#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gka s ILE 3 N 0.00 3.32 0.72 -0.18 1.01 -1.26 -4.91 121.20 119.90 1gka s ILE 3 Ca 0.00 0.71 -0.16 0.00 0.00 0.00 0.00 60.65 61.20 1gka s ILE 3 Cb 0.00 -3.46 -0.03 0.00 0.01 0.00 0.00 42.46 38.99 1gka s ILE 3 CO 0.00 -0.01 0.63 -2.65 0.00 0.00 0.00 174.94 172.92 1gka n PRO 4 N 5.67 0.34 0.22 2.79 -0.02 -1.26 -4.87 135.00 137.88 1gka n PRO 4 Ca 0.15 0.16 0.07 0.00 -2.02 0.00 0.00 63.50 61.86 1gka n PRO 4 Cb 0.42 -1.92 0.53 0.00 -0.02 0.00 0.00 33.50 32.51 1gka n PRO 4 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1gka h ASN 5 N -0.35 0.00 0.52 2.55 2.35 -2.04 -2.75 115.58 115.86 1gka h ASN 5 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1gka h ASN 5 Cb 1.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.72 1gka h ASN 5 CO 0.44 0.23 -0.03 2.22 -1.65 0.00 0.00 177.43 178.64 1gka n PHE 6 N -3.92 0.00 -3.07 1.19 -1.74 -1.26 -4.61 117.46 104.05 1gka n PHE 6 Ca -0.02 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.44 1gka n PHE 6 Cb 0.32 -0.26 -0.06 0.00 1.52 0.00 0.00 39.48 41.00 1gka n PHE 6 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1gka s VAL 7 N -2.55 4.75 0.14 1.97 1.01 -1.04 -4.44 120.40 120.25 1gka s VAL 7 Ca 0.29 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.17 1gka s VAL 7 Cb 0.20 -4.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1gka s VAL 7 CO 0.47 -0.82 -0.16 -0.69 0.00 0.00 0.00 175.10 173.89 1gka s VAL 8 N 2.97 1.54 0.35 2.92 1.01 -0.54 -4.89 120.40 123.77 1gka s VAL 8 Ca 0.20 -1.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.09 1gka s VAL 8 Cb -0.16 -1.68 -0.12 0.00 0.00 0.00 0.00 36.38 34.42 1gka s VAL 8 CO 0.15 -0.38 1.42 -2.65 0.00 0.00 0.00 175.10 173.64 1gka n PRO 9 N 0.41 2.44 0.00 2.72 -0.02 -1.26 -0.56 135.00 138.73 1gka n PRO 9 Ca -0.14 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1gka n PRO 9 Cb 0.57 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1gka n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gka n GLY 10 N 0.80 2.97 3.76 -1.23 0.00 -0.21 -4.79 105.19 106.49 1gka n GLY 10 Ca 0.04 -1.91 -0.22 0.00 0.00 0.00 0.00 46.02 43.92 1gka n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gka s LYS 11 N -2.06 2.61 0.75 1.61 1.02 -1.26 -3.63 119.74 118.77 1gka s LYS 11 Ca 0.00 -1.28 -0.12 0.00 0.02 0.00 0.00 55.97 54.59 1gka s LYS 11 Cb 0.00 -2.36 0.04 0.00 -0.52 0.00 0.00 37.83 34.99 1gka s LYS 11 CO 0.00 0.30 1.13 0.00 -0.92 0.00 0.00 175.35 175.86 1gka s ALA 13 N -3.45 3.59 -0.62 0.00 0.00 -1.26 -5.01 121.76 115.00 1gka s ALA 13 Ca 0.60 -0.64 -0.25 0.00 0.00 0.00 0.00 51.96 51.67 1gka s ALA 13 Cb -0.11 -2.32 0.05 0.00 0.00 0.00 0.00 23.12 20.74 1gka s ALA 13 CO 0.50 0.03 1.06 -1.12 0.00 0.00 0.00 175.76 176.23 1gka s SER 14 N -3.62 6.27 0.16 0.00 0.01 -1.26 -5.01 113.70 110.26 1gka s SER 14 Ca 0.44 -0.48 0.04 0.00 1.31 0.00 0.00 55.95 57.25 1gka s SER 14 Cb -0.10 -2.47 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 1gka s SER 14 CO 0.35 -1.45 0.23 0.68 0.41 0.00 0.00 173.24 173.46 1gka s VAL 15 N 4.50 5.01 -1.02 3.43 -7.23 -1.26 -4.99 120.40 118.84 1gka s VAL 15 Ca 0.31 -0.85 -0.17 0.00 -1.81 0.00 0.00 61.98 59.45 1gka s VAL 15 Cb -0.12 -3.58 0.14 0.00 0.56 0.00 0.00 36.38 33.38 1gka s VAL 15 CO 0.17 -0.11 1.24 -0.62 -0.31 0.00 0.00 175.10 175.46 1gka s ASP 16 N -3.24 6.76 0.35 4.85 3.68 -1.26 -4.83 116.67 122.99 1gka s ASP 16 Ca 0.33 -2.33 0.18 0.00 2.13 0.00 0.00 52.55 52.87 1gka s ASP 16 Cb -0.11 -2.41 0.54 0.00 -1.45 0.00 0.00 42.92 39.50 1gka s ASP 16 CO 0.27 -0.98 1.67 0.03 0.13 0.00 0.00 175.17 176.28 1gka h ARG 17 N 8.32 0.00 -0.28 4.34 3.08 -1.95 -3.07 114.38 124.82 1gka h ARG 17 Ca 0.21 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.20 1gka h ARG 17 Cb 0.97 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 1gka h ARG 17 CO 1.17 0.41 -0.09 -0.91 -1.07 0.00 0.00 179.97 179.47 1gka h ASN 18 N 0.00 0.56 0.29 7.04 4.21 -1.88 0.12 115.58 125.92 1gka h ASN 18 Ca -0.00 -0.38 -0.01 0.00 1.21 0.00 0.00 56.30 57.12 1gka h ASN 18 Cb 1.01 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 38.05 1gka h ASN 18 CO 0.05 0.81 -0.20 0.50 -1.29 0.00 0.00 177.43 177.31 1gka h LYS 19 N 0.30 -0.46 -0.41 0.81 3.64 -1.97 -1.65 116.57 116.82 1gka h LYS 19 Ca 0.07 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1gka h LYS 19 Cb 0.58 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.46 1gka h LYS 19 CO 0.03 -0.31 0.13 -0.07 -2.27 0.00 0.00 179.45 176.97 1gka h LEU 20 N -0.48 0.12 -1.87 5.20 3.38 -1.48 -1.85 115.31 118.34 1gka h LEU 20 Ca -0.02 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1gka h LEU 20 Cb 0.41 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1gka h LEU 20 CO 0.01 0.11 -0.08 -0.25 0.09 0.00 0.00 178.44 178.32 1gka h TRP 21 N 0.29 0.00 0.03 1.13 2.91 -0.43 0.31 115.95 120.19 1gka h TRP 21 Ca 0.19 0.00 -0.26 0.00 1.13 0.00 0.00 58.89 59.95 1gka h TRP 21 Cb 0.19 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.81 1gka h TRP 21 CO -0.16 0.08 -1.36 0.00 -1.03 0.00 0.00 178.44 175.96 1gka h ALA 22 N 1.92 0.47 -0.15 2.65 0.00 -0.56 -1.65 119.26 121.95 1gka h ALA 22 Ca -0.00 -1.14 -0.11 0.00 0.00 0.00 0.00 54.91 53.65 1gka h ALA 22 Cb 0.14 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1gka h ALA 22 CO 0.01 1.33 -0.35 0.93 0.00 0.00 0.00 179.25 181.17 1gka h GLU 23 N 0.02 0.50 0.00 0.00 5.08 -0.92 -3.36 114.58 115.90 1gka h GLU 23 Ca -0.16 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 57.84 1gka h GLU 23 Cb 1.91 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 31.21 1gka h GLU 23 CO 0.12 0.95 -0.14 1.96 -1.00 0.00 0.00 179.01 180.91 1gka h GLN 24 N 0.12 0.00 0.00 2.33 4.20 -0.39 -3.38 115.11 117.99 1gka h GLN 24 Ca -0.00 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.56 1gka h GLN 24 Cb 0.96 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 1gka h GLN 24 CO 0.08 0.08 -0.68 1.15 -0.67 0.00 0.00 178.83 178.79 1gka h THR 25 N 0.00 1.47 -0.03 -0.54 2.02 -1.44 -3.17 112.91 111.22 1gka h THR 25 Ca -0.00 -2.35 -0.12 0.00 0.77 0.00 0.00 66.41 64.71 1gka h THR 25 Cb 1.06 2.27 -0.02 0.00 -1.74 0.00 0.00 68.15 69.73 1gka h THR 25 CO 0.01 0.67 -0.56 -0.65 0.37 0.00 0.00 175.52 175.36 1gka h PRO 26 N 0.00 0.08 -2.37 6.66 0.11 -1.79 -3.34 132.00 131.35 1gka h PRO 26 Ca -0.01 -0.05 -0.71 0.00 0.11 0.00 0.00 66.00 65.35 1gka h PRO 26 Cb 1.22 0.01 -0.34 0.00 0.11 0.00 0.00 31.00 31.99 1gka h PRO 26 CO 0.09 0.62 0.19 0.09 -0.21 0.00 0.00 178.00 178.78 1gka n ASN 27 N -3.89 5.70 0.00 -2.05 3.02 -1.20 -4.74 115.26 112.11 1gka n ASN 27 Ca -0.02 -3.60 0.11 0.00 -0.03 0.00 0.00 54.58 51.04 1gka n ASN 27 Cb 0.57 -0.91 -0.02 0.00 -0.61 0.00 0.00 39.78 38.80 1gka n ASN 27 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1gka n ARG 28 N 0.28 0.02 0.03 3.52 0.63 -1.26 -3.67 116.66 116.22 1gka n ARG 28 Ca 0.35 -0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 57.22 1gka n ARG 28 Cb 0.34 -1.50 -0.11 0.00 0.45 0.00 0.00 32.46 31.64 1gka n ARG 28 CO 0.00 0.00 0.00 -0.97 -2.51 0.00 0.00 177.63 174.15 1gka h ASN 29 N 0.00 0.00 0.00 6.15 -1.24 -1.92 -3.14 115.58 115.43 1gka h ASN 29 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1gka h ASN 29 Cb 0.52 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.57 1gka h ASN 29 CO 0.00 0.89 0.00 -1.20 -1.29 0.00 0.00 177.43 175.83 1gka n SER 30 N -3.16 0.00 -0.01 1.15 7.64 -1.24 -1.45 113.62 116.55 1gka n SER 30 Ca -0.07 -0.47 0.03 0.00 1.01 0.00 0.00 58.87 59.36 1gka n SER 30 Cb 0.95 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 64.09 1gka n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gka n TYR 31 N -0.56 0.00 -0.27 1.43 9.36 -1.19 -4.70 117.16 121.23 1gka n TYR 31 Ca 0.01 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 60.98 1gka n TYR 31 Cb 0.00 -0.17 0.24 0.00 -0.63 0.00 0.00 39.34 38.78 1gka n TYR 31 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1gka n ALA 32 N -1.79 -4.27 0.00 2.98 0.00 -0.53 -4.81 120.51 112.08 1gka n ALA 32 Ca -0.02 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.17 1gka n ALA 32 Cb 0.24 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.58 1gka n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gka n GLY 33 N -4.34 0.10 3.22 0.00 0.00 -0.19 -4.90 105.19 99.08 1gka n GLY 33 Ca 0.11 -2.13 -0.25 0.00 0.00 0.00 0.00 46.02 43.74 1gka n GLY 33 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gka s VAL 34 N 0.00 1.56 -0.04 1.61 -7.23 -1.26 0.25 120.40 115.28 1gka s VAL 34 Ca 0.00 -1.01 0.03 0.00 -1.81 0.00 0.00 61.98 59.20 1gka s VAL 34 Cb 0.00 -1.33 0.00 0.00 0.56 0.00 0.00 36.38 35.62 1gka s VAL 34 CO 0.00 0.30 -0.13 0.26 -0.31 0.00 0.00 175.10 175.22 1gka s TRP 35 N -0.64 1.39 0.16 2.82 0.52 0.29 -4.82 118.94 118.67 1gka s TRP 35 Ca 0.07 -0.42 -0.07 0.00 0.02 0.00 0.00 56.10 55.70 1gka s TRP 35 Cb -0.08 -0.98 -0.06 0.00 -1.15 0.00 0.00 33.47 31.20 1gka s TRP 35 CO 0.01 -0.18 0.44 0.71 0.02 0.00 0.00 176.95 177.95 1gka s TYR 36 N 0.27 3.47 -0.34 -1.98 1.51 0.37 -0.79 117.35 119.87 1gka s TYR 36 Ca -0.07 0.69 -0.22 0.00 -1.01 0.00 0.00 57.07 56.46 1gka s TYR 36 Cb -0.12 -2.11 0.00 0.00 -0.11 0.00 0.00 41.96 39.62 1gka s TYR 36 CO 0.02 0.39 0.74 -1.14 -1.11 0.00 0.00 175.55 174.46 1gka s GLN 37 N -2.61 3.83 0.01 -0.62 0.74 -0.78 -0.44 119.66 119.79 1gka s GLN 37 Ca 0.42 0.36 -0.18 0.00 0.05 0.00 0.00 55.36 56.01 1gka s GLN 37 Cb -0.12 -3.77 -0.29 0.00 1.10 0.00 0.00 33.01 29.92 1gka s GLN 37 CO 0.23 -0.75 1.03 0.35 -0.55 0.00 0.00 175.29 175.60 1gka h PHE 38 N 8.33 0.78 -1.41 1.67 3.57 -1.13 -3.42 116.94 125.33 1gka h PHE 38 Ca -0.25 -0.50 0.12 0.00 3.53 0.00 0.00 57.97 60.87 1gka h PHE 38 Cb 1.10 -0.06 -0.25 0.00 2.79 0.00 0.00 35.95 39.53 1gka h PHE 38 CO 0.78 1.36 0.66 0.00 -2.23 0.00 0.00 178.31 178.87 1gka s ALA 39 N -2.84 -2.00 0.01 2.41 0.00 -1.24 -1.90 121.76 116.21 1gka s ALA 39 Ca -0.12 1.70 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1gka s ALA 39 Cb 0.03 -1.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.09 1gka s ALA 39 CO 0.88 -0.27 -0.02 -0.48 0.00 0.00 0.00 175.76 175.86 1gka s LEU 40 N -0.87 2.16 0.29 0.00 0.05 -1.22 -0.74 118.68 118.35 1gka s LEU 40 Ca 0.02 -0.34 -0.29 0.00 0.05 0.00 0.00 54.13 53.57 1gka s LEU 40 Cb -0.01 0.04 -0.09 0.00 -2.05 0.00 0.00 46.19 44.08 1gka s LEU 40 CO -0.03 -0.19 1.07 0.42 -0.55 0.00 0.00 176.35 177.07 1gka s THR 41 N -0.97 3.60 -0.04 5.48 -4.23 -1.01 -2.80 115.64 115.67 1gka s THR 41 Ca -0.10 1.56 -0.09 0.00 -1.18 0.00 0.00 61.69 61.88 1gka s THR 41 Cb -0.07 -3.98 -0.04 0.00 1.34 0.00 0.00 72.50 69.75 1gka s THR 41 CO -0.01 0.33 0.28 -3.20 -0.54 0.00 0.00 174.62 171.49 1gka n ASN 42 N 1.07 0.09 -3.29 3.99 5.15 -1.26 -4.57 115.26 116.45 1gka n ASN 42 Ca -0.00 0.26 -0.09 0.00 -0.60 0.00 0.00 54.58 54.15 1gka n ASN 42 Cb 0.46 -0.20 -0.05 0.00 -0.53 0.00 0.00 39.78 39.46 1gka n ASN 42 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1gka s ASN 43 N 0.24 -0.01 0.00 1.20 3.84 -1.26 -4.92 114.94 114.03 1gka s ASN 43 Ca 0.21 -1.02 0.00 0.00 0.21 0.00 0.00 52.86 52.26 1gka s ASN 43 Cb -0.30 1.20 0.00 0.00 -0.55 0.00 0.00 41.25 41.60 1gka s ASN 43 CO 0.15 -0.25 0.58 -0.81 -2.79 0.00 0.00 177.10 173.98 1gka n PRO 44 N 4.55 0.00 0.00 0.43 -0.04 -1.26 -1.24 135.00 137.44 1gka n PRO 44 Ca 0.09 0.11 0.13 0.00 -0.04 0.00 0.00 63.50 63.79 1gka n PRO 44 Cb 0.50 -1.84 0.28 0.00 -0.04 0.00 0.00 33.50 32.40 1gka n PRO 44 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1gka n TYR 45 N -1.08 0.00 -2.73 0.54 4.02 -1.26 -4.69 117.16 111.95 1gka n TYR 45 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 1gka n TYR 45 Cb 0.34 -0.07 -0.03 0.00 -0.02 0.00 0.00 39.34 39.56 1gka n TYR 45 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 1gka s GLN 46 N -2.41 3.15 0.00 -0.72 2.00 -0.37 -4.85 119.66 116.46 1gka s GLN 46 Ca 0.25 -0.61 0.28 0.00 -2.00 0.00 0.00 55.36 53.28 1gka s GLN 46 Cb 0.19 -4.23 1.04 0.00 0.80 0.00 0.00 33.01 30.82 1gka s GLN 46 CO 0.50 -1.95 1.74 1.28 -0.50 0.00 0.00 175.29 176.36 1gka n LEU 47 N 8.38 1.16 -4.41 3.68 4.77 -1.26 -4.72 117.00 124.60 1gka n LEU 47 Ca -0.01 -0.35 -0.43 0.00 -0.03 0.00 0.00 56.01 55.20 1gka n LEU 47 Cb 0.47 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.41 1gka n LEU 47 CO 0.67 0.20 -0.06 -0.63 -1.33 0.00 0.00 177.39 176.23 1gka s ILE 48 N -2.19 5.02 0.07 -0.08 1.01 -1.26 -3.87 121.20 119.90 1gka s ILE 48 Ca 0.34 -0.88 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 1gka s ILE 48 Cb 0.20 -3.87 -0.24 0.00 0.01 0.00 0.00 42.46 38.56 1gka s ILE 48 CO 0.40 -0.39 1.18 -0.08 0.00 0.00 0.00 174.94 176.05 1gka h GLU 49 N 8.60 0.69 -3.67 2.79 4.81 -0.97 -3.46 114.58 123.38 1gka h GLU 49 Ca -0.27 -0.77 -0.11 0.00 -0.13 0.00 0.00 59.36 58.08 1gka h GLU 49 Cb 1.11 0.22 -0.17 0.00 0.63 0.00 0.00 28.75 30.54 1gka h GLU 49 CO 0.76 1.34 -0.44 -1.59 -0.73 0.00 0.00 179.01 178.35 1gka s LYS 50 N -3.27 0.67 -0.71 1.92 -2.85 -0.99 -4.38 119.74 110.13 1gka s LYS 50 Ca -0.10 -0.70 0.00 0.00 -1.00 0.00 0.00 55.97 54.17 1gka s LYS 50 Cb 0.07 0.27 0.00 0.00 -2.06 0.00 0.00 37.83 36.11 1gka s LYS 50 CO 0.92 -0.19 0.00 0.00 0.10 0.00 0.00 175.35 176.19 1gka n VAL 52 N -3.31 0.07 -4.03 0.00 0.31 -1.24 -4.15 118.33 105.98 1gka n VAL 52 Ca -0.08 -0.46 -0.31 0.00 -0.01 0.00 0.00 64.34 63.47 1gka n VAL 52 Cb 0.38 -2.07 -0.15 0.00 -0.91 0.00 0.00 33.84 31.09 1gka n VAL 52 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1gka s ARG 53 N 7.50 1.71 -0.41 5.55 3.52 0.65 -1.86 118.95 135.61 1gka s ARG 53 Ca 1.08 -1.73 -0.19 0.00 -0.13 0.00 0.00 55.73 54.77 1gka s ARG 53 Cb -0.57 -3.13 0.01 0.00 -1.56 0.00 0.00 34.95 29.70 1gka s ARG 53 CO 0.38 -0.84 0.52 -0.80 -0.81 0.00 0.00 175.30 173.76 1gka s ASN 54 N 0.98 6.27 -0.42 -2.12 0.01 0.03 -1.84 114.94 117.84 1gka s ASN 54 Ca 0.05 -0.38 -0.08 0.00 -0.71 0.00 0.00 52.86 51.75 1gka s ASN 54 Cb -0.19 -2.27 0.09 0.00 0.41 0.00 0.00 41.25 39.29 1gka s ASN 54 CO -0.07 -0.61 0.26 -0.70 -1.51 0.00 0.00 177.10 174.46 1gka s GLU 55 N 2.43 2.45 0.00 -0.60 2.12 0.51 0.11 118.70 125.72 1gka s GLU 55 Ca 0.17 -1.60 -0.26 0.00 0.36 0.00 0.00 54.97 53.64 1gka s GLU 55 Cb -0.16 -3.75 -0.04 0.00 0.26 0.00 0.00 34.13 30.44 1gka s GLU 55 CO 0.15 -1.02 0.82 0.71 -0.54 0.00 0.00 175.26 175.38 1gka s TYR 56 N 1.35 3.67 -0.26 5.30 1.51 0.14 -2.82 117.35 126.24 1gka s TYR 56 Ca 0.04 1.49 0.02 0.00 -1.01 0.00 0.00 57.07 57.61 1gka s TYR 56 Cb -0.24 -2.92 0.07 0.00 -0.11 0.00 0.00 41.96 38.76 1gka s TYR 56 CO 0.00 0.13 -0.06 0.45 -1.11 0.00 0.00 175.55 174.96 1gka s SER 57 N 0.52 4.18 0.44 2.29 0.15 -1.10 -1.02 113.70 119.16 1gka s SER 57 Ca 0.43 -1.38 -0.21 0.00 0.70 0.00 0.00 55.95 55.48 1gka s SER 57 Cb -0.20 -1.36 -0.10 0.00 -1.71 0.00 0.00 66.02 62.66 1gka s SER 57 CO 0.23 -0.24 1.00 0.12 1.20 0.00 0.00 173.24 175.55 1gka s PHE 58 N 1.24 3.19 0.00 3.44 5.99 -1.26 -1.58 117.98 129.00 1gka s PHE 58 Ca -0.05 1.61 0.00 0.00 0.00 0.00 0.00 56.93 58.49 1gka s PHE 58 Cb -0.19 -2.98 0.00 0.00 0.00 0.00 0.00 43.02 39.85 1gka s PHE 58 CO -0.07 -0.46 0.51 -0.40 -0.00 0.00 0.00 175.22 174.81 1gka n ASP 59 N -0.64 0.85 0.00 6.13 5.75 -1.09 -4.97 116.55 122.58 1gka n ASP 59 Ca 0.07 -1.26 0.00 0.00 -0.01 0.00 0.00 54.79 53.60 1gka n ASP 59 Cb 0.53 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.62 1gka n ASP 59 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gka n GLY 60 N -0.13 3.63 0.08 6.12 0.00 -1.26 -4.89 105.19 108.75 1gka n GLY 60 Ca 0.00 -0.88 -0.04 0.00 0.00 0.00 0.00 46.02 45.10 1gka n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gka n LYS 61 N 0.00 0.25 -4.42 1.61 5.02 -1.26 -5.04 118.16 114.32 1gka n LYS 61 Ca 0.00 0.10 -0.21 0.00 -2.02 0.00 0.00 58.31 56.18 1gka n LYS 61 Cb 0.00 -0.93 -0.10 0.00 -0.02 0.00 0.00 35.03 33.98 1gka n LYS 61 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1gka s GLN 62 N -1.91 1.53 0.22 1.97 -2.07 -1.26 -4.61 119.66 113.53 1gka s GLN 62 Ca -0.14 -1.75 0.04 0.00 -1.82 0.00 0.00 55.36 51.69 1gka s GLN 62 Cb 0.02 -1.27 -0.03 0.00 -1.09 0.00 0.00 33.01 30.64 1gka s GLN 62 CO 0.20 0.12 0.36 -0.06 -1.32 0.00 0.00 175.29 174.59 1gka s PHE 63 N -2.91 3.47 -0.25 9.60 0.40 -0.25 -2.68 117.98 125.36 1gka s PHE 63 Ca 0.28 0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.69 1gka s PHE 63 Cb 0.01 -1.64 0.05 0.00 0.51 0.00 0.00 43.02 41.95 1gka s PHE 63 CO 0.11 0.43 -0.11 0.08 0.70 0.00 0.00 175.22 176.44 1gka s VAL 64 N -1.93 2.36 0.34 -0.44 1.01 -0.61 -1.90 120.40 119.22 1gka s VAL 64 Ca 0.35 -1.39 -0.11 0.00 0.00 0.00 0.00 61.98 60.84 1gka s VAL 64 Cb -0.10 -2.29 -0.07 0.00 0.00 0.00 0.00 36.38 33.93 1gka s VAL 64 CO 0.29 0.10 0.69 -0.63 0.00 0.00 0.00 175.10 175.56 1gka s ILE 65 N 1.19 4.82 -0.10 2.22 1.01 -0.19 -2.71 121.20 127.43 1gka s ILE 65 Ca -0.05 0.60 -0.03 0.00 0.00 0.00 0.00 60.65 61.17 1gka s ILE 65 Cb -0.18 -3.68 0.04 0.00 0.01 0.00 0.00 42.46 38.65 1gka s ILE 65 CO -0.06 -0.33 0.05 -0.75 0.00 0.00 0.00 174.94 173.85 1gka s LYS 66 N -3.41 0.23 -0.06 2.79 2.47 -1.13 -2.04 119.74 118.59 1gka s LYS 66 Ca 0.50 0.08 0.06 0.00 -1.56 0.00 0.00 55.97 55.05 1gka s LYS 66 Cb -0.10 -1.18 -0.01 0.00 -1.46 0.00 0.00 37.83 35.07 1gka s LYS 66 CO 0.26 -0.45 -0.24 -1.12 0.16 0.00 0.00 175.35 173.96 1gka s SER 67 N 2.07 3.17 0.03 1.43 0.01 0.99 -0.36 113.70 121.05 1gka s SER 67 Ca 0.03 -0.48 -0.01 0.00 1.31 0.00 0.00 55.95 56.80 1gka s SER 67 Cb -0.14 -0.87 -0.03 0.00 0.21 0.00 0.00 66.02 65.19 1gka s SER 67 CO -0.06 0.25 -0.02 0.42 0.41 0.00 0.00 173.24 174.24 1gka s THR 68 N -0.18 0.16 -4.45 1.44 -4.23 -0.77 0.39 115.64 108.00 1gka s THR 68 Ca -0.03 -1.30 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1gka s THR 68 Cb -0.14 -0.84 0.00 0.00 1.34 0.00 0.00 72.50 72.86 1gka s THR 68 CO 0.04 -0.72 0.00 0.61 -0.54 0.00 0.00 174.62 174.01 1gka n GLY 69 N 0.90 -0.50 3.35 3.99 0.00 -1.10 -0.25 105.19 111.57 1gka n GLY 69 Ca -0.19 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 1gka n GLY 69 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gka s ILE 70 N -3.19 2.63 0.47 -0.61 -0.00 0.41 -0.44 121.20 120.47 1gka s ILE 70 Ca 0.00 -0.84 -0.07 0.00 -0.00 0.00 0.00 60.65 59.74 1gka s ILE 70 Cb 0.00 -2.04 0.11 0.00 -0.00 0.00 0.00 42.46 40.54 1gka s ILE 70 CO 0.00 0.56 0.25 0.00 -0.00 0.00 0.00 174.94 175.75 1gka n ALA 71 N 3.06 -1.55 0.02 2.27 0.00 0.21 -0.54 120.51 123.98 1gka n ALA 71 Ca -0.18 -0.45 -0.04 0.00 0.00 0.00 0.00 53.44 52.78 1gka n ALA 71 Cb 0.52 -0.04 -0.10 0.00 0.00 0.00 0.00 19.45 19.84 1gka n ALA 71 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1gka h TYR 72 N -2.37 0.00 -0.22 0.00 -1.99 -1.88 -3.28 116.97 107.23 1gka h TYR 72 Ca -0.12 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.63 1gka h TYR 72 Cb 0.39 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.11 1gka h TYR 72 CO 0.00 0.76 0.15 0.38 -0.00 0.00 0.00 178.16 179.45 1gka h ASP 73 N 0.00 0.21 0.00 3.88 3.04 -1.91 -3.46 116.42 118.18 1gka h ASP 73 Ca -0.18 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.61 1gka h ASP 73 Cb 1.74 -0.05 0.00 0.00 -1.04 0.00 0.00 39.33 39.98 1gka h ASP 73 CO 0.07 0.15 0.00 0.61 -2.04 0.00 0.00 179.24 178.03 1gka n GLY 74 N -1.52 0.99 3.78 7.15 0.00 -1.24 -5.14 105.19 109.22 1gka n GLY 74 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1gka n GLY 74 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gka s ASN 75 N -0.59 3.25 -0.03 1.61 0.01 -1.26 -4.66 114.94 113.27 1gka s ASN 75 Ca 0.00 0.90 -0.28 0.00 -0.71 0.00 0.00 52.86 52.77 1gka s ASN 75 Cb 0.00 -1.42 -0.03 0.00 0.41 0.00 0.00 41.25 40.21 1gka s ASN 75 CO 0.00 -2.70 0.91 -0.76 -1.51 0.00 0.00 177.10 173.04 1gka s LEU 76 N -6.11 4.34 -0.07 0.60 1.02 -1.26 0.66 118.68 117.86 1gka s LEU 76 Ca 0.65 1.53 0.03 0.00 0.02 0.00 0.00 54.13 56.35 1gka s LEU 76 Cb -0.14 -3.45 0.01 0.00 0.02 0.00 0.00 46.19 42.63 1gka s LEU 76 CO 0.54 -0.25 -0.14 -0.22 0.02 0.00 0.00 176.35 176.29 1gka s LEU 77 N 1.10 1.73 -0.17 1.79 2.96 0.41 -4.85 118.68 121.66 1gka s LEU 77 Ca 0.48 -0.34 -0.00 0.00 -0.22 0.00 0.00 54.13 54.05 1gka s LEU 77 Cb -0.20 -0.92 0.00 0.00 0.50 0.00 0.00 46.19 45.58 1gka s LEU 77 CO 0.24 0.06 -0.15 -0.75 -1.32 0.00 0.00 176.35 174.44 1gka s LYS 78 N 0.56 3.19 -0.14 1.98 2.20 -1.26 -2.72 119.74 123.56 1gka s LYS 78 Ca -0.14 -0.75 0.02 0.00 -0.36 0.00 0.00 55.97 54.73 1gka s LYS 78 Cb -0.16 -2.66 0.00 0.00 -1.51 0.00 0.00 37.83 33.51 1gka s LYS 78 CO 0.04 -0.05 -0.19 1.03 -0.36 0.00 0.00 175.35 175.82 1gka s ARG 79 N 0.98 3.15 0.01 4.03 1.81 0.16 -4.96 118.95 124.13 1gka s ARG 79 Ca -0.02 -0.80 -0.16 0.00 -1.72 0.00 0.00 55.73 53.03 1gka s ARG 79 Cb -0.15 -2.50 -0.06 0.00 -0.45 0.00 0.00 34.95 31.79 1gka s ARG 79 CO -0.03 0.07 0.44 -0.80 -0.68 0.00 0.00 175.30 174.30 1gka s ASN 80 N 0.66 6.86 0.19 0.23 0.01 -1.26 -0.00 114.94 121.63 1gka s ASN 80 Ca -0.09 1.03 -0.02 0.00 -0.71 0.00 0.00 52.86 53.06 1gka s ASN 80 Cb -0.16 -2.27 0.01 0.00 0.41 0.00 0.00 41.25 39.23 1gka s ASN 80 CO 0.02 0.31 0.29 0.61 -1.51 0.00 0.00 177.10 176.82 1gka n GLY 81 N 1.81 2.42 3.33 0.66 0.00 -0.87 -1.79 105.19 110.74 1gka n GLY 81 Ca -0.13 -1.45 -0.14 0.00 0.00 0.00 0.00 46.02 44.30 1gka n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gka s LYS 82 N -2.38 0.65 -0.28 1.61 1.02 -0.99 -1.02 119.74 118.36 1gka s LYS 82 Ca 0.15 0.26 -0.00 0.00 0.02 0.00 0.00 55.97 56.39 1gka s LYS 82 Cb -0.01 0.30 0.09 0.00 -0.52 0.00 0.00 37.83 37.69 1gka s LYS 82 CO 0.11 -0.15 0.05 -1.17 -0.92 0.00 0.00 175.35 173.27 1gka s LEU 83 N -0.56 2.41 0.40 3.17 2.96 -0.80 -0.38 118.68 125.87 1gka s LEU 83 Ca -0.07 -1.47 0.07 0.00 -0.22 0.00 0.00 54.13 52.45 1gka s LEU 83 Cb -0.03 -0.97 -0.08 0.00 0.50 0.00 0.00 46.19 45.61 1gka s LEU 83 CO 0.03 -0.36 -0.00 -0.72 -1.32 0.00 0.00 176.35 173.98 1gka s TYR 84 N 1.53 2.51 0.41 5.38 -0.85 -1.05 -1.09 117.35 124.19 1gka s TYR 84 Ca 0.05 -0.64 -0.24 0.00 -0.52 0.00 0.00 57.07 55.72 1gka s TYR 84 Cb -0.18 -1.72 -0.09 0.00 0.38 0.00 0.00 41.96 40.36 1gka s TYR 84 CO -0.17 0.46 1.08 -1.25 -1.52 0.00 0.00 175.55 174.16 1gka s PRO 85 N -3.70 4.08 0.20 -3.49 0.04 -1.26 -1.37 135.00 129.49 1gka s PRO 85 Ca 0.35 1.59 -0.31 0.00 0.04 0.00 0.00 61.00 62.68 1gka s PRO 85 Cb 0.09 -2.53 -0.16 0.00 0.04 0.00 0.00 34.50 31.93 1gka s PRO 85 CO 0.18 -0.23 0.93 -1.71 0.04 0.00 0.00 177.00 176.21 1gka n ASN 86 N -0.13 0.51 -0.80 6.66 5.15 -0.50 -4.61 115.26 121.54 1gka n ASN 86 Ca 0.05 1.15 0.07 0.00 -0.60 0.00 0.00 54.58 55.26 1gka n ASN 86 Cb 0.49 -1.14 0.20 0.00 -0.53 0.00 0.00 39.78 38.80 1gka n ASN 86 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1gka n PRO 87 N 1.22 2.01 -0.29 1.20 -0.04 -1.26 -3.24 135.00 134.60 1gka n PRO 87 Ca 0.15 -1.57 0.08 0.00 -0.04 0.00 0.00 63.50 62.12 1gka n PRO 87 Cb 0.25 -1.35 0.18 0.00 -0.04 0.00 0.00 33.50 32.55 1gka n PRO 87 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1gka n PHE 88 N 0.78 0.33 -0.98 0.54 0.99 -1.26 -4.96 117.46 112.89 1gka n PHE 88 Ca 0.15 -1.08 0.00 0.00 -0.00 0.00 0.00 57.45 56.52 1gka n PHE 88 Cb 0.37 -0.23 0.00 0.00 -1.00 0.00 0.00 39.48 38.62 1gka n PHE 88 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1gka n GLY 89 N -1.14 0.32 3.76 1.37 0.00 -1.20 -5.01 105.19 103.29 1gka n GLY 89 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1gka n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gka s GLU 90 N -0.79 2.36 -1.56 1.61 0.41 -1.26 -4.91 118.70 114.56 1gka s GLU 90 Ca 0.00 1.27 -0.10 0.00 -0.41 0.00 0.00 54.97 55.73 1gka s GLU 90 Cb 0.00 -1.90 -0.04 0.00 -1.78 0.00 0.00 34.13 30.41 1gka s GLU 90 CO 0.00 -1.57 2.76 -0.35 -0.49 0.00 0.00 175.26 175.61 1gka n PRO 91 N -3.19 3.72 -3.52 0.39 -0.04 -1.26 -4.50 135.00 126.60 1gka n PRO 91 Ca 0.10 -2.47 -0.08 0.00 -0.04 0.00 0.00 63.50 61.01 1gka n PRO 91 Cb 0.53 -2.84 -0.02 0.00 -0.04 0.00 0.00 33.50 31.12 1gka n PRO 91 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1gka s HIS 92 N 1.78 -0.31 0.50 0.54 -3.43 -1.26 -4.65 115.29 108.45 1gka s HIS 92 Ca 0.64 0.20 0.04 0.00 -0.80 0.00 0.00 55.06 55.14 1gka s HIS 92 Cb 0.17 0.53 0.02 0.00 -1.43 0.00 0.00 32.58 31.88 1gka s HIS 92 CO -0.07 -0.49 0.69 -0.51 -2.00 0.00 0.00 174.74 172.37 1gka s LEU 93 N -2.40 3.44 -0.07 5.38 1.02 -1.24 -1.40 118.68 123.40 1gka s LEU 93 Ca 0.06 -0.16 0.03 0.00 0.02 0.00 0.00 54.13 54.07 1gka s LEU 93 Cb -0.01 -2.80 -0.02 0.00 0.02 0.00 0.00 46.19 43.38 1gka s LEU 93 CO -0.08 -0.98 -0.14 -0.44 0.02 0.00 0.00 176.35 174.74 1gka s SER 94 N -4.39 4.06 -0.10 2.29 0.01 -0.47 -0.75 113.70 114.35 1gka s SER 94 Ca 0.56 -0.21 -0.01 0.00 1.31 0.00 0.00 55.95 57.59 1gka s SER 94 Cb -0.10 -1.02 -0.03 0.00 0.21 0.00 0.00 66.02 65.08 1gka s SER 94 CO 0.36 0.31 -0.04 -0.51 0.41 0.00 0.00 173.24 173.77 1gka s ILE 95 N -0.51 3.90 -0.32 1.44 2.07 0.12 -2.54 121.20 125.36 1gka s ILE 95 Ca 0.07 -0.39 0.02 0.00 -1.41 0.00 0.00 60.65 58.94 1gka s ILE 95 Cb -0.12 -2.64 0.15 0.00 0.13 0.00 0.00 42.46 39.98 1gka s ILE 95 CO 0.02 0.56 0.35 -0.62 -1.91 0.00 0.00 174.94 173.35 1gka s ASP 96 N -0.42 1.17 0.21 4.50 3.68 0.49 -1.22 116.67 125.07 1gka s ASP 96 Ca 0.07 -1.00 -0.19 0.00 2.13 0.00 0.00 52.55 53.56 1gka s ASP 96 Cb -0.12 0.67 -0.08 0.00 -1.45 0.00 0.00 42.92 41.94 1gka s ASP 96 CO 0.02 -0.33 0.70 -0.31 0.13 0.00 0.00 175.17 175.39 1gka s TYR 97 N 2.03 3.66 0.63 -5.34 1.51 -1.26 -2.33 117.35 116.24 1gka s TYR 97 Ca 0.12 1.36 -0.18 0.00 -1.01 0.00 0.00 57.07 57.36 1gka s TYR 97 Cb -0.14 -2.59 -0.02 0.00 -0.11 0.00 0.00 41.96 39.10 1gka s TYR 97 CO -0.21 0.36 1.20 -2.00 -1.11 0.00 0.00 175.55 173.79 1gka s GLU 98 N -1.93 2.77 -0.60 -0.62 2.56 -0.74 -2.13 118.70 118.00 1gka s GLU 98 Ca 0.42 1.77 -0.03 0.00 0.00 0.00 0.00 54.97 57.13 1gka s GLU 98 Cb -0.17 -1.91 0.00 0.00 2.00 0.00 0.00 34.13 34.06 1gka s GLU 98 CO 0.21 -1.35 0.34 -1.71 -0.56 0.00 0.00 175.26 172.19 1gka n ASN 99 N -1.92 -3.55 -3.56 -1.70 5.15 -1.26 -4.93 115.26 103.48 1gka n ASN 99 Ca 0.13 -0.16 -0.13 0.00 -0.60 0.00 0.00 54.58 53.82 1gka n ASN 99 Cb 0.50 -2.33 -0.06 0.00 -0.53 0.00 0.00 39.78 37.36 1gka n ASN 99 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1gka s SER 100 N -2.98 -0.50 0.12 1.20 0.15 -0.91 -5.17 113.70 105.62 1gka s SER 100 Ca 0.17 0.60 -0.26 0.00 0.70 0.00 0.00 55.95 57.16 1gka s SER 100 Cb -0.07 0.48 -0.07 0.00 -1.71 0.00 0.00 66.02 64.65 1gka s SER 100 CO 0.21 -0.43 0.80 -0.36 1.20 0.00 0.00 173.24 174.66 1gka s PHE 101 N -0.99 3.84 0.84 3.44 0.08 -1.26 -4.55 117.98 119.38 1gka s PHE 101 Ca -0.05 1.61 -0.14 0.00 0.12 0.00 0.00 56.93 58.47 1gka s PHE 101 Cb -0.01 -2.83 0.02 0.00 -0.57 0.00 0.00 43.02 39.63 1gka s PHE 101 CO 0.04 0.39 0.64 0.00 -0.10 0.00 0.00 175.22 176.19 1gka n ALA 102 N 2.18 -1.64 -2.19 5.36 0.00 -1.26 -4.88 120.51 118.07 1gka n ALA 102 Ca -0.03 -0.42 -0.11 0.00 0.00 0.00 0.00 53.44 52.87 1gka n ALA 102 Cb 0.49 -1.92 -0.10 0.00 0.00 0.00 0.00 19.45 17.92 1gka n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gka s ALA 103 N -2.18 1.09 0.61 0.00 0.00 -0.36 -4.91 121.76 116.01 1gka s ALA 103 Ca 0.63 -1.38 -0.14 0.00 0.00 0.00 0.00 51.96 51.07 1gka s ALA 103 Cb -0.28 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 1gka s ALA 103 CO 0.60 -0.20 1.05 -1.25 0.00 0.00 0.00 175.76 175.96 1gka s PRO 104 N -3.81 3.33 -0.28 0.00 0.04 -1.26 0.14 135.00 133.15 1gka s PRO 104 Ca 0.13 1.07 0.01 0.00 0.04 0.00 0.00 61.00 62.26 1gka s PRO 104 Cb 0.05 -2.04 0.17 0.00 0.04 0.00 0.00 34.50 32.71 1gka s PRO 104 CO -0.03 -0.79 0.47 -1.17 0.04 0.00 0.00 177.00 175.51 1gka s LEU 105 N -4.75 -1.01 0.03 -3.56 2.96 0.07 -4.54 118.68 107.88 1gka s LEU 105 Ca 0.61 0.06 -0.22 0.00 -0.22 0.00 0.00 54.13 54.37 1gka s LEU 105 Cb -0.14 1.46 -0.06 0.00 0.50 0.00 0.00 46.19 47.95 1gka s LEU 105 CO 0.42 -0.32 0.64 -0.69 -1.32 0.00 0.00 176.35 175.08 1gka s VAL 106 N 2.65 4.80 -0.52 1.68 1.01 0.08 -3.63 120.40 126.47 1gka s VAL 106 Ca 0.12 1.35 -0.20 0.00 0.00 0.00 0.00 61.98 63.25 1gka s VAL 106 Cb -0.13 -3.98 0.05 0.00 0.00 0.00 0.00 36.38 32.33 1gka s VAL 106 CO -0.25 0.44 0.70 -0.63 0.00 0.00 0.00 175.10 175.36 1gka s ILE 107 N -0.39 4.76 0.36 2.22 1.01 -1.26 -1.74 121.20 126.16 1gka s ILE 107 Ca 0.33 -0.32 0.05 0.00 0.00 0.00 0.00 60.65 60.70 1gka s ILE 107 Cb -0.19 -4.36 0.21 0.00 0.01 0.00 0.00 42.46 38.12 1gka s ILE 107 CO 0.19 -0.88 1.95 -0.07 0.00 0.00 0.00 174.94 176.13 1gka h LEU 108 N 10.01 0.53 -7.00 2.97 3.38 -1.47 -3.45 115.31 120.28 1gka h LEU 108 Ca -0.27 -0.06 0.16 0.00 0.09 0.00 0.00 57.88 57.79 1gka h LEU 108 Cb 1.09 -0.14 -0.30 0.00 0.09 0.00 0.00 40.66 41.40 1gka h LEU 108 CO 1.00 0.50 0.62 -0.70 0.09 0.00 0.00 178.44 179.94 1gka s GLU 109 N -5.25 0.21 0.03 1.13 2.12 -1.24 -5.00 118.70 110.69 1gka s GLU 109 Ca -0.08 0.33 -0.20 0.00 0.36 0.00 0.00 54.97 55.38 1gka s GLU 109 Cb 0.16 0.06 0.04 0.00 0.26 0.00 0.00 34.13 34.66 1gka s GLU 109 CO 0.76 -0.04 0.45 -0.08 -0.54 0.00 0.00 175.26 175.80 1gka s THR 110 N 0.86 0.05 -0.12 -1.70 -1.32 -1.26 -0.89 115.64 111.25 1gka s THR 110 Ca -0.04 -0.37 0.18 0.00 -1.21 0.00 0.00 61.69 60.24 1gka s THR 110 Cb -0.03 -0.92 0.28 0.00 -1.51 0.00 0.00 72.50 70.31 1gka s THR 110 CO -0.12 -0.21 1.15 -0.90 -2.21 0.00 0.00 174.62 172.33 1gka n ASP 111 N 0.61 2.35 0.00 8.08 3.85 -1.10 -4.98 116.55 125.36 1gka n ASP 111 Ca -0.19 -3.03 0.00 0.00 -0.71 0.00 0.00 54.79 50.86 1gka n ASP 111 Cb 0.59 -0.41 0.00 0.00 -1.35 0.00 0.00 41.12 39.95 1gka n ASP 111 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 1gka n TYR 112 N -1.37 0.00 -1.02 2.11 4.02 -1.26 -4.31 117.16 115.33 1gka n TYR 112 Ca 0.15 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 58.06 1gka n TYR 112 Cb 0.62 -0.23 0.03 0.00 -0.02 0.00 0.00 39.34 39.74 1gka n TYR 112 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1gka n SER 113 N 0.03 0.93 0.00 7.72 3.41 -1.26 -4.83 113.62 119.62 1gka n SER 113 Ca 0.00 -1.88 0.00 0.00 -0.26 0.00 0.00 58.87 56.73 1gka n SER 113 Cb 0.00 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 1gka n SER 113 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1gka n ASN 114 N -0.39 0.07 -3.79 4.04 3.02 -1.26 -4.81 115.26 112.13 1gka n ASN 114 Ca 0.03 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.48 1gka n ASN 114 Cb 0.51 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.64 1gka n ASN 114 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1gka s TYR 115 N -1.85 0.40 -0.24 3.10 -0.85 -1.26 -1.70 117.35 114.95 1gka s TYR 115 Ca 0.00 -0.78 -0.14 0.00 -0.52 0.00 0.00 57.07 55.64 1gka s TYR 115 Cb 0.00 0.25 0.07 0.00 0.38 0.00 0.00 41.96 42.66 1gka s TYR 115 CO 0.00 -1.08 0.59 0.00 -1.52 0.00 0.00 175.55 173.54 1gka s ALA 116 N -3.73 -1.60 -0.25 9.51 0.00 -0.21 -2.71 121.76 122.77 1gka s ALA 116 Ca 0.22 2.12 -0.08 0.00 0.00 0.00 0.00 51.96 54.22 1gka s ALA 116 Cb -0.01 -1.26 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 1gka s ALA 116 CO 0.11 -0.35 0.11 0.00 0.00 0.00 0.00 175.76 175.63 1gka s LEU 118 N 1.51 4.08 -0.01 0.00 1.43 -0.87 -1.10 118.68 123.72 1gka s LEU 118 Ca 0.06 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 1gka s LEU 118 Cb -0.15 -2.00 -0.00 0.00 0.03 0.00 0.00 46.19 44.07 1gka s LEU 118 CO 0.06 0.39 -0.05 -0.47 0.23 0.00 0.00 176.35 176.50 1gka s TYR 119 N -0.99 0.51 -0.20 0.29 5.04 -0.71 -1.32 117.35 119.96 1gka s TYR 119 Ca 0.15 -0.10 -0.04 0.00 -2.44 0.00 0.00 57.07 54.64 1gka s TYR 119 Cb -0.12 -0.35 0.10 0.00 0.35 0.00 0.00 41.96 41.95 1gka s TYR 119 CO 0.04 -0.03 0.30 0.45 -1.34 0.00 0.00 175.55 174.97 1gka s SER 120 N -0.00 0.66 0.05 4.32 0.15 0.24 -0.74 113.70 118.38 1gka s SER 120 Ca 0.01 0.18 0.04 0.00 0.70 0.00 0.00 55.95 56.87 1gka s SER 120 Cb -0.04 0.77 -0.02 0.00 -1.71 0.00 0.00 66.02 65.02 1gka s SER 120 CO -0.00 -0.29 -0.12 0.00 1.20 0.00 0.00 173.24 174.03 1gka s ILE 122 N -1.17 1.00 0.00 0.00 1.01 -0.45 -4.90 121.20 116.69 1gka s ILE 122 Ca -0.04 -0.52 -0.11 0.00 0.00 0.00 0.00 60.65 59.98 1gka s ILE 122 Cb -0.09 -0.85 -0.05 0.00 0.01 0.00 0.00 42.46 41.48 1gka s ILE 122 CO 0.01 0.29 0.35 -1.81 0.00 0.00 0.00 174.94 173.78 1gka s ASP 123 N -0.14 6.66 0.18 3.58 1.01 -1.26 -2.54 116.67 124.15 1gka s ASP 123 Ca 0.02 0.79 0.00 0.00 0.71 0.00 0.00 52.55 54.07 1gka s ASP 123 Cb -0.06 -2.18 -0.00 0.00 1.01 0.00 0.00 42.92 41.68 1gka s ASP 123 CO 0.00 0.29 0.01 -1.22 0.21 0.00 0.00 175.17 174.46 1gka n TYR 124 N 1.51 0.35 -2.01 4.23 4.02 -0.41 -4.94 117.16 119.92 1gka n TYR 124 Ca -0.13 -0.92 -0.29 0.00 -0.01 0.00 0.00 57.90 56.56 1gka n TYR 124 Cb 0.53 -0.10 0.15 0.00 -0.02 0.00 0.00 39.34 39.90 1gka n TYR 124 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1gka s ASN 125 N -1.99 3.66 -2.12 7.72 4.22 -1.26 -4.10 114.94 121.06 1gka s ASN 125 Ca 0.02 0.33 0.00 0.00 -2.14 0.00 0.00 52.86 51.07 1gka s ASN 125 Cb 0.00 -0.55 0.00 0.00 1.28 0.00 0.00 41.25 41.98 1gka s ASN 125 CO 0.01 -2.39 0.00 0.49 -2.04 0.00 0.00 177.10 173.17 1gka n PHE 126 N -3.52 -0.10 -0.65 1.54 3.01 -1.26 -2.49 117.46 114.00 1gka n PHE 126 Ca 0.13 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.59 1gka n PHE 126 Cb 0.60 -3.44 0.00 0.00 -0.01 0.00 0.00 39.48 36.63 1gka n PHE 126 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gka n GLY 127 N -0.42 0.94 3.94 1.37 0.00 -1.26 -5.00 105.19 104.77 1gka n GLY 127 Ca -0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1gka n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gka s TYR 128 N -3.34 2.18 0.04 1.61 1.51 -1.04 -1.04 117.35 117.27 1gka s TYR 128 Ca 0.00 0.33 -0.20 0.00 -1.01 0.00 0.00 57.07 56.19 1gka s TYR 128 Cb 0.00 -3.58 0.07 0.00 -0.11 0.00 0.00 41.96 38.33 1gka s TYR 128 CO 0.00 -2.02 0.90 -2.39 -1.11 0.00 0.00 175.55 170.93 1gka n HIS 129 N -3.31 -0.62 -3.64 2.71 1.44 0.28 -1.29 115.22 110.78 1gka n HIS 129 Ca 0.12 -0.69 -0.04 0.00 -2.01 0.00 0.00 57.72 55.10 1gka n HIS 129 Cb 0.60 0.32 -0.07 0.00 0.12 0.00 0.00 29.99 30.97 1gka n HIS 129 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1gka s SER 130 N -3.04 -0.37 0.16 4.39 1.04 -1.05 -1.46 113.70 113.37 1gka s SER 130 Ca 0.21 0.64 0.08 0.00 0.48 0.00 0.00 55.95 57.36 1gka s SER 130 Cb -0.01 0.95 -0.04 0.00 0.10 0.00 0.00 66.02 67.02 1gka s SER 130 CO 0.01 -0.10 -0.17 1.51 0.98 0.00 0.00 173.24 175.47 1gka s ASP 131 N 0.83 2.57 -0.05 7.02 1.47 -1.26 -1.34 116.67 125.91 1gka s ASP 131 Ca -0.04 -0.87 -0.01 0.00 1.18 0.00 0.00 52.55 52.81 1gka s ASP 131 Cb -0.04 -0.14 0.03 0.00 -0.34 0.00 0.00 42.92 42.43 1gka s ASP 131 CO -0.12 -0.07 0.02 -0.36 0.68 0.00 0.00 175.17 175.32 1gka s PHE 132 N -2.17 0.44 0.29 2.11 0.08 -0.23 -4.98 117.98 113.53 1gka s PHE 132 Ca 0.15 -0.02 0.10 0.00 0.12 0.00 0.00 56.93 57.28 1gka s PHE 132 Cb -0.05 -0.64 -0.05 0.00 -0.57 0.00 0.00 43.02 41.71 1gka s PHE 132 CO 0.06 -0.25 -0.04 -1.12 -0.10 0.00 0.00 175.22 173.77 1gka s SER 133 N 1.82 4.21 0.21 1.36 0.01 -1.26 -0.59 113.70 119.45 1gka s SER 133 Ca 0.02 -0.84 -0.11 0.00 1.31 0.00 0.00 55.95 56.32 1gka s SER 133 Cb -0.12 -0.62 -0.00 0.00 0.21 0.00 0.00 66.02 65.48 1gka s SER 133 CO -0.04 -0.06 0.39 -0.36 0.41 0.00 0.00 173.24 173.58 1gka s PHE 134 N -2.43 0.35 -0.06 2.43 0.08 -0.44 -2.40 117.98 115.52 1gka s PHE 134 Ca 0.32 -0.70 -0.01 0.00 0.12 0.00 0.00 56.93 56.66 1gka s PHE 134 Cb -0.04 0.08 0.03 0.00 -0.57 0.00 0.00 43.02 42.52 1gka s PHE 134 CO 0.19 -0.86 0.02 0.42 -0.10 0.00 0.00 175.22 174.88 1gka s ILE 135 N -3.99 0.21 -0.09 0.64 1.01 0.08 -2.05 121.20 117.02 1gka s ILE 135 Ca 0.19 0.20 -0.01 0.00 0.00 0.00 0.00 60.65 61.03 1gka s ILE 135 Cb 0.01 -0.39 -0.03 0.00 0.01 0.00 0.00 42.46 42.06 1gka s ILE 135 CO 0.04 0.22 -0.01 -0.36 0.00 0.00 0.00 174.94 174.83 1gka s PHE 136 N 1.85 3.12 0.24 3.97 2.99 0.16 -0.51 117.98 129.79 1gka s PHE 136 Ca 0.02 0.15 0.11 0.00 0.00 0.00 0.00 56.93 57.21 1gka s PHE 136 Cb -0.12 -1.78 -0.05 0.00 0.00 0.00 0.00 43.02 41.07 1gka s PHE 136 CO -0.04 0.43 -0.18 -1.54 -0.00 0.00 0.00 175.22 173.89 1gka s SER 137 N -0.82 3.72 0.16 1.36 1.04 0.41 -1.05 113.70 118.53 1gka s SER 137 Ca 0.12 -0.90 0.23 0.00 0.48 0.00 0.00 55.95 55.89 1gka s SER 137 Cb -0.11 -0.39 0.07 0.00 0.10 0.00 0.00 66.02 65.69 1gka s SER 137 CO 0.02 0.06 1.08 0.54 0.98 0.00 0.00 173.24 175.93 1gka n ARG 138 N -0.34 0.50 -4.01 4.02 5.12 -0.69 -0.48 116.66 120.79 1gka n ARG 138 Ca -0.08 0.09 -0.19 0.00 -1.93 0.00 0.00 57.85 55.74 1gka n ARG 138 Cb 0.58 -1.76 -0.16 0.00 -1.16 0.00 0.00 32.46 29.96 1gka n ARG 138 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1gka s SER 139 N -4.92 0.83 0.00 0.55 0.15 -1.26 -4.73 113.70 104.32 1gka s SER 139 Ca 0.01 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.58 1gka s SER 139 Cb 0.11 -0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.07 1gka s SER 139 CO 0.78 -0.10 0.00 0.00 1.20 0.00 0.00 173.24 175.12 1gka n ALA 140 N 4.26 0.00 -2.91 5.45 0.00 -1.26 -3.75 120.51 122.30 1gka n ALA 140 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.88 1gka n ALA 140 Cb 0.50 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.84 1gka n ALA 140 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1gka s ASN 141 N -4.73 4.87 -0.24 0.00 2.47 -1.26 -4.73 114.94 111.32 1gka s ASN 141 Ca 0.00 -0.09 -0.09 0.00 0.42 0.00 0.00 52.86 53.09 1gka s ASN 141 Cb 0.00 -1.75 -0.04 0.00 -1.45 0.00 0.00 41.25 38.01 1gka s ASN 141 CO 0.00 0.19 0.13 -0.22 -3.72 0.00 0.00 177.10 173.48 1gka s LEU 142 N 0.23 3.89 -0.52 3.21 2.96 -1.25 -4.95 118.68 122.26 1gka s LEU 142 Ca -0.02 0.00 -0.37 0.00 -0.22 0.00 0.00 54.13 53.52 1gka s LEU 142 Cb -0.14 -2.05 -0.15 0.00 0.50 0.00 0.00 46.19 44.35 1gka s LEU 142 CO 0.03 0.03 2.27 0.00 -1.32 0.00 0.00 176.35 177.36 1gka n ALA 143 N 4.54 0.64 0.00 5.97 0.00 -1.26 -4.72 120.51 125.68 1gka n ALA 143 Ca -0.15 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1gka n ALA 143 Cb 0.52 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1gka n ALA 143 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1gka n ASP 144 N 9.60 0.00 -0.06 0.00 9.92 -1.26 0.25 116.55 135.00 1gka n ASP 144 Ca 0.50 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.71 1gka n ASP 144 Cb 0.13 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.50 1gka n ASP 144 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1gka n GLN 145 N 0.95 1.59 -0.08 -1.24 10.64 -1.26 -4.32 117.38 123.65 1gka n GLN 145 Ca 0.00 -0.03 -0.14 0.00 -1.83 0.00 0.00 57.00 55.00 1gka n GLN 145 Cb 0.00 -1.34 -0.08 0.00 -0.86 0.00 0.00 30.24 27.95 1gka n GLN 145 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.06 177.11 1gka h TYR 146 N 0.00 0.00 -0.38 2.61 0.99 -0.55 -3.29 116.97 116.35 1gka h TYR 146 Ca -0.30 0.00 0.11 0.00 2.00 0.00 0.00 58.73 60.54 1gka h TYR 146 Cb 1.63 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 39.35 1gka h TYR 146 CO 0.00 0.91 0.89 0.28 -0.00 0.00 0.00 178.16 180.24 1gka h VAL 147 N -1.00 0.05 0.00 -2.88 2.07 -1.78 1.30 116.25 114.00 1gka h VAL 147 Ca -0.17 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 1gka h VAL 147 Cb 0.93 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1gka h VAL 147 CO -0.10 0.00 -0.94 0.11 0.02 0.00 0.00 177.57 176.66 1gka h LYS 148 N 0.00 0.00 0.00 1.57 1.57 -1.75 -2.52 116.57 115.43 1gka h LYS 148 Ca 0.18 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.86 1gka h LYS 148 Cb 1.96 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.25 1gka h LYS 148 CO -0.00 0.06 -0.45 -0.22 -0.57 0.00 0.00 179.45 178.27 1gka h LYS 149 N 0.00 0.00 0.00 3.15 3.64 0.16 -2.71 116.57 120.81 1gka h LYS 149 Ca -0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1gka h LYS 149 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1gka h LYS 149 CO 0.01 0.45 -0.01 0.00 -2.27 0.00 0.00 179.45 177.63 1gka h GLU 151 N -0.86 0.00 0.03 0.00 5.08 -1.53 1.92 114.58 119.21 1gka h GLU 151 Ca 0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 1gka h GLU 151 Cb 0.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1gka h GLU 151 CO 0.00 0.00 -1.04 0.00 -1.00 0.00 0.00 179.01 176.97 1gka h ALA 152 N 0.86 0.31 0.09 3.43 0.00 -1.51 -2.99 119.26 119.46 1gka h ALA 152 Ca 0.41 -0.89 -0.29 0.00 0.00 0.00 0.00 54.91 54.15 1gka h ALA 152 Cb 2.37 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 20.06 1gka h ALA 152 CO -0.00 1.17 -1.19 0.00 0.00 0.00 0.00 179.25 179.22 1gka h ALA 153 N 0.91 0.05 0.00 0.00 0.00 0.32 -3.23 119.26 117.32 1gka h ALA 153 Ca -0.04 -0.76 -0.08 0.00 0.00 0.00 0.00 54.91 54.03 1gka h ALA 153 Cb 1.79 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 1gka h ALA 153 CO 0.15 0.72 -0.37 0.74 0.00 0.00 0.00 179.25 180.48 1gka h PHE 154 N 0.28 0.00 0.00 0.00 -1.00 -1.36 -2.66 116.94 112.20 1gka h PHE 154 Ca -0.17 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.61 1gka h PHE 154 Cb 1.86 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.42 1gka h PHE 154 CO 0.11 0.37 0.00 0.87 -1.61 0.00 0.00 178.31 178.05 1gka h LYS 155 N 0.00 0.00 0.00 1.51 1.57 -1.54 -1.04 116.57 117.07 1gka h LYS 155 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1gka h LYS 155 Cb 0.93 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.24 1gka h LYS 155 CO 0.05 0.00 -0.51 -0.97 -0.57 0.00 0.00 179.45 177.45 1gka h ASN 156 N 0.00 0.00 -0.18 0.86 -1.24 -1.53 -3.22 115.58 110.27 1gka h ASN 156 Ca 0.00 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.96 1gka h ASN 156 Cb 0.47 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.49 1gka h ASN 156 CO 0.00 0.05 -0.08 2.30 -1.29 0.00 0.00 177.43 178.41 1gka n ILE 157 N -2.92 2.24 -4.03 2.57 -5.35 -1.01 -4.99 119.36 105.87 1gka n ILE 157 Ca 0.02 -2.38 -0.32 0.00 -0.27 0.00 0.00 62.75 59.79 1gka n ILE 157 Cb 0.56 -0.27 0.01 0.00 -1.74 0.00 0.00 39.64 38.20 1gka n ILE 157 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1gka n ASN 158 N -1.00 -4.06 -4.69 7.28 3.02 -0.99 -4.74 115.26 110.08 1gka n ASN 158 Ca 0.23 -0.87 -0.39 0.00 -0.03 0.00 0.00 54.58 53.51 1gka n ASN 158 Cb 0.84 -3.45 -0.05 0.00 -0.61 0.00 0.00 39.78 36.51 1gka n ASN 158 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1gka s VAL 159 N -3.32 5.06 -0.71 2.41 1.01 -0.43 -4.96 120.40 119.46 1gka s VAL 159 Ca 0.66 1.22 -0.26 0.00 0.00 0.00 0.00 61.98 63.60 1gka s VAL 159 Cb -0.34 -3.95 -0.06 0.00 0.00 0.00 0.00 36.38 32.02 1gka s VAL 159 CO 0.87 0.20 2.11 -0.62 0.00 0.00 0.00 175.10 177.65 1gka s ASP 160 N 0.96 4.78 0.42 3.32 3.68 -1.26 -4.56 116.67 124.01 1gka s ASP 160 Ca 0.31 0.12 0.29 0.00 2.13 0.00 0.00 52.55 55.39 1gka s ASP 160 Cb -0.16 -2.54 1.43 0.00 -1.45 0.00 0.00 42.92 40.20 1gka s ASP 160 CO 0.13 -2.90 1.60 0.74 0.13 0.00 0.00 175.17 174.86 1gka h THR 161 N 7.33 0.06 0.00 1.71 2.02 -1.93 0.53 112.91 122.63 1gka h THR 161 Ca -0.09 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1gka h THR 161 Cb 1.10 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1gka h THR 161 CO 1.16 0.01 0.10 0.35 0.37 0.00 0.00 175.52 177.51 1gka n THR 162 N -4.84 1.23 0.22 3.16 -2.24 -1.26 -1.69 114.28 108.86 1gka n THR 162 Ca 0.39 0.63 0.12 0.00 -2.27 0.00 0.00 64.05 62.92 1gka n THR 162 Cb 1.44 -1.63 0.27 0.00 -2.10 0.00 0.00 70.33 68.31 1gka n THR 162 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1gka h ARG 163 N 0.00 0.00 -7.40 -0.78 3.08 -0.29 -3.46 114.38 105.53 1gka h ARG 163 Ca 0.00 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.57 1gka h ARG 163 Cb 0.21 0.00 0.13 0.00 0.08 0.00 0.00 29.97 30.38 1gka h ARG 163 CO 0.00 0.05 0.30 -0.06 -1.07 0.00 0.00 179.97 179.19 1gka s PHE 164 N -3.29 2.61 -0.23 3.04 0.08 -0.68 -4.00 117.98 115.51 1gka s PHE 164 Ca 0.05 1.13 -0.03 0.00 0.12 0.00 0.00 56.93 58.21 1gka s PHE 164 Cb 0.06 -3.17 0.10 0.00 -0.57 0.00 0.00 43.02 39.44 1gka s PHE 164 CO 0.65 -2.08 0.24 0.08 -0.10 0.00 0.00 175.22 174.01 1gka s VAL 165 N -3.10 -0.34 0.05 -0.44 1.01 -1.12 -4.92 120.40 111.55 1gka s VAL 165 Ca 0.62 -0.22 -0.37 0.00 0.00 0.00 0.00 61.98 62.01 1gka s VAL 165 Cb -0.16 -0.76 -0.17 0.00 0.00 0.00 0.00 36.38 35.29 1gka s VAL 165 CO 0.55 -0.28 1.34 0.29 0.00 0.00 0.00 175.10 177.00 1gka n LYS 166 N 5.32 1.05 -2.36 2.72 5.02 -1.26 -3.39 118.16 125.25 1gka n LYS 166 Ca -0.05 0.38 -0.25 0.00 -2.02 0.00 0.00 58.31 56.37 1gka n LYS 166 Cb 0.49 -2.01 0.12 0.00 -0.02 0.00 0.00 35.03 33.60 1gka n LYS 166 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1gka s THR 167 N 0.64 2.15 -0.42 -0.18 -4.23 -0.80 -4.92 115.64 107.88 1gka s THR 167 Ca 0.86 -0.40 -0.12 0.00 -1.18 0.00 0.00 61.69 60.85 1gka s THR 167 Cb -0.99 -2.75 0.06 0.00 1.34 0.00 0.00 72.50 70.15 1gka s THR 167 CO 0.49 0.00 0.28 -0.69 -0.54 0.00 0.00 174.62 174.16 1gka s VAL 168 N -3.33 4.71 0.08 2.29 1.01 -1.26 -4.84 120.40 119.07 1gka s VAL 168 Ca 0.67 -1.07 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1gka s VAL 168 Cb -0.06 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1gka s VAL 168 CO 0.46 -0.42 -0.08 -1.10 0.00 0.00 0.00 175.10 173.96 1gka s GLN 169 N 1.55 2.30 0.00 2.72 -1.52 -1.26 -0.64 119.66 122.81 1gka s GLN 169 Ca 0.03 -0.92 0.00 0.00 -1.95 0.00 0.00 55.36 52.52 1gka s GLN 169 Cb -0.22 -2.39 0.00 0.00 -0.22 0.00 0.00 33.01 30.18 1gka s GLN 169 CO 0.06 0.54 0.00 0.41 -0.25 0.00 0.00 175.29 176.04 1gka n GLY 170 N 0.90 -1.09 0.26 3.09 0.00 -1.26 -4.91 105.19 102.17 1gka n GLY 170 Ca -0.13 -0.99 -0.02 0.00 0.00 0.00 0.00 46.02 44.87 1gka n GLY 170 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1gka h SER 171 N 0.00 0.52 0.06 1.61 4.64 -2.01 -3.15 113.55 115.22 1gka h SER 171 Ca 0.00 -0.14 0.03 0.00 -0.47 0.00 0.00 61.79 61.21 1gka h SER 171 Cb 0.00 -0.14 -0.05 0.00 -0.31 0.00 0.00 62.40 61.90 1gka h SER 171 CO 0.00 0.67 -0.37 0.28 -0.87 0.00 0.00 176.83 176.55 1gka h SER 172 N 0.49 -1.09 -0.97 4.97 0.02 -1.99 -3.45 113.55 111.52 1gka h SER 172 Ca 0.09 0.13 -0.78 0.00 -0.84 0.00 0.00 61.79 60.39 1gka h SER 172 Cb 0.51 0.42 0.04 0.00 0.14 0.00 0.00 62.40 63.51 1gka h SER 172 CO 0.03 -0.43 0.16 0.00 -1.14 0.00 0.00 176.83 175.45 1gka n PRO 174 N 1.86 1.04 -0.23 0.00 -0.04 -1.26 -4.63 135.00 131.73 1gka n PRO 174 Ca 0.21 -0.08 -0.06 0.00 -0.04 0.00 0.00 63.50 63.53 1gka n PRO 174 Cb 0.06 -1.03 -0.06 0.00 -0.04 0.00 0.00 33.50 32.43 1gka n PRO 174 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1gka n TYR 175 N 1.18 -0.24 -0.39 0.54 0.53 -1.26 0.31 117.16 117.82 1gka n TYR 175 Ca 0.01 0.69 0.34 0.00 -1.02 0.00 0.00 57.90 57.93 1gka n TYR 175 Cb 0.51 -0.51 0.67 0.00 -1.03 0.00 0.00 39.34 38.98 1gka n TYR 175 CO 0.00 0.00 0.00 -0.44 -1.02 0.00 0.00 176.86 175.40 1gka h ASP 176 N 0.00 0.18 0.04 7.72 5.19 -2.00 0.18 116.42 127.72 1gka h ASP 176 Ca 0.09 0.05 -0.22 0.00 -0.62 0.00 0.00 57.03 56.33 1gka h ASP 176 Cb 0.23 0.03 0.02 0.00 0.18 0.00 0.00 39.33 39.79 1gka h ASP 176 CO -0.52 -0.01 -0.87 0.74 -3.12 0.00 0.00 179.24 175.45 1gka h THR 177 N 0.13 1.37 -0.48 0.35 2.02 0.44 -3.29 112.91 113.46 1gka h THR 177 Ca 0.67 -2.25 0.02 0.00 0.77 0.00 0.00 66.41 65.63 1gka h THR 177 Cb 2.28 2.62 -0.03 0.00 -1.74 0.00 0.00 68.15 71.28 1gka h THR 177 CO -0.18 0.67 0.28 1.56 0.37 0.00 0.00 175.52 178.22 1gka h GLN 178 N 0.08 0.54 0.00 6.66 4.20 0.14 -1.82 115.11 124.91 1gka h GLN 178 Ca -0.12 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1gka h GLN 178 Cb 1.57 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.23 1gka h GLN 178 CO 0.17 0.36 0.12 1.63 -0.67 0.00 0.00 178.83 180.44 1gka n LYS 179 N -4.83 0.00 0.00 1.46 5.02 -0.43 0.18 118.16 119.56 1gka n LYS 179 Ca 0.03 0.14 0.04 0.00 -2.02 0.00 0.00 58.31 56.50 1gka n LYS 179 Cb 0.08 -1.62 -0.02 0.00 -0.02 0.00 0.00 35.03 33.45 1gka n LYS 179 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1gka n THR 180 N -1.04 0.00 0.00 -0.18 -2.24 -0.69 -5.12 114.28 105.02 1gka n THR 180 Ca 0.00 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1gka n THR 180 Cb 0.12 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 1gka n THR 180 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02