#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gjr s VAL 10 N 0.00 5.10 -0.03 2.12 1.01 -1.26 -5.02 120.40 122.32 1gjr s VAL 10 Ca 0.00 0.81 -0.30 0.00 0.00 0.00 0.00 61.98 62.49 1gjr s VAL 10 Cb 0.00 -3.79 -0.06 0.00 0.00 0.00 0.00 36.38 32.53 1gjr s VAL 10 CO 0.00 0.11 1.61 -2.16 0.00 0.00 0.00 175.10 174.66 1gjr s PRO 11 N 2.18 4.20 -0.02 2.72 0.04 -1.26 -5.01 135.00 137.85 1gjr s PRO 11 Ca 0.20 2.17 0.02 0.00 0.04 0.00 0.00 61.00 63.42 1gjr s PRO 11 Cb -0.16 -3.86 0.00 0.00 0.04 0.00 0.00 34.50 30.52 1gjr s PRO 11 CO 0.09 -0.79 -0.06 0.08 0.04 0.00 0.00 177.00 176.36 1gjr s VAL 12 N 3.58 0.54 -1.00 -0.36 1.01 -1.26 -4.70 120.40 118.22 1gjr s VAL 12 Ca 0.72 -0.25 -0.04 0.00 0.00 0.00 0.00 61.98 62.41 1gjr s VAL 12 Cb -0.34 -0.49 0.00 0.00 0.00 0.00 0.00 36.38 35.56 1gjr s VAL 12 CO 0.29 0.17 0.51 0.59 0.00 0.00 0.00 175.10 176.67 1gjr n ASN 13 N 3.21 -4.68 -0.22 3.32 3.02 0.68 -4.88 115.26 115.72 1gjr n ASN 13 Ca -0.17 -0.24 -0.03 0.00 -0.03 0.00 0.00 54.58 54.12 1gjr n ASN 13 Cb 0.56 -3.47 0.17 0.00 -0.61 0.00 0.00 39.78 36.42 1gjr n ASN 13 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1gjr h LEU 14 N -1.17 0.92 -8.65 3.41 3.38 -1.59 -3.40 115.31 108.21 1gjr h LEU 14 Ca -0.36 -0.11 -0.68 0.00 0.09 0.00 0.00 57.88 56.82 1gjr h LEU 14 Cb 1.24 -0.23 -0.28 0.00 0.09 0.00 0.00 40.66 41.48 1gjr h LEU 14 CO 0.38 0.79 -0.82 -0.31 0.09 0.00 0.00 178.44 178.56 1gjr s TYR 15 N -5.55 2.59 0.25 1.13 2.02 -0.71 -4.99 117.35 112.09 1gjr s TYR 15 Ca -0.11 -0.52 0.08 0.00 -0.37 0.00 0.00 57.07 56.15 1gjr s TYR 15 Cb 0.16 -1.65 -0.04 0.00 -0.40 0.00 0.00 41.96 40.03 1gjr s TYR 15 CO 0.81 -0.08 0.09 1.03 -1.57 0.00 0.00 175.55 175.82 1gjr s ARG 16 N -0.25 2.59 0.55 -0.62 0.52 -1.26 -1.08 118.95 119.40 1gjr s ARG 16 Ca 0.00 -1.22 0.23 0.00 -0.52 0.00 0.00 55.73 54.23 1gjr s ARG 16 Cb -0.13 -2.36 1.54 0.00 0.52 0.00 0.00 34.95 34.51 1gjr s ARG 16 CO 0.03 0.39 2.19 -1.35 0.02 0.00 0.00 175.30 176.58 1gjr h PRO 17 N 1.81 0.00 0.00 3.54 0.11 -1.98 -1.75 132.00 133.73 1gjr h PRO 17 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1gjr h PRO 17 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1gjr h PRO 17 CO 0.60 0.02 -0.06 -2.95 -0.21 0.00 0.00 178.00 175.41 1gjr h ASN 18 N 0.00 0.00 -0.74 -2.05 -1.07 -2.01 -3.34 115.58 106.36 1gjr h ASN 18 Ca -0.00 0.00 -0.33 0.00 0.07 0.00 0.00 56.30 56.04 1gjr h ASN 18 Cb 0.04 0.00 -0.23 0.00 -2.07 0.00 0.00 38.32 36.06 1gjr h ASN 18 CO 0.00 0.06 -0.70 0.00 0.07 0.00 0.00 177.43 176.86 1gjr n ALA 19 N -2.14 -0.13 -1.02 4.14 0.00 -0.68 -5.15 120.51 115.53 1gjr n ALA 19 Ca -0.00 -2.05 -0.31 0.00 0.00 0.00 0.00 53.44 51.08 1gjr n ALA 19 Cb 0.28 -1.17 0.12 0.00 0.00 0.00 0.00 19.45 18.68 1gjr n ALA 19 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1gjr s PRO 20 N 0.11 1.69 0.36 0.00 0.04 -1.08 -4.26 135.00 131.85 1gjr s PRO 20 Ca 0.33 1.42 -0.27 0.00 0.04 0.00 0.00 61.00 62.52 1gjr s PRO 20 Cb 0.19 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.83 1gjr s PRO 20 CO -0.19 -2.11 1.20 0.12 0.04 0.00 0.00 177.00 176.06 1gjr s PHE 21 N -2.66 3.15 -0.55 0.56 5.36 -0.41 -4.84 117.98 118.58 1gjr s PHE 21 Ca 0.65 1.54 -0.15 0.00 -0.96 0.00 0.00 56.93 58.01 1gjr s PHE 21 Cb -0.21 -3.46 0.14 0.00 -0.34 0.00 0.00 43.02 39.14 1gjr s PHE 21 CO 0.55 -1.35 0.51 0.42 -1.46 0.00 0.00 175.22 173.88 1gjr s ILE 22 N -1.28 5.14 0.76 3.12 -1.09 -1.26 -0.34 121.20 126.25 1gjr s ILE 22 Ca 0.52 -1.60 -0.10 0.00 -2.23 0.00 0.00 60.65 57.25 1gjr s ILE 22 Cb -0.34 -4.30 0.07 0.00 -1.58 0.00 0.00 42.46 36.32 1gjr s ILE 22 CO 0.43 -0.87 1.11 -0.83 -1.23 0.00 0.00 174.94 173.55 1gjr s GLY 23 N 3.41 1.63 -0.06 6.18 0.00 0.40 -4.85 107.32 114.03 1gjr s GLY 23 Ca 0.04 -0.74 0.03 0.00 0.00 0.00 0.00 44.72 44.05 1gjr s GLY 23 CO 0.02 -0.29 -0.14 1.25 0.00 0.00 0.00 173.10 173.94 1gjr s LYS 24 N -5.44 1.70 0.11 2.90 2.20 -1.24 -0.93 119.74 119.05 1gjr s LYS 24 Ca 0.61 -0.48 -0.31 0.00 -0.36 0.00 0.00 55.97 55.43 1gjr s LYS 24 Cb -0.11 -1.43 -0.09 0.00 -1.51 0.00 0.00 37.83 34.70 1gjr s LYS 24 CO 0.47 0.10 1.54 0.08 -0.36 0.00 0.00 175.35 177.19 1gjr s VAL 25 N 0.42 2.98 -0.21 4.02 1.01 0.68 -1.48 120.40 127.82 1gjr s VAL 25 Ca -0.10 0.62 -0.20 0.00 0.00 0.00 0.00 61.98 62.30 1gjr s VAL 25 Cb -0.14 -3.40 -0.17 0.00 0.00 0.00 0.00 36.38 32.68 1gjr s VAL 25 CO 0.03 0.03 0.12 -0.38 0.00 0.00 0.00 175.10 174.90 1gjr n ILE 26 N 4.24 1.52 -3.75 2.22 5.41 0.74 -0.48 119.36 129.27 1gjr n ILE 26 Ca 0.14 -0.03 -0.13 0.00 1.00 0.00 0.00 62.75 63.73 1gjr n ILE 26 Cb 0.40 -2.07 -0.09 0.00 -0.71 0.00 0.00 39.64 37.17 1gjr n ILE 26 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1gjr s SER 27 N -6.78 -0.27 -0.29 4.38 1.04 -1.14 -4.68 113.70 105.96 1gjr s SER 27 Ca -0.28 0.34 -0.00 0.00 0.48 0.00 0.00 55.95 56.49 1gjr s SER 27 Cb 0.06 0.48 0.09 0.00 0.10 0.00 0.00 66.02 66.75 1gjr s SER 27 CO 0.54 -0.32 0.07 0.21 0.98 0.00 0.00 173.24 174.72 1gjr s ASN 28 N -0.73 3.97 0.03 7.02 3.04 -1.26 -1.16 114.94 125.85 1gjr s ASN 28 Ca -0.08 -1.55 0.07 0.00 0.04 0.00 0.00 52.86 51.34 1gjr s ASN 28 Cb -0.04 -0.96 -0.03 0.00 -1.54 0.00 0.00 41.25 38.68 1gjr s ASN 28 CO 0.03 -0.38 -0.20 -1.61 -3.04 0.00 0.00 177.10 171.90 1gjr s GLU 29 N 1.54 2.03 0.33 0.43 0.41 -0.36 -4.96 118.70 118.11 1gjr s GLU 29 Ca 0.07 -1.00 -0.27 0.00 -0.41 0.00 0.00 54.97 53.36 1gjr s GLU 29 Cb -0.18 -2.14 -0.09 0.00 -1.78 0.00 0.00 34.13 29.94 1gjr s GLU 29 CO -0.19 0.54 1.10 -1.25 -0.49 0.00 0.00 175.26 174.97 1gjr s PRO 30 N -1.32 4.44 -0.01 0.39 0.04 -1.26 -0.63 135.00 136.64 1gjr s PRO 30 Ca 0.13 1.74 0.09 0.00 0.04 0.00 0.00 61.00 63.00 1gjr s PRO 30 Cb -0.10 -2.95 -0.14 0.00 0.04 0.00 0.00 34.50 31.35 1gjr s PRO 30 CO 0.04 0.05 0.19 1.28 0.04 0.00 0.00 177.00 178.59 1gjr n LEU 31 N 0.71 0.00 -4.49 -3.56 4.77 0.86 -4.84 117.00 110.44 1gjr n LEU 31 Ca 0.01 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.56 1gjr n LEU 31 Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.50 1gjr n LEU 31 CO 0.51 0.00 0.47 -0.69 -1.33 0.00 0.00 177.39 176.35 1gjr s VAL 32 N -2.60 4.72 1.04 4.08 1.01 -1.23 -4.62 120.40 122.81 1gjr s VAL 32 Ca -0.03 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 1gjr s VAL 32 Cb 0.06 -4.33 0.21 0.00 0.00 0.00 0.00 36.38 32.32 1gjr s VAL 32 CO 0.36 -0.81 1.16 -0.54 0.00 0.00 0.00 175.10 175.26 1gjr s LYS 33 N 3.07 0.06 0.35 2.72 1.02 -0.90 -4.88 119.74 121.18 1gjr s LYS 33 Ca 0.22 0.05 -0.28 0.00 0.02 0.00 0.00 55.97 55.99 1gjr s LYS 33 Cb -0.15 -1.73 -0.09 0.00 -0.52 0.00 0.00 37.83 35.33 1gjr s LYS 33 CO 0.17 -2.88 1.25 -2.00 -0.92 0.00 0.00 175.35 170.96 1gjr s GLU 34 N -5.40 4.25 0.00 1.68 2.56 -1.26 -1.64 118.70 118.89 1gjr s GLU 34 Ca 0.69 2.07 0.00 0.00 0.00 0.00 0.00 54.97 57.73 1gjr s GLU 34 Cb -0.11 -2.94 0.00 0.00 2.00 0.00 0.00 34.13 33.08 1gjr s GLU 34 CO 0.55 -0.23 0.00 0.41 -0.56 0.00 0.00 175.26 175.43 1gjr n GLY 35 N 0.79 2.20 3.89 -1.50 0.00 -1.26 -4.84 105.19 104.47 1gjr n GLY 35 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1gjr n GLY 35 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gjr s GLY 36 N -2.43 1.57 -0.26 -0.02 0.00 -0.65 -4.92 107.32 100.61 1gjr s GLY 36 Ca 0.00 -0.35 -0.22 0.00 0.00 0.00 0.00 44.72 44.15 1gjr s GLY 36 CO 0.00 -0.15 0.72 -0.42 0.00 0.00 0.00 173.10 173.25 1gjr s ILE 37 N -2.88 4.90 0.00 0.90 1.01 -1.26 -4.96 121.20 118.91 1gjr s ILE 37 Ca 0.50 1.29 0.00 0.00 0.00 0.00 0.00 60.65 62.44 1gjr s ILE 37 Cb -0.11 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.33 1gjr s ILE 37 CO 0.48 -0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.97 1gjr n GLY 38 N 4.02 -0.87 2.72 6.18 0.00 -1.26 -4.86 105.19 111.12 1gjr n GLY 38 Ca 0.02 -1.18 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 1gjr n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gjr s ILE 39 N 0.00 0.32 -0.13 -0.61 1.01 -1.26 -4.86 121.20 115.67 1gjr s ILE 39 Ca 0.00 -0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.50 1gjr s ILE 39 Cb 0.00 -0.70 0.02 0.00 0.01 0.00 0.00 42.46 41.79 1gjr s ILE 39 CO 0.00 -0.01 -0.15 -0.69 0.00 0.00 0.00 174.94 174.09 1gjr s VAL 40 N 1.97 1.55 0.07 2.92 1.01 -1.26 -0.21 120.40 126.45 1gjr s VAL 40 Ca 0.02 -0.65 0.09 0.00 0.00 0.00 0.00 61.98 61.45 1gjr s VAL 40 Cb -0.15 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1gjr s VAL 40 CO -0.07 0.45 -0.23 -1.10 0.00 0.00 0.00 175.10 174.15 1gjr s GLN 41 N 1.21 1.79 -0.37 2.72 -1.52 0.20 -0.10 119.66 123.59 1gjr s GLN 41 Ca -0.01 -1.13 -0.13 0.00 -1.95 0.00 0.00 55.36 52.13 1gjr s GLN 41 Cb -0.14 -2.04 0.00 0.00 -0.22 0.00 0.00 33.01 30.62 1gjr s GLN 41 CO -0.06 0.50 0.24 -1.58 -0.25 0.00 0.00 175.29 174.15 1gjr s HIS 42 N -0.93 3.23 -0.23 0.91 5.65 0.20 -1.02 115.29 123.10 1gjr s HIS 42 Ca 0.14 -0.51 -0.01 0.00 0.25 0.00 0.00 55.06 54.92 1gjr s HIS 42 Cb -0.10 -2.49 0.02 0.00 -1.18 0.00 0.00 32.58 28.82 1gjr s HIS 42 CO 0.05 -0.50 -0.09 0.42 -0.65 0.00 0.00 174.74 173.97 1gjr s ILE 43 N 1.67 2.80 -0.20 0.89 1.01 -0.71 -1.22 121.20 125.44 1gjr s ILE 43 Ca 0.05 -0.89 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 1gjr s ILE 43 Cb -0.18 -2.34 -0.05 0.00 0.01 0.00 0.00 42.46 39.90 1gjr s ILE 43 CO 0.09 0.33 0.20 -0.75 0.00 0.00 0.00 174.94 174.81 1gjr s LYS 44 N 1.35 4.17 -0.00 2.79 2.20 -0.31 -1.10 119.74 128.84 1gjr s LYS 44 Ca 0.02 -0.13 0.03 0.00 -0.36 0.00 0.00 55.97 55.53 1gjr s LYS 44 Cb -0.15 -3.47 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 1gjr s LYS 44 CO -0.06 0.19 -0.05 -0.06 -0.36 0.00 0.00 175.35 175.00 1gjr s PHE 45 N 0.67 2.93 -0.13 4.03 0.40 0.62 -0.18 117.98 126.32 1gjr s PHE 45 Ca 0.11 -0.01 -0.29 0.00 -0.60 0.00 0.00 56.93 56.13 1gjr s PHE 45 Cb -0.12 -1.63 -0.01 0.00 0.51 0.00 0.00 43.02 41.76 1gjr s PHE 45 CO 0.02 0.39 1.10 0.34 0.70 0.00 0.00 175.22 177.77 1gjr s ASP 46 N -1.40 7.12 -0.04 1.36 2.15 -0.55 -1.65 116.67 123.65 1gjr s ASP 46 Ca 0.17 1.59 0.21 0.00 0.43 0.00 0.00 52.55 54.95 1gjr s ASP 46 Cb -0.11 -2.55 -0.32 0.00 -0.30 0.00 0.00 42.92 39.64 1gjr s ASP 46 CO 0.08 -0.58 0.44 0.18 -0.17 0.00 0.00 175.17 175.11 1gjr n LEU 47 N 5.61 0.00 -4.74 -1.34 4.77 0.70 -3.68 117.00 118.33 1gjr n LEU 47 Ca 0.11 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.67 1gjr n LEU 47 Cb 0.47 0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1gjr n LEU 47 CO 0.53 0.03 1.06 0.35 -1.33 0.00 0.00 177.39 178.04 1gjr n THR 48 N -2.27 1.80 0.00 -5.08 -2.24 -1.23 -1.49 114.28 103.77 1gjr n THR 48 Ca -0.06 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1gjr n THR 48 Cb 0.59 -1.80 0.00 0.00 -2.10 0.00 0.00 70.33 67.02 1gjr n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gjr n GLY 49 N 0.91 2.59 0.00 3.38 0.00 -1.26 -4.71 105.19 106.10 1gjr n GLY 49 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1gjr n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gjr n GLY 50 N -1.77 0.00 3.97 -0.02 0.00 -0.65 -5.05 105.19 101.67 1gjr n GLY 50 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1gjr n GLY 50 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gjr n ASN 51 N -1.21 -0.90 -4.69 1.61 3.02 -0.55 -4.89 115.26 107.64 1gjr n ASN 51 Ca 0.00 -0.98 -0.42 0.00 -0.03 0.00 0.00 54.58 53.14 1gjr n ASN 51 Cb 0.09 -3.12 -0.03 0.00 -0.61 0.00 0.00 39.78 36.11 1gjr n ASN 51 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1gjr s LEU 52 N -7.00 4.37 -0.12 3.41 2.96 -1.26 -4.98 118.68 116.07 1gjr s LEU 52 Ca 0.12 2.51 -0.05 0.00 -0.22 0.00 0.00 54.13 56.48 1gjr s LEU 52 Cb -0.06 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.03 1gjr s LEU 52 CO 0.89 -0.90 0.08 -0.54 -1.32 0.00 0.00 176.35 174.55 1gjr s LYS 53 N 2.70 3.39 0.16 1.98 -0.14 -1.26 -5.04 119.74 121.53 1gjr s LYS 53 Ca 0.75 -0.26 -0.17 0.00 -1.36 0.00 0.00 55.97 54.92 1gjr s LYS 53 Cb -0.40 -3.06 0.03 0.00 -1.68 0.00 0.00 37.83 32.72 1gjr s LYS 53 CO 0.33 0.66 0.47 1.52 -0.76 0.00 0.00 175.35 177.56 1gjr s TYR 54 N -0.71 -0.17 0.34 3.18 1.13 -1.26 -4.55 117.35 115.30 1gjr s TYR 54 Ca 0.12 -0.15 0.04 0.00 -1.41 0.00 0.00 57.07 55.67 1gjr s TYR 54 Cb -0.12 0.33 -0.06 0.00 -1.10 0.00 0.00 41.96 41.02 1gjr s TYR 54 CO 0.03 -0.81 0.07 0.96 -2.51 0.00 0.00 175.55 173.29 1gjr s ILE 55 N -3.84 1.05 0.24 -3.49 -4.36 -1.26 -4.28 121.20 105.26 1gjr s ILE 55 Ca 0.06 -2.00 -0.31 0.00 -0.26 0.00 0.00 60.65 58.14 1gjr s ILE 55 Cb 0.00 -2.70 -0.11 0.00 1.25 0.00 0.00 42.46 40.90 1gjr s ILE 55 CO -0.08 0.00 1.59 -1.61 0.24 0.00 0.00 174.94 175.09 1gjr s GLU 56 N -3.87 4.17 0.00 0.37 8.01 -1.26 -2.63 118.70 123.48 1gjr s GLU 56 Ca 0.34 2.49 0.00 0.00 0.01 0.00 0.00 54.97 57.81 1gjr s GLU 56 Cb 0.08 -3.08 0.00 0.00 -4.31 0.00 0.00 34.13 26.82 1gjr s GLU 56 CO 0.15 -0.62 0.00 0.41 0.01 0.00 0.00 175.26 175.21 1gjr n GLY 57 N 2.98 1.75 3.91 -1.39 0.00 -1.26 -4.44 105.19 106.74 1gjr n GLY 57 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1gjr n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gjr s GLN 58 N -0.93 2.49 0.27 1.61 -0.21 -1.08 -4.54 119.66 117.27 1gjr s GLN 58 Ca 0.00 0.06 0.11 0.00 0.02 0.00 0.00 55.36 55.55 1gjr s GLN 58 Cb 0.00 -2.11 -0.05 0.00 1.00 0.00 0.00 33.01 31.85 1gjr s GLN 58 CO 0.00 -1.13 -0.14 -1.12 -2.12 0.00 0.00 175.29 170.78 1gjr s SER 59 N -4.44 3.88 0.17 5.90 0.01 0.12 -1.42 113.70 117.92 1gjr s SER 59 Ca 0.58 -0.90 0.10 0.00 1.31 0.00 0.00 55.95 57.05 1gjr s SER 59 Cb -0.11 -0.47 -0.04 0.00 0.21 0.00 0.00 66.02 65.61 1gjr s SER 59 CO 0.47 0.04 -0.22 0.27 0.41 0.00 0.00 173.24 174.21 1gjr s ILE 60 N -2.39 2.10 0.03 1.44 -4.36 -0.60 -0.07 121.20 117.35 1gjr s ILE 60 Ca 0.30 -1.92 -0.20 0.00 -0.26 0.00 0.00 60.65 58.57 1gjr s ILE 60 Cb -0.06 -1.96 -0.06 0.00 1.25 0.00 0.00 42.46 41.64 1gjr s ILE 60 CO 0.16 -0.16 0.58 -0.83 0.24 0.00 0.00 174.94 174.94 1gjr s GLY 61 N -2.53 2.64 -0.18 6.27 0.00 -0.60 -1.05 107.32 111.86 1gjr s GLY 61 Ca 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 44.72 44.91 1gjr s GLY 61 CO 0.08 0.63 -0.13 -0.42 0.00 0.00 0.00 173.10 173.26 1gjr s ILE 62 N -0.58 2.79 -0.36 0.90 -1.09 -0.25 -0.71 121.20 121.90 1gjr s ILE 62 Ca 0.30 -0.71 -0.14 0.00 -2.23 0.00 0.00 60.65 57.87 1gjr s ILE 62 Cb -0.19 -2.21 -0.01 0.00 -1.58 0.00 0.00 42.46 38.47 1gjr s ILE 62 CO 0.18 0.49 0.28 -0.63 -1.23 0.00 0.00 174.94 174.03 1gjr s ILE 63 N 1.07 5.26 0.64 2.92 1.01 -1.01 -0.64 121.20 130.45 1gjr s ILE 63 Ca -0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 60.65 60.28 1gjr s ILE 63 Cb -0.15 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.54 1gjr s ILE 63 CO -0.03 -0.10 0.99 -2.16 0.00 0.00 0.00 174.94 173.64 1gjr s PRO 64 N 1.77 3.00 0.81 2.79 0.04 -1.26 -4.30 135.00 137.85 1gjr s PRO 64 Ca 0.07 0.29 -0.11 0.00 0.04 0.00 0.00 61.00 61.29 1gjr s PRO 64 Cb -0.18 -2.15 0.08 0.00 0.04 0.00 0.00 34.50 32.30 1gjr s PRO 64 CO 0.11 -0.81 1.12 -1.25 0.04 0.00 0.00 177.00 176.21 1gjr s PRO 65 N -5.16 1.83 0.00 0.56 0.04 -1.26 -4.58 135.00 126.42 1gjr s PRO 65 Ca 0.55 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1gjr s PRO 65 Cb -0.11 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1gjr s PRO 65 CO 0.49 -2.00 0.00 0.41 0.04 0.00 0.00 177.00 175.94 1gjr n GLY 66 N -0.52 1.02 3.59 0.56 0.00 -1.26 -4.82 105.19 103.77 1gjr n GLY 66 Ca 0.11 -2.07 -0.27 0.00 0.00 0.00 0.00 46.02 43.79 1gjr n GLY 66 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gjr s VAL 67 N -1.56 1.78 0.04 1.61 -7.23 -1.26 -1.74 120.40 112.04 1gjr s VAL 67 Ca 0.00 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 1gjr s VAL 67 Cb 0.00 -2.91 0.01 0.00 0.56 0.00 0.00 36.38 34.03 1gjr s VAL 67 CO 0.00 0.00 0.05 -0.90 -0.31 0.00 0.00 175.10 173.94 1gjr n ASP 68 N -0.93 0.26 0.00 4.85 5.75 -0.10 -4.83 116.55 121.55 1gjr n ASP 68 Ca -0.05 -1.10 0.02 0.00 -0.01 0.00 0.00 54.79 53.65 1gjr n ASP 68 Cb 0.67 -0.02 0.12 0.00 -1.03 0.00 0.00 41.12 40.86 1gjr n ASP 68 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1gjr n LYS 69 N -1.02 0.12 -0.01 0.11 2.85 -1.26 -1.99 118.16 116.97 1gjr n LYS 69 Ca 0.01 0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.30 1gjr n LYS 69 Cb 0.04 -1.50 0.01 0.00 -0.65 0.00 0.00 35.03 32.93 1gjr n LYS 69 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1gjr n ASN 70 N -1.04 1.50 0.00 -5.58 4.05 -1.26 -4.99 115.26 107.94 1gjr n ASN 70 Ca 0.03 -1.81 0.00 0.00 0.45 0.00 0.00 54.58 53.25 1gjr n ASN 70 Cb 0.02 -0.02 0.00 0.00 1.23 0.00 0.00 39.78 41.00 1gjr n ASN 70 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1gjr n GLY 71 N -0.42 2.74 3.77 8.20 0.00 -0.84 -5.02 105.19 113.62 1gjr n GLY 71 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1gjr n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gjr s LYS 72 N -0.16 4.33 0.38 1.61 -0.14 -1.26 -4.58 119.74 119.92 1gjr s LYS 72 Ca 0.00 1.75 -0.26 0.00 -1.36 0.00 0.00 55.97 56.10 1gjr s LYS 72 Cb 0.00 -2.86 -0.11 0.00 -1.68 0.00 0.00 37.83 33.18 1gjr s LYS 72 CO 0.00 -0.05 1.06 -2.30 -0.76 0.00 0.00 175.35 173.30 1gjr n PRO 73 N 0.51 1.49 -2.01 -1.68 -0.02 -1.26 -0.92 135.00 131.11 1gjr n PRO 73 Ca 0.02 0.53 -0.41 0.00 -2.02 0.00 0.00 63.50 61.62 1gjr n PRO 73 Cb 0.46 -2.06 -0.02 0.00 -0.02 0.00 0.00 33.50 31.87 1gjr n PRO 73 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1gjr s GLU 74 N -1.91 4.27 0.65 -0.52 0.41 -0.71 -4.76 118.70 116.13 1gjr s GLU 74 Ca 0.61 2.33 -0.05 0.00 -0.41 0.00 0.00 54.97 57.44 1gjr s GLU 74 Cb -0.58 -3.06 0.05 0.00 -1.78 0.00 0.00 34.13 28.75 1gjr s GLU 74 CO 0.58 -0.35 0.95 0.15 -0.49 0.00 0.00 175.26 176.11 1gjr s LYS 75 N -1.34 2.40 0.53 1.61 1.02 -1.26 -4.78 119.74 117.93 1gjr s LYS 75 Ca 0.54 -0.29 -0.20 0.00 0.02 0.00 0.00 55.97 56.03 1gjr s LYS 75 Cb -0.42 -2.24 -0.06 0.00 -0.52 0.00 0.00 37.83 34.59 1gjr s LYS 75 CO 0.52 -1.04 1.15 -0.48 -0.92 0.00 0.00 175.35 174.58 1gjr s LEU 76 N -5.11 3.80 -0.03 3.17 0.05 -1.26 -4.47 118.68 114.83 1gjr s LEU 76 Ca 0.58 2.25 0.03 0.00 0.05 0.00 0.00 54.13 57.04 1gjr s LEU 76 Cb -0.11 -4.50 -0.03 0.00 -2.05 0.00 0.00 46.19 39.50 1gjr s LEU 76 CO 0.44 -1.21 -0.09 -0.13 -0.55 0.00 0.00 176.35 174.81 1gjr s ARG 77 N -3.15 2.58 0.07 1.48 3.00 0.19 -4.93 118.95 118.19 1gjr s ARG 77 Ca 0.71 -0.68 -0.20 0.00 0.00 0.00 0.00 55.73 55.56 1gjr s ARG 77 Cb -0.26 -2.49 -0.07 0.00 0.00 0.00 0.00 34.95 32.13 1gjr s ARG 77 CO 0.30 0.62 0.61 -0.51 0.00 0.00 0.00 175.30 176.32 1gjr s LEU 78 N -1.11 4.52 -0.03 2.53 1.43 -1.26 -1.09 118.68 123.66 1gjr s LEU 78 Ca 0.14 1.30 0.03 0.00 -1.03 0.00 0.00 54.13 54.58 1gjr s LEU 78 Cb -0.11 -2.96 -0.00 0.00 0.03 0.00 0.00 46.19 43.15 1gjr s LEU 78 CO 0.04 0.23 -0.12 -0.31 0.23 0.00 0.00 176.35 176.42 1gjr s TYR 79 N -0.93 1.21 0.24 0.29 2.02 -0.22 -4.96 117.35 115.01 1gjr s TYR 79 Ca 0.30 -0.30 -0.30 0.00 -0.37 0.00 0.00 57.07 56.40 1gjr s TYR 79 Cb -0.20 -0.83 -0.10 0.00 -0.40 0.00 0.00 41.96 40.43 1gjr s TYR 79 CO 0.20 -0.10 1.41 -1.12 -1.57 0.00 0.00 175.55 174.37 1gjr s SER 80 N 0.04 6.70 0.14 2.29 0.01 -1.26 -1.56 113.70 120.06 1gjr s SER 80 Ca -0.01 2.62 -0.31 0.00 1.31 0.00 0.00 55.95 59.56 1gjr s SER 80 Cb -0.09 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.44 1gjr s SER 80 CO 0.01 -0.66 1.36 -0.63 0.41 0.00 0.00 173.24 173.73 1gjr s ILE 81 N -0.04 3.26 -0.71 1.44 1.01 -0.51 -4.34 121.20 121.31 1gjr s ILE 81 Ca 0.58 0.95 0.19 0.00 0.00 0.00 0.00 60.65 62.37 1gjr s ILE 81 Cb -0.41 -3.61 -0.23 0.00 0.01 0.00 0.00 42.46 38.23 1gjr s ILE 81 CO 0.43 0.10 0.72 0.00 0.00 0.00 0.00 174.94 176.19 1gjr n ALA 82 N 3.49 4.10 -2.82 9.38 0.00 0.07 -3.93 120.51 130.80 1gjr n ALA 82 Ca 0.10 -0.52 -0.22 0.00 0.00 0.00 0.00 53.44 52.79 1gjr n ALA 82 Cb 0.42 -0.68 -0.05 0.00 0.00 0.00 0.00 19.45 19.15 1gjr n ALA 82 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1gjr s SER 83 N -3.09 5.51 1.00 0.00 1.04 -1.23 -3.80 113.70 113.13 1gjr s SER 83 Ca 0.04 -0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.10 1gjr s SER 83 Cb 0.14 -1.40 0.19 0.00 0.10 0.00 0.00 66.02 65.05 1gjr s SER 83 CO 0.78 -0.02 1.10 0.42 0.98 0.00 0.00 173.24 176.50 1gjr s THR 84 N -2.09 1.98 0.59 2.02 -4.23 -1.26 -4.74 115.64 107.91 1gjr s THR 84 Ca 0.33 0.00 0.30 0.00 -1.18 0.00 0.00 61.69 61.14 1gjr s THR 84 Cb -0.08 -2.54 0.43 0.00 1.34 0.00 0.00 72.50 71.65 1gjr s THR 84 CO 0.25 0.00 1.64 0.08 -0.54 0.00 0.00 174.62 176.05 1gjr h ARG 85 N -1.89 0.00 -0.01 3.99 0.11 -1.89 -1.06 114.38 113.64 1gjr h ARG 85 Ca -0.54 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.54 1gjr h ARG 85 Cb 1.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.41 1gjr h ARG 85 CO 0.57 0.00 -0.26 0.72 0.10 0.00 0.00 179.97 181.10 1gjr n HIS 86 N -3.60 0.00 -0.31 4.08 8.25 -1.26 -4.73 115.22 117.65 1gjr n HIS 86 Ca 0.18 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.68 1gjr n HIS 86 Cb 1.15 -0.14 -0.01 0.00 1.12 0.00 0.00 29.99 32.11 1gjr n HIS 86 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gjr n GLY 87 N 1.35 -1.92 0.21 -1.41 0.00 -0.40 -1.16 105.19 101.86 1gjr n GLY 87 Ca 0.12 -1.43 0.07 0.00 0.00 0.00 0.00 46.02 44.79 1gjr n GLY 87 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1gjr h ASP 88 N -0.29 0.00 0.02 1.61 3.32 -1.86 -2.76 116.42 116.45 1gjr h ASP 88 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1gjr h ASP 88 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1gjr h ASP 88 CO 0.01 0.29 -0.03 0.47 -1.72 0.00 0.00 179.24 178.26 1gjr n ASP 89 N -3.63 1.40 -3.59 6.45 8.00 -1.26 -4.95 116.55 118.97 1gjr n ASP 89 Ca -0.01 -1.41 -0.20 0.00 0.71 0.00 0.00 54.79 53.87 1gjr n ASP 89 Cb 0.41 0.01 0.05 0.00 -0.02 0.00 0.00 41.12 41.58 1gjr n ASP 89 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1gjr n VAL 90 N 0.05 -5.46 -0.85 2.53 0.31 -1.04 -4.97 118.33 108.90 1gjr n VAL 90 Ca 0.18 -0.63 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 1gjr n VAL 90 Cb 0.35 -4.41 0.00 0.00 -0.91 0.00 0.00 33.84 28.87 1gjr n VAL 90 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1gjr n ASP 91 N -3.06 0.26 -2.16 4.52 5.68 -0.76 -5.01 116.55 116.01 1gjr n ASP 91 Ca -0.26 -1.11 -0.16 0.00 -0.50 0.00 0.00 54.79 52.76 1gjr n ASP 91 Cb 0.66 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.62 1gjr n ASP 91 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1gjr n ASP 92 N -0.05 -4.70 -0.00 -1.12 10.43 -0.31 -4.88 116.55 115.91 1gjr n ASP 92 Ca 0.00 0.18 0.08 0.00 2.57 0.00 0.00 54.79 57.62 1gjr n ASP 92 Cb 0.40 -4.03 -0.11 0.00 1.84 0.00 0.00 41.12 39.21 1gjr n ASP 92 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1gjr n LYS 93 N -2.68 1.05 -4.13 -1.24 5.02 -1.26 -4.82 118.16 110.10 1gjr n LYS 93 Ca -0.19 -0.05 -0.09 0.00 -2.02 0.00 0.00 58.31 55.96 1gjr n LYS 93 Cb 0.62 -1.35 -0.10 0.00 -0.02 0.00 0.00 35.03 34.18 1gjr n LYS 93 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1gjr s THR 94 N -2.82 0.50 -0.01 -0.18 -4.23 -1.26 -0.21 115.64 107.42 1gjr s THR 94 Ca 0.02 -1.86 0.03 0.00 -1.18 0.00 0.00 61.69 58.70 1gjr s THR 94 Cb 0.13 -1.58 -0.00 0.00 1.34 0.00 0.00 72.50 72.38 1gjr s THR 94 CO 0.72 -0.91 -0.09 -0.51 -0.54 0.00 0.00 174.62 173.30 1gjr s ILE 95 N -3.66 0.71 0.12 2.99 2.07 -0.66 -3.67 121.20 119.11 1gjr s ILE 95 Ca 0.09 -0.36 0.10 0.00 -1.41 0.00 0.00 60.65 59.08 1gjr s ILE 95 Cb 0.06 -0.62 -0.04 0.00 0.13 0.00 0.00 42.46 41.99 1gjr s ILE 95 CO -0.07 0.21 -0.24 -0.44 -1.91 0.00 0.00 174.94 172.50 1gjr s SER 96 N -0.02 3.53 0.13 4.50 0.01 -1.26 -0.27 113.70 120.32 1gjr s SER 96 Ca 0.00 -0.67 0.10 0.00 1.31 0.00 0.00 55.95 56.69 1gjr s SER 96 Cb -0.06 -0.35 -0.04 0.00 0.21 0.00 0.00 66.02 65.79 1gjr s SER 96 CO -0.00 0.18 -0.24 -0.76 0.41 0.00 0.00 173.24 172.83 1gjr s LEU 97 N -2.05 2.33 -0.39 2.44 1.43 -0.26 -0.75 118.68 121.44 1gjr s LEU 97 Ca 0.15 -0.75 -0.03 0.00 -1.03 0.00 0.00 54.13 52.47 1gjr s LEU 97 Cb -0.10 -1.08 0.10 0.00 0.03 0.00 0.00 46.19 45.14 1gjr s LEU 97 CO 0.07 0.12 0.17 0.00 0.23 0.00 0.00 176.35 176.94 1gjr s VAL 99 N 1.18 2.76 0.04 0.00 1.01 -0.19 -4.92 120.40 120.29 1gjr s VAL 99 Ca 0.06 -1.16 -0.30 0.00 0.00 0.00 0.00 61.98 60.57 1gjr s VAL 99 Cb -0.22 -2.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 1gjr s VAL 99 CO -0.03 0.13 1.11 -0.60 0.00 0.00 0.00 175.10 175.72 1gjr s ARG 100 N 1.28 4.49 -0.23 2.72 6.06 -1.26 -0.63 118.95 131.38 1gjr s ARG 100 Ca -0.02 1.64 -0.28 0.00 -2.50 0.00 0.00 55.73 54.57 1gjr s ARG 100 Cb -0.17 -3.38 -0.04 0.00 0.06 0.00 0.00 34.95 31.41 1gjr s ARG 100 CO -0.04 -0.17 2.08 -1.14 -2.50 0.00 0.00 175.30 173.53 1gjr s GLN 101 N 0.98 3.27 -0.40 5.12 -0.44 0.71 -4.83 119.66 124.07 1gjr s GLN 101 Ca 0.56 1.90 -0.29 0.00 -2.50 0.00 0.00 55.36 55.03 1gjr s GLN 101 Cb -0.26 -4.30 0.02 0.00 -1.64 0.00 0.00 33.01 26.82 1gjr s GLN 101 CO 0.29 -1.95 1.20 -1.17 0.50 0.00 0.00 175.29 174.16 1gjr s LEU 102 N 7.61 3.74 -0.04 3.68 2.96 -1.26 -4.75 118.68 130.61 1gjr s LEU 102 Ca 0.94 0.78 -0.02 0.00 -0.22 0.00 0.00 54.13 55.61 1gjr s LEU 102 Cb -0.31 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 42.86 1gjr s LEU 102 CO 0.35 -1.17 0.09 -1.83 -1.32 0.00 0.00 176.35 172.47 1gjr s GLU 103 N 4.31 0.05 0.34 1.98 -1.05 -1.26 -0.03 118.70 123.04 1gjr s GLU 103 Ca 0.51 0.22 0.02 0.00 -0.15 0.00 0.00 54.97 55.57 1gjr s GLU 103 Cb -0.11 -0.12 -0.01 0.00 -0.44 0.00 0.00 34.13 33.46 1gjr s GLU 103 CO 0.27 -0.11 0.08 2.48 0.95 0.00 0.00 175.26 178.93 1gjr n TYR 104 N 3.76 0.35 -3.74 4.83 4.11 -0.84 -4.97 117.16 120.66 1gjr n TYR 104 Ca -0.22 -2.02 -0.36 0.00 -0.00 0.00 0.00 57.90 55.30 1gjr n TYR 104 Cb 0.54 -0.08 -0.10 0.00 -0.00 0.00 0.00 39.34 39.69 1gjr n TYR 104 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 1gjr s LYS 105 N -3.28 3.95 0.20 -3.48 -0.14 -1.26 -0.87 119.74 114.86 1gjr s LYS 105 Ca 0.11 -0.33 -0.32 0.00 -1.36 0.00 0.00 55.97 54.07 1gjr s LYS 105 Cb 0.01 -3.45 -0.15 0.00 -1.68 0.00 0.00 37.83 32.56 1gjr s LYS 105 CO 0.08 0.01 1.28 1.58 -0.76 0.00 0.00 175.35 177.54 1gjr n HIS 106 N 4.39 1.71 -0.46 3.18 -0.00 0.53 -4.73 115.22 119.84 1gjr n HIS 106 Ca -0.15 0.56 -0.34 0.00 -0.00 0.00 0.00 57.72 57.79 1gjr n HIS 106 Cb 0.52 -2.37 -0.08 0.00 -0.00 0.00 0.00 29.99 28.06 1gjr n HIS 106 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 1gjr n PRO 107 N 1.90 0.22 -2.14 1.57 -0.02 -1.26 -0.89 135.00 134.38 1gjr n PRO 107 Ca 0.13 -0.99 -0.04 0.00 -2.02 0.00 0.00 63.50 60.59 1gjr n PRO 107 Cb 0.28 -2.43 0.02 0.00 -0.02 0.00 0.00 33.50 31.35 1gjr n PRO 107 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1gjr n GLU 108 N 7.10 -1.08 0.00 -0.52 4.07 -1.26 -4.90 120.64 124.05 1gjr n GLU 108 Ca 0.37 0.20 0.00 0.00 -0.06 0.00 0.00 57.16 57.66 1gjr n GLU 108 Cb 0.31 -2.93 0.00 0.00 -0.06 0.00 0.00 31.44 28.76 1gjr n GLU 108 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1gjr n SER 109 N -1.66 3.63 0.00 4.31 3.41 -1.06 -5.05 113.62 117.19 1gjr n SER 109 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 1gjr n SER 109 Cb 0.53 0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.98 1gjr n SER 109 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gjr n GLY 110 N 2.12 2.12 3.71 5.00 0.00 -0.07 -4.95 105.19 113.13 1gjr n GLY 110 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1gjr n GLY 110 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gjr s GLU 111 N -0.08 4.16 -0.21 1.61 -1.05 -1.26 -4.36 118.70 117.52 1gjr s GLU 111 Ca 0.00 2.50 -0.40 0.00 -0.15 0.00 0.00 54.97 56.92 1gjr s GLU 111 Cb 0.00 -3.20 -0.16 0.00 -0.44 0.00 0.00 34.13 30.32 1gjr s GLU 111 CO 0.00 -0.71 1.64 2.41 0.95 0.00 0.00 175.26 179.55 1gjr n THR 112 N 4.13 0.22 -4.66 1.83 -1.04 -1.26 -0.35 114.28 113.15 1gjr n THR 112 Ca 0.15 -0.04 -0.33 0.00 -2.04 0.00 0.00 64.05 61.79 1gjr n THR 112 Cb 0.37 -1.07 -0.13 0.00 -1.82 0.00 0.00 70.33 67.68 1gjr n THR 112 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1gjr s VAL 113 N 2.78 3.41 -0.18 12.58 1.01 -0.05 -4.85 120.40 135.10 1gjr s VAL 113 Ca 0.96 -0.55 -0.10 0.00 0.00 0.00 0.00 61.98 62.29 1gjr s VAL 113 Cb -1.08 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 1gjr s VAL 113 CO 0.62 0.54 0.14 -0.31 0.00 0.00 0.00 175.10 176.09 1gjr s TYR 114 N 0.02 3.44 0.19 5.22 2.02 -1.26 -2.00 117.35 124.99 1gjr s TYR 114 Ca -0.02 0.37 -0.31 0.00 -0.37 0.00 0.00 57.07 56.74 1gjr s TYR 114 Cb -0.14 -2.13 -0.10 0.00 -0.40 0.00 0.00 41.96 39.19 1gjr s TYR 114 CO 0.04 0.37 1.58 0.20 -1.57 0.00 0.00 175.55 176.16 1gjr s GLY 115 N 0.13 1.63 0.02 0.71 0.00 0.96 -4.99 107.32 105.77 1gjr s GLY 115 Ca 0.09 1.42 -0.10 0.00 0.00 0.00 0.00 44.72 46.13 1gjr s GLY 115 CO -0.01 2.63 1.16 -2.08 0.00 0.00 0.00 173.10 174.80 1gjr h VAL 116 N 3.88 0.00 -0.62 1.40 2.07 -1.98 -2.44 116.25 118.55 1gjr h VAL 116 Ca -0.43 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 1gjr h VAL 116 Cb 1.21 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1gjr h VAL 116 CO 0.90 0.00 0.28 0.00 0.02 0.00 0.00 177.57 178.77 1gjr h SER 118 N 0.86 0.38 0.08 0.00 4.64 -1.88 -1.10 113.55 116.53 1gjr h SER 118 Ca 0.21 -0.20 -0.21 0.00 -0.47 0.00 0.00 61.79 61.12 1gjr h SER 118 Cb 0.15 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1gjr h SER 118 CO -0.02 0.85 -0.81 0.74 -0.87 0.00 0.00 176.83 176.72 1gjr h THR 119 N 0.27 1.33 -0.20 2.95 2.02 -1.23 -0.38 112.91 117.67 1gjr h THR 119 Ca 0.01 -2.13 0.04 0.00 0.77 0.00 0.00 66.41 65.10 1gjr h THR 119 Cb 1.04 2.13 -0.04 0.00 -1.74 0.00 0.00 68.15 69.53 1gjr h THR 119 CO 0.09 0.65 -0.07 0.22 0.37 0.00 0.00 175.52 176.79 1gjr h TYR 120 N 0.39 -0.15 0.03 3.16 3.20 -1.06 -2.82 116.97 119.72 1gjr h TYR 120 Ca -0.06 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1gjr h TYR 120 Cb 1.42 0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.79 1gjr h TYR 120 CO 0.07 -0.11 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.39 1gjr h LEU 121 N -0.03 -0.04 -1.51 2.82 3.38 -1.15 -1.53 115.31 117.27 1gjr h LEU 121 Ca 0.10 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1gjr h LEU 121 Cb 0.18 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1gjr h LEU 121 CO -0.22 0.23 0.00 0.71 0.09 0.00 0.00 178.44 179.25 1gjr h THR 122 N -0.30 0.00 -0.29 0.22 1.35 -1.07 -1.49 112.91 111.33 1gjr h THR 122 Ca -0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 1gjr h THR 122 Cb 0.28 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1gjr h THR 122 CO 0.01 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 176.69 1gjr n HIS 123 N -2.63 0.38 -2.17 4.73 8.25 -1.07 -5.01 115.22 117.71 1gjr n HIS 123 Ca -0.00 -0.29 -0.37 0.00 -0.26 0.00 0.00 57.72 56.79 1gjr n HIS 123 Cb 0.18 -0.01 -0.00 0.00 1.12 0.00 0.00 29.99 31.27 1gjr n HIS 123 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1gjr s ILE 124 N -1.13 2.91 -0.09 1.59 1.10 -0.56 -5.03 121.20 119.99 1gjr s ILE 124 Ca 0.27 0.69 -0.05 0.00 -0.51 0.00 0.00 60.65 61.05 1gjr s ILE 124 Cb 0.15 -3.35 -0.04 0.00 0.15 0.00 0.00 42.46 39.37 1gjr s ILE 124 CO 0.21 -0.00 0.12 -1.61 -2.11 0.00 0.00 174.94 171.55 1gjr s GLU 125 N -2.70 3.33 0.04 3.50 0.41 -1.26 -4.78 118.70 117.24 1gjr s GLU 125 Ca 0.64 -0.23 -0.37 0.00 -0.41 0.00 0.00 54.97 54.61 1gjr s GLU 125 Cb -0.31 -3.09 -0.16 0.00 -1.78 0.00 0.00 34.13 28.79 1gjr s GLU 125 CO 0.38 0.74 1.44 -2.30 -0.49 0.00 0.00 175.26 175.03 1gjr n PRO 126 N 1.82 1.31 0.00 0.39 -0.02 -1.26 -0.27 135.00 136.96 1gjr n PRO 126 Ca -0.18 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1gjr n PRO 126 Cb 0.54 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1gjr n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gjr n GLY 127 N 2.92 1.71 3.78 -1.23 0.00 0.37 -4.96 105.19 107.78 1gjr n GLY 127 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 1gjr n GLY 127 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gjr s SER 128 N -1.54 5.10 -0.09 1.61 0.01 0.62 -4.66 113.70 114.76 1gjr s SER 128 Ca 0.00 1.94 -0.00 0.00 1.31 0.00 0.00 55.95 59.20 1gjr s SER 128 Cb 0.00 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 1gjr s SER 128 CO 0.00 -1.63 -0.06 -1.61 0.41 0.00 0.00 173.24 170.35 1gjr s GLU 129 N -4.24 2.98 0.02 12.44 2.02 -1.26 -0.23 118.70 130.42 1gjr s GLU 129 Ca 0.65 -0.53 0.05 0.00 0.02 0.00 0.00 54.97 55.17 1gjr s GLU 129 Cb -0.19 -2.68 -0.02 0.00 0.10 0.00 0.00 34.13 31.34 1gjr s GLU 129 CO 0.44 0.57 -0.16 0.08 0.02 0.00 0.00 175.26 176.20 1gjr s VAL 130 N -0.54 1.30 -0.22 2.63 1.01 -0.10 -4.95 120.40 119.52 1gjr s VAL 130 Ca 0.08 -0.91 -0.22 0.00 0.00 0.00 0.00 61.98 60.93 1gjr s VAL 130 Cb -0.12 -1.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.12 1gjr s VAL 130 CO 0.02 0.19 0.70 -0.54 0.00 0.00 0.00 175.10 175.47 1gjr s LYS 131 N -0.83 4.18 -0.07 2.72 1.02 -1.26 -0.45 119.74 125.04 1gjr s LYS 131 Ca 0.05 0.72 0.05 0.00 0.02 0.00 0.00 55.97 56.81 1gjr s LYS 131 Cb -0.07 -3.62 -0.01 0.00 -0.52 0.00 0.00 37.83 33.61 1gjr s LYS 131 CO 0.01 -0.37 -0.24 0.42 -0.92 0.00 0.00 175.35 174.25 1gjr s ILE 132 N 2.35 2.13 0.35 2.17 1.01 0.54 -2.39 121.20 127.36 1gjr s ILE 132 Ca 0.30 -1.02 0.08 0.00 0.00 0.00 0.00 60.65 60.01 1gjr s ILE 132 Cb -0.16 -1.79 -0.07 0.00 0.01 0.00 0.00 42.46 40.46 1gjr s ILE 132 CO 0.09 0.57 -0.05 0.42 0.00 0.00 0.00 174.94 175.97 1gjr s THR 133 N 0.00 1.99 0.00 2.92 -4.23 0.11 -1.28 115.64 115.16 1gjr s THR 133 Ca -0.08 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.31 1gjr s THR 133 Cb -0.15 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 70.95 1gjr s THR 133 CO 0.05 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 1gjr n GLY 134 N -0.81 -0.07 3.77 3.99 0.00 -0.24 -1.56 105.19 110.27 1gjr n GLY 134 Ca -0.05 -1.96 -0.32 0.00 0.00 0.00 0.00 46.02 43.70 1gjr n GLY 134 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gjr s PRO 135 N 0.00 2.46 0.15 1.61 0.04 -1.26 -1.74 135.00 136.26 1gjr s PRO 135 Ca 0.00 1.27 0.07 0.00 0.04 0.00 0.00 61.00 62.38 1gjr s PRO 135 Cb 0.00 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 1gjr s PRO 135 CO 0.00 -1.50 -0.16 0.14 0.04 0.00 0.00 177.00 175.52 1gjr s VAL 136 N -2.66 1.60 0.00 -0.36 -7.23 0.89 -0.23 120.40 112.42 1gjr s VAL 136 Ca 0.64 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 1gjr s VAL 136 Cb -0.19 -1.73 0.00 0.00 0.56 0.00 0.00 36.38 35.03 1gjr s VAL 136 CO 0.50 -0.38 0.00 0.61 -0.31 0.00 0.00 175.10 175.52 1gjr n GLY 137 N 0.35 2.87 0.00 2.32 0.00 -1.26 -0.70 105.19 108.76 1gjr n GLY 137 Ca -0.14 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1gjr n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gjr n LYS 138 N 1.05 0.46 0.00 1.61 5.02 -1.26 -4.69 118.16 120.35 1gjr n LYS 138 Ca 0.00 -0.68 0.12 0.00 -2.02 0.00 0.00 58.31 55.73 1gjr n LYS 138 Cb 0.00 -0.83 0.16 0.00 -0.02 0.00 0.00 35.03 34.34 1gjr n LYS 138 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1gjr n GLU 139 N -0.14 1.44 -1.57 1.97 -0.58 -1.26 -4.29 120.64 116.21 1gjr n GLU 139 Ca 0.00 -1.10 -0.06 0.00 -0.42 0.00 0.00 57.16 55.57 1gjr n GLU 139 Cb 0.19 -1.48 0.09 0.00 -0.57 0.00 0.00 31.44 29.68 1gjr n GLU 139 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1gjr n MET 140 N 0.18 2.14 -3.33 3.49 2.81 -1.26 -4.57 117.12 116.58 1gjr n MET 140 Ca 0.12 -3.48 -0.38 0.00 -1.81 0.00 0.00 57.70 52.15 1gjr n MET 140 Cb 0.46 -1.64 -0.06 0.00 -0.71 0.00 0.00 33.22 31.27 1gjr n MET 140 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1gjr s LEU 141 N -3.01 4.46 0.44 4.03 1.43 -1.26 -4.18 118.68 120.59 1gjr s LEU 141 Ca 0.41 1.10 -0.24 0.00 -1.03 0.00 0.00 54.13 54.36 1gjr s LEU 141 Cb 0.38 -2.78 -0.08 0.00 0.03 0.00 0.00 46.19 43.74 1gjr s LEU 141 CO -0.04 0.22 1.22 -0.22 0.23 0.00 0.00 176.35 177.76 1gjr s LEU 142 N -0.71 4.10 0.66 1.79 2.96 -1.26 -5.02 118.68 121.20 1gjr s LEU 142 Ca 0.27 2.44 -0.13 0.00 -0.22 0.00 0.00 54.13 56.49 1gjr s LEU 142 Cb -0.18 -4.09 -0.01 0.00 0.50 0.00 0.00 46.19 42.41 1gjr s LEU 142 CO 0.16 -0.88 1.07 -2.16 -1.32 0.00 0.00 176.35 173.21 1gjr s PRO 143 N -2.48 3.01 0.47 0.98 0.04 -1.26 -4.93 135.00 130.83 1gjr s PRO 143 Ca 0.61 1.11 0.27 0.00 0.04 0.00 0.00 61.00 63.02 1gjr s PRO 143 Cb -0.32 -1.99 1.01 0.00 0.04 0.00 0.00 34.50 33.23 1gjr s PRO 143 CO 0.40 -1.05 1.86 -0.44 0.04 0.00 0.00 177.00 177.81 1gjr h ASP 144 N -0.25 0.00 -2.17 6.66 3.32 -2.01 -3.43 116.42 118.55 1gjr h ASP 144 Ca -0.45 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.02 1gjr h ASP 144 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1gjr h ASP 144 CO 0.56 0.14 1.40 -0.62 -1.72 0.00 0.00 179.24 179.00 1gjr s ASP 145 N -6.03 5.76 0.00 6.45 2.15 -1.26 -4.86 116.67 118.87 1gjr s ASP 145 Ca 0.01 2.02 0.23 0.00 0.43 0.00 0.00 52.55 55.25 1gjr s ASP 145 Cb 0.09 -2.52 1.40 0.00 -0.30 0.00 0.00 42.92 41.60 1gjr s ASP 145 CO 0.61 -1.70 1.84 -0.81 -0.17 0.00 0.00 175.17 174.94 1gjr n PRO 146 N 8.40 0.90 -0.19 4.34 -0.04 -1.26 -2.46 135.00 144.69 1gjr n PRO 146 Ca 0.26 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.78 1gjr n PRO 146 Cb 0.44 -1.41 0.14 0.00 -0.04 0.00 0.00 33.50 32.64 1gjr n PRO 146 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1gjr n GLU 147 N -0.91 2.78 -2.24 0.54 1.02 -1.26 0.17 120.64 120.73 1gjr n GLU 147 Ca 0.18 -2.16 -0.36 0.00 -0.02 0.00 0.00 57.16 54.80 1gjr n GLU 147 Cb 0.08 -1.36 -0.00 0.00 -0.02 0.00 0.00 31.44 30.14 1gjr n GLU 147 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gjr s ALA 148 N -1.56 2.82 -0.04 0.62 0.00 -1.03 -4.39 121.76 118.18 1gjr s ALA 148 Ca 0.23 0.89 -0.13 0.00 0.00 0.00 0.00 51.96 52.95 1gjr s ALA 148 Cb 0.16 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 1gjr s ALA 148 CO 0.10 -0.74 0.34 -0.80 0.00 0.00 0.00 175.76 174.66 1gjr s ASN 149 N -1.56 6.69 -0.24 0.00 -0.87 -0.81 -2.77 114.94 115.38 1gjr s ASN 149 Ca 0.69 0.82 -0.03 0.00 -1.57 0.00 0.00 52.86 52.77 1gjr s ASN 149 Cb -0.26 -2.20 0.08 0.00 -0.02 0.00 0.00 41.25 38.84 1gjr s ASN 149 CO 0.31 0.33 0.07 -0.69 -2.57 0.00 0.00 177.10 174.55 1gjr s VAL 150 N -0.97 0.44 -0.11 1.60 1.01 0.65 -0.52 120.40 122.50 1gjr s VAL 150 Ca 0.21 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.29 1gjr s VAL 150 Cb -0.15 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 1gjr s VAL 150 CO 0.11 -0.42 0.36 -0.63 0.00 0.00 0.00 175.10 174.52 1gjr s ILE 151 N 1.87 5.22 -0.26 2.22 1.01 0.09 -0.65 121.20 130.70 1gjr s ILE 151 Ca 0.04 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.40 1gjr s ILE 151 Cb -0.17 -3.69 0.07 0.00 0.01 0.00 0.00 42.46 38.68 1gjr s ILE 151 CO -0.17 0.42 0.01 -0.04 0.00 0.00 0.00 174.94 175.16 1gjr s MET 152 N 0.12 1.24 -0.33 2.79 -1.94 0.17 -0.66 119.30 120.68 1gjr s MET 152 Ca 0.21 -1.01 -0.07 0.00 -1.71 0.00 0.00 55.69 53.10 1gjr s MET 152 Cb -0.14 -2.45 0.03 0.00 2.01 0.00 0.00 34.83 34.28 1gjr s MET 152 CO 0.08 -0.73 0.11 -0.51 -0.01 0.00 0.00 175.02 173.96 1gjr s LEU 153 N 1.47 4.24 -0.01 -0.03 1.43 0.98 -0.27 118.68 126.49 1gjr s LEU 153 Ca 0.00 -1.01 0.03 0.00 -1.03 0.00 0.00 54.13 52.12 1gjr s LEU 153 Cb -0.18 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.14 1gjr s LEU 153 CO -0.11 -0.30 -0.10 0.00 0.23 0.00 0.00 176.35 176.08 1gjr s ALA 154 N 1.45 0.80 -0.08 4.21 0.00 -0.10 -1.26 121.76 126.77 1gjr s ALA 154 Ca -0.00 -0.41 0.03 0.00 0.00 0.00 0.00 51.96 51.58 1gjr s ALA 154 Cb -0.19 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.71 1gjr s ALA 154 CO 0.03 0.19 -0.17 0.95 0.00 0.00 0.00 175.76 176.77 1gjr s THR 155 N -0.20 2.78 0.00 0.00 -4.23 -0.97 -0.67 115.64 112.35 1gjr s THR 155 Ca 0.03 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 1gjr s THR 155 Cb -0.04 -2.10 0.00 0.00 1.34 0.00 0.00 72.50 71.70 1gjr s THR 155 CO -0.00 0.56 0.00 0.61 -0.54 0.00 0.00 174.62 175.25 1gjr n GLY 156 N 2.98 3.73 0.00 3.99 0.00 -0.45 -0.76 105.19 114.68 1gjr n GLY 156 Ca -0.18 -0.04 0.09 0.00 0.00 0.00 0.00 46.02 45.90 1gjr n GLY 156 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gjr n THR 157 N 0.00 0.47 0.07 2.61 -2.24 -1.26 -2.35 114.28 111.57 1gjr n THR 157 Ca 0.00 0.12 0.04 0.00 -2.27 0.00 0.00 64.05 61.94 1gjr n THR 157 Cb 0.00 -0.80 0.23 0.00 -2.10 0.00 0.00 70.33 67.66 1gjr n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gjr n GLY 158 N 0.37 -0.60 0.32 3.38 0.00 0.07 -1.07 105.19 107.65 1gjr n GLY 158 Ca 0.08 0.08 0.19 0.00 0.00 0.00 0.00 46.02 46.37 1gjr n GLY 158 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1gjr h ILE 159 N 0.00 0.23 0.30 -0.61 6.09 -1.65 -3.36 117.51 118.50 1gjr h ILE 159 Ca 0.00 -0.07 -0.00 0.00 -1.37 0.00 0.00 64.86 63.42 1gjr h ILE 159 Cb 0.12 1.05 -0.01 0.00 0.47 0.00 0.00 36.82 38.45 1gjr h ILE 159 CO 0.00 0.01 -0.25 0.00 -3.07 0.00 0.00 178.15 174.84 1gjr h ALA 160 N 1.99 -0.55 0.00 0.18 0.00 -1.39 0.16 119.26 119.65 1gjr h ALA 160 Ca -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1gjr h ALA 160 Cb 0.05 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1gjr h ALA 160 CO 0.00 -0.83 -0.10 -1.00 0.00 0.00 0.00 179.25 177.32 1gjr h PRO 161 N -0.56 0.00 -0.22 0.00 0.13 -1.71 -2.76 132.00 126.87 1gjr h PRO 161 Ca -0.02 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 1gjr h PRO 161 Cb 0.50 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 1gjr h PRO 161 CO -0.03 0.10 -0.28 0.52 -0.23 0.00 0.00 178.00 178.08 1gjr h MET 162 N 0.00 0.44 -0.54 0.86 2.86 -1.33 -0.94 114.93 116.27 1gjr h MET 162 Ca -0.00 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 1gjr h MET 162 Cb 0.17 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1gjr h MET 162 CO 0.01 0.68 0.16 -0.09 1.06 0.00 0.00 176.91 178.74 1gjr h ARG 163 N 0.38 0.85 -0.77 1.72 2.43 -0.76 -0.65 114.38 117.58 1gjr h ARG 163 Ca 0.05 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.01 1gjr h ARG 163 Cb 0.70 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.09 1gjr h ARG 163 CO 0.05 0.78 0.38 1.79 -1.51 0.00 0.00 179.97 181.46 1gjr h THR 164 N 0.76 1.24 0.41 0.20 1.35 -1.01 -0.24 112.91 115.62 1gjr h THR 164 Ca 0.17 -0.66 -0.02 0.00 -0.55 0.00 0.00 66.41 65.35 1gjr h THR 164 Cb 0.29 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 66.95 1gjr h THR 164 CO -0.00 0.28 -0.20 1.88 -0.25 0.00 0.00 175.52 177.24 1gjr h TYR 165 N 1.10 -0.51 0.00 4.73 0.05 -1.25 -2.68 116.97 118.41 1gjr h TYR 165 Ca 0.27 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.99 1gjr h TYR 165 Cb 0.10 0.17 -0.01 0.00 1.01 0.00 0.00 36.73 38.00 1gjr h TYR 165 CO 0.01 -0.19 -0.21 -0.07 -1.05 0.00 0.00 178.16 176.65 1gjr h LEU 166 N -0.82 0.00 0.08 3.88 3.38 -0.99 -0.56 115.31 120.29 1gjr h LEU 166 Ca -0.06 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.74 1gjr h LEU 166 Cb 0.54 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.31 1gjr h LEU 166 CO 0.09 0.21 -0.75 -0.50 0.09 0.00 0.00 178.44 177.59 1gjr h TRP 167 N 0.00 0.60 -0.78 1.13 -0.00 -1.09 -1.33 115.95 114.48 1gjr h TRP 167 Ca -0.00 -0.38 -0.00 0.00 -0.00 0.00 0.00 58.89 58.50 1gjr h TRP 167 Cb 0.62 -0.05 -0.04 0.00 -0.00 0.00 0.00 29.16 29.69 1gjr h TRP 167 CO 0.00 1.25 0.49 -0.09 -0.00 0.00 0.00 178.44 180.08 1gjr h ARG 168 N -0.22 1.05 -0.27 0.49 2.43 -1.12 -0.50 114.38 116.24 1gjr h ARG 168 Ca -0.12 -0.08 -0.17 0.00 -0.81 0.00 0.00 59.98 58.80 1gjr h ARG 168 Cb 1.51 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1gjr h ARG 168 CO 0.14 0.73 -0.48 0.52 -1.51 0.00 0.00 179.97 179.37 1gjr h MET 169 N 1.07 0.81 0.00 0.20 2.86 -1.08 -3.40 114.93 115.39 1gjr h MET 169 Ca 0.28 -0.51 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 1gjr h MET 169 Cb -0.07 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.65 1gjr h MET 169 CO -0.06 1.14 0.00 1.19 1.06 0.00 0.00 176.91 180.24 1gjr n PHE 170 N -4.09 0.00 -2.19 -0.22 3.72 -0.51 -4.46 117.46 109.71 1gjr n PHE 170 Ca -0.05 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.94 1gjr n PHE 170 Cb 0.59 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.10 1gjr n PHE 170 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1gjr s LYS 171 N -0.40 4.38 0.21 -1.08 -0.14 -0.21 -4.91 119.74 117.59 1gjr s LYS 171 Ca 0.00 2.10 -0.09 0.00 -1.36 0.00 0.00 55.97 56.62 1gjr s LYS 171 Cb 0.00 -3.16 0.27 0.00 -1.68 0.00 0.00 37.83 33.26 1gjr s LYS 171 CO 0.00 -0.24 1.78 -0.44 -0.76 0.00 0.00 175.35 175.69 1gjr h ASP 172 N 4.88 0.39 1.59 2.83 3.45 -1.95 -2.04 116.42 125.58 1gjr h ASP 172 Ca -0.46 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.06 1gjr h ASP 172 Cb 1.22 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 1gjr h ASP 172 CO 0.75 0.24 0.00 0.00 -1.57 0.00 0.00 179.24 178.66 1gjr h ALA 173 N 1.39 1.00 0.01 3.45 0.00 -1.94 -2.13 119.26 121.04 1gjr h ALA 173 Ca 0.31 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 1gjr h ALA 173 Cb 0.30 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1gjr h ALA 173 CO -0.25 0.00 -0.32 0.93 0.00 0.00 0.00 179.25 179.62 1gjr h GLU 174 N 0.00 0.19 -0.70 0.00 4.39 -1.68 -2.21 114.58 114.57 1gjr h GLU 174 Ca 0.00 -0.22 0.08 0.00 0.34 0.00 0.00 59.36 59.56 1gjr h GLU 174 Cb 0.79 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 29.45 1gjr h GLU 174 CO 0.00 0.98 0.36 0.00 -1.16 0.00 0.00 179.01 179.19 1gjr h ARG 175 N -0.50 0.61 -1.01 2.33 3.08 -1.28 0.57 114.38 118.18 1gjr h ARG 175 Ca -0.04 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.00 1gjr h ARG 175 Cb 1.10 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 30.96 1gjr h ARG 175 CO 0.06 0.40 0.66 0.00 -1.07 0.00 0.00 179.97 180.03 1gjr h ALA 176 N 1.40 1.32 0.00 0.04 0.00 -1.46 -2.86 119.26 117.70 1gjr h ALA 176 Ca 0.34 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1gjr h ALA 176 Cb 0.31 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1gjr h ALA 176 CO -0.24 0.60 -0.55 0.00 0.00 0.00 0.00 179.25 179.06 1gjr h ALA 177 N 1.40 0.64 -3.10 0.00 0.00 -0.60 -3.40 119.26 114.19 1gjr h ALA 177 Ca 0.39 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.68 1gjr h ALA 177 Cb -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.31 1gjr h ALA 177 CO -0.11 0.00 -0.58 -0.80 0.00 0.00 0.00 179.25 177.76 1gjr s ASN 178 N -4.43 4.76 0.49 0.00 0.01 0.19 -4.93 114.94 111.04 1gjr s ASN 178 Ca 0.06 -3.79 0.24 0.00 -0.71 0.00 0.00 52.86 48.66 1gjr s ASN 178 Cb 0.13 -1.63 1.25 0.00 0.41 0.00 0.00 41.25 41.41 1gjr s ASN 178 CO 0.71 -0.09 2.00 1.55 -1.51 0.00 0.00 177.10 179.76 1gjr h PRO 179 N 5.48 0.00 -0.00 -0.60 0.13 -1.79 -1.83 132.00 133.39 1gjr h PRO 179 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1gjr h PRO 179 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1gjr h PRO 179 CO 0.71 0.17 -0.04 -0.85 -0.23 0.00 0.00 178.00 177.77 1gjr n GLU 180 N -3.73 0.40 -3.56 0.86 0.00 -1.26 -4.49 120.64 108.86 1gjr n GLU 180 Ca -0.02 -0.04 -0.29 0.00 0.00 0.00 0.00 57.16 56.81 1gjr n GLU 180 Cb 0.28 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.09 1gjr n GLU 180 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 1gjr s TYR 181 N -2.63 0.82 -0.54 -1.84 5.04 -0.69 -5.00 117.35 112.51 1gjr s TYR 181 Ca 0.26 -1.41 0.02 0.00 -2.44 0.00 0.00 57.07 53.50 1gjr s TYR 181 Cb 0.20 -1.12 0.14 0.00 0.35 0.00 0.00 41.96 41.53 1gjr s TYR 181 CO 0.48 -0.83 0.30 -0.65 -1.34 0.00 0.00 175.55 173.51 1gjr s GLN 182 N 1.51 2.13 0.26 4.97 -1.52 -1.26 -4.83 119.66 120.92 1gjr s GLN 182 Ca 0.13 -2.57 -0.30 0.00 -1.95 0.00 0.00 55.36 50.67 1gjr s GLN 182 Cb -0.19 -3.44 -0.10 0.00 -0.22 0.00 0.00 33.01 29.06 1gjr s GLN 182 CO -0.19 -1.12 1.40 0.12 -0.25 0.00 0.00 175.29 175.25 1gjr s PHE 183 N -0.19 3.04 0.00 0.91 5.36 -1.26 -4.88 117.98 120.96 1gjr s PHE 183 Ca 0.17 1.13 0.00 0.00 -0.96 0.00 0.00 56.93 57.27 1gjr s PHE 183 Cb -0.24 -3.78 0.00 0.00 -0.34 0.00 0.00 43.02 38.66 1gjr s PHE 183 CO -0.01 -2.43 0.28 1.63 -1.46 0.00 0.00 175.22 173.23 1gjr n LYS 184 N 2.00 0.00 0.00 10.12 5.02 0.13 -5.04 118.16 130.39 1gjr n LYS 184 Ca 0.05 -0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 1gjr n LYS 184 Cb 0.41 -0.35 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 1gjr n LYS 184 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gjr n GLY 185 N 0.00 0.05 3.18 0.72 0.00 -0.44 -4.82 105.19 103.89 1gjr n GLY 185 Ca 0.00 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 1gjr n GLY 185 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gjr s PHE 186 N 0.20 2.33 -0.06 1.61 5.36 -1.11 -4.57 117.98 121.73 1gjr s PHE 186 Ca 0.00 -0.94 0.05 0.00 -0.96 0.00 0.00 56.93 55.08 1gjr s PHE 186 Cb 0.00 -1.57 -0.02 0.00 -0.34 0.00 0.00 43.02 41.09 1gjr s PHE 186 CO 0.00 -0.39 -0.21 -1.12 -1.46 0.00 0.00 175.22 172.04 1gjr s SER 187 N 0.40 3.41 -0.19 6.13 0.01 0.11 -0.25 113.70 123.31 1gjr s SER 187 Ca -0.18 -0.41 -0.03 0.00 1.31 0.00 0.00 55.95 56.64 1gjr s SER 187 Cb -0.17 -0.90 0.06 0.00 0.21 0.00 0.00 66.02 65.22 1gjr s SER 187 CO 0.08 0.26 0.05 0.86 0.41 0.00 0.00 173.24 174.90 1gjr s TRP 188 N -0.27 0.87 -0.30 2.43 -0.11 0.17 -1.03 118.94 120.71 1gjr s TRP 188 Ca 0.00 -0.76 -0.14 0.00 1.22 0.00 0.00 56.10 56.42 1gjr s TRP 188 Cb -0.13 -0.97 -0.03 0.00 -1.50 0.00 0.00 33.47 30.85 1gjr s TRP 188 CO 0.03 -0.59 0.33 -1.17 -4.62 0.00 0.00 176.95 170.92 1gjr s LEU 189 N 1.91 4.22 -0.35 5.86 2.96 -0.51 0.42 118.68 133.19 1gjr s LEU 189 Ca -0.00 -0.01 -0.13 0.00 -0.22 0.00 0.00 54.13 53.77 1gjr s LEU 189 Cb -0.17 -2.32 -0.00 0.00 0.50 0.00 0.00 46.19 44.19 1gjr s LEU 189 CO -0.08 -0.23 0.24 -0.69 -1.32 0.00 0.00 176.35 174.27 1gjr s VAL 190 N 1.98 5.11 -0.21 1.68 1.01 0.63 -0.63 120.40 129.97 1gjr s VAL 190 Ca 0.12 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1gjr s VAL 190 Cb -0.16 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.57 1gjr s VAL 190 CO 0.11 -0.08 -0.14 0.12 0.00 0.00 0.00 175.10 175.11 1gjr s PHE 191 N 1.68 2.76 -0.26 5.22 5.36 -0.15 -0.93 117.98 131.67 1gjr s PHE 191 Ca 0.05 -1.79 -0.08 0.00 -0.96 0.00 0.00 56.93 54.15 1gjr s PHE 191 Cb -0.18 -1.82 -0.03 0.00 -0.34 0.00 0.00 43.02 40.66 1gjr s PHE 191 CO 0.09 -0.80 0.09 0.20 -1.46 0.00 0.00 175.22 173.34 1gjr s GLY 192 N 1.28 1.79 0.15 13.12 0.00 0.15 -1.54 107.32 122.27 1gjr s GLY 192 Ca -0.01 -1.14 0.01 0.00 0.00 0.00 0.00 44.72 43.58 1gjr s GLY 192 CO -0.09 0.56 0.00 -1.34 0.00 0.00 0.00 173.10 172.23 1gjr s VAL 193 N 1.63 0.53 0.11 1.40 -7.23 -0.95 -1.34 120.40 114.56 1gjr s VAL 193 Ca 0.06 -1.95 -0.12 0.00 -1.81 0.00 0.00 61.98 58.16 1gjr s VAL 193 Cb -0.15 -2.00 -0.12 0.00 0.56 0.00 0.00 36.38 34.66 1gjr s VAL 193 CO 0.05 -0.56 1.36 1.55 -0.31 0.00 0.00 175.10 177.18 1gjr h PRO 194 N 2.80 0.85 -4.93 4.82 0.13 -1.87 0.14 132.00 133.94 1gjr h PRO 194 Ca -0.36 -0.60 -0.39 0.00 -0.87 0.00 0.00 66.00 63.77 1gjr h PRO 194 Cb 1.19 0.10 -0.14 0.00 0.13 0.00 0.00 31.00 32.28 1gjr h PRO 194 CO 0.62 1.23 -0.59 0.95 -0.23 0.00 0.00 178.00 179.98 1gjr s THR 195 N -3.96 0.54 0.19 1.56 -4.23 -1.26 -1.01 115.64 107.47 1gjr s THR 195 Ca -0.11 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.32 1gjr s THR 195 Cb 0.09 -2.59 0.10 0.00 1.34 0.00 0.00 72.50 71.44 1gjr s THR 195 CO 0.90 0.00 1.69 0.74 -0.54 0.00 0.00 174.62 177.41 1gjr h THR 196 N 2.26 1.26 0.00 3.99 2.02 -1.95 -1.93 112.91 118.57 1gjr h THR 196 Ca -0.37 -1.03 0.00 0.00 0.77 0.00 0.00 66.41 65.78 1gjr h THR 196 Cb 1.25 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 1gjr h THR 196 CO 0.58 0.39 0.00 -2.65 0.37 0.00 0.00 175.52 174.21 1gjr n PRO 197 N -4.23 0.18 -0.00 6.66 -0.02 -1.26 -2.06 135.00 134.27 1gjr n PRO 197 Ca 0.04 0.46 0.14 0.00 -2.02 0.00 0.00 63.50 62.13 1gjr n PRO 197 Cb 0.29 -1.88 0.56 0.00 -0.02 0.00 0.00 33.50 32.45 1gjr n PRO 197 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1gjr n ASN 198 N -2.21 1.38 -4.55 2.55 4.13 -0.74 -2.11 115.26 113.70 1gjr n ASN 198 Ca 0.01 -1.46 -0.33 0.00 1.68 0.00 0.00 54.58 54.49 1gjr n ASN 198 Cb 0.19 -0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.38 1gjr n ASN 198 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1gjr s ILE 199 N -2.00 3.31 0.20 2.41 1.01 -0.88 -4.81 121.20 120.45 1gjr s ILE 199 Ca 0.39 -0.02 -0.31 0.00 0.00 0.00 0.00 60.65 60.71 1gjr s ILE 199 Cb 0.21 -3.77 -0.11 0.00 0.01 0.00 0.00 42.46 38.80 1gjr s ILE 199 CO 0.34 -0.74 1.59 -0.76 0.00 0.00 0.00 174.94 175.37 1gjr s LEU 200 N 10.23 4.37 -1.37 2.97 1.43 -1.26 -2.78 118.68 132.27 1gjr s LEU 200 Ca 0.74 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 56.56 1gjr s LEU 200 Cb -0.11 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.50 1gjr s LEU 200 CO 0.14 -0.86 0.00 -1.22 0.23 0.00 0.00 176.35 174.64 1gjr n TYR 201 N 3.57 0.00 -0.31 0.29 4.01 -1.26 -4.88 117.16 118.58 1gjr n TYR 201 Ca 0.13 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.97 1gjr n TYR 201 Cb 0.38 -2.58 0.23 0.00 -0.31 0.00 0.00 39.34 37.06 1gjr n TYR 201 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1gjr h LYS 202 N 0.05 0.06 -0.33 -0.72 3.64 -1.92 -0.55 116.57 116.80 1gjr h LYS 202 Ca -0.26 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.04 1gjr h LYS 202 Cb 1.02 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 1gjr h LYS 202 CO 0.39 0.04 -0.07 0.93 -2.27 0.00 0.00 179.45 178.47 1gjr h GLU 203 N 0.07 0.64 -0.36 1.90 3.07 -1.90 -1.84 114.58 116.16 1gjr h GLU 203 Ca 0.52 -0.24 -0.14 0.00 -0.50 0.00 0.00 59.36 59.00 1gjr h GLU 203 Cb 1.01 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.87 1gjr h GLU 203 CO -0.80 0.80 -0.34 0.93 -1.40 0.00 0.00 179.01 178.20 1gjr h GLU 204 N 0.42 0.82 0.00 2.33 3.07 -1.56 0.13 114.58 119.79 1gjr h GLU 204 Ca 0.09 -0.40 -0.02 0.00 -0.50 0.00 0.00 59.36 58.53 1gjr h GLU 204 Cb 0.56 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.46 1gjr h GLU 204 CO 0.03 1.03 -0.09 -0.07 -1.40 0.00 0.00 179.01 178.51 1gjr h LEU 205 N 0.69 0.00 0.00 1.33 3.38 -1.10 -1.95 115.31 117.66 1gjr h LEU 205 Ca 0.07 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1gjr h LEU 205 Cb 0.89 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1gjr h LEU 205 CO 0.08 0.09 -1.48 -0.62 0.09 0.00 0.00 178.44 176.60 1gjr n GLU 206 N -3.95 0.63 0.09 1.13 1.02 -0.70 -2.81 120.64 116.05 1gjr n GLU 206 Ca -0.02 0.10 -0.13 0.00 -0.02 0.00 0.00 57.16 57.09 1gjr n GLU 206 Cb 0.18 -1.74 -0.08 0.00 -0.02 0.00 0.00 31.44 29.78 1gjr n GLU 206 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1gjr h GLU 207 N 0.00 -0.17 -0.58 3.49 5.08 -0.71 -2.55 114.58 119.15 1gjr h GLU 207 Ca -0.12 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.37 1gjr h GLU 207 Cb 1.38 0.04 -0.10 0.00 0.50 0.00 0.00 28.75 30.57 1gjr h GLU 207 CO 0.02 0.03 -0.02 0.82 -1.00 0.00 0.00 179.01 178.87 1gjr h ILE 208 N -0.36 0.52 0.00 3.13 2.04 -1.45 0.11 117.51 121.49 1gjr h ILE 208 Ca -0.02 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 65.73 1gjr h ILE 208 Cb 0.29 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1gjr h ILE 208 CO 0.03 0.02 -0.36 -0.61 0.00 0.00 0.00 178.15 177.23 1gjr h GLN 209 N 0.10 0.00 0.00 2.37 4.15 -1.41 0.34 115.11 120.66 1gjr h GLN 209 Ca 0.30 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.54 1gjr h GLN 209 Cb 0.47 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.13 1gjr h GLN 209 CO -0.51 0.36 -1.10 1.96 -1.93 0.00 0.00 178.83 177.62 1gjr h GLN 210 N 0.00 0.00 -0.02 1.69 1.08 -0.98 -3.06 115.11 113.82 1gjr h GLN 210 Ca -0.00 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 56.96 1gjr h GLN 210 Cb 0.66 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.11 1gjr h GLN 210 CO 0.05 0.52 -0.90 -0.22 -0.95 0.00 0.00 178.83 177.33 1gjr h LYS 211 N 0.00 0.65 -2.10 1.46 3.64 -0.38 -3.38 116.57 116.45 1gjr h LYS 211 Ca -0.10 -0.67 -0.58 0.00 -1.27 0.00 0.00 60.65 58.03 1gjr h LYS 211 Cb 1.62 0.18 -0.41 0.00 -0.41 0.00 0.00 32.23 33.22 1gjr h LYS 211 CO 0.07 1.26 -0.84 0.66 -2.27 0.00 0.00 179.45 178.33 1gjr n TYR 212 N -3.96 1.75 0.20 1.91 4.01 0.12 -4.98 117.16 116.21 1gjr n TYR 212 Ca -0.10 -3.87 0.04 0.00 -0.16 0.00 0.00 57.90 53.80 1gjr n TYR 212 Cb 0.81 -0.46 0.41 0.00 -0.31 0.00 0.00 39.34 39.79 1gjr n TYR 212 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1gjr h PRO 213 N 4.04 0.00 -0.01 -0.72 0.13 -1.72 -1.44 132.00 132.27 1gjr h PRO 213 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1gjr h PRO 213 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1gjr h PRO 213 CO 0.66 0.32 -0.20 -3.47 -0.23 0.00 0.00 178.00 175.07 1gjr n ASP 214 N -4.09 1.09 -0.03 1.44 -0.08 -1.26 -4.27 116.55 109.36 1gjr n ASP 214 Ca -0.02 -0.99 -0.00 0.00 -1.51 0.00 0.00 54.79 52.27 1gjr n ASP 214 Cb 0.37 0.10 -0.08 0.00 2.34 0.00 0.00 41.12 43.85 1gjr n ASP 214 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1gjr n ASN 215 N -0.51 2.55 -3.93 1.67 4.13 -0.86 -4.83 115.26 113.48 1gjr n ASN 215 Ca 0.13 0.00 -0.25 0.00 1.68 0.00 0.00 54.58 56.15 1gjr n ASN 215 Cb 0.35 1.09 -0.17 0.00 -1.54 0.00 0.00 39.78 39.51 1gjr n ASN 215 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1gjr s PHE 216 N -2.47 1.29 -0.08 3.10 5.36 -0.60 0.08 117.98 124.66 1gjr s PHE 216 Ca -0.04 -0.55 0.01 0.00 -0.96 0.00 0.00 56.93 55.38 1gjr s PHE 216 Cb 0.05 -1.06 -0.03 0.00 -0.34 0.00 0.00 43.02 41.64 1gjr s PHE 216 CO 0.43 -0.38 -0.09 0.50 -1.46 0.00 0.00 175.22 174.22 1gjr s ARG 217 N 1.30 2.91 -0.16 10.12 3.52 -0.20 -4.65 118.95 131.79 1gjr s ARG 217 Ca -0.03 -0.59 0.00 0.00 -0.13 0.00 0.00 55.73 54.98 1gjr s ARG 217 Cb -0.14 -2.60 0.03 0.00 -1.56 0.00 0.00 34.95 30.69 1gjr s ARG 217 CO -0.03 0.54 -0.11 -1.17 -0.81 0.00 0.00 175.30 173.72 1gjr s LEU 218 N -0.49 1.76 -0.09 -0.88 2.96 -1.26 -1.42 118.68 119.25 1gjr s LEU 218 Ca 0.07 -0.59 0.04 0.00 -0.22 0.00 0.00 54.13 53.43 1gjr s LEU 218 Cb -0.12 -1.10 -0.00 0.00 0.50 0.00 0.00 46.19 45.47 1gjr s LEU 218 CO 0.02 -0.11 -0.23 -0.89 -1.32 0.00 0.00 176.35 173.82 1gjr s THR 219 N 1.52 2.00 -0.14 3.68 2.01 0.19 -5.02 115.64 119.88 1gjr s THR 219 Ca 0.03 -0.99 -0.06 0.00 0.31 0.00 0.00 61.69 60.97 1gjr s THR 219 Cb -0.14 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 1gjr s THR 219 CO -0.09 0.55 0.08 -0.31 -0.69 0.00 0.00 174.62 174.16 1gjr s TYR 220 N 0.28 3.37 -0.78 4.92 2.02 -1.26 -0.98 117.35 124.92 1gjr s TYR 220 Ca -0.16 0.29 0.01 0.00 -0.37 0.00 0.00 57.07 56.84 1gjr s TYR 220 Cb -0.17 -1.98 0.19 0.00 -0.40 0.00 0.00 41.96 39.60 1gjr s TYR 220 CO 0.08 0.44 0.62 0.00 -1.57 0.00 0.00 175.55 175.12 1gjr s ALA 221 N -0.39 4.00 -1.00 3.71 0.00 -0.59 -4.92 121.76 122.56 1gjr s ALA 221 Ca 0.10 -3.78 -0.21 0.00 0.00 0.00 0.00 51.96 48.06 1gjr s ALA 221 Cb -0.12 -2.52 0.08 0.00 0.00 0.00 0.00 23.12 20.56 1gjr s ALA 221 CO 0.02 -2.12 1.35 0.42 0.00 0.00 0.00 175.76 175.43 1gjr s ILE 222 N -1.27 4.19 0.18 0.00 1.01 -1.26 -2.23 121.20 121.83 1gjr s ILE 222 Ca 0.25 -1.06 0.04 0.00 0.00 0.00 0.00 60.65 59.88 1gjr s ILE 222 Cb -0.08 -4.97 0.23 0.00 0.01 0.00 0.00 42.46 37.65 1gjr s ILE 222 CO -0.13 -1.80 0.89 -0.24 0.00 0.00 0.00 174.94 173.66 1gjr n SER 223 N 8.09 0.00 -0.40 3.58 2.88 0.49 -1.86 113.62 126.40 1gjr n SER 223 Ca 0.30 0.95 0.06 0.00 -1.33 0.00 0.00 58.87 58.85 1gjr n SER 223 Cb 0.50 -0.38 0.13 0.00 -0.75 0.00 0.00 64.21 63.72 1gjr n SER 223 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1gjr n ARG 224 N -4.59 2.56 0.00 -1.46 1.74 -0.18 -3.70 116.66 111.04 1gjr n ARG 224 Ca 0.15 -2.21 0.00 0.00 -0.77 0.00 0.00 57.85 55.03 1gjr n ARG 224 Cb 0.51 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 1gjr n ARG 224 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1gjr n GLU 225 N -0.44 -0.34 -3.71 5.56 1.02 -0.78 -5.01 120.64 116.94 1gjr n GLU 225 Ca 0.12 -0.45 -0.11 0.00 -0.02 0.00 0.00 57.16 56.70 1gjr n GLU 225 Cb 0.54 -0.84 -0.11 0.00 -0.02 0.00 0.00 31.44 31.00 1gjr n GLU 225 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1gjr s GLN 226 N -0.09 0.34 -0.01 3.49 -0.21 -1.14 -5.07 119.66 116.98 1gjr s GLN 226 Ca 0.00 0.69 0.01 0.00 0.02 0.00 0.00 55.36 56.07 1gjr s GLN 226 Cb 0.00 -0.03 -0.04 0.00 1.00 0.00 0.00 33.01 33.94 1gjr s GLN 226 CO 0.00 -0.15 0.03 0.15 -2.12 0.00 0.00 175.29 173.20 1gjr s LYS 227 N 1.26 2.89 0.94 2.91 1.02 -1.26 -1.45 119.74 126.05 1gjr s LYS 227 Ca -0.09 -0.56 -0.12 0.00 0.02 0.00 0.00 55.97 55.23 1gjr s LYS 227 Cb -0.08 -2.74 0.15 0.00 -0.52 0.00 0.00 37.83 34.64 1gjr s LYS 227 CO -0.10 0.64 1.11 0.54 -0.92 0.00 0.00 175.35 176.62 1gjr s ASN 228 N -1.58 3.21 0.65 2.83 6.03 -0.19 -4.75 114.94 121.14 1gjr s ASN 228 Ca 0.20 1.10 0.36 0.00 -1.03 0.00 0.00 52.86 53.49 1gjr s ASN 228 Cb -0.12 -1.73 1.97 0.00 -3.03 0.00 0.00 41.25 38.35 1gjr s ASN 228 CO 0.11 -2.75 2.11 -0.65 -2.03 0.00 0.00 177.10 173.89 1gjr h PRO 229 N -1.63 0.00 -0.76 3.55 0.11 -1.97 -0.38 132.00 130.92 1gjr h PRO 229 Ca -0.52 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.36 1gjr h PRO 229 Cb 1.32 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.29 1gjr h PRO 229 CO 0.60 0.00 0.29 1.04 -0.21 0.00 0.00 178.00 179.72 1gjr n GLN 230 N -2.94 3.67 -1.34 1.05 3.00 -1.26 -4.94 117.38 114.61 1gjr n GLN 230 Ca -0.02 -3.10 -0.12 0.00 -0.01 0.00 0.00 57.00 53.75 1gjr n GLN 230 Cb 0.23 -2.22 -0.05 0.00 0.00 0.00 0.00 30.24 28.19 1gjr n GLN 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1gjr n GLY 231 N -0.21 1.26 3.02 1.08 0.00 -0.15 -5.02 105.19 105.18 1gjr n GLY 231 Ca 0.42 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 1gjr n GLY 231 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gjr n GLY 232 N -1.12 1.91 3.75 -0.02 0.00 -1.26 -4.86 105.19 103.59 1gjr n GLY 232 Ca -0.12 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.29 1gjr n GLY 232 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gjr s ARG 233 N -4.05 4.46 -0.65 1.61 0.52 -1.26 -1.02 118.95 118.56 1gjr s ARG 233 Ca 0.47 1.98 -0.27 0.00 -0.52 0.00 0.00 55.73 57.40 1gjr s ARG 233 Cb -0.04 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.25 1gjr s ARG 233 CO 0.30 -0.10 1.61 1.41 0.02 0.00 0.00 175.30 178.54 1gjr s MET 234 N -0.72 2.89 0.48 3.54 -2.45 -0.53 -4.45 119.30 118.07 1gjr s MET 234 Ca 0.52 0.29 0.08 0.00 -1.25 0.00 0.00 55.69 55.33 1gjr s MET 234 Cb -0.35 -4.29 0.03 0.00 1.25 0.00 0.00 34.83 31.47 1gjr s MET 234 CO 0.41 -2.45 0.59 0.71 1.05 0.00 0.00 175.02 175.33 1gjr s TYR 235 N 7.60 2.22 0.25 4.11 2.02 -1.26 -3.48 117.35 128.81 1gjr s TYR 235 Ca 0.54 -0.57 -0.03 0.00 -0.37 0.00 0.00 57.07 56.65 1gjr s TYR 235 Cb -0.11 -2.24 0.46 0.00 -0.40 0.00 0.00 41.96 39.67 1gjr s TYR 235 CO 0.19 -0.62 1.79 0.97 -1.57 0.00 0.00 175.55 176.32 1gjr h ILE 236 N 0.57 0.83 0.00 2.71 6.09 -1.93 -1.46 117.51 124.32 1gjr h ILE 236 Ca -0.37 -0.25 -0.03 0.00 -1.37 0.00 0.00 64.86 62.85 1gjr h ILE 236 Cb 1.28 0.04 -0.00 0.00 0.47 0.00 0.00 36.82 38.61 1gjr h ILE 236 CO 0.47 0.13 -0.13 0.06 -3.07 0.00 0.00 178.15 175.61 1gjr h GLN 237 N 0.73 0.00 0.03 2.19 -0.00 -1.91 0.53 115.11 116.68 1gjr h GLN 237 Ca 0.43 0.00 -0.24 0.00 -0.00 0.00 0.00 58.65 58.84 1gjr h GLN 237 Cb 0.49 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 27.98 1gjr h GLN 237 CO -0.30 0.13 -1.01 -0.44 -0.00 0.00 0.00 178.83 177.22 1gjr h ASP 238 N 0.00 0.55 -0.50 0.06 3.32 -1.63 -1.68 116.42 116.53 1gjr h ASP 238 Ca -0.00 -0.46 -0.07 0.00 0.02 0.00 0.00 57.03 56.52 1gjr h ASP 238 Cb 0.66 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1gjr h ASP 238 CO 0.02 1.28 0.06 0.03 -1.72 0.00 0.00 179.24 178.90 1gjr h ARG 239 N 0.21 0.85 -0.16 3.56 2.47 -0.71 -2.18 114.38 118.42 1gjr h ARG 239 Ca -0.10 -0.24 0.01 0.00 -1.26 0.00 0.00 59.98 58.39 1gjr h ARG 239 Cb 1.66 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 29.88 1gjr h ARG 239 CO 0.18 0.86 0.09 0.28 0.56 0.00 0.00 179.97 181.93 1gjr h VAL 240 N 0.73 1.01 -0.72 2.04 2.07 -0.95 -1.00 116.25 119.42 1gjr h VAL 240 Ca 0.15 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.62 1gjr h VAL 240 Cb 0.43 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 1gjr h VAL 240 CO 0.01 0.03 0.48 0.00 0.02 0.00 0.00 177.57 178.12 1gjr h ALA 241 N 1.08 1.52 -0.45 1.67 0.00 -1.31 0.84 119.26 122.61 1gjr h ALA 241 Ca 0.06 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1gjr h ALA 241 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1gjr h ALA 241 CO -0.04 0.42 -0.02 1.49 0.00 0.00 0.00 179.25 181.10 1gjr h GLU 242 N 0.94 0.76 -0.32 0.00 4.81 -0.67 -2.73 114.58 117.37 1gjr h GLU 242 Ca 0.27 -0.21 -0.20 0.00 -0.13 0.00 0.00 59.36 59.09 1gjr h GLU 242 Cb -0.04 -0.09 -0.14 0.00 0.63 0.00 0.00 28.75 29.11 1gjr h GLU 242 CO -0.07 0.79 -0.37 0.72 -0.73 0.00 0.00 179.01 179.35 1gjr n HIS 243 N -4.21 1.07 -0.35 0.92 8.25 -0.46 -4.84 115.22 115.61 1gjr n HIS 243 Ca 0.02 -1.75 0.03 0.00 -0.26 0.00 0.00 57.72 55.76 1gjr n HIS 243 Cb 0.31 -0.40 0.18 0.00 1.12 0.00 0.00 29.99 31.20 1gjr n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1gjr h ALA 244 N 1.28 1.36 0.05 -1.41 0.00 0.99 -1.29 119.26 120.24 1gjr h ALA 244 Ca 0.18 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.83 1gjr h ALA 244 Cb 1.33 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 18.89 1gjr h ALA 244 CO 0.36 0.31 -1.08 -0.44 0.00 0.00 0.00 179.25 178.39 1gjr h ASP 245 N 1.04 0.72 -0.33 0.00 3.32 -1.84 -1.86 116.42 117.47 1gjr h ASP 245 Ca 0.43 -0.62 -0.02 0.00 0.02 0.00 0.00 57.03 56.85 1gjr h ASP 245 Cb 0.28 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1gjr h ASP 245 CO -0.21 1.43 0.16 1.56 -1.72 0.00 0.00 179.24 180.46 1gjr h GLN 246 N 0.27 0.52 0.15 3.56 4.20 -1.85 -1.79 115.11 120.18 1gjr h GLN 246 Ca -0.13 -0.06 -0.26 0.00 0.06 0.00 0.00 58.65 58.27 1gjr h GLN 246 Cb 1.74 -0.10 0.03 0.00 0.30 0.00 0.00 27.48 29.45 1gjr h GLN 246 CO 0.20 0.42 -1.09 -0.07 -0.67 0.00 0.00 178.83 177.62 1gjr h LEU 247 N 0.52 0.70 -1.26 1.46 3.38 -1.12 -3.13 115.31 115.86 1gjr h LEU 247 Ca 0.13 -0.88 -0.07 0.00 0.09 0.00 0.00 57.88 57.15 1gjr h LEU 247 Cb 0.08 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1gjr h LEU 247 CO -0.02 1.52 -0.33 -0.25 0.09 0.00 0.00 178.44 179.46 1gjr h TRP 248 N -0.02 0.00 -0.36 1.13 2.91 -1.27 -0.03 115.95 118.31 1gjr h TRP 248 Ca -0.18 0.00 -0.09 0.00 1.13 0.00 0.00 58.89 59.75 1gjr h TRP 248 Cb 1.82 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 30.46 1gjr h TRP 248 CO 0.15 0.33 -0.17 0.37 -1.03 0.00 0.00 178.44 178.10 1gjr h GLN 249 N 0.00 0.66 0.09 2.65 5.75 -1.35 -2.13 115.11 120.79 1gjr h GLN 249 Ca -0.00 -0.23 -0.28 0.00 -0.15 0.00 0.00 58.65 57.99 1gjr h GLN 249 Cb 0.69 -0.05 0.02 0.00 1.07 0.00 0.00 27.48 29.21 1gjr h GLN 249 CO 0.04 0.80 -1.17 -0.07 -2.65 0.00 0.00 178.83 175.78 1gjr h LEU 250 N 0.60 0.71 -1.94 -2.39 3.38 -1.18 -3.32 115.31 111.16 1gjr h LEU 250 Ca 0.10 -0.65 -0.01 0.00 0.09 0.00 0.00 57.88 57.40 1gjr h LEU 250 Cb 0.62 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1gjr h LEU 250 CO 0.04 1.47 -0.06 0.40 0.09 0.00 0.00 178.44 180.38 1gjr h ILE 251 N 0.23 0.25 0.00 1.22 2.04 -0.88 -2.07 117.51 118.29 1gjr h ILE 251 Ca -0.15 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1gjr h ILE 251 Cb 1.85 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 39.28 1gjr h ILE 251 CO 0.21 0.06 0.00 0.29 0.00 0.00 0.00 178.15 178.71 1gjr n LYS 252 N -3.31 0.26 -2.88 2.37 5.02 -0.82 -4.72 118.16 114.09 1gjr n LYS 252 Ca -0.01 0.27 -0.41 0.00 -2.02 0.00 0.00 58.31 56.14 1gjr n LYS 252 Cb 0.24 -1.83 -0.04 0.00 -0.02 0.00 0.00 35.03 33.37 1gjr n LYS 252 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1gjr s ASN 253 N -4.52 7.27 0.06 4.39 3.84 -0.78 -4.97 114.94 120.22 1gjr s ASN 253 Ca 0.09 1.52 0.26 0.00 0.21 0.00 0.00 52.86 54.94 1gjr s ASN 253 Cb 0.11 -2.51 1.05 0.00 -0.55 0.00 0.00 41.25 39.35 1gjr s ASN 253 CO 0.55 -0.09 1.82 0.00 -2.79 0.00 0.00 177.10 176.59 1gjr n GLN 254 N 3.25 0.06 0.00 0.43 6.02 -1.26 -2.10 117.38 123.78 1gjr n GLN 254 Ca 0.01 0.10 0.14 0.00 -0.01 0.00 0.00 57.00 57.24 1gjr n GLN 254 Cb 0.50 -1.58 0.81 0.00 1.02 0.00 0.00 30.24 30.99 1gjr n GLN 254 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1gjr n LYS 255 N -1.70 0.75 -3.87 -1.09 5.02 -1.26 -4.86 118.16 111.15 1gjr n LYS 255 Ca 0.06 0.01 -0.35 0.00 -2.02 0.00 0.00 58.31 56.01 1gjr n LYS 255 Cb 0.33 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.74 1gjr n LYS 255 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1gjr s THR 256 N -2.16 4.97 -0.04 -0.18 2.01 -0.89 -1.92 115.64 117.42 1gjr s THR 256 Ca 0.38 0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.43 1gjr s THR 256 Cb 0.19 -3.27 -0.03 0.00 0.01 0.00 0.00 72.50 69.41 1gjr s THR 256 CO 0.36 0.42 -0.06 -1.00 -0.69 0.00 0.00 174.62 173.65 1gjr s HIS 257 N 0.60 2.93 -0.10 4.92 3.76 0.32 -4.89 115.29 122.82 1gjr s HIS 257 Ca 0.05 0.01 0.03 0.00 -0.15 0.00 0.00 55.06 55.00 1gjr s HIS 257 Cb -0.13 -1.67 -0.00 0.00 1.11 0.00 0.00 32.58 31.89 1gjr s HIS 257 CO 0.01 0.35 -0.21 0.99 -0.85 0.00 0.00 174.74 175.03 1gjr s THR 258 N -0.89 2.30 -0.14 1.30 2.01 0.04 -0.73 115.64 119.53 1gjr s THR 258 Ca 0.14 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.22 1gjr s THR 258 Cb -0.11 -1.90 0.00 0.00 0.01 0.00 0.00 72.50 70.51 1gjr s THR 258 CO 0.04 0.55 -0.19 -0.31 -0.69 0.00 0.00 174.62 174.03 1gjr s TYR 259 N 0.28 2.72 -0.22 4.92 1.51 0.16 0.13 117.35 126.85 1gjr s TYR 259 Ca -0.15 -1.17 0.02 0.00 -1.01 0.00 0.00 57.07 54.75 1gjr s TYR 259 Cb -0.17 -1.85 0.05 0.00 -0.11 0.00 0.00 41.96 39.88 1gjr s TYR 259 CO 0.08 -0.53 -0.11 0.42 -1.11 0.00 0.00 175.55 174.30 1gjr s ILE 260 N 0.78 1.88 -0.08 2.71 1.01 0.49 -0.02 121.20 127.97 1gjr s ILE 260 Ca -0.07 -1.25 0.01 0.00 0.00 0.00 0.00 60.65 59.34 1gjr s ILE 260 Cb -0.16 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.39 1gjr s ILE 260 CO -0.00 0.12 -0.08 0.00 0.00 0.00 0.00 174.94 174.97 1gjr n GLY 262 N 4.35 0.39 3.74 0.00 0.00 -0.88 -2.28 105.19 110.51 1gjr n GLY 262 Ca -0.18 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.57 1gjr n GLY 262 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gjr s LEU 263 N 0.00 4.38 0.39 0.99 1.43 -1.26 -2.08 118.68 122.53 1gjr s LEU 263 Ca 0.00 2.69 0.28 0.00 -1.03 0.00 0.00 54.13 56.07 1gjr s LEU 263 Cb 0.00 -3.62 1.17 0.00 0.03 0.00 0.00 46.19 43.77 1gjr s LEU 263 CO 0.00 -0.72 1.84 0.08 0.23 0.00 0.00 176.35 177.78 1gjr h ARG 264 N 5.06 0.00 0.00 1.70 0.11 -1.92 -2.76 114.38 116.57 1gjr h ARG 264 Ca -0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.62 1gjr h ARG 264 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 1gjr h ARG 264 CO 0.78 0.00 0.00 0.78 0.10 0.00 0.00 179.97 181.63 1gjr h GLY 265 N 2.11 0.00 2.00 0.08 0.00 -2.03 -2.90 103.07 102.33 1gjr h GLY 265 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1gjr h GLY 265 CO 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 176.54 176.35 1gjr h MET 266 N 0.00 0.00 0.04 4.80 -0.00 -1.90 -3.36 114.93 114.52 1gjr h MET 266 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1gjr h MET 266 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.16 1gjr h MET 266 CO 0.00 0.19 -0.02 0.93 -0.00 0.00 0.00 176.91 178.01 1gjr h GLU 267 N 0.00 -0.05 0.00 -0.10 5.08 -1.73 -1.57 114.58 116.20 1gjr h GLU 267 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1gjr h GLU 267 Cb 0.51 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1gjr h GLU 267 CO 0.02 0.27 -0.19 1.05 -1.00 0.00 0.00 179.01 179.17 1gjr h GLU 268 N -0.38 0.00 0.12 2.33 4.11 -1.79 0.27 114.58 119.24 1gjr h GLU 268 Ca -0.01 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.14 1gjr h GLU 268 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1gjr h GLU 268 CO 0.01 0.19 -1.36 0.78 0.07 0.00 0.00 179.01 178.70 1gjr h GLY 269 N 1.51 0.28 0.83 1.06 0.00 -1.72 -1.25 103.07 103.78 1gjr h GLY 269 Ca -0.00 -0.72 0.04 0.00 0.00 0.00 0.00 47.33 46.65 1gjr h GLY 269 CO 0.02 0.63 0.57 -2.22 0.00 0.00 0.00 176.54 175.55 1gjr h ILE 270 N 0.07 1.12 0.00 2.60 2.04 -0.15 -0.83 117.51 122.36 1gjr h ILE 270 Ca -0.18 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.28 1gjr h ILE 270 Cb 1.98 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 1gjr h ILE 270 CO 0.18 0.20 -0.15 0.44 0.00 0.00 0.00 178.15 178.82 1gjr h ASP 271 N 1.09 0.00 0.18 1.72 3.32 -0.43 -1.75 116.42 120.56 1gjr h ASP 271 Ca 0.37 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.17 1gjr h ASP 271 Cb 0.05 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.63 1gjr h ASP 271 CO -0.13 0.15 -1.11 0.00 -1.72 0.00 0.00 179.24 176.42 1gjr h ALA 272 N 1.85 -0.10 -0.60 3.45 0.00 -0.89 -3.00 119.26 119.97 1gjr h ALA 272 Ca -0.00 -0.79 -0.08 0.00 0.00 0.00 0.00 54.91 54.04 1gjr h ALA 272 Cb 0.65 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1gjr h ALA 272 CO 0.02 0.53 0.08 0.00 0.00 0.00 0.00 179.25 179.88 1gjr h ALA 273 N 0.10 0.80 0.00 0.00 0.00 -0.86 -2.59 119.26 116.72 1gjr h ALA 273 Ca -0.20 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.27 1gjr h ALA 273 Cb 1.85 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.39 1gjr h ALA 273 CO 0.19 0.58 -1.00 -0.07 0.00 0.00 0.00 179.25 178.94 1gjr h LEU 274 N 0.91 0.00 -1.03 0.00 3.38 -1.50 -2.98 115.31 114.10 1gjr h LEU 274 Ca 0.18 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 1gjr h LEU 274 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1gjr h LEU 274 CO 0.02 0.69 -0.40 -1.28 0.09 0.00 0.00 178.44 177.56 1gjr h SER 275 N 0.00 0.18 0.04 -0.43 0.87 -1.43 0.32 113.55 113.10 1gjr h SER 275 Ca -0.08 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.41 1gjr h SER 275 Cb 1.60 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 1gjr h SER 275 CO 0.08 0.56 -0.02 0.00 -0.53 0.00 0.00 176.83 176.92 1gjr h ALA 276 N 1.45 -0.05 -0.92 6.23 0.00 -1.50 -1.67 119.26 122.80 1gjr h ALA 276 Ca 0.01 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1gjr h ALA 276 Cb 0.77 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 1gjr h ALA 276 CO 0.06 -0.25 0.61 0.00 0.00 0.00 0.00 179.25 179.66 1gjr h ALA 277 N 0.30 1.39 -0.64 0.00 0.00 -1.35 -1.92 119.26 117.03 1gjr h ALA 277 Ca -0.01 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1gjr h ALA 277 Cb 0.55 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1gjr h ALA 277 CO 0.01 0.54 0.18 0.00 0.00 0.00 0.00 179.25 179.98 1gjr h ALA 278 N 1.45 0.84 -0.42 0.00 0.00 -0.41 -3.17 119.26 117.55 1gjr h ALA 278 Ca 0.35 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1gjr h ALA 278 Cb -0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1gjr h ALA 278 CO -0.09 0.53 0.22 0.00 0.00 0.00 0.00 179.25 179.91 1gjr h ALA 279 N 1.06 0.53 -1.00 0.00 0.00 -0.55 0.07 119.26 119.38 1gjr h ALA 279 Ca 0.20 -0.09 0.25 0.00 0.00 0.00 0.00 54.91 55.28 1gjr h ALA 279 Cb 0.33 -0.17 -0.13 0.00 0.00 0.00 0.00 17.79 17.82 1gjr h ALA 279 CO -0.00 0.07 0.59 0.87 0.00 0.00 0.00 179.25 180.77 1gjr h LYS 280 N 0.54 0.54 -0.64 0.00 1.57 -1.38 0.19 116.57 117.39 1gjr h LYS 280 Ca 0.15 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1gjr h LYS 280 Cb 0.07 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1gjr h LYS 280 CO -0.02 0.36 0.00 0.39 -0.57 0.00 0.00 179.45 179.60 1gjr n GLU 281 N -4.91 3.32 -0.64 3.15 1.02 -0.96 -4.92 120.64 116.71 1gjr n GLU 281 Ca 0.27 -2.28 0.00 0.00 -0.02 0.00 0.00 57.16 55.13 1gjr n GLU 281 Cb 0.77 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1gjr n GLU 281 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gjr n GLY 282 N 0.87 0.91 3.85 0.62 0.00 0.67 -5.02 105.19 107.09 1gjr n GLY 282 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 1gjr n GLY 282 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gjr s VAL 283 N -3.32 5.19 -0.34 1.61 1.01 -0.03 -4.94 120.40 119.59 1gjr s VAL 283 Ca 0.00 0.63 -0.13 0.00 0.00 0.00 0.00 61.98 62.47 1gjr s VAL 283 Cb 0.00 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1gjr s VAL 283 CO 0.00 0.58 0.28 0.42 0.00 0.00 0.00 175.10 176.38 1gjr s THR 284 N -1.00 5.25 0.43 3.92 -4.23 -1.26 -2.10 115.64 116.65 1gjr s THR 284 Ca 0.21 -0.13 0.14 0.00 -1.18 0.00 0.00 61.69 60.73 1gjr s THR 284 Cb -0.15 -3.74 0.17 0.00 1.34 0.00 0.00 72.50 70.12 1gjr s THR 284 CO 0.10 -0.03 1.96 -0.25 -0.54 0.00 0.00 174.62 175.87 1gjr h TRP 285 N 8.48 0.02 0.00 3.99 2.91 -1.88 -2.75 115.95 126.72 1gjr h TRP 285 Ca -0.31 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 59.64 1gjr h TRP 285 Cb 1.15 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 29.79 1gjr h TRP 285 CO 0.67 0.22 -0.31 0.66 -1.03 0.00 0.00 178.44 178.66 1gjr h SER 286 N 0.02 0.00 0.18 2.65 4.64 -1.94 0.78 113.55 119.88 1gjr h SER 286 Ca 0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.01 1gjr h SER 286 Cb 0.37 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.47 1gjr h SER 286 CO 0.03 0.31 -1.52 0.44 -0.87 0.00 0.00 176.83 175.21 1gjr h ASP 287 N 0.00 0.61 -0.83 4.97 3.32 -1.93 -3.18 116.42 119.36 1gjr h ASP 287 Ca -0.00 -0.92 -0.03 0.00 0.02 0.00 0.00 57.03 56.10 1gjr h ASP 287 Cb 0.66 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.97 1gjr h ASP 287 CO 0.04 1.70 0.40 0.22 -1.72 0.00 0.00 179.24 179.88 1gjr h TYR 288 N -0.02 1.21 -0.16 4.55 3.20 -1.30 -1.52 116.97 122.93 1gjr h TYR 288 Ca -0.30 -0.06 -0.10 0.00 3.14 0.00 0.00 58.73 61.42 1gjr h TYR 288 Cb 2.00 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.88 1gjr h TYR 288 CO 0.12 0.87 -0.33 0.37 -1.64 0.00 0.00 178.16 177.56 1gjr h GLN 289 N 1.19 0.31 -0.42 1.82 4.15 -1.00 -0.51 115.11 120.66 1gjr h GLN 289 Ca 0.29 -0.13 -0.04 0.00 0.77 0.00 0.00 58.65 59.54 1gjr h GLN 289 Cb 0.12 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 1gjr h GLN 289 CO -0.04 0.61 0.09 -0.22 -1.93 0.00 0.00 178.83 177.34 1gjr h LYS 290 N 0.27 0.62 0.04 1.69 3.64 -1.28 -0.87 116.57 120.69 1gjr h LYS 290 Ca 0.03 -0.11 -0.23 0.00 -1.27 0.00 0.00 60.65 59.08 1gjr h LYS 290 Cb 0.71 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1gjr h LYS 290 CO 0.05 0.58 -1.04 -0.44 -2.27 0.00 0.00 179.45 176.33 1gjr h ASP 291 N 0.61 0.20 -0.08 4.20 3.32 -0.76 -2.46 116.42 121.45 1gjr h ASP 291 Ca 0.14 -0.20 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 1gjr h ASP 291 Cb 0.25 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1gjr h ASP 291 CO -0.00 1.11 -0.08 -0.07 -1.72 0.00 0.00 179.24 178.48 1gjr h LEU 292 N 0.05 0.33 0.10 1.55 3.38 -0.55 -0.91 115.31 119.27 1gjr h LEU 292 Ca -0.06 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1gjr h LEU 292 Cb 1.76 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1gjr h LEU 292 CO 0.15 0.46 -0.05 0.11 0.09 0.00 0.00 178.44 179.21 1gjr h LYS 293 N 0.34 -0.13 -0.84 1.13 1.57 -1.14 0.45 116.57 117.95 1gjr h LYS 293 Ca 0.07 0.01 0.18 0.00 -1.87 0.00 0.00 60.65 59.03 1gjr h LYS 293 Cb 0.36 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 1gjr h LYS 293 CO 0.02 0.33 0.56 -0.22 -0.57 0.00 0.00 179.45 179.57 1gjr h LYS 294 N -0.66 0.43 0.00 3.15 3.64 -1.35 -0.08 116.57 121.71 1gjr h LYS 294 Ca -0.01 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1gjr h LYS 294 Cb 0.52 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1gjr h LYS 294 CO 0.02 0.29 0.00 0.00 -2.27 0.00 0.00 179.45 177.49 1gjr h ALA 295 N 1.62 1.00 -0.29 5.00 0.00 -1.06 -3.47 119.26 122.06 1gjr h ALA 295 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1gjr h ALA 295 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1gjr h ALA 295 CO -0.16 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.50 1gjr n GLY 296 N 1.18 0.81 0.18 0.00 0.00 -0.04 -4.98 105.19 102.34 1gjr n GLY 296 Ca 0.05 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.45 1gjr n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gjr n ARG 297 N -0.77 1.48 -3.99 1.61 1.74 0.04 -4.89 116.66 111.88 1gjr n ARG 297 Ca 0.00 -1.26 -0.31 0.00 -0.77 0.00 0.00 57.85 55.51 1gjr n ARG 297 Cb 0.39 -1.08 -0.15 0.00 -1.02 0.00 0.00 32.46 30.61 1gjr n ARG 297 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 1gjr s TRP 298 N -0.70 3.54 -0.27 -1.55 -0.11 -1.21 -0.78 118.94 117.86 1gjr s TRP 298 Ca 0.06 -2.97 -0.08 0.00 1.22 0.00 0.00 56.10 54.34 1gjr s TRP 298 Cb 0.03 -2.84 -0.02 0.00 -1.50 0.00 0.00 33.47 29.15 1gjr s TRP 298 CO 0.05 -0.91 0.09 -1.01 -4.62 0.00 0.00 176.95 170.55 1gjr s HIS 299 N 0.73 3.12 -0.10 5.86 3.76 0.12 -4.81 115.29 123.96 1gjr s HIS 299 Ca 0.12 -0.55 0.01 0.00 -0.15 0.00 0.00 55.06 54.49 1gjr s HIS 299 Cb -0.20 -2.27 0.02 0.00 1.11 0.00 0.00 32.58 31.24 1gjr s HIS 299 CO -0.07 -0.42 -0.13 0.08 -0.85 0.00 0.00 174.74 173.34 1gjr s VAL 300 N 1.60 1.34 -0.35 -0.90 1.01 -1.26 -0.38 120.40 121.46 1gjr s VAL 300 Ca 0.05 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 1gjr s VAL 300 Cb -0.16 -1.24 0.12 0.00 0.00 0.00 0.00 36.38 35.10 1gjr s VAL 300 CO 0.04 0.41 0.17 -0.70 0.00 0.00 0.00 175.10 175.02 1gjr s GLU 301 N 1.04 0.65 0.11 2.72 2.12 0.17 -4.99 118.70 120.52 1gjr s GLU 301 Ca -0.06 -1.23 0.10 0.00 0.36 0.00 0.00 54.97 54.14 1gjr s GLU 301 Cb -0.15 -1.62 -0.04 0.00 0.26 0.00 0.00 34.13 32.58 1gjr s GLU 301 CO -0.02 -1.11 -0.24 0.95 -0.54 0.00 0.00 175.26 174.30 1gjr s THR 302 N 1.28 2.42 0.00 -1.70 -4.23 -1.26 -2.07 115.64 110.08 1gjr s THR 302 Ca 0.14 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 1gjr s THR 302 Cb -0.20 -2.07 0.00 0.00 1.34 0.00 0.00 72.50 71.57 1gjr s THR 302 CO -0.13 0.13 0.00 0.00 -0.54 0.00 0.00 174.62 174.08