s TYR 64 N -1.59 2.74 0.00 1.24 1.51 -0.95 -0.78 117.35 119.52 1gjb s TYR 64 Ca 0.44 -0.15 0.06 0.00 -1.01 0.00 0.00 57.07 56.41 1gjb s TYR 64 Cb 0.26 -1.49 -0.02 0.00 -0.11 0.00 0.00 41.96 40.60 1gjb s TYR 64 CO 0.24 0.37 -0.18 0.42 -1.11 0.00 0.00 175.55 175.29 1gjb s ILE 65 N -1.07 1.39 -0.10 2.71 -1.09 0.07 -4.27 121.20 118.84 1gjb s ILE 65 Ca 0.18 -0.86 0.04 0.00 -2.23 0.00 0.00 60.65 57.78 1gjb s ILE 65 Cb -0.11 -1.18 -0.00 0.00 -1.58 0.00 0.00 42.46 39.59 1gjb s ILE 65 CO 0.10 0.30 -0.23 -0.69 -1.23 0.00 0.00 174.94 173.19 1gjb s VAL 66 N -0.54 2.15 -0.06 2.92 1.01 -0.78 -0.80 120.40 124.31 1gjb s VAL 66 Ca 0.06 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.11 1gjb s VAL 66 Cb -0.07 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.48 1gjb s VAL 66 CO 0.00 0.56 -0.24 -0.31 0.00 0.00 0.00 175.10 175.11 1gjb s TYR 67 N 0.29 2.36 0.15 5.22 2.02 0.66 0.26 117.35 128.31 1gjb s TYR 67 Ca -0.17 -0.72 0.09 0.00 -0.37 0.00 0.00 57.07 55.91 1gjb s TYR 67 Cb -0.17 -1.55 -0.04 0.00 -0.40 0.00 0.00 41.96 39.79 1gjb s TYR 67 CO 0.08 -0.22 -0.14 -0.51 -1.57 0.00 0.00 175.55 173.19 1gjb s LEU 68 N -0.11 2.85 -0.55 -1.29 1.43 -0.46 -1.10 118.68 119.44 1gjb s LEU 68 Ca -0.04 -0.58 -0.02 0.00 -1.03 0.00 0.00 54.13 52.46 1gjb s LEU 68 Cb -0.14 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.49 1gjb s LEU 68 CO 0.04 0.14 0.23 0.61 0.23 0.00 0.00 176.35 177.60 1gjb n GLY 69 N 0.38 0.27 3.24 -3.19 0.00 -1.26 -0.57 105.19 104.06 1gjb n GLY 69 Ca -0.13 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 1gjb n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1gjb s ARG 70 N -4.98 3.22 0.01 1.61 3.52 -1.26 -3.68 118.95 117.39 1gjb s ARG 70 Ca 0.12 -0.71 0.22 0.00 -0.13 0.00 0.00 55.73 55.23 1gjb s ARG 70 Cb -0.05 -2.85 -0.21 0.00 -1.56 0.00 0.00 34.95 30.29 1gjb s ARG 70 CO 0.14 -0.21 0.73 0.43 -0.81 0.00 0.00 175.30 175.58 1gjb n SER 71 N 4.73 0.40 -4.35 -2.12 7.64 -1.26 -4.59 113.62 114.07 1gjb n SER 71 Ca -0.19 -0.21 -0.25 0.00 1.01 0.00 0.00 58.87 59.23 1gjb n SER 71 Cb 0.50 1.41 -0.12 0.00 -1.01 0.00 0.00 64.21 65.00 1gjb n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1gjb s ARG 72 N -3.34 1.31 -0.01 1.43 0.52 -1.26 -1.77 118.95 115.83 1gjb s ARG 72 Ca -0.02 -1.34 -0.25 0.00 -0.52 0.00 0.00 55.73 53.60 1gjb s ARG 72 Cb 0.14 -1.58 -0.18 0.00 0.52 0.00 0.00 34.95 33.85 1gjb s ARG 72 CO 0.87 0.35 1.21 1.25 0.02 0.00 0.00 175.30 179.00 1gjb h LEU 73 N 3.63 -0.15 -0.40 2.53 5.85 -1.56 -3.40 115.31 121.81 1gjb h LEU 73 Ca -0.46 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 57.92 1gjb h LEU 73 Cb 1.19 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1gjb h LEU 73 CO 0.44 0.29 -0.17 0.59 -0.34 0.00 0.00 178.44 179.26 1gjb n ASN 74 N -4.97 0.65 -4.88 1.25 3.02 -1.26 -5.02 115.26 104.06 1gjb n ASN 74 Ca -0.09 -0.83 -0.21 0.00 -0.03 0.00 0.00 54.58 53.43 1gjb n ASN 74 Cb 0.25 0.68 -0.03 0.00 -0.61 0.00 0.00 39.78 40.06 1gjb n ASN 74 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1gjb s SER 75 N -1.17 5.06 0.45 6.41 0.01 -1.26 -5.12 113.70 118.07 1gjb s SER 75 Ca 0.04 -0.74 -0.01 0.00 1.31 0.00 0.00 55.95 56.55 1gjb s SER 75 Cb 0.04 -0.58 -0.01 0.00 0.21 0.00 0.00 66.02 65.68 1gjb s SER 75 CO 0.17 -0.65 0.68 0.20 0.41 0.00 0.00 173.24 174.06 1gjb s ASN 76 N -4.13 5.97 0.08 2.44 -0.87 -1.26 -4.63 114.94 112.54 1gjb s ASN 76 Ca 0.48 0.46 0.08 0.00 -1.57 0.00 0.00 52.86 52.30 1gjb s ASN 76 Cb -0.03 -1.76 -0.03 0.00 -0.02 0.00 0.00 41.25 39.41 1gjb s ASN 76 CO 0.28 -0.63 -0.21 -0.89 -2.57 0.00 0.00 177.10 173.08 1gjb s THR 77 N -2.57 1.69 -0.02 1.60 2.01 -1.26 -4.90 115.64 112.18 1gjb s THR 77 Ca 0.47 -1.42 -0.27 0.00 0.31 0.00 0.00 61.69 60.78 1gjb s THR 77 Cb -0.10 -1.51 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 1gjb s THR 77 CO 0.39 0.02 0.85 -1.58 -0.69 0.00 0.00 174.62 173.61 1gjb s GLN 78 N -1.66 4.51 0.00 4.92 2.00 -1.26 -3.33 119.66 124.84 1gjb s GLN 78 Ca 0.07 1.17 0.00 0.00 -2.00 0.00 0.00 55.36 54.60 1gjb s GLN 78 Cb -0.10 -3.45 0.00 0.00 0.80 0.00 0.00 33.01 30.27 1gjb s GLN 78 CO 0.03 0.03 0.00 0.41 -0.50 0.00 0.00 175.29 175.26 1gjb n GLY 79 N 2.94 2.28 3.72 2.59 0.00 -1.26 -5.05 105.19 110.41 1gjb n GLY 79 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1gjb n GLY 79 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1gjb n GLU 80 N -1.11 1.00 -4.65 1.61 0.28 -1.21 -4.75 120.64 111.81 1gjb n GLU 80 Ca 0.00 0.40 -0.27 0.00 -0.16 0.00 0.00 57.16 57.13 1gjb n GLU 80 Cb 0.00 -2.51 -0.14 0.00 1.43 0.00 0.00 31.44 30.22 1gjb n GLU 80 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 1gjb s MET 81 N -3.43 1.48 0.03 3.44 -1.94 0.27 -4.95 119.30 114.20 1gjb s MET 81 Ca 0.82 -1.06 0.05 0.00 -1.71 0.00 0.00 55.69 53.78 1gjb s MET 81 Cb -0.37 -1.68 -0.03 0.00 2.01 0.00 0.00 34.83 34.76 1gjb s MET 81 CO 0.42 0.42 -0.10 0.21 -0.01 0.00 0.00 175.02 175.96 1gjb s LYS 82 N -1.38 2.38 0.15 2.03 2.20 -1.26 -1.36 119.74 122.50 1gjb s LYS 82 Ca 0.09 -0.83 -0.03 0.00 -0.36 0.00 0.00 55.97 54.84 1gjb s LYS 82 Cb -0.09 -2.40 -0.03 0.00 -1.51 0.00 0.00 37.83 33.79 1gjb s LYS 82 CO 0.03 0.57 0.14 -0.06 -0.36 0.00 0.00 175.35 175.67 1gjb s PHE 83 N -1.02 0.78 0.15 4.03 0.08 0.14 -4.68 117.98 117.45 1gjb s PHE 83 Ca 0.17 -1.12 0.08 0.00 0.12 0.00 0.00 56.93 56.18 1gjb s PHE 83 Cb -0.11 -0.36 -0.04 0.00 -0.57 0.00 0.00 43.02 41.94 1gjb s PHE 83 CO 0.08 -0.61 -0.07 -1.21 -0.10 0.00 0.00 175.22 173.31 1gjb s GLU 84 N -4.05 2.17 -0.27 0.44 2.02 0.19 -1.86 118.70 117.34 1gjb s GLU 84 Ca 0.25 -1.13 -0.21 0.00 0.02 0.00 0.00 54.97 53.91 1gjb s GLU 84 Cb 0.06 -2.27 -0.01 0.00 0.10 0.00 0.00 34.13 32.00 1gjb s GLU 84 CO 0.03 0.47 0.64 0.08 0.02 0.00 0.00 175.26 176.51 1gjb s VAL 85 N -1.51 4.96 -0.16 2.63 1.01 -1.26 -0.70 120.40 125.36 1gjb s VAL 85 Ca 0.24 1.07 -0.14 0.00 0.00 0.00 0.00 61.98 63.15 1gjb s VAL 85 Cb -0.10 -3.97 -0.23 0.00 0.00 0.00 0.00 36.38 32.08 1gjb s VAL 85 CO 0.15 -0.04 0.31 -0.08 0.00 0.00 0.00 175.10 175.44 1gjb h GLU 86 N 7.98 0.15 -4.01 2.72 4.81 -0.03 -3.44 114.58 122.77 1gjb h GLU 86 Ca -0.26 -0.25 -0.35 0.00 -0.13 0.00 0.00 59.36 58.36 1gjb h GLU 86 Cb 1.12 0.09 -0.32 0.00 0.63 0.00 0.00 28.75 30.27 1gjb h GLU 86 CO 0.79 1.12 -0.76 -0.80 -0.73 0.00 0.00 179.01 178.63 1gjb s ASN 87 N -6.97 0.61 -0.21 1.04 0.01 -1.15 -4.93 114.94 103.34 1gjb s ASN 87 Ca -0.25 -0.08 -0.01 0.00 -0.71 0.00 0.00 52.86 51.81 1gjb s ASN 87 Cb 0.06 -0.23 0.01 0.00 0.41 0.00 0.00 41.25 41.51 1gjb s ASN 87 CO 0.69 -0.03 -0.13 -0.22 -1.51 0.00 0.00 177.10 175.91 1gjb s LEU 88 N 0.56 2.57 -0.26 0.60 2.96 -1.26 -0.41 118.68 123.44 1gjb s LEU 88 Ca -0.06 -0.62 0.02 0.00 -0.22 0.00 0.00 54.13 53.25 1gjb s LEU 88 Cb -0.10 -1.59 0.06 0.00 0.50 0.00 0.00 46.19 45.06 1gjb s LEU 88 CO -0.01 -0.03 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.27 1gjb s ILE 89 N 1.35 2.33 0.44 6.68 1.01 0.58 -4.99 121.20 128.61 1gjb s ILE 89 Ca 0.04 -1.54 0.04 0.00 0.00 0.00 0.00 60.65 59.19 1gjb s ILE 89 Cb -0.14 -2.34 0.01 0.00 0.01 0.00 0.00 42.46 39.99 1gjb s ILE 89 CO -0.08 -0.01 0.62 -0.76 0.00 0.00 0.00 174.94 174.71 1gjb s LEU 90 N 1.14 3.65 0.04 2.97 1.43 -1.26 -0.52 118.68 126.13 1gjb s LEU 90 Ca -0.07 -0.08 -0.19 0.00 -1.03 0.00 0.00 54.13 52.76 1gjb s LEU 90 Cb -0.20 -2.86 -0.06 0.00 0.03 0.00 0.00 46.19 43.10 1gjb s LEU 90 CO -0.05 -0.75 0.54 -2.28 0.23 0.00 0.00 176.35 174.05 1gjb s HIS 91 N -2.45 3.76 -0.24 0.29 2.46 -1.25 -4.95 115.29 112.91 1gjb s HIS 91 Ca 0.51 1.20 -0.14 0.00 0.47 0.00 0.00 55.06 57.10 1gjb s HIS 91 Cb -0.10 -2.48 -0.04 0.00 -0.13 0.00 0.00 32.58 29.83 1gjb s HIS 91 CO 0.35 0.55 0.33 -1.59 -2.47 0.00 0.00 174.74 171.91 1gjb s LYS 92 N -0.90 4.07 0.00 2.88 0.00 -1.26 -3.16 119.74 121.38 1gjb s LYS 92 Ca 0.28 0.02 0.00 0.00 0.00 0.00 0.00 55.97 56.27 1gjb s LYS 92 Cb -0.19 -3.60 0.00 0.00 0.00 0.00 0.00 37.83 34.04 1gjb s LYS 92 CO 0.17 -0.15 0.00 -0.25 0.00 0.00 0.00 175.35 175.13 1gjb n ASP 93 N 4.89 0.00 -4.75 0.03 8.00 -1.26 -5.10 116.55 118.36 1gjb n ASP 93 Ca -0.10 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.03 1gjb n ASP 93 Cb 0.51 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.55 1gjb n ASP 93 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1gjb s TYR 94 N -2.00 3.54 0.04 1.24 5.04 -1.19 -4.40 117.35 119.62 1gjb s TYR 94 Ca 0.00 0.79 -0.14 0.00 -2.44 0.00 0.00 57.07 55.28 1gjb s TYR 94 Cb 0.00 -2.39 0.02 0.00 0.35 0.00 0.00 41.96 39.94 1gjb s TYR 94 CO 0.00 0.32 0.31 -1.12 -1.34 0.00 0.00 175.55 173.72 1gjb s SER 95 N 0.13 -0.14 0.09 4.32 0.01 -1.05 -4.94 113.70 112.11 1gjb s SER 95 Ca 0.21 -0.15 0.03 0.00 1.31 0.00 0.00 55.95 57.35 1gjb s SER 95 Cb -0.15 0.36 -0.04 0.00 0.21 0.00 0.00 66.02 66.41 1gjb s SER 95 CO 0.08 -0.60 -0.09 0.00 0.41 0.00 0.00 173.24 173.04 1gjb s ALA 96 N -2.42 1.01 0.00 1.44 0.00 -1.26 0.45 121.76 120.98 1gjb s ALA 96 Ca -0.06 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.72 1gjb s ALA 96 Cb -0.01 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.17 1gjb s ALA 96 CO -0.02 -0.09 0.00 -0.40 0.00 0.00 0.00 175.76 175.25 1gjb n ASP 97 N 0.50 0.79 -3.62 0.00 5.75 0.61 -4.97 116.55 115.61 1gjb n ASP 97 Ca -0.16 0.00 -0.41 0.00 -0.01 0.00 0.00 54.79 54.21 1gjb n ASP 97 Cb 0.58 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.66 1gjb n ASP 97 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1gjb n THR 97 N 0.00 3.26 0.00 2.12 -2.24 -1.26 -4.24 114.28 111.93 1gjb n THR 97 Ca 0.00 -2.64 0.00 0.00 -2.27 0.00 0.00 64.05 59.14 1gjb n THR 97 Cb 0.00 -2.54 0.00 0.00 -2.10 0.00 0.00 70.33 65.69 1gjb n THR 97 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1gjb n LEU 97 N 5.87 0.00 -4.86 3.22 4.77 -1.26 -5.12 117.00 119.61 1gjb n LEU 97 Ca 0.55 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 56.22 1gjb n LEU 97 Cb 0.36 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.44 1gjb n LEU 97 CO 0.91 0.00 0.67 0.00 -1.33 0.00 0.00 177.39 177.64 1gjb s ALA 98 N -0.14 3.13 -0.02 -1.18 0.00 -1.26 -4.65 121.76 117.63 1gjb s ALA 98 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 51.96 51.97 1gjb s ALA 98 Cb 0.00 -3.03 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 1gjb s ALA 98 CO 0.00 -0.49 -0.18 -1.01 0.00 0.00 0.00 175.76 174.08 1gjb s HIS 99 N -2.93 1.70 0.02 0.00 3.76 -1.26 -0.28 115.29 116.29 1gjb s HIS 99 Ca 0.55 -0.38 0.04 0.00 -0.15 0.00 0.00 55.06 55.13 1gjb s HIS 99 Cb -0.11 -1.11 -0.03 0.00 1.11 0.00 0.00 32.58 32.44 1gjb s HIS 99 CO 0.45 -0.08 -0.09 -1.01 -0.85 0.00 0.00 174.74 173.16 1gjb s HIS 100 N -0.27 2.81 -1.25 1.40 3.76 0.17 -4.61 115.29 117.29 1gjb s HIS 100 Ca 0.03 -0.09 -0.07 0.00 -0.15 0.00 0.00 55.06 54.78 1gjb s HIS 100 Cb -0.09 -1.57 -0.01 0.00 1.11 0.00 0.00 32.58 32.03 1gjb s HIS 100 CO 0.00 0.35 0.68 0.09 -0.85 0.00 0.00 174.74 175.02 1gjb n ASN 101 N 1.51 -2.69 -4.10 1.40 3.02 -1.26 -2.54 115.26 110.59 1gjb n ASN 101 Ca -0.15 -0.91 -0.43 0.00 -0.03 0.00 0.00 54.58 53.05 1gjb n ASN 101 Cb 0.52 -3.72 0.01 0.00 -0.61 0.00 0.00 39.78 35.98 1gjb n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1gjb n ASP 102 N -2.94 5.78 -3.98 6.41 2.03 -1.26 -4.60 116.55 117.99 1gjb n ASP 102 Ca -0.22 -3.21 -0.09 0.00 0.52 0.00 0.00 54.79 51.79 1gjb n ASP 102 Cb 0.65 -1.38 -0.11 0.00 -0.72 0.00 0.00 41.12 39.56 1gjb n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1gjb s ILE 103 N -1.20 0.12 0.11 5.18 2.07 -1.26 -4.34 121.20 121.89 1gjb s ILE 103 Ca 0.34 -0.97 -0.16 0.00 -1.41 0.00 0.00 60.65 58.46 1gjb s ILE 103 Cb 0.02 -0.39 0.03 0.00 0.13 0.00 0.00 42.46 42.25 1gjb s ILE 103 CO 0.03 -0.53 0.38 0.00 -1.91 0.00 0.00 174.94 172.91 1gjb s ALA 104 N -1.68 -0.88 0.02 1.50 0.00 0.36 -3.34 121.76 117.75 1gjb s ALA 104 Ca -0.14 -0.05 0.06 0.00 0.00 0.00 0.00 51.96 51.83 1gjb s ALA 104 Cb -0.08 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.65 1gjb s ALA 104 CO -0.02 -0.61 -0.18 -0.51 0.00 0.00 0.00 175.76 174.45 1gjb s LEU 105 N -2.70 2.13 -0.03 0.00 1.43 0.32 -1.51 118.68 118.31 1gjb s LEU 105 Ca 0.02 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 52.71 1gjb s LEU 105 Cb 0.02 -0.86 -0.00 0.00 0.03 0.00 0.00 46.19 45.37 1gjb s LEU 105 CO -0.11 0.15 -0.14 -0.76 0.23 0.00 0.00 176.35 175.72 1gjb s LEU 106 N -0.93 1.87 -0.22 1.79 1.02 -0.32 -0.31 118.68 121.58 1gjb s LEU 106 Ca 0.06 -0.28 -0.07 0.00 0.02 0.00 0.00 54.13 53.86 1gjb s LEU 106 Cb -0.08 -0.78 -0.04 0.00 0.02 0.00 0.00 46.19 45.31 1gjb s LEU 106 CO 0.01 0.12 0.07 -0.75 0.02 0.00 0.00 176.35 175.82 1gjb s LYS 107 N 0.07 3.81 -0.04 1.70 2.20 0.45 -1.18 119.74 126.75 1gjb s LYS 107 Ca -0.03 -0.41 -0.06 0.00 -0.36 0.00 0.00 55.97 55.10 1gjb s LYS 107 Cb -0.10 -3.27 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1gjb s LYS 107 CO 0.01 0.03 0.21 0.96 -0.36 0.00 0.00 175.35 176.21 1gjb s ILE 108 N 1.02 5.39 -0.00 5.43 -4.36 -0.59 0.72 121.20 128.81 1gjb s ILE 108 Ca 0.04 0.16 0.02 0.00 -0.26 0.00 0.00 60.65 60.62 1gjb s ILE 108 Cb -0.14 -3.51 -0.01 0.00 1.25 0.00 0.00 42.46 40.05 1gjb s ILE 108 CO 0.03 0.46 -0.08 -0.60 0.24 0.00 0.00 174.94 175.00 1gjb s ARG 109 N -1.48 0.63 0.40 0.37 3.52 0.12 -4.63 118.95 117.86 1gjb s ARG 109 Ca 0.23 -0.31 -0.01 0.00 -0.13 0.00 0.00 55.73 55.51 1gjb s ARG 109 Cb -0.13 -0.60 -0.03 0.00 -1.56 0.00 0.00 34.95 32.63 1gjb s ARG 109 CO 0.12 0.16 0.63 0.45 -0.81 0.00 0.00 175.30 175.85 1gjb s SER 110 N -0.26 6.19 0.00 -2.12 0.15 0.68 -0.64 113.70 117.70 1gjb s SER 110 Ca 0.02 0.52 0.06 0.00 0.70 0.00 0.00 55.95 57.26 1gjb s SER 110 Cb -0.03 -1.98 0.30 0.00 -1.71 0.00 0.00 66.02 62.61 1gjb s SER 110 CO -0.00 -0.44 1.11 0.29 1.20 0.00 0.00 173.24 175.40 1gjb n LYS 110 N -1.95 0.06 0.00 5.44 4.76 -1.26 -0.62 118.16 124.59 1gjb n LYS 110 Ca -0.02 0.29 0.09 0.00 -2.87 0.00 0.00 58.31 55.79 1gjb n LYS 110 Cb 0.56 -1.50 0.07 0.00 -1.84 0.00 0.00 35.03 32.32 1gjb n LYS 110 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1gjb n GLU 110 N -1.36 1.53 -1.47 1.97 1.02 -1.26 -4.97 120.64 116.09 1gjb n GLU 110 Ca 0.02 -1.49 0.00 0.00 -0.02 0.00 0.00 57.16 55.67 1gjb n GLU 110 Cb 0.06 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 1gjb n GLU 110 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gjb n GLY 110 N 1.04 0.94 3.49 0.62 0.00 0.21 -5.09 105.19 106.41 1gjb n GLY 110 Ca 0.10 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 1gjb n GLY 110 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1gjb s ARG 110 N -3.14 1.73 0.34 1.61 1.70 -1.25 -4.82 118.95 115.12 1gjb s ARG 110 Ca 0.00 -1.96 0.03 0.00 -0.47 0.00 0.00 55.73 53.33 1gjb s ARG 110 Cb 0.00 -1.05 0.03 0.00 -0.57 0.00 0.00 34.95 33.37 1gjb s ARG 110 CO 0.00 -0.16 0.28 0.00 -1.08 0.00 0.00 175.30 174.35 1gjb n ALA 112 N -2.34 -1.39 -2.75 0.00 0.00 -0.44 -4.93 120.51 108.66 1gjb n ALA 112 Ca -0.10 -0.37 -0.17 0.00 0.00 0.00 0.00 53.44 52.80 1gjb n ALA 112 Cb 0.38 -1.95 -0.12 0.00 0.00 0.00 0.00 19.45 17.76 1gjb n ALA 112 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1gjb s GLN 113 N -3.37 0.73 -0.30 0.00 -1.52 -1.26 -4.82 119.66 109.12 1gjb s GLN 113 Ca 0.65 -0.85 -0.28 0.00 -1.95 0.00 0.00 55.36 52.93 1gjb s GLN 113 Cb -0.30 -0.67 0.01 0.00 -0.22 0.00 0.00 33.01 31.84 1gjb s GLN 113 CO 0.58 0.15 1.02 -2.14 -0.25 0.00 0.00 175.29 174.65 1gjb s PRO 114 N -1.57 4.09 0.00 2.91 0.02 -1.26 -4.84 135.00 134.35 1gjb s PRO 114 Ca -0.04 1.06 0.00 0.00 0.02 0.00 0.00 61.00 62.04 1gjb s PRO 114 Cb -0.09 -3.71 0.00 0.00 0.02 0.00 0.00 34.50 30.71 1gjb s PRO 114 CO 0.01 -0.81 0.00 -1.13 -0.33 0.00 0.00 177.00 174.75 1gjb n SER 115 N 6.64 0.00 -0.58 2.53 3.41 -1.05 -4.99 113.62 119.58 1gjb n SER 115 Ca 0.11 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.81 1gjb n SER 115 Cb 0.47 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.45 1gjb n SER 115 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1gjb n ARG 116 N 0.00 1.60 -0.00 4.33 1.85 -1.26 -4.19 116.66 119.00 1gjb n ARG 116 Ca 0.00 -1.21 0.01 0.00 -1.00 0.00 0.00 57.85 55.65 1gjb n ARG 116 Cb 0.00 -1.38 -0.01 0.00 -1.05 0.00 0.00 32.46 30.02 1gjb n ARG 116 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1gjb n THR 117 N 0.39 0.00 -3.98 8.89 -2.24 -1.26 -4.42 114.28 111.66 1gjb n THR 117 Ca 0.09 -0.41 -0.31 0.00 -2.27 0.00 0.00 64.05 61.16 1gjb n THR 117 Cb 0.44 0.93 -0.16 0.00 -2.10 0.00 0.00 70.33 69.45 1gjb n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1gjb s ILE 118 N -1.27 1.65 0.06 2.28 1.01 -1.26 -4.01 121.20 119.67 1gjb s ILE 118 Ca 0.00 -1.19 -0.03 0.00 0.00 0.00 0.00 60.65 59.43 1gjb s ILE 118 Cb 0.01 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.63 1gjb s ILE 118 CO 0.06 0.01 0.03 -1.58 0.00 0.00 0.00 174.94 173.47 1gjb s GLN 119 N 1.36 0.66 0.36 2.79 2.00 0.82 -2.53 119.66 125.12 1gjb s GLN 119 Ca -0.04 -1.12 -0.05 0.00 -2.00 0.00 0.00 55.36 52.14 1gjb s GLN 119 Cb -0.18 0.24 -0.05 0.00 0.80 0.00 0.00 33.01 33.82 1gjb s GLN 119 CO -0.07 -0.15 0.64 0.95 -0.50 0.00 0.00 175.29 176.16 1gjb s THR 120 N -3.80 4.97 0.23 -0.34 -4.23 -1.26 -3.07 115.64 108.15 1gjb s THR 120 Ca 0.05 0.11 0.06 0.00 -1.18 0.00 0.00 61.69 60.74 1gjb s THR 120 Cb 0.06 -3.78 -0.03 0.00 1.34 0.00 0.00 72.50 70.09 1gjb s THR 120 CO -0.10 -0.50 0.23 -0.51 -0.54 0.00 0.00 174.62 173.21 1gjb s ILE 121 N -2.30 4.68 0.24 2.99 1.10 0.00 -4.86 121.20 123.06 1gjb s ILE 121 Ca 0.45 -1.23 -0.07 0.00 -0.51 0.00 0.00 60.65 59.29 1gjb s ILE 121 Cb -0.10 -3.51 -0.06 0.00 0.15 0.00 0.00 42.46 38.93 1gjb s ILE 121 CO 0.34 -0.30 0.53 0.00 -2.11 0.00 0.00 174.94 173.40 1gjb s LEU 123 N -3.08 3.84 0.87 0.00 2.01 -1.26 -1.02 118.68 120.04 1gjb s LEU 123 Ca 0.45 0.91 -0.13 0.00 0.01 0.00 0.00 54.13 55.37 1gjb s LEU 123 Cb -0.11 -3.79 0.12 0.00 0.01 0.00 0.00 46.19 42.42 1gjb s LEU 123 CO 0.25 -0.40 1.20 -2.16 1.01 0.00 0.00 176.35 176.26 1gjb s PRO 124 N -4.09 1.44 0.34 1.29 0.04 -1.26 -4.84 135.00 127.93 1gjb s PRO 124 Ca 0.47 0.02 0.02 0.00 0.04 0.00 0.00 61.00 61.55 1gjb s PRO 124 Cb -0.10 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 1gjb s PRO 124 CO 0.36 -1.94 0.52 -1.12 0.04 0.00 0.00 177.00 174.86 1gjb s SER 125 N -4.54 6.19 -0.28 6.66 0.01 -1.26 -4.94 113.70 115.54 1gjb s SER 125 Ca 0.65 0.27 -0.28 0.00 1.31 0.00 0.00 55.95 57.91 1gjb s SER 125 Cb -0.10 -1.83 -0.12 0.00 0.21 0.00 0.00 66.02 64.18 1gjb s SER 125 CO 0.51 -0.33 0.94 0.23 0.41 0.00 0.00 173.24 175.00 1gjb n MET 126 N -1.74 0.00 -2.36 12.44 2.81 -1.26 -1.17 117.12 125.84 1gjb n MET 126 Ca -0.04 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.81 1gjb n MET 126 Cb 0.57 -0.89 -0.01 0.00 -0.71 0.00 0.00 33.22 32.18 1gjb n MET 126 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1gjb n TYR 127 N 2.31 -1.57 -3.66 2.03 4.01 -0.18 -4.91 117.16 115.20 1gjb n TYR 127 Ca 0.18 0.07 -0.36 0.00 -0.16 0.00 0.00 57.90 57.63 1gjb n TYR 127 Cb -0.03 -0.91 -0.09 0.00 -0.31 0.00 0.00 39.34 38.01 1gjb n TYR 127 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1gjb s ASN 128 N -1.79 6.20 0.18 7.72 2.47 -0.32 -4.97 114.94 124.44 1gjb s ASN 128 Ca 0.08 0.22 0.05 0.00 0.42 0.00 0.00 52.86 53.63 1gjb s ASN 128 Cb -0.05 -2.11 -0.05 0.00 -1.45 0.00 0.00 41.25 37.59 1gjb s ASN 128 CO 0.10 0.11 -0.08 -1.81 -3.72 0.00 0.00 177.10 171.70 1gjb s ASP 129 N 0.72 1.91 0.93 -4.21 1.01 -1.26 -4.55 116.67 111.22 1gjb s ASP 129 Ca 0.09 -1.08 -0.11 0.00 0.71 0.00 0.00 52.55 52.16 1gjb s ASP 129 Cb -0.13 -0.02 0.15 0.00 1.01 0.00 0.00 42.92 43.94 1gjb s ASP 129 CO 0.02 -0.37 1.10 -2.84 0.21 0.00 0.00 175.17 173.29 1gjb s PRO 130 N -3.77 0.94 0.55 8.23 0.02 -1.26 -5.03 135.00 134.68 1gjb s PRO 130 Ca 0.21 1.12 -0.08 0.00 0.02 0.00 0.00 61.00 62.26 1gjb s PRO 130 Cb 0.03 -1.75 -0.04 0.00 0.02 0.00 0.00 34.50 32.76 1gjb s PRO 130 CO 0.04 -2.54 0.92 -0.65 -0.33 0.00 0.00 177.00 174.43 1gjb s GLN 131 N -4.75 3.58 0.71 5.54 -1.52 -1.26 -4.99 119.66 116.98 1gjb s GLN 131 Ca 0.65 0.50 -0.16 0.00 -1.95 0.00 0.00 55.36 54.41 1gjb s GLN 131 Cb -0.21 -2.22 0.03 0.00 -0.22 0.00 0.00 33.01 30.39 1gjb s GLN 131 CO 0.59 -0.39 1.23 -0.59 -0.25 0.00 0.00 175.29 175.87 1gjb s PHE 132 N -2.96 2.05 0.00 0.91 -0.71 -1.26 -2.59 117.98 113.41 1gjb s PHE 132 Ca 0.52 1.58 0.00 0.00 -1.04 0.00 0.00 56.93 57.98 1gjb s PHE 132 Cb -0.11 -3.53 0.00 0.00 -1.21 0.00 0.00 43.02 38.17 1gjb s PHE 132 CO 0.49 -2.69 0.00 0.41 -1.34 0.00 0.00 175.22 172.09 1gjb n GLY 133 N 0.53 3.18 3.42 1.99 0.00 0.94 -4.95 105.19 110.31 1gjb n GLY 133 Ca 0.14 -0.93 -0.50 0.00 0.00 0.00 0.00 46.02 44.73 1gjb n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gjb n THR 134 N 0.00 1.56 -3.62 2.61 -1.04 -1.07 -4.31 114.28 108.41 1gjb n THR 134 Ca 0.00 -0.39 -0.36 0.00 -2.04 0.00 0.00 64.05 61.26 1gjb n THR 134 Cb 0.00 -0.01 -0.07 0.00 -1.82 0.00 0.00 70.33 68.42 1gjb n THR 134 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1gjb s SER 135 N -0.77 6.34 0.28 8.00 0.01 -1.26 -0.35 113.70 125.94 1gjb s SER 135 Ca 0.70 0.39 0.04 0.00 1.31 0.00 0.00 55.95 58.39 1gjb s SER 135 Cb -1.00 -2.14 -0.06 0.00 0.21 0.00 0.00 66.02 63.03 1gjb s SER 135 CO 0.56 0.13 0.02 0.00 0.41 0.00 0.00 173.24 174.36 1gjb s GLU 137 N -3.86 1.37 0.14 0.00 -1.05 -0.45 -0.71 118.70 114.15 1gjb s GLU 137 Ca 0.32 -1.01 0.10 0.00 -0.15 0.00 0.00 54.97 54.23 1gjb s GLU 137 Cb 0.07 -1.54 -0.04 0.00 -0.44 0.00 0.00 34.13 32.18 1gjb s GLU 137 CO 0.12 0.39 -0.24 0.96 0.95 0.00 0.00 175.26 177.44 1gjb s ILE 138 N -0.88 2.12 0.05 1.83 -4.36 -0.36 -1.17 121.20 118.43 1gjb s ILE 138 Ca 0.08 -1.78 -0.01 0.00 -0.26 0.00 0.00 60.65 58.68 1gjb s ILE 138 Cb -0.09 -1.92 -0.04 0.00 1.25 0.00 0.00 42.46 41.66 1gjb s ILE 138 CO 0.02 -0.02 -0.03 0.28 0.24 0.00 0.00 174.94 175.43 1gjb s THR 139 N -1.30 0.23 0.00 8.37 -1.32 -1.23 -1.83 115.64 118.56 1gjb s THR 139 Ca 0.14 -1.79 0.00 0.00 -1.21 0.00 0.00 61.69 58.83 1gjb s THR 139 Cb -0.09 -1.50 0.00 0.00 -1.51 0.00 0.00 72.50 69.40 1gjb s THR 139 CO 0.06 -0.98 0.00 0.61 -2.21 0.00 0.00 174.62 172.10 1gjb n GLY 140 N 0.14 0.92 2.30 6.08 0.00 -1.15 -4.58 105.19 108.91 1gjb n GLY 140 Ca -0.14 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.23 1gjb n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1gjb n PHE 141 N -1.17 3.14 -2.95 1.61 3.72 -1.26 -2.53 117.46 118.02 1gjb n PHE 141 Ca 0.00 -2.85 -0.19 0.00 -0.05 0.00 0.00 57.45 54.36 1gjb n PHE 141 Cb 0.00 -1.22 0.03 0.00 -0.94 0.00 0.00 39.48 37.35 1gjb n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1gjb s GLY 142 N -2.15 1.86 0.58 1.37 0.00 -1.26 -4.36 107.32 103.37 1gjb s GLY 142 Ca 0.61 -1.76 -0.17 0.00 0.00 0.00 0.00 44.72 43.41 1gjb s GLY 142 CO -0.02 -1.47 -0.27 0.28 0.00 0.00 0.00 173.10 171.61 1gjb n LYS 143 N -2.08 0.00 -0.01 2.90 5.02 -0.09 -2.02 118.16 121.88 1gjb n LYS 143 Ca 0.11 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.46 1gjb n LYS 143 Cb 0.60 -0.93 -0.10 0.00 -0.02 0.00 0.00 35.03 34.58 1gjb n LYS 143 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1gjb n GLU 144 N 1.63 0.66 -3.90 1.97 1.02 -1.25 0.91 120.64 121.67 1gjb n GLU 144 Ca 0.05 -0.11 -0.10 0.00 -0.02 0.00 0.00 57.16 56.99 1gjb n GLU 144 Cb 0.46 -1.29 -0.09 0.00 -0.02 0.00 0.00 31.44 30.50 1gjb n GLU 144 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gjb s ALA 145 N -2.83 -0.17 0.12 0.62 0.00 -1.26 -4.55 121.76 113.69 1gjb s ALA 145 Ca -0.04 -0.44 0.26 0.00 0.00 0.00 0.00 51.96 51.74 1gjb s ALA 145 Cb 0.08 0.25 1.00 0.00 0.00 0.00 0.00 23.12 24.46 1gjb s ALA 145 CO 0.54 -0.32 1.86 0.77 0.00 0.00 0.00 175.76 178.60 1gjb h SER 146 N 3.64 0.00 1.43 0.00 0.02 -1.93 -3.01 113.55 113.70 1gjb h SER 146 Ca -0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1gjb h SER 146 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1gjb h SER 146 CO 0.49 0.18 0.00 0.35 -1.14 0.00 0.00 176.83 176.71 1gjb n THR 147 N -3.34 0.61 -1.56 -2.27 -2.24 -1.26 -4.90 114.28 99.33 1gjb n THR 147 Ca 0.00 -0.26 -0.33 0.00 -2.27 0.00 0.00 64.05 61.19 1gjb n THR 147 Cb 0.40 -0.62 0.07 0.00 -2.10 0.00 0.00 70.33 68.08 1gjb n THR 147 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1gjb s ASP 148 N -4.53 4.63 -0.01 3.42 1.01 -1.14 -4.93 116.67 115.12 1gjb s ASP 148 Ca 0.10 2.13 0.01 0.00 0.71 0.00 0.00 52.55 55.51 1gjb s ASP 148 Cb 0.12 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.51 1gjb s ASP 148 CO 0.58 -1.96 0.92 0.00 0.21 0.00 0.00 175.17 174.93 1gjb n TYR 149 N -2.67 0.00 -4.21 4.23 4.11 -1.26 -4.98 117.16 112.38 1gjb n TYR 149 Ca 0.11 -0.44 -0.12 0.00 -0.00 0.00 0.00 57.90 57.45 1gjb n TYR 149 Cb 0.51 -0.05 -0.10 0.00 -0.00 0.00 0.00 39.34 39.70 1gjb n TYR 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1gjb s LEU 150 N -0.95 2.48 0.14 -3.48 2.01 -1.26 -5.16 118.68 112.45 1gjb s LEU 150 Ca 0.02 -1.03 0.05 0.00 0.01 0.00 0.00 54.13 53.18 1gjb s LEU 150 Cb 0.02 -0.19 -0.04 0.00 0.01 0.00 0.00 46.19 45.99 1gjb s LEU 150 CO 0.00 -0.42 0.11 -0.31 1.01 0.00 0.00 176.35 176.74 1gjb s TYR 151 N -3.50 3.14 0.86 0.29 2.02 -1.26 -4.68 117.35 114.22 1gjb s TYR 151 Ca 0.15 0.00 -0.10 0.00 -0.37 0.00 0.00 57.07 56.75 1gjb s TYR 151 Cb 0.04 -1.54 0.11 0.00 -0.40 0.00 0.00 41.96 40.18 1gjb s TYR 151 CO -0.02 0.52 1.12 -1.25 -1.57 0.00 0.00 175.55 174.36 1gjb s PRO 152 N -2.86 1.46 0.03 -1.71 0.04 -1.26 -4.95 135.00 125.76 1gjb s PRO 152 Ca 0.30 1.39 0.22 0.00 0.04 0.00 0.00 61.00 62.95 1gjb s PRO 152 Cb -0.11 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 1gjb s PRO 152 CO 0.23 -2.27 0.88 0.39 0.04 0.00 0.00 177.00 176.26 1gjb n GLU 153 N -3.97 0.35 -4.34 4.56 -0.58 -1.26 -4.70 120.64 110.69 1gjb n GLU 153 Ca 0.11 -0.04 -0.32 0.00 -0.42 0.00 0.00 57.16 56.49 1gjb n GLU 153 Cb 0.52 -1.58 -0.10 0.00 -0.57 0.00 0.00 31.44 29.72 1gjb n GLU 153 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1gjb s GLN 154 N -3.25 2.58 0.35 3.49 2.00 -1.26 -1.56 119.66 122.00 1gjb s GLN 154 Ca 0.01 -0.73 -0.28 0.00 -2.00 0.00 0.00 55.36 52.36 1gjb s GLN 154 Cb 0.14 -2.54 -0.10 0.00 0.80 0.00 0.00 33.01 31.31 1gjb s GLN 154 CO 0.84 0.59 1.35 -1.17 -0.50 0.00 0.00 175.29 176.40 1gjb s LEU 155 N -1.65 4.38 0.44 3.68 2.96 -0.73 -4.85 118.68 122.91 1gjb s LEU 155 Ca 0.19 2.77 0.05 0.00 -0.22 0.00 0.00 54.13 56.93 1gjb s LEU 155 Cb -0.11 -3.68 -0.06 0.00 0.50 0.00 0.00 46.19 42.84 1gjb s LEU 155 CO 0.10 -0.65 0.01 -0.54 -1.32 0.00 0.00 176.35 173.95 1gjb s LYS 156 N -1.92 2.04 0.06 1.98 1.02 -1.05 -0.33 119.74 121.54 1gjb s LYS 156 Ca 0.51 -2.19 -0.25 0.00 0.02 0.00 0.00 55.97 54.05 1gjb s LYS 156 Cb -0.41 -1.62 0.06 0.00 -0.52 0.00 0.00 37.83 35.34 1gjb s LYS 156 CO 0.55 -0.15 0.60 1.41 -0.92 0.00 0.00 175.35 176.84 1gjb s MET 157 N -3.77 1.14 0.26 1.68 -2.45 0.11 -2.91 119.30 113.36 1gjb s MET 157 Ca 0.26 -0.18 -0.19 0.00 -1.25 0.00 0.00 55.69 54.34 1gjb s MET 157 Cb 0.07 0.53 0.02 0.00 1.25 0.00 0.00 34.83 36.70 1gjb s MET 157 CO 0.14 -0.43 0.64 -0.08 1.05 0.00 0.00 175.02 176.33 1gjb s THR 158 N -2.57 0.00 -0.07 10.11 -1.32 -0.76 -0.65 115.64 120.39 1gjb s THR 158 Ca -0.05 -1.03 0.04 0.00 -1.21 0.00 0.00 61.69 59.45 1gjb s THR 158 Cb -0.01 -1.96 -0.02 0.00 -1.51 0.00 0.00 72.50 69.01 1gjb s THR 158 CO -0.02 -0.01 -0.18 -0.69 -2.21 0.00 0.00 174.62 171.50 1gjb s VAL 159 N -3.93 2.68 0.12 5.08 1.01 -1.26 -1.23 120.40 122.87 1gjb s VAL 159 Ca 0.13 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1gjb s VAL 159 Cb -0.04 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1gjb s VAL 159 CO 0.06 0.57 -0.05 0.54 0.00 0.00 0.00 175.10 176.21 1gjb s VAL 160 N -0.32 0.71 0.12 2.92 0.11 0.11 -4.90 120.40 119.14 1gjb s VAL 160 Ca 0.02 -1.95 0.07 0.00 -2.93 0.00 0.00 61.98 57.19 1gjb s VAL 160 Cb -0.13 -1.79 -0.04 0.00 -1.53 0.00 0.00 36.38 32.89 1gjb s VAL 160 CO 0.02 -0.78 -0.08 -0.54 -3.33 0.00 0.00 175.10 170.39 1gjb s LYS 161 N -3.85 2.17 0.14 1.54 1.02 -0.18 -0.26 119.74 120.33 1gjb s LYS 161 Ca 0.15 -1.04 -0.30 0.00 0.02 0.00 0.00 55.97 54.80 1gjb s LYS 161 Cb 0.05 -2.31 -0.07 0.00 -0.52 0.00 0.00 37.83 34.98 1gjb s LYS 161 CO -0.03 0.50 0.97 -0.51 -0.92 0.00 0.00 175.35 175.37 1gjb s LEU 162 N -2.34 4.53 0.41 3.17 1.43 0.52 -1.23 118.68 125.18 1gjb s LEU 162 Ca 0.23 1.86 0.07 0.00 -1.03 0.00 0.00 54.13 55.26 1gjb s LEU 162 Cb -0.11 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.47 1gjb s LEU 162 CO 0.15 -0.04 0.22 0.27 0.23 0.00 0.00 176.35 177.18 1gjb s ILE 163 N -0.27 2.40 0.69 -0.59 -4.36 -0.80 -0.04 121.20 118.23 1gjb s ILE 163 Ca 0.46 -1.62 -0.05 0.00 -0.26 0.00 0.00 60.65 59.18 1gjb s ILE 163 Cb -0.25 -3.00 0.06 0.00 1.25 0.00 0.00 42.46 40.53 1gjb s ILE 163 CO 0.31 -0.00 0.98 -0.94 0.24 0.00 0.00 174.94 175.53 1gjb s SER 164 N -3.95 4.82 0.09 4.36 1.04 -1.26 -4.49 113.70 114.31 1gjb s SER 164 Ca 0.43 0.34 -0.15 0.00 0.48 0.00 0.00 55.95 57.05 1gjb s SER 164 Cb 0.02 -1.00 -0.11 0.00 0.10 0.00 0.00 66.02 65.04 1gjb s SER 164 CO 0.24 -1.57 1.37 0.45 0.98 0.00 0.00 173.24 174.71 1gjb h HIS 165 N -0.52 0.89 -0.89 5.02 -0.00 -1.97 -2.71 115.15 114.97 1gjb h HIS 165 Ca -0.44 -0.31 0.20 0.00 -0.00 0.00 0.00 60.37 59.83 1gjb h HIS 165 Cb 1.31 -0.17 -0.12 0.00 -0.00 0.00 0.00 27.41 28.43 1gjb h HIS 165 CO 0.28 1.08 0.41 -0.09 -0.00 0.00 0.00 177.93 179.61 1gjb h ARG 166 N 0.44 0.45 0.00 2.45 9.65 -1.96 0.25 114.38 125.66 1gjb h ARG 166 Ca 0.02 -0.03 -0.18 0.00 -1.10 0.00 0.00 59.98 58.69 1gjb h ARG 166 Cb 1.01 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.47 1gjb h ARG 166 CO 0.09 0.30 -0.83 1.49 2.80 0.00 0.00 179.97 183.82 1gjb h GLU 167 N 0.47 0.08 0.19 0.20 4.81 -1.91 -3.28 114.58 115.14 1gjb h GLU 167 Ca 0.53 -0.08 -0.31 0.00 -0.13 0.00 0.00 59.36 59.37 1gjb h GLU 167 Cb 0.95 0.02 0.02 0.00 0.63 0.00 0.00 28.75 30.38 1gjb h GLU 167 CO -0.48 0.86 -1.36 0.00 -0.73 0.00 0.00 179.01 177.30 1gjb n GLN 169 N -3.63 1.13 -2.13 0.00 6.02 0.75 -1.48 117.38 118.03 1gjb n GLN 169 Ca -0.13 -0.16 -0.36 0.00 -0.01 0.00 0.00 57.00 56.34 1gjb n GLN 169 Cb 1.06 -1.15 0.01 0.00 1.02 0.00 0.00 30.24 31.19 1gjb n GLN 169 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1gjb s GLN 170 N -1.75 3.29 0.25 -1.09 -0.21 -1.22 -3.53 119.66 115.40 1gjb s GLN 170 Ca 0.03 1.78 -0.03 0.00 0.02 0.00 0.00 55.36 57.15 1gjb s GLN 170 Cb 0.02 -2.09 0.44 0.00 1.00 0.00 0.00 33.01 32.38 1gjb s GLN 170 CO 0.02 -0.94 1.78 -1.00 -2.12 0.00 0.00 175.29 173.03 1gjb h PRO 170 N 1.30 0.66 -0.98 2.91 0.13 -1.91 -1.03 132.00 133.08 1gjb h PRO 170 Ca -0.50 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.58 1gjb h PRO 170 Cb 1.27 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1gjb h PRO 170 CO 0.57 0.44 0.02 -2.39 -0.23 0.00 0.00 178.00 176.41 1gjb n HIS 170 N -4.82 0.19 0.00 1.56 1.44 -1.26 -4.38 115.22 107.95 1gjb n HIS 170 Ca 0.15 -0.22 0.00 0.00 -2.01 0.00 0.00 57.72 55.63 1gjb n HIS 170 Cb 0.34 -0.18 0.00 0.00 0.12 0.00 0.00 29.99 30.27 1gjb n HIS 170 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1gjb n TYR 171 N 0.15 0.00 0.34 -1.40 4.02 -0.45 -4.87 117.16 114.94 1gjb n TYR 171 Ca 0.03 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.97 1gjb n TYR 171 Cb 0.41 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.77 1gjb n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1gjb n TYR 172 N 0.00 0.04 -0.43 -0.72 4.01 -0.55 -4.95 117.16 114.56 1gjb n TYR 172 Ca 0.00 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1gjb n TYR 172 Cb 0.00 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1gjb n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gjb n GLY 173 N 0.51 3.45 1.03 2.72 0.00 -0.83 -1.92 105.19 110.15 1gjb n GLY 173 Ca 0.06 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.03 1gjb n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gjb n SER 174 N 4.24 2.98 0.19 1.61 3.41 -1.26 -4.12 113.62 120.67 1gjb n SER 174 Ca 0.00 -2.17 0.05 0.00 -0.26 0.00 0.00 58.87 56.49 1gjb n SER 174 Cb 0.00 -0.40 0.38 0.00 -0.26 0.00 0.00 64.21 63.92 1gjb n SER 174 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1gjb h GLU 175 N 2.72 0.00 -5.69 4.33 4.39 -1.78 -3.41 114.58 115.14 1gjb h GLU 175 Ca 0.00 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.12 1gjb h GLU 175 Cb 0.87 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.43 1gjb h GLU 175 CO 0.09 0.36 -0.04 0.08 -1.16 0.00 0.00 179.01 178.35 1gjb s VAL 176 N -3.80 5.12 0.48 3.13 1.01 -1.26 -4.89 120.40 120.19 1gjb s VAL 176 Ca -0.01 1.05 0.03 0.00 0.00 0.00 0.00 61.98 63.05 1gjb s VAL 176 Cb 0.12 -3.87 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1gjb s VAL 176 CO 0.69 0.23 0.24 0.35 0.00 0.00 0.00 175.10 176.61 1gjb n THR 177 N 4.14 0.00 0.31 3.92 -2.24 -1.26 -4.96 114.28 114.19 1gjb n THR 177 Ca -0.05 -2.00 0.11 0.00 -2.27 0.00 0.00 64.05 59.85 1gjb n THR 177 Cb 0.51 0.09 0.51 0.00 -2.10 0.00 0.00 70.33 69.33 1gjb n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gjb n THR 178 N -1.47 0.93 -1.01 4.28 -2.24 -1.26 -2.56 114.28 110.95 1gjb n THR 178 Ca -0.07 0.40 -0.01 0.00 -2.27 0.00 0.00 64.05 62.09 1gjb n THR 178 Cb 0.56 -1.35 0.34 0.00 -2.10 0.00 0.00 70.33 67.77 1gjb n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1gjb n LYS 179 N -2.20 4.06 -4.22 -0.78 5.02 -1.26 -4.91 118.16 113.87 1gjb n LYS 179 Ca 0.01 -3.12 -0.12 0.00 -2.02 0.00 0.00 58.31 53.06 1gjb n LYS 179 Cb 0.16 -2.22 -0.10 0.00 -0.02 0.00 0.00 35.03 32.85 1gjb n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1gjb s MET 180 N -2.93 1.02 0.07 1.97 -1.94 -1.06 -2.20 119.30 114.23 1gjb s MET 180 Ca 0.55 -1.47 0.02 0.00 -1.71 0.00 0.00 55.69 53.08 1gjb s MET 180 Cb 0.43 -0.22 -0.03 0.00 2.01 0.00 0.00 34.83 37.02 1gjb s MET 180 CO 0.14 -0.11 -0.08 -0.51 -0.01 0.00 0.00 175.02 174.46 1gjb s LEU 181 N -3.13 2.38 0.08 -0.03 1.43 0.52 -4.69 118.68 115.24 1gjb s LEU 181 Ca 0.21 -0.77 0.09 0.00 -1.03 0.00 0.00 54.13 52.63 1gjb s LEU 181 Cb 0.06 -0.14 -0.03 0.00 0.03 0.00 0.00 46.19 46.11 1gjb s LEU 181 CO 0.01 -0.32 -0.24 0.00 0.23 0.00 0.00 176.35 176.03 1gjb s ALA 183 N -0.94 -0.44 0.31 0.00 0.00 -0.51 -1.90 121.76 118.27 1gjb s ALA 183 Ca 0.11 0.48 -0.09 0.00 0.00 0.00 0.00 51.96 52.45 1gjb s ALA 183 Cb -0.10 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1gjb s ALA 183 CO 0.04 -0.09 0.53 0.00 0.00 0.00 0.00 175.76 176.23 1gjb s ALA 184 N 0.04 0.07 -0.19 0.00 0.00 -0.36 -1.01 121.76 120.32 1gjb s ALA 184 Ca -0.01 -1.11 -0.07 0.00 0.00 0.00 0.00 51.96 50.78 1gjb s ALA 184 Cb -0.01 1.04 -0.04 0.00 0.00 0.00 0.00 23.12 24.11 1gjb s ALA 184 CO 0.00 -0.85 0.06 0.34 0.00 0.00 0.00 175.76 175.31 1gjb s ASP 185 N -3.11 5.52 0.24 0.00 -1.08 -1.26 -1.01 116.67 115.97 1gjb s ASP 185 Ca 0.24 0.04 0.11 0.00 -0.52 0.00 0.00 52.55 52.42 1gjb s ASP 185 Cb -0.01 -1.95 0.83 0.00 -1.46 0.00 0.00 42.92 40.33 1gjb s ASP 185 CO 0.14 0.15 1.07 -2.65 0.52 0.00 0.00 175.17 174.40 1gjb n PRO 185 N 3.68 -0.04 -0.85 4.34 -0.02 -1.26 0.10 135.00 140.95 1gjb n PRO 185 Ca -0.17 0.96 -0.05 0.00 -2.02 0.00 0.00 63.50 62.22 1gjb n PRO 185 Cb 0.52 -1.67 0.23 0.00 -0.02 0.00 0.00 33.50 32.56 1gjb n PRO 185 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1gjb n GLN 185 N -4.63 2.54 -4.16 -0.52 6.02 -1.26 -4.96 117.38 110.42 1gjb n GLN 185 Ca 0.24 -3.06 -0.34 0.00 -0.01 0.00 0.00 57.00 53.83 1gjb n GLN 185 Cb 0.80 -1.97 -0.06 0.00 1.02 0.00 0.00 30.24 30.02 1gjb n GLN 185 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1gjb n TRP 186 N -0.79 -1.20 -0.07 1.08 7.02 0.12 -4.86 117.44 118.73 1gjb n TRP 186 Ca 0.37 0.41 -0.08 0.00 -1.02 0.00 0.00 57.50 57.18 1gjb n TRP 186 Cb 1.19 -2.60 -0.08 0.00 -2.42 0.00 0.00 31.31 27.41 1gjb n TRP 186 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1gjb n LYS 187 N -4.49 1.11 -4.38 -0.99 3.00 -1.26 -4.74 118.16 106.41 1gjb n LYS 187 Ca -0.25 0.05 -0.20 0.00 -0.00 0.00 0.00 58.31 57.91 1gjb n LYS 187 Cb 0.61 -1.29 -0.10 0.00 0.00 0.00 0.00 35.03 34.25 1gjb n LYS 187 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1gjb s THR 188 N -2.29 1.81 -0.02 3.15 -1.32 -1.26 -4.42 115.64 111.30 1gjb s THR 188 Ca -0.14 -2.22 -0.21 0.00 -1.21 0.00 0.00 61.69 57.91 1gjb s THR 188 Cb 0.04 -2.17 0.07 0.00 -1.51 0.00 0.00 72.50 68.93 1gjb s THR 188 CO 0.40 -0.51 0.95 -0.67 -2.21 0.00 0.00 174.62 172.58 1gjb n ASP 189 N -0.46 -0.88 -4.94 8.08 2.03 -1.15 -4.20 116.55 115.04 1gjb n ASP 189 Ca -0.07 -1.18 -0.20 0.00 0.52 0.00 0.00 54.79 53.86 1gjb n ASP 189 Cb 0.61 1.36 0.05 0.00 -0.72 0.00 0.00 41.12 42.42 1gjb n ASP 189 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1gjb s SER 190 N -3.09 5.15 0.28 1.67 1.04 -1.26 -2.20 113.70 115.28 1gjb s SER 190 Ca 0.22 -0.44 -0.19 0.00 0.48 0.00 0.00 55.95 56.02 1gjb s SER 190 Cb -0.01 -0.30 0.07 0.00 0.10 0.00 0.00 66.02 65.89 1gjb s SER 190 CO -0.01 -1.24 0.93 0.00 0.98 0.00 0.00 173.24 173.90 1gjb n GLN 192 N -0.63 1.26 0.00 0.00 7.27 -1.26 -0.13 117.38 123.90 1gjb n GLN 192 Ca -0.05 0.46 0.00 0.00 0.07 0.00 0.00 57.00 57.47 1gjb n GLN 192 Cb 0.60 -2.13 0.00 0.00 2.41 0.00 0.00 30.24 31.11 1gjb n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1gjb n GLY 193 N 3.15 2.96 0.05 1.69 0.00 -1.26 -0.92 105.19 110.85 1gjb n GLY 193 Ca 0.21 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.35 1gjb n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gjb n ASP 194 N 0.00 0.65 -4.43 1.61 8.00 0.82 -4.04 116.55 119.15 1gjb n ASP 194 Ca 0.00 -0.02 -0.50 0.00 0.71 0.00 0.00 54.79 54.97 1gjb n ASP 194 Cb 0.00 0.36 -0.04 0.00 -0.02 0.00 0.00 41.12 41.42 1gjb n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1gjb n SER 195 N -1.99 -0.85 0.00 -2.24 7.64 -1.26 -1.35 113.62 113.58 1gjb n SER 195 Ca 0.03 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.05 1gjb n SER 195 Cb 0.42 -0.96 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1gjb n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gjb n GLY 196 N 1.87 2.85 3.84 0.23 0.00 -0.54 -2.10 105.19 111.34 1gjb n GLY 196 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1gjb n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gjb s GLY 197 N -1.91 1.63 0.59 -0.02 0.00 -0.46 -2.77 107.32 104.39 1gjb s GLY 197 Ca 0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 44.72 44.39 1gjb s GLY 197 CO 0.00 0.15 0.96 2.56 0.00 0.00 0.00 173.10 176.76 1gjb s PRO 198 N -5.24 3.39 -0.20 2.90 0.04 -1.26 -0.46 135.00 134.16 1gjb s PRO 198 Ca 0.59 0.46 0.00 0.00 0.04 0.00 0.00 61.00 62.09 1gjb s PRO 198 Cb -0.13 -2.18 0.05 0.00 0.04 0.00 0.00 34.50 32.28 1gjb s PRO 198 CO 0.53 -0.56 -0.07 -1.17 0.04 0.00 0.00 177.00 175.78 1gjb s LEU 199 N -5.06 2.14 -0.06 -3.56 2.96 0.14 -3.52 118.68 111.71 1gjb s LEU 199 Ca 0.53 -0.92 0.04 0.00 -0.22 0.00 0.00 54.13 53.57 1gjb s LEU 199 Cb -0.11 -1.10 -0.02 0.00 0.50 0.00 0.00 46.19 45.47 1gjb s LEU 199 CO 0.50 -0.19 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.46 1gjb s VAL 200 N 1.48 2.61 0.24 1.68 1.01 -0.32 -0.51 120.40 126.59 1gjb s VAL 200 Ca -0.02 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 1gjb s VAL 200 Cb -0.17 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 1gjb s VAL 200 CO -0.07 0.57 0.22 0.00 0.00 0.00 0.00 175.10 175.82 1gjb s SER 202 N -3.20 5.80 -0.05 0.00 1.04 -1.26 0.03 113.70 116.06 1gjb s SER 202 Ca 0.37 0.30 -0.01 0.00 0.48 0.00 0.00 55.95 57.10 1gjb s SER 202 Cb 0.05 -1.76 0.03 0.00 0.10 0.00 0.00 66.02 64.43 1gjb s SER 202 CO 0.16 0.39 0.02 -0.76 0.98 0.00 0.00 173.24 174.03 1gjb s LEU 203 N -0.96 0.60 -1.24 2.42 1.43 0.01 -4.83 118.68 116.11 1gjb s LEU 203 Ca 0.14 -0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.15 1gjb s LEU 203 Cb -0.12 -0.27 0.06 0.00 0.03 0.00 0.00 46.19 45.89 1gjb s LEU 203 CO 0.03 -0.19 0.42 0.00 0.23 0.00 0.00 176.35 176.85 1gjb n GLN 204 N 4.91 -3.27 0.00 1.70 6.02 -1.26 -1.58 117.38 123.89 1gjb n GLN 204 Ca -0.11 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.37 1gjb n GLN 204 Cb 0.50 -5.18 0.00 0.00 1.02 0.00 0.00 30.24 26.58 1gjb n GLN 204 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1gjb n GLY 205 N -1.12 3.27 3.95 1.08 0.00 -1.26 -5.06 105.19 106.05 1gjb n GLY 205 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1gjb n GLY 205 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gjb s ARG 206 N -0.58 3.03 -0.32 1.61 0.52 -0.62 -5.04 118.95 117.55 1gjb s ARG 206 Ca 0.00 -0.52 -0.14 0.00 -0.52 0.00 0.00 55.73 54.56 1gjb s ARG 206 Cb 0.00 -2.56 -0.02 0.00 0.52 0.00 0.00 34.95 32.89 1gjb s ARG 206 CO 0.00 -0.30 0.30 -1.64 0.02 0.00 0.00 175.30 173.68 1gjb s MET 207 N -4.57 3.68 0.01 3.54 -1.94 -1.26 -0.81 119.30 117.96 1gjb s MET 207 Ca 0.49 -0.40 0.07 0.00 -1.71 0.00 0.00 55.69 54.14 1gjb s MET 207 Cb -0.10 -3.76 -0.03 0.00 2.01 0.00 0.00 34.83 32.96 1gjb s MET 207 CO 0.38 -0.40 -0.20 0.99 -0.01 0.00 0.00 175.02 175.78 1gjb s THR 208 N 1.89 2.64 -0.71 2.05 2.01 0.10 -2.92 115.64 120.70 1gjb s THR 208 Ca 0.10 -1.09 -0.27 0.00 0.31 0.00 0.00 61.69 60.73 1gjb s THR 208 Cb -0.17 -2.05 0.02 0.00 0.01 0.00 0.00 72.50 70.31 1gjb s THR 208 CO 0.11 0.44 1.38 -0.22 -0.69 0.00 0.00 174.62 175.64 1gjb s LEU 209 N -1.11 3.19 -0.08 4.42 0.20 -0.19 -1.36 118.68 123.74 1gjb s LEU 209 Ca 0.13 -0.30 0.06 0.00 0.69 0.00 0.00 54.13 54.70 1gjb s LEU 209 Cb -0.10 -2.56 -0.24 0.00 -0.43 0.00 0.00 46.19 42.85 1gjb s LEU 209 CO 0.03 -1.93 0.52 0.41 -0.29 0.00 0.00 176.35 175.08 1gjb n THR 210 N 6.53 1.66 -4.12 3.68 -1.04 0.33 -4.46 114.28 116.87 1gjb n THR 210 Ca 0.06 -0.75 -0.11 0.00 -2.04 0.00 0.00 64.05 61.22 1gjb n THR 210 Cb 0.50 -1.27 -0.09 0.00 -1.82 0.00 0.00 70.33 67.65 1gjb n THR 210 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1gjb s GLY 211 N -5.32 1.03 -0.05 3.41 0.00 -0.93 -2.74 107.32 102.73 1gjb s GLY 211 Ca -0.12 -1.39 0.06 0.00 0.00 0.00 0.00 44.72 43.27 1gjb s GLY 211 CO 0.80 -1.19 -0.23 -0.42 0.00 0.00 0.00 173.10 172.06 1gjb s ILE 212 N -4.08 1.88 0.22 0.90 1.01 -1.19 -0.68 121.20 119.25 1gjb s ILE 212 Ca 0.29 -0.97 -0.31 0.00 0.00 0.00 0.00 60.65 59.66 1gjb s ILE 212 Cb 0.05 -1.59 -0.10 0.00 0.01 0.00 0.00 42.46 40.83 1gjb s ILE 212 CO 0.07 0.53 1.53 -0.69 0.00 0.00 0.00 174.94 176.37 1gjb s VAL 213 N -0.17 2.53 0.16 2.92 1.01 0.39 -2.05 120.40 125.20 1gjb s VAL 213 Ca -0.02 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1gjb s VAL 213 Cb -0.13 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1gjb s VAL 213 CO 0.03 0.05 0.00 -0.24 0.00 0.00 0.00 175.10 174.94 1gjb n SER 214 N 3.07 0.54 -2.43 3.32 2.88 -0.79 -1.46 113.62 118.76 1gjb n SER 214 Ca 0.10 0.25 -0.09 0.00 -1.33 0.00 0.00 58.87 57.80 1gjb n SER 214 Cb 0.39 -0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.81 1gjb n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1gjb n TRP 215 N -3.39 -1.48 0.00 0.66 4.27 -1.00 -4.91 117.44 111.58 1gjb n TRP 215 Ca 0.00 -1.63 0.00 0.00 -3.89 0.00 0.00 57.50 51.98 1gjb n TRP 215 Cb 0.00 0.51 0.00 0.00 -1.36 0.00 0.00 31.31 30.46 1gjb n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1gjb n GLY 216 N -0.42 2.09 3.44 -1.67 0.00 -1.26 -1.40 105.19 105.97 1gjb n GLY 216 Ca -0.02 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 1gjb n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1gjb s ARG 217 N -2.00 2.95 1.61 1.61 3.52 -1.26 -4.93 118.95 120.46 1gjb s ARG 217 Ca 0.00 -1.08 0.00 0.00 -0.13 0.00 0.00 55.73 54.52 1gjb s ARG 217 Cb 0.00 -3.98 0.00 0.00 -1.56 0.00 0.00 34.95 29.41 1gjb s ARG 217 CO 0.00 -0.79 0.00 0.41 -0.81 0.00 0.00 175.30 174.11 1gjb n GLY 219 N 5.15 -1.41 2.87 8.12 0.00 -1.26 -4.60 105.19 114.07 1gjb n GLY 219 Ca -0.11 -1.23 -0.20 0.00 0.00 0.00 0.00 46.02 44.47 1gjb n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gjb n ALA 221 N 4.19 -1.91 -2.64 0.00 0.00 -1.26 -4.88 120.51 114.00 1gjb n ALA 221 Ca -0.23 -0.17 -0.23 0.00 0.00 0.00 0.00 53.44 52.80 1gjb n ALA 221 Cb 0.51 -2.03 -0.01 0.00 0.00 0.00 0.00 19.45 17.92 1gjb n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gjb s LEU 222 N -6.89 4.00 0.10 0.00 1.43 -1.26 -4.71 118.68 111.35 1gjb s LEU 222 Ca 0.10 0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 53.28 1gjb s LEU 222 Cb -0.05 -3.25 -0.06 0.00 0.03 0.00 0.00 46.19 42.87 1gjb s LEU 222 CO 0.85 -0.33 1.05 -0.75 0.23 0.00 0.00 176.35 177.41 1gjb s LYS 223 N -4.31 4.59 -1.58 1.70 2.20 -1.26 -3.23 119.74 117.84 1gjb s LYS 223 Ca 0.41 1.59 -0.04 0.00 -0.36 0.00 0.00 55.97 57.57 1gjb s LYS 223 Cb -0.10 -3.36 0.01 0.00 -1.51 0.00 0.00 37.83 32.88 1gjb s LYS 223 CO 0.36 0.03 0.46 -0.25 -0.36 0.00 0.00 175.35 175.58 1gjb n ASP 223 N 3.10 -5.87 -3.22 1.43 8.00 -1.26 -4.92 116.55 113.82 1gjb n ASP 223 Ca 0.04 -0.22 -0.23 0.00 0.71 0.00 0.00 54.79 55.09 1gjb n ASP 223 Cb 0.48 -4.78 -0.07 0.00 -0.02 0.00 0.00 41.12 36.73 1gjb n ASP 223 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1gjb n LYS 224 N -3.77 0.51 -0.50 -1.24 4.76 -1.20 -4.26 118.16 112.46 1gjb n LYS 224 Ca -0.14 -3.06 -0.28 0.00 -2.87 0.00 0.00 58.31 51.96 1gjb n LYS 224 Cb 0.63 -1.41 0.22 0.00 -1.84 0.00 0.00 35.03 32.63 1gjb n LYS 224 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1gjb n PRO 225 N 2.02 -2.65 -3.81 1.97 -0.02 -1.26 -4.27 135.00 126.99 1gjb n PRO 225 Ca 0.23 -0.77 -0.33 0.00 -2.02 0.00 0.00 63.50 60.62 1gjb n PRO 225 Cb 0.52 -1.81 -0.05 0.00 -0.02 0.00 0.00 33.50 32.14 1gjb n PRO 225 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1gjb s GLY 226 N -2.23 2.22 -0.09 -1.23 0.00 -0.18 -4.50 107.32 101.30 1gjb s GLY 226 Ca 0.58 -0.68 0.01 0.00 0.00 0.00 0.00 44.72 44.62 1gjb s GLY 226 CO 0.58 -0.59 -0.11 0.14 0.00 0.00 0.00 173.10 173.13 1gjb s VAL 227 N -1.45 3.30 0.15 1.40 1.01 -0.49 -1.43 120.40 122.88 1gjb s VAL 227 Ca 0.33 -0.61 0.10 0.00 0.00 0.00 0.00 61.98 61.80 1gjb s VAL 227 Cb -0.13 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1gjb s VAL 227 CO 0.22 0.56 -0.24 -0.31 0.00 0.00 0.00 175.10 175.34 1gjb s TYR 228 N -0.28 2.13 0.28 5.22 1.51 0.05 -1.88 117.35 124.38 1gjb s TYR 228 Ca 0.03 -0.39 -0.29 0.00 -1.01 0.00 0.00 57.07 55.40 1gjb s TYR 228 Cb -0.13 -1.11 -0.09 0.00 -0.11 0.00 0.00 41.96 40.52 1gjb s TYR 228 CO 0.03 0.36 1.08 0.99 -1.11 0.00 0.00 175.55 176.89 1gjb s THR 229 N -1.39 3.55 -0.92 -0.71 2.01 -0.87 -0.36 115.64 116.94 1gjb s THR 229 Ca 0.15 1.54 -0.18 0.00 0.31 0.00 0.00 61.69 63.50 1gjb s THR 229 Cb -0.09 -3.97 0.14 0.00 0.01 0.00 0.00 72.50 68.59 1gjb s THR 229 CO 0.07 0.35 1.10 -0.60 -0.69 0.00 0.00 174.62 174.85 1gjb s ARG 230 N -1.50 3.60 0.29 4.92 3.52 -0.93 -3.18 118.95 125.66 1gjb s ARG 230 Ca 0.45 -1.82 0.03 0.00 -0.13 0.00 0.00 55.73 54.26 1gjb s ARG 230 Cb -0.31 -4.88 0.65 0.00 -1.56 0.00 0.00 34.95 28.85 1gjb s ARG 230 CO 0.39 -1.74 1.77 0.28 -0.81 0.00 0.00 175.30 175.20 1gjb h VAL 231 N 5.75 0.72 -0.42 7.11 2.07 -1.83 -1.83 116.25 127.82 1gjb h VAL 231 Ca 0.15 -0.24 0.12 0.00 0.82 0.00 0.00 66.70 67.55 1gjb h VAL 231 Cb 1.02 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1gjb h VAL 231 CO 1.08 0.13 0.47 0.77 0.02 0.00 0.00 177.57 180.04 1gjb h SER 232 N 0.71 0.00 -0.21 0.57 4.64 -1.86 0.97 113.55 118.37 1gjb h SER 232 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 1gjb h SER 232 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1gjb h SER 232 CO -0.37 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.00 1gjb n HIS 233 N -3.67 0.27 -0.02 4.77 -0.00 -0.69 -1.01 115.22 114.88 1gjb n HIS 233 Ca 0.08 -0.14 0.00 0.00 -0.00 0.00 0.00 57.72 57.66 1gjb n HIS 233 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.64 1gjb n HIS 233 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1gjb n PHE 234 N 0.62 0.00 -0.28 4.41 3.01 0.32 -4.80 117.46 120.74 1gjb n PHE 234 Ca 0.17 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.72 1gjb n PHE 234 Cb 0.40 0.00 0.23 0.00 -0.01 0.00 0.00 39.48 40.10 1gjb n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1gjb h LEU 235 N 0.00 -0.15 -0.41 4.37 -0.00 -1.66 0.59 115.31 118.05 1gjb h LEU 235 Ca 0.00 0.20 0.06 0.00 -0.00 0.00 0.00 57.88 58.14 1gjb h LEU 235 Cb 0.01 0.30 -0.09 0.00 -0.00 0.00 0.00 40.66 40.88 1gjb h LEU 235 CO 0.00 -0.16 -0.48 -0.65 -0.00 0.00 0.00 178.44 177.14 1gjb h PRO 236 N 0.17 -0.35 0.03 1.13 0.11 -1.90 -0.21 132.00 130.98 1gjb h PRO 236 Ca 0.49 0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.64 1gjb h PRO 236 Cb 0.94 0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 1gjb h PRO 236 CO -0.66 -0.23 -0.44 2.35 -0.21 0.00 0.00 178.00 178.81 1gjb h TRP 237 N -0.36 -1.30 -0.35 0.65 7.01 -1.30 0.10 115.95 120.40 1gjb h TRP 237 Ca 0.11 0.04 0.04 0.00 2.11 0.00 0.00 58.89 61.19 1gjb h TRP 237 Cb 0.59 0.56 -0.06 0.00 -2.10 0.00 0.00 29.16 28.16 1gjb h TRP 237 CO -0.67 -0.48 -0.36 0.82 -2.79 0.00 0.00 178.44 174.96 1gjb h ILE 238 N -0.58 0.00 -0.76 2.65 2.04 -1.00 -1.02 117.51 118.84 1gjb h ILE 238 Ca 0.00 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.99 1gjb h ILE 238 Cb 0.61 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.55 1gjb h ILE 238 CO -0.28 0.00 -0.35 0.03 0.00 0.00 0.00 178.15 177.55 1gjb h ARG 239 N -0.20 -0.09 -1.21 2.37 3.08 -0.69 0.22 114.38 117.86 1gjb h ARG 239 Ca 0.06 0.01 0.35 0.00 0.07 0.00 0.00 59.98 60.47 1gjb h ARG 239 Cb 0.36 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.38 1gjb h ARG 239 CO -0.43 -0.06 0.91 0.77 -1.07 0.00 0.00 179.97 180.08 1gjb h SER 240 N -0.09 0.00 0.00 7.04 0.02 0.40 -2.44 113.55 118.48 1gjb h SER 240 Ca 0.28 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 61.04 1gjb h SER 240 Cb 0.57 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.07 1gjb h SER 240 CO -0.81 0.00 -1.95 1.41 -1.14 0.00 0.00 176.83 174.34 1gjb n HIS 241 N -4.07 0.00 -2.91 3.45 8.25 0.60 -4.63 115.22 115.92 1gjb n HIS 241 Ca 0.26 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.32 1gjb n HIS 241 Cb 1.30 -0.63 0.00 0.00 1.12 0.00 0.00 29.99 31.78 1gjb n HIS 241 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1gjb n THR 242 N -2.41 5.26 0.74 1.59 -1.04 -0.24 -5.13 114.28 113.05 1gjb n THR 242 Ca -0.18 -5.88 0.09 0.00 -2.04 0.00 0.00 64.05 56.03 1gjb n THR 242 Cb 0.82 -1.85 0.07 0.00 -1.82 0.00 0.00 70.33 67.55 1gjb n THR 242 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60