#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gkp s PHE 3 N 0.00 2.68 0.14 -1.42 0.08 -1.26 -4.94 117.98 113.25 2gkp s PHE 3 Ca 0.00 -0.85 -0.13 0.00 0.12 0.00 0.00 56.93 56.07 2gkp s PHE 3 Cb 0.00 -1.77 -0.07 0.00 -0.57 0.00 0.00 43.02 40.61 2gkp s PHE 3 CO 0.00 -0.32 0.52 -0.80 -0.10 0.00 0.00 175.22 174.52 2gkp s ASN 4 N 0.33 6.78 0.38 1.36 0.01 -1.26 -5.06 114.94 117.48 2gkp s ASN 4 Ca -0.15 1.01 -0.27 0.00 -0.71 0.00 0.00 52.86 52.74 2gkp s ASN 4 Cb -0.17 -2.26 -0.09 0.00 0.41 0.00 0.00 41.25 39.13 2gkp s ASN 4 CO 0.07 0.11 1.31 -1.58 -1.51 0.00 0.00 177.10 175.51 2gkp s GLN 5 N -1.98 4.10 0.00 -0.60 2.00 -1.26 -2.41 119.66 119.52 2gkp s GLN 5 Ca 0.37 2.20 0.00 0.00 -2.00 0.00 0.00 55.36 55.93 2gkp s GLN 5 Cb -0.15 -2.87 0.00 0.00 0.80 0.00 0.00 33.01 30.79 2gkp s GLN 5 CO 0.19 -0.39 0.00 0.39 -0.50 0.00 0.00 175.29 174.97 2gkp n GLU 6 N 0.36 0.00 -3.22 1.67 -0.58 -1.26 -4.99 120.64 112.63 2gkp n GLU 6 Ca 0.02 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.38 2gkp n GLU 6 Cb 0.43 -2.16 -0.06 0.00 -0.57 0.00 0.00 31.44 29.08 2gkp n GLU 6 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2gkp s GLN 7 N 0.00 4.27 -0.05 3.49 0.74 -1.01 -4.96 119.66 122.14 2gkp s GLN 7 Ca 0.00 0.81 -0.16 0.00 0.05 0.00 0.00 55.36 56.06 2gkp s GLN 7 Cb 0.00 -3.25 -0.05 0.00 1.10 0.00 0.00 33.01 30.81 2gkp s GLN 7 CO 0.00 0.60 0.43 -0.51 -0.55 0.00 0.00 175.29 175.26 2gkp s ASP 8 N -1.04 6.75 -0.03 6.67 1.01 -1.26 -4.37 116.67 124.40 2gkp s ASP 8 Ca 0.30 0.89 0.05 0.00 0.71 0.00 0.00 52.55 54.50 2gkp s ASP 8 Cb -0.20 -2.26 -0.01 0.00 1.01 0.00 0.00 42.92 41.46 2gkp s ASP 8 CO 0.20 0.20 -0.18 -0.31 0.21 0.00 0.00 175.17 175.29 2gkp s TYR 9 N -0.39 1.68 0.08 4.23 2.02 -0.47 -4.80 117.35 119.71 2gkp s TYR 9 Ca 0.24 -0.40 0.05 0.00 -0.37 0.00 0.00 57.07 56.59 2gkp s TYR 9 Cb -0.16 -1.11 -0.03 0.00 -0.40 0.00 0.00 41.96 40.26 2gkp s TYR 9 CO 0.12 -0.10 -0.13 -1.58 -1.57 0.00 0.00 175.55 172.29 2gkp s TRP 10 N -0.20 1.19 0.21 2.71 0.52 -1.26 -0.35 118.94 121.75 2gkp s TRP 10 Ca 0.02 -0.51 -0.18 0.00 0.02 0.00 0.00 56.10 55.45 2gkp s TRP 10 Cb -0.09 -0.66 0.03 0.00 -1.15 0.00 0.00 33.47 31.60 2gkp s TRP 10 CO 0.01 0.05 0.55 0.00 0.02 0.00 0.00 176.95 177.58 2gkp s ALA 11 N -1.58 -0.95 0.14 0.98 0.00 -0.29 -1.45 121.76 118.61 2gkp s ALA 11 Ca 0.00 -0.26 0.07 0.00 0.00 0.00 0.00 51.96 51.77 2gkp s ALA 11 Cb -0.08 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.87 2gkp s ALA 11 CO 0.02 -0.84 -0.15 0.20 0.00 0.00 0.00 175.76 174.98 2gkp s GLY 12 N -2.89 1.20 -0.28 0.00 0.00 0.66 -0.53 107.32 105.48 2gkp s GLY 12 Ca 0.10 -1.39 -0.03 0.00 0.00 0.00 0.00 44.72 43.40 2gkp s GLY 12 CO -0.01 -1.45 0.12 -0.47 0.00 0.00 0.00 173.10 171.29 2gkp s TYR 13 N -2.23 0.60 0.16 1.90 5.04 0.18 -0.84 117.35 122.17 2gkp s TYR 13 Ca 0.12 -1.00 0.06 0.00 -2.44 0.00 0.00 57.07 53.81 2gkp s TYR 13 Cb -0.04 -1.05 -0.04 0.00 0.35 0.00 0.00 41.96 41.18 2gkp s TYR 13 CO 0.04 -0.81 0.08 0.15 -1.34 0.00 0.00 175.55 173.67 2gkp s LYS 14 N 2.00 2.70 -0.16 4.97 1.02 -0.25 -0.26 119.74 129.75 2gkp s LYS 14 Ca 0.08 -0.96 -0.11 0.00 0.02 0.00 0.00 55.97 55.01 2gkp s LYS 14 Cb -0.16 -2.53 0.05 0.00 -0.52 0.00 0.00 37.83 34.67 2gkp s LYS 14 CO -0.32 0.48 0.41 0.00 -0.92 0.00 0.00 175.35 175.00 2gkp s ALA 15 N -1.73 -1.02 0.00 5.17 0.00 -1.26 -0.34 121.76 122.58 2gkp s ALA 15 Ca 0.29 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.64 2gkp s ALA 15 Cb -0.10 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.19 2gkp s ALA 15 CO 0.21 -0.24 0.00 0.27 0.00 0.00 0.00 175.76 176.01 2gkp n ASN 16 N 3.77 0.96 0.00 0.00 2.04 -0.46 -4.78 115.26 116.78 2gkp n ASN 16 Ca -0.20 -0.46 0.10 0.00 -0.44 0.00 0.00 54.58 53.59 2gkp n ASN 16 Cb 0.56 0.00 0.55 0.00 -2.53 0.00 0.00 39.78 38.36 2gkp n ASN 16 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 2gkp n GLU 17 N 0.00 0.36 -0.01 -3.83 0.00 -1.26 -3.41 120.64 112.49 2gkp n GLU 17 Ca 0.00 0.07 0.02 0.00 0.00 0.00 0.00 57.16 57.26 2gkp n GLU 17 Cb 0.00 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 29.88 2gkp n GLU 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2gkp n ARG 18 N -1.24 0.79 -3.47 3.44 1.74 -1.26 -5.05 116.66 111.61 2gkp n ARG 18 Ca 0.11 -0.06 -0.11 0.00 -0.77 0.00 0.00 57.85 57.02 2gkp n ARG 18 Cb 0.15 -1.20 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 2gkp n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gkp s ALA 19 N -2.50 -1.72 0.03 7.54 0.00 -1.22 -4.73 121.76 119.16 2gkp s ALA 19 Ca -0.03 0.85 -0.12 0.00 0.00 0.00 0.00 51.96 52.65 2gkp s ALA 19 Cb 0.05 0.51 -0.06 0.00 0.00 0.00 0.00 23.12 23.62 2gkp s ALA 19 CO 0.34 -0.66 0.39 -0.51 0.00 0.00 0.00 175.76 175.32 2gkp s LEU 20 N -2.36 4.42 -0.20 0.00 1.43 -0.30 -1.36 118.68 120.31 2gkp s LEU 20 Ca 0.01 0.86 -0.03 0.00 -1.03 0.00 0.00 54.13 53.94 2gkp s LEU 20 Cb -0.01 -2.72 0.06 0.00 0.03 0.00 0.00 46.19 43.55 2gkp s LEU 20 CO -0.08 0.27 0.04 -0.63 0.23 0.00 0.00 176.35 176.18 2gkp s ILE 21 N -1.21 0.48 -0.14 -0.59 1.01 0.54 -0.95 121.20 120.33 2gkp s ILE 21 Ca 0.27 -0.57 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 2gkp s ILE 21 Cb -0.15 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 2gkp s ILE 21 CO 0.15 -0.25 0.02 -0.63 0.00 0.00 0.00 174.94 174.23 2gkp s ILE 22 N 1.87 4.48 -0.02 2.92 -1.09 -0.16 -1.09 121.20 128.11 2gkp s ILE 22 Ca -0.00 -0.16 0.01 0.00 -2.23 0.00 0.00 60.65 58.27 2gkp s ILE 22 Cb -0.17 -2.96 0.02 0.00 -1.58 0.00 0.00 42.46 37.77 2gkp s ILE 22 CO -0.09 0.52 -0.01 -1.58 -1.23 0.00 0.00 174.94 172.55 2gkp s GLN 23 N -0.09 0.27 0.28 2.79 2.00 -0.02 -1.03 119.66 123.87 2gkp s GLN 23 Ca 0.05 0.02 -0.29 0.00 -2.00 0.00 0.00 55.36 53.14 2gkp s GLN 23 Cb -0.12 -0.39 -0.10 0.00 0.80 0.00 0.00 33.01 33.20 2gkp s GLN 23 CO 0.02 -0.07 1.32 0.99 -0.50 0.00 0.00 175.29 177.04 2gkp s THR 24 N 0.67 2.87 0.17 -0.34 2.01 -1.26 -0.25 115.64 119.51 2gkp s THR 24 Ca -0.07 0.81 0.07 0.00 0.31 0.00 0.00 61.69 62.82 2gkp s THR 24 Cb -0.10 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2gkp s THR 24 CO -0.01 0.16 -0.02 0.26 -0.69 0.00 0.00 174.62 174.32 2gkp s TRP 25 N -0.64 2.81 0.30 4.92 0.52 -0.53 -1.08 118.94 125.25 2gkp s TRP 25 Ca 0.52 -0.15 0.02 0.00 0.02 0.00 0.00 56.10 56.52 2gkp s TRP 25 Cb -0.39 -1.37 -0.02 0.00 -1.15 0.00 0.00 33.47 30.54 2gkp s TRP 25 CO 0.47 0.51 0.31 -1.12 0.02 0.00 0.00 176.95 177.14 2gkp s SER 26 N -2.86 1.08 0.00 2.95 0.01 -0.20 -3.77 113.70 110.91 2gkp s SER 26 Ca 0.27 -1.57 0.00 0.00 1.31 0.00 0.00 55.95 55.95 2gkp s SER 26 Cb -0.09 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.69 2gkp s SER 26 CO 0.18 -1.09 0.00 0.61 0.41 0.00 0.00 173.24 173.35 2gkp n GLY 27 N -0.53 -0.14 3.32 3.44 0.00 -0.27 -1.13 105.19 109.88 2gkp n GLY 27 Ca 0.04 -1.42 -0.09 0.00 0.00 0.00 0.00 46.02 44.55 2gkp n GLY 27 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2gkp s PHE 28 N -2.89 -0.72 0.00 1.61 5.36 -1.26 -0.84 117.98 119.23 2gkp s PHE 28 Ca 0.00 1.46 0.00 0.00 -0.96 0.00 0.00 56.93 57.43 2gkp s PHE 28 Cb 0.00 0.33 0.00 0.00 -0.34 0.00 0.00 43.02 43.01 2gkp s PHE 28 CO 0.00 -0.41 0.00 0.41 -1.46 0.00 0.00 175.22 173.76 2gkp n GLY 29 N 4.60 1.45 3.29 13.12 0.00 -1.26 -4.78 105.19 121.61 2gkp n GLY 29 Ca -0.19 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 2gkp n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gkp s ARG 30 N 0.00 1.14 0.28 1.61 0.52 -1.26 -5.16 118.95 116.07 2gkp s ARG 30 Ca 0.00 -1.24 0.12 0.00 -0.52 0.00 0.00 55.73 54.09 2gkp s ARG 30 Cb 0.00 -1.26 -0.05 0.00 0.52 0.00 0.00 34.95 34.16 2gkp s ARG 30 CO 0.00 0.27 -0.20 0.71 0.02 0.00 0.00 175.30 176.11 2gkp s TYR 31 N -1.60 2.27 0.17 -0.53 2.02 -1.26 -4.44 117.35 113.98 2gkp s TYR 31 Ca 0.09 -0.34 -0.21 0.00 -0.37 0.00 0.00 57.07 56.24 2gkp s TYR 31 Cb -0.08 -0.98 0.06 0.00 -0.40 0.00 0.00 41.96 40.55 2gkp s TYR 31 CO 0.05 0.71 0.58 0.00 -1.57 0.00 0.00 175.55 175.31 2gkp s ALA 32 N -2.52 -1.42 0.20 3.71 0.00 -0.29 -4.94 121.76 116.51 2gkp s ALA 32 Ca 0.30 0.28 -0.32 0.00 0.00 0.00 0.00 51.96 52.22 2gkp s ALA 32 Cb -0.05 0.86 -0.15 0.00 0.00 0.00 0.00 23.12 23.78 2gkp s ALA 32 CO 0.15 -0.78 1.21 -2.30 0.00 0.00 0.00 175.76 174.04 2gkp n PRO 33 N -0.36 1.40 -3.67 0.00 -0.02 -1.26 -1.04 135.00 130.05 2gkp n PRO 33 Ca -0.15 0.50 -0.38 0.00 -2.02 0.00 0.00 63.50 61.44 2gkp n PRO 33 Cb 0.64 -2.02 -0.10 0.00 -0.02 0.00 0.00 33.50 32.00 2gkp n PRO 33 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2gkp s ASP 34 N 0.02 5.47 0.00 2.55 -1.08 -0.24 -4.73 116.67 118.65 2gkp s ASP 34 Ca 0.70 -2.14 0.12 0.00 -0.52 0.00 0.00 52.55 50.71 2gkp s ASP 34 Cb -0.79 -1.91 0.69 0.00 -1.46 0.00 0.00 42.92 39.45 2gkp s ASP 34 CO 0.52 -0.57 1.20 1.41 0.52 0.00 0.00 175.17 178.25 2gkp n HIS 35 N 4.51 0.00 0.13 -5.34 8.25 -1.26 -1.53 115.22 119.97 2gkp n HIS 35 Ca -0.02 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.49 2gkp n HIS 35 Cb 0.41 0.00 0.49 0.00 1.12 0.00 0.00 29.99 32.01 2gkp n HIS 35 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2gkp h LEU 36 N 0.00 0.23 -8.22 2.41 5.85 -1.95 -3.39 115.31 110.24 2gkp h LEU 36 Ca 0.00 -0.02 -0.71 0.00 0.84 0.00 0.00 57.88 57.99 2gkp h LEU 36 Cb 0.00 -0.06 -0.26 0.00 0.37 0.00 0.00 40.66 40.71 2gkp h LEU 36 CO 0.00 0.23 -0.49 -0.31 -0.34 0.00 0.00 178.44 177.54 2gkp s TYR 37 N -5.11 3.29 0.50 1.25 2.02 -0.59 -5.08 117.35 113.64 2gkp s TYR 37 Ca -0.06 -1.28 -0.20 0.00 -0.37 0.00 0.00 57.07 55.16 2gkp s TYR 37 Cb 0.17 -2.72 -0.11 0.00 -0.40 0.00 0.00 41.96 38.90 2gkp s TYR 37 CO 0.71 -0.76 0.53 -2.30 -1.57 0.00 0.00 175.55 172.15 2gkp n PRO 38 N 4.95 0.56 -2.00 -1.71 -0.02 -1.26 -4.64 135.00 130.88 2gkp n PRO 38 Ca -0.11 0.21 -0.37 0.00 -2.02 0.00 0.00 63.50 61.21 2gkp n PRO 38 Cb 0.44 -1.61 0.02 0.00 -0.02 0.00 0.00 33.50 32.33 2gkp n PRO 38 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2gkp s PRO 39 N -1.83 3.31 -0.33 0.52 0.02 -1.26 -4.84 135.00 130.58 2gkp s PRO 39 Ca 0.66 1.98 -0.12 0.00 0.02 0.00 0.00 61.00 63.55 2gkp s PRO 39 Cb -0.51 -2.23 -0.01 0.00 0.02 0.00 0.00 34.50 31.77 2gkp s PRO 39 CO 0.56 -0.98 0.21 -1.01 -0.33 0.00 0.00 177.00 175.45 2gkp s HIS 40 N -1.45 3.21 -0.09 6.54 3.76 -0.20 -4.93 115.29 122.14 2gkp s HIS 40 Ca 0.70 -0.36 -0.13 0.00 -0.15 0.00 0.00 55.06 55.12 2gkp s HIS 40 Cb -0.34 -2.43 -0.05 0.00 1.11 0.00 0.00 32.58 30.87 2gkp s HIS 40 CO 0.40 -0.40 0.33 0.42 -0.85 0.00 0.00 174.74 174.64 2gkp s ILE 41 N 1.68 5.22 0.06 0.60 1.01 -1.26 -0.99 121.20 127.52 2gkp s ILE 41 Ca 0.05 0.64 0.02 0.00 0.00 0.00 0.00 60.65 61.37 2gkp s ILE 41 Cb -0.17 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 2gkp s ILE 41 CO 0.09 0.50 -0.07 -0.76 0.00 0.00 0.00 174.94 174.70 2gkp s LEU 42 N -0.39 2.36 0.74 2.97 1.43 -0.12 -4.99 118.68 120.67 2gkp s LEU 42 Ca 0.20 -0.73 -0.13 0.00 -1.03 0.00 0.00 54.13 52.44 2gkp s LEU 42 Cb -0.14 -0.10 0.04 0.00 0.03 0.00 0.00 46.19 46.02 2gkp s LEU 42 CO 0.08 -0.32 1.12 -2.16 0.23 0.00 0.00 176.35 175.31 2gkp s PRO 43 N -2.50 2.29 0.43 1.29 0.04 -1.26 -1.14 135.00 134.15 2gkp s PRO 43 Ca -0.02 1.40 0.18 0.00 0.04 0.00 0.00 61.00 62.60 2gkp s PRO 43 Cb -0.04 -1.89 0.96 0.00 0.04 0.00 0.00 34.50 33.58 2gkp s PRO 43 CO -0.02 -1.65 1.91 -0.07 0.04 0.00 0.00 177.00 177.21 2gkp h LEU 44 N -0.64 0.00 -3.75 -3.56 3.38 -1.92 -2.54 115.31 106.28 2gkp h LEU 44 Ca -0.45 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.12 2gkp h LEU 44 Cb 1.25 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.77 2gkp h LEU 44 CO 0.51 0.27 0.37 -0.90 0.09 0.00 0.00 178.44 178.78 2gkp n ASP 45 N -3.95 3.33 -4.62 -0.43 5.75 -1.26 -4.98 116.55 110.38 2gkp n ASP 45 Ca -0.02 -3.69 -0.42 0.00 -0.01 0.00 0.00 54.79 50.66 2gkp n ASP 45 Cb 0.34 -0.76 0.01 0.00 -1.03 0.00 0.00 41.12 39.68 2gkp n ASP 45 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2gkp n THR 46 N -1.14 2.41 -1.74 2.12 -2.24 -0.96 -4.90 114.28 107.84 2gkp n THR 46 Ca 0.50 -0.50 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 2gkp n THR 46 Cb 1.42 -1.22 0.05 0.00 -2.10 0.00 0.00 70.33 68.49 2gkp n THR 46 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2gkp s ASP 47 N -0.68 4.93 0.27 3.42 -4.77 -1.26 -4.80 116.67 113.77 2gkp s ASP 47 Ca 0.62 2.13 -0.02 0.00 -3.30 0.00 0.00 52.55 51.98 2gkp s ASP 47 Cb -0.56 -2.57 0.42 0.00 -1.09 0.00 0.00 42.92 39.12 2gkp s ASP 47 CO 0.57 -1.76 1.88 0.78 0.70 0.00 0.00 175.17 177.35 2gkp h ASN 48 N 0.11 1.04 -0.49 2.11 2.35 -1.90 -1.53 115.58 117.26 2gkp h ASN 48 Ca -0.47 0.01 0.09 0.00 -0.55 0.00 0.00 56.30 55.37 2gkp h ASN 48 Cb 1.26 -0.21 -0.07 0.00 0.05 0.00 0.00 38.32 39.35 2gkp h ASN 48 CO 0.53 0.66 0.07 -0.08 -1.65 0.00 0.00 177.43 176.96 2gkp h GLU 49 N 1.17 0.19 -0.28 0.81 4.57 -1.80 0.14 114.58 119.38 2gkp h GLU 49 Ca 0.44 -0.01 -0.17 0.00 -1.18 0.00 0.00 59.36 58.44 2gkp h GLU 49 Cb 0.18 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.72 2gkp h GLU 49 CO -0.17 0.13 -0.48 1.15 -1.18 0.00 0.00 179.01 178.45 2gkp h THR 50 N 0.20 1.29 -0.22 0.32 2.02 -1.77 -0.95 112.91 113.80 2gkp h THR 50 Ca 0.25 -1.66 -0.03 0.00 0.77 0.00 0.00 66.41 65.73 2gkp h THR 50 Cb 0.34 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 2gkp h THR 50 CO -0.35 0.54 0.01 0.25 0.37 0.00 0.00 175.52 176.35 2gkp h LEU 51 N 0.59 0.37 -0.25 2.58 5.85 -0.96 -0.40 115.31 123.09 2gkp h LEU 51 Ca 0.02 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 58.46 2gkp h LEU 51 Cb 1.08 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2gkp h LEU 51 CO 0.11 0.57 0.13 1.23 -0.34 0.00 0.00 178.44 180.14 2gkp h GLY 52 N 0.15 0.33 1.01 3.75 0.00 -0.69 -1.63 103.07 106.00 2gkp h GLY 52 Ca 0.06 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.31 2gkp h GLY 52 CO 0.01 0.08 0.56 -0.84 0.00 0.00 0.00 176.54 176.35 2gkp h THR 53 N 0.27 1.22 -0.55 4.70 2.02 -1.10 0.51 112.91 119.98 2gkp h THR 53 Ca 0.10 -0.41 -0.08 0.00 0.77 0.00 0.00 66.41 66.79 2gkp h THR 53 Cb 0.02 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.38 2gkp h THR 53 CO -0.06 0.22 0.04 0.74 0.37 0.00 0.00 175.52 176.83 2gkp h THR 54 N 1.16 1.26 -0.43 3.16 2.02 -0.82 -0.25 112.91 119.01 2gkp h THR 54 Ca 0.31 -1.05 -0.15 0.00 0.77 0.00 0.00 66.41 66.30 2gkp h THR 54 Cb -0.12 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2gkp h THR 54 CO -0.07 0.38 -0.30 0.58 0.37 0.00 0.00 175.52 176.48 2gkp h VAL 55 N 0.84 1.27 -0.99 3.16 2.07 -1.01 -1.15 116.25 120.44 2gkp h VAL 55 Ca 0.16 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.24 2gkp h VAL 55 Cb 0.48 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.45 2gkp h VAL 55 CO 0.02 0.50 0.65 -0.07 0.02 0.00 0.00 177.57 178.69 2gkp h LEU 56 N 0.80 1.10 -0.67 2.57 3.38 -0.70 0.45 115.31 122.24 2gkp h LEU 56 Ca 0.09 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 2gkp h LEU 56 Cb 0.88 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2gkp h LEU 56 CO 0.08 0.78 -0.34 -0.61 0.09 0.00 0.00 178.44 178.43 2gkp h GLN 57 N 1.29 0.65 -0.63 1.13 5.75 -0.78 -0.72 115.11 121.80 2gkp h GLN 57 Ca 0.38 -0.31 -0.03 0.00 -0.15 0.00 0.00 58.65 58.54 2gkp h GLN 57 Cb -0.07 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.44 2gkp h GLN 57 CO -0.10 0.90 0.28 0.00 -2.65 0.00 0.00 178.83 177.26 2gkp h ALA 58 N 1.07 0.81 -0.78 3.38 0.00 -0.55 -2.71 119.26 120.49 2gkp h ALA 58 Ca 0.06 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2gkp h ALA 58 Cb 0.85 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2gkp h ALA 58 CO 0.07 0.40 0.33 -0.07 0.00 0.00 0.00 179.25 179.98 2gkp h LEU 59 N 0.87 1.05 -2.03 0.00 3.38 -0.72 -2.65 115.31 115.21 2gkp h LEU 59 Ca 0.21 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2gkp h LEU 59 Cb 0.16 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2gkp h LEU 59 CO -0.02 0.92 -0.07 0.00 0.09 0.00 0.00 178.44 179.36 2gkp h ALA 60 N 1.23 1.62 -0.01 1.53 0.00 -0.82 -0.82 119.26 122.00 2gkp h ALA 60 Ca 0.26 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2gkp h ALA 60 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2gkp h ALA 60 CO -0.02 0.09 -0.12 0.09 0.00 0.00 0.00 179.25 179.29 2gkp n ASN 61 N -4.08 0.87 -4.69 0.00 3.02 -1.01 -4.92 115.26 104.45 2gkp n ASN 61 Ca -0.03 -0.94 -0.42 0.00 -0.03 0.00 0.00 54.58 53.16 2gkp n ASN 61 Cb 0.16 0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 2gkp n ASN 61 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2gkp s SER 62 N -2.33 6.44 -0.11 6.41 0.15 -0.31 -4.96 113.70 118.99 2gkp s SER 62 Ca 0.31 2.72 -0.09 0.00 0.70 0.00 0.00 55.95 59.59 2gkp s SER 62 Cb 0.20 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.90 2gkp s SER 62 CO 0.45 -0.99 0.20 -0.13 1.20 0.00 0.00 173.24 173.96 2gkp s ARG 63 N 2.82 3.70 -0.23 5.44 0.52 -1.25 -4.89 118.95 125.05 2gkp s ARG 63 Ca 0.80 -0.03 -0.04 0.00 -0.52 0.00 0.00 55.73 55.94 2gkp s ARG 63 Cb -0.45 -3.25 -0.00 0.00 0.52 0.00 0.00 34.95 31.77 2gkp s ARG 63 CO 0.36 0.65 -0.03 0.99 0.02 0.00 0.00 175.30 177.29 2gkp s THR 64 N -0.71 3.41 0.54 0.02 2.01 -1.26 -1.11 115.64 118.54 2gkp s THR 64 Ca 0.16 -0.55 -0.08 0.00 0.31 0.00 0.00 61.69 61.53 2gkp s THR 64 Cb -0.13 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 2gkp s THR 64 CO 0.05 0.37 0.89 -0.36 -0.69 0.00 0.00 174.62 174.87 2gkp s PHE 65 N 1.47 3.58 -0.03 4.92 0.08 -0.02 -4.99 117.98 122.99 2gkp s PHE 65 Ca 0.05 1.04 -0.28 0.00 0.12 0.00 0.00 56.93 57.86 2gkp s PHE 65 Cb -0.15 -2.49 -0.03 0.00 -0.57 0.00 0.00 43.02 39.78 2gkp s PHE 65 CO -0.03 -0.44 0.89 0.08 -0.10 0.00 0.00 175.22 175.62 2gkp s VAL 66 N -2.90 4.92 0.16 -0.44 1.01 -1.26 -4.72 120.40 117.17 2gkp s VAL 66 Ca 0.51 1.85 -0.34 0.00 0.00 0.00 0.00 61.98 63.99 2gkp s VAL 66 Cb -0.11 -4.22 -0.15 0.00 0.00 0.00 0.00 36.38 31.91 2gkp s VAL 66 CO 0.48 0.17 1.48 0.00 0.00 0.00 0.00 175.10 177.23 2gkp n TYR 67 N 3.99 2.05 -0.95 5.22 9.36 -1.26 -1.23 117.16 134.34 2gkp n TYR 67 Ca 0.04 0.39 0.00 0.00 3.32 0.00 0.00 57.90 61.65 2gkp n TYR 67 Cb 0.51 -2.47 0.00 0.00 -0.63 0.00 0.00 39.34 36.75 2gkp n TYR 67 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2gkp n ASP 68 N 2.97 -3.67 -4.72 2.98 9.92 -1.26 -5.01 116.55 117.76 2gkp n ASP 68 Ca 0.16 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 54.12 2gkp n ASP 68 Cb 0.27 -1.92 0.12 0.00 -0.64 0.00 0.00 41.12 38.95 2gkp n ASP 68 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2gkp s SER 69 N -2.09 3.78 0.29 -2.24 1.04 -0.37 -4.76 113.70 109.36 2gkp s SER 69 Ca 0.00 1.85 0.03 0.00 0.48 0.00 0.00 55.95 58.31 2gkp s SER 69 Cb 0.00 -2.47 0.62 0.00 0.10 0.00 0.00 66.02 64.27 2gkp s SER 69 CO 0.00 -2.50 1.83 1.55 0.98 0.00 0.00 173.24 175.10 2gkp h PRO 70 N -1.45 0.89 -0.60 4.02 0.13 -1.95 -1.21 132.00 131.83 2gkp h PRO 70 Ca -0.45 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 64.63 2gkp h PRO 70 Cb 1.25 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 32.15 2gkp h PRO 70 CO 0.49 0.59 0.40 0.93 -0.23 0.00 0.00 178.00 180.18 2gkp h GLU 71 N 0.92 0.79 -0.07 0.86 3.07 -1.91 -2.09 114.58 116.15 2gkp h GLU 71 Ca 0.51 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 59.32 2gkp h GLU 71 Cb 0.59 -0.18 -0.00 0.00 -0.84 0.00 0.00 28.75 28.32 2gkp h GLU 71 CO -0.28 0.52 0.03 0.22 -1.40 0.00 0.00 179.01 178.10 2gkp h ASP 72 N 0.81 0.09 -0.58 1.42 3.58 -1.55 -1.19 116.42 118.99 2gkp h ASP 72 Ca 0.22 -0.13 0.01 0.00 0.42 0.00 0.00 57.03 57.56 2gkp h ASP 72 Cb -0.09 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 2gkp h ASP 72 CO -0.05 0.19 0.38 1.56 -2.88 0.00 0.00 179.24 178.43 2gkp h GLN 73 N -0.02 0.74 -0.52 0.28 4.20 -1.21 -1.88 115.11 116.70 2gkp h GLN 73 Ca 0.02 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 2gkp h GLN 73 Cb 0.13 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 2gkp h GLN 73 CO -0.00 0.49 0.32 0.22 -0.67 0.00 0.00 178.83 179.18 2gkp h ASP 74 N 0.76 0.62 -0.25 1.46 3.58 -1.34 -1.26 116.42 119.99 2gkp h ASP 74 Ca 0.22 -0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.58 2gkp h ASP 74 Cb -0.05 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.83 2gkp h ASP 74 CO -0.07 0.48 0.02 0.15 -2.88 0.00 0.00 179.24 176.94 2gkp h PHE 75 N 0.70 0.57 -0.31 0.28 3.57 -0.90 -3.02 116.94 117.82 2gkp h PHE 75 Ca 0.19 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2gkp h PHE 75 Cb -0.03 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.55 2gkp h PHE 75 CO -0.03 0.54 0.00 1.19 -2.23 0.00 0.00 178.31 177.78 2gkp n PHE 76 N -4.29 0.40 -1.93 0.41 3.72 -0.73 -4.71 117.46 110.32 2gkp n PHE 76 Ca 0.02 -0.23 -0.42 0.00 -0.05 0.00 0.00 57.45 56.77 2gkp n PHE 76 Cb 0.24 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.74 2gkp n PHE 76 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2gkp s ASP 77 N -1.40 6.60 0.14 4.37 2.15 -0.49 -4.92 116.67 123.12 2gkp s ASP 77 Ca 0.33 2.55 -0.18 0.00 0.43 0.00 0.00 52.55 55.68 2gkp s ASP 77 Cb 0.20 -2.58 0.02 0.00 -0.30 0.00 0.00 42.92 40.26 2gkp s ASP 77 CO 0.28 -0.85 1.73 0.74 -0.17 0.00 0.00 175.17 176.89 2gkp h THR 78 N 4.40 0.85 -0.19 1.71 2.02 -1.91 -0.39 112.91 119.40 2gkp h THR 78 Ca -0.43 -0.05 -0.18 0.00 0.77 0.00 0.00 66.41 66.52 2gkp h THR 78 Cb 1.20 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 68.31 2gkp h THR 78 CO 0.92 0.02 -0.63 -0.08 0.37 0.00 0.00 175.52 176.12 2gkp h GLU 79 N 0.13 0.66 -0.46 6.66 4.57 -1.97 -1.73 114.58 122.44 2gkp h GLU 79 Ca 0.13 -0.46 -0.02 0.00 -1.18 0.00 0.00 59.36 57.83 2gkp h GLU 79 Cb 0.15 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.79 2gkp h GLU 79 CO -0.19 1.08 0.23 0.87 -1.18 0.00 0.00 179.01 179.83 2gkp h LYS 80 N 0.49 0.66 -0.45 1.92 1.79 -1.82 0.36 116.57 119.52 2gkp h LYS 80 Ca -0.01 -0.09 0.06 0.00 -2.18 0.00 0.00 60.65 58.42 2gkp h LYS 80 Cb 1.21 -0.12 -0.05 0.00 -1.58 0.00 0.00 32.23 31.69 2gkp h LYS 80 CO 0.12 0.55 0.16 0.82 -1.08 0.00 0.00 179.45 180.03 2gkp h ILE 81 N 0.61 0.86 -0.34 1.86 2.04 -0.90 -0.12 117.51 121.51 2gkp h ILE 81 Ca 0.16 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 2gkp h ILE 81 Cb 0.10 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2gkp h ILE 81 CO -0.02 0.06 0.19 -0.09 0.00 0.00 0.00 178.15 178.29 2gkp h ARG 82 N 0.33 0.47 -0.26 2.37 2.43 -0.91 0.07 114.38 118.89 2gkp h ARG 82 Ca 0.21 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 2gkp h ARG 82 Cb 0.20 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2gkp h ARG 82 CO -0.21 0.39 0.11 1.96 -1.51 0.00 0.00 179.97 180.70 2gkp h GLN 83 N 0.43 0.39 -0.23 0.20 4.20 -0.68 -0.94 115.11 118.49 2gkp h GLN 83 Ca 0.12 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 2gkp h GLN 83 Cb 0.05 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2gkp h GLN 83 CO -0.02 0.42 -0.25 0.00 -0.67 0.00 0.00 178.83 178.31 2gkp h ARG 84 N 0.27 0.43 -0.10 1.46 3.08 -0.88 -1.46 114.38 117.17 2gkp h ARG 84 Ca 0.09 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 2gkp h ARG 84 Cb 0.17 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 2gkp h ARG 84 CO -0.01 0.65 -0.05 -0.92 -1.07 0.00 0.00 179.97 178.57 2gkp h TYR 85 N 0.38 0.25 -0.63 3.04 3.20 -0.71 -1.03 116.97 121.46 2gkp h TYR 85 Ca 0.06 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 2gkp h TYR 85 Cb 0.64 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.83 2gkp h TYR 85 CO 0.02 0.57 0.21 0.93 -1.64 0.00 0.00 178.16 178.25 2gkp h GLU 86 N -0.14 0.96 -0.47 1.82 4.39 -1.03 -0.36 114.58 119.75 2gkp h GLU 86 Ca 0.02 -0.18 0.04 0.00 0.34 0.00 0.00 59.36 59.59 2gkp h GLU 86 Cb 0.51 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 28.96 2gkp h GLU 86 CO 0.02 0.82 0.22 0.22 -1.16 0.00 0.00 179.01 179.12 2gkp h ASP 87 N 0.93 0.30 -0.56 1.42 3.58 -1.18 -1.38 116.42 119.53 2gkp h ASP 87 Ca 0.21 0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.67 2gkp h ASP 87 Cb 0.25 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.25 2gkp h ASP 87 CO -0.01 0.22 0.28 -0.25 -2.88 0.00 0.00 179.24 176.59 2gkp h TRP 88 N 0.44 0.80 -0.17 0.28 7.01 -0.47 -0.65 115.95 123.20 2gkp h TRP 88 Ca 0.21 -0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.16 2gkp h TRP 88 Cb 0.14 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 26.94 2gkp h TRP 88 CO -0.11 0.61 0.06 0.28 -2.79 0.00 0.00 178.44 176.49 2gkp h VAL 89 N 0.76 1.17 -0.71 2.65 2.07 -0.82 -0.65 116.25 120.71 2gkp h VAL 89 Ca 0.19 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 67.20 2gkp h VAL 89 Cb 0.10 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 2gkp h VAL 89 CO -0.03 0.16 0.47 0.00 0.02 0.00 0.00 177.57 178.19 2gkp h ALA 90 N 0.89 0.91 -0.50 1.67 0.00 -1.11 -0.54 119.26 120.58 2gkp h ALA 90 Ca 0.05 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2gkp h ALA 90 Cb 0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2gkp h ALA 90 CO -0.00 0.33 -0.05 -0.22 0.00 0.00 0.00 179.25 179.32 2gkp h LYS 91 N 0.97 0.91 -0.65 0.00 3.64 -0.95 -1.76 116.57 118.72 2gkp h LYS 91 Ca 0.26 -0.31 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 2gkp h LYS 91 Cb -0.10 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 2gkp h LYS 91 CO -0.06 0.96 0.21 -0.07 -2.27 0.00 0.00 179.45 178.23 2gkp h LEU 92 N 0.77 0.94 -0.46 5.20 3.38 -0.79 0.10 115.31 124.45 2gkp h LEU 92 Ca 0.14 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.91 2gkp h LEU 92 Cb 0.58 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2gkp h LEU 92 CO 0.03 0.89 0.30 0.00 0.09 0.00 0.00 178.44 179.76 2gkp h GLY 94 N 0.61 1.12 2.00 0.00 0.00 -0.99 -0.94 103.07 104.87 2gkp h GLY 94 Ca 0.17 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2gkp h GLY 94 CO -0.05 0.49 0.00 0.70 0.00 0.00 0.00 176.54 177.68 2gkp n ASN 95 N -4.45 0.74 0.00 0.19 5.03 -0.01 -3.70 115.26 113.07 2gkp n ASN 95 Ca 0.07 0.65 0.00 0.00 0.87 0.00 0.00 54.58 56.16 2gkp n ASN 95 Cb 0.09 -0.82 0.00 0.00 -1.02 0.00 0.00 39.78 38.03 2gkp n ASN 95 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2gkp n LEU 96 N -2.28 1.38 0.00 3.41 4.77 -0.55 -5.02 117.00 118.71 2gkp n LEU 96 Ca 0.03 -1.38 0.00 0.00 -0.03 0.00 0.00 56.01 54.63 2gkp n LEU 96 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2gkp n LEU 96 CO 0.23 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 2gkp n GLY 97 N -0.24 0.52 3.88 -0.72 0.00 -0.62 -5.05 105.19 102.96 2gkp n GLY 97 Ca 0.00 -0.83 -0.35 0.00 0.00 0.00 0.00 46.02 44.83 2gkp n GLY 97 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gkp s TYR 98 N -2.00 3.59 -0.46 1.61 2.02 -0.45 -4.99 117.35 116.67 2gkp s TYR 98 Ca 0.00 0.57 0.19 0.00 -0.37 0.00 0.00 57.07 57.45 2gkp s TYR 98 Cb 0.00 -1.98 -0.24 0.00 -0.40 0.00 0.00 41.96 39.34 2gkp s TYR 98 CO 0.00 0.66 0.60 1.63 -1.57 0.00 0.00 175.55 176.87 2gkp n LYS 99 N 1.42 0.77 -4.37 -0.62 4.76 -1.26 -4.43 118.16 114.44 2gkp n LYS 99 Ca -0.14 -0.08 -0.19 0.00 -2.87 0.00 0.00 58.31 55.03 2gkp n LYS 99 Cb 0.53 -1.40 -0.14 0.00 -1.84 0.00 0.00 35.03 32.18 2gkp n LYS 99 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2gkp s THR 100 N -3.01 0.88 0.44 -0.18 -4.23 -1.26 -5.02 115.64 103.26 2gkp s THR 100 Ca 0.00 -0.68 0.16 0.00 -1.18 0.00 0.00 61.69 59.99 2gkp s THR 100 Cb 0.13 -0.78 0.19 0.00 1.34 0.00 0.00 72.50 73.39 2gkp s THR 100 CO 0.77 0.09 1.99 0.08 -0.54 0.00 0.00 174.62 177.01 2gkp h ARG 101 N 5.44 0.00 -0.68 3.99 0.11 -1.96 -2.54 114.38 118.73 2gkp h ARG 101 Ca -0.34 0.00 0.06 0.00 0.10 0.00 0.00 59.98 59.80 2gkp h ARG 101 Cb 1.18 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.21 2gkp h ARG 101 CO 0.47 0.19 0.39 -0.09 0.10 0.00 0.00 179.97 181.03 2gkp h ARG 102 N 0.00 0.70 -0.31 0.08 2.43 -1.99 -1.47 114.38 113.82 2gkp h ARG 102 Ca -0.00 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 58.97 2gkp h ARG 102 Cb 0.35 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2gkp h ARG 102 CO 0.02 0.47 -0.40 0.00 -1.51 0.00 0.00 179.97 178.55 2gkp h ALA 103 N 1.34 0.47 -0.67 2.80 0.00 -1.93 -0.76 119.26 120.52 2gkp h ALA 103 Ca 0.30 -0.46 0.09 0.00 0.00 0.00 0.00 54.91 54.84 2gkp h ALA 103 Cb 0.16 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 2gkp h ALA 103 CO -0.17 0.59 0.32 1.25 0.00 0.00 0.00 179.25 181.24 2gkp h LEU 104 N 0.61 0.42 0.00 0.00 5.85 -1.08 -3.10 115.31 118.01 2gkp h LEU 104 Ca 0.04 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2gkp h LEU 104 Cb 1.00 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2gkp h LEU 104 CO 0.10 0.25 -0.99 0.49 -0.34 0.00 0.00 178.44 177.94 2gkp n PHE 105 N -4.88 0.71 -0.37 1.25 3.72 -0.59 -4.57 117.46 112.74 2gkp n PHE 105 Ca 0.10 0.21 -0.00 0.00 -0.05 0.00 0.00 57.45 57.70 2gkp n PHE 105 Cb 0.25 -0.79 0.05 0.00 -0.94 0.00 0.00 39.48 38.06 2gkp n PHE 105 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 2gkp n LYS 106 N -2.42 -0.21 -3.79 -1.08 4.81 -0.30 -4.96 118.16 110.21 2gkp n LYS 106 Ca 0.01 1.48 -0.36 0.00 -0.87 0.00 0.00 58.31 58.57 2gkp n LYS 106 Cb 0.51 -2.20 -0.12 0.00 0.02 0.00 0.00 35.03 33.24 2gkp n LYS 106 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2gkp s ASN 107 N -5.33 5.20 -0.28 3.14 0.01 -1.26 -5.11 114.94 111.30 2gkp s ASN 107 Ca -0.13 -1.72 -0.17 0.00 -0.71 0.00 0.00 52.86 50.13 2gkp s ASN 107 Cb 0.20 -1.82 0.12 0.00 0.41 0.00 0.00 41.25 40.17 2gkp s ASN 107 CO 0.69 -0.45 0.87 -0.55 -1.51 0.00 0.00 177.10 176.15 2gkp s SER 110 N 1.67 -0.66 -0.02 -1.22 0.15 -1.26 -4.42 113.70 107.93 2gkp s SER 110 Ca 0.03 1.08 0.08 0.00 0.70 0.00 0.00 55.95 57.84 2gkp s SER 110 Cb -0.22 1.25 -0.02 0.00 -1.71 0.00 0.00 66.02 65.33 2gkp s SER 110 CO -0.02 -0.17 -0.26 -0.69 1.20 0.00 0.00 173.24 173.30 2gkp s VAL 111 N 1.33 2.03 0.21 4.45 1.01 0.64 -3.34 120.40 126.72 2gkp s VAL 111 Ca -0.08 -1.10 0.10 0.00 0.00 0.00 0.00 61.98 60.90 2gkp s VAL 111 Cb -0.04 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 2gkp s VAL 111 CO -0.15 0.57 -0.15 1.51 0.00 0.00 0.00 175.10 176.88 2gkp s ASP 112 N -0.59 3.94 -0.07 3.32 1.47 -0.49 -0.65 116.67 123.60 2gkp s ASP 112 Ca 0.09 -0.74 0.02 0.00 1.18 0.00 0.00 52.55 53.11 2gkp s ASP 112 Cb -0.10 -0.53 0.02 0.00 -0.34 0.00 0.00 42.92 41.97 2gkp s ASP 112 CO -0.01 0.09 -0.11 -0.63 0.68 0.00 0.00 175.17 175.19 2gkp s ILE 113 N -1.86 1.07 -0.17 2.11 1.09 0.31 -0.93 121.20 122.83 2gkp s ILE 113 Ca 0.25 -0.42 0.01 0.00 -1.10 0.00 0.00 60.65 59.38 2gkp s ILE 113 Cb -0.08 -1.00 0.02 0.00 -1.06 0.00 0.00 42.46 40.34 2gkp s ILE 113 CO 0.14 0.35 -0.18 0.86 -0.10 0.00 0.00 174.94 176.01 2gkp s TRP 114 N 0.84 2.53 -0.15 3.97 -0.00 -0.31 -1.14 118.94 124.68 2gkp s TRP 114 Ca -0.11 -1.46 -0.04 0.00 -0.00 0.00 0.00 56.10 54.48 2gkp s TRP 114 Cb -0.15 -1.78 -0.03 0.00 -0.00 0.00 0.00 33.47 31.50 2gkp s TRP 114 CO 0.02 -0.74 -0.01 -1.17 -0.00 0.00 0.00 176.95 175.04 2gkp s LEU 115 N 1.35 3.44 -0.24 5.86 2.96 0.52 -0.68 118.68 131.89 2gkp s LEU 115 Ca 0.04 -0.03 -0.09 0.00 -0.22 0.00 0.00 54.13 53.83 2gkp s LEU 115 Cb -0.13 -1.83 0.10 0.00 0.50 0.00 0.00 46.19 44.83 2gkp s LEU 115 CO -0.12 0.21 0.52 -2.28 -1.32 0.00 0.00 176.35 173.37 2gkp s HIS 116 N 0.13 -0.98 -1.50 5.38 5.65 -0.69 -1.36 115.29 121.91 2gkp s HIS 116 Ca 0.01 1.83 -0.04 0.00 0.25 0.00 0.00 55.06 57.10 2gkp s HIS 116 Cb -0.13 0.50 0.04 0.00 -1.18 0.00 0.00 32.58 31.81 2gkp s HIS 116 CO 0.02 -0.53 0.41 0.09 -0.65 0.00 0.00 174.74 174.09 2gkp n ASN 117 N 5.12 -0.68 0.00 9.88 3.02 -1.26 -1.14 115.26 130.20 2gkp n ASN 117 Ca -0.13 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 2gkp n ASN 117 Cb 0.51 -2.68 0.00 0.00 -0.61 0.00 0.00 39.78 37.00 2gkp n ASN 117 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gkp n GLY 118 N -1.97 2.17 3.68 7.41 0.00 -1.26 -5.00 105.19 110.22 2gkp n GLY 118 Ca -0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 2gkp n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gkp s LEU 120 N 1.14 4.40 -0.36 0.00 1.43 0.01 -1.71 118.68 123.60 2gkp s LEU 120 Ca 0.19 -0.55 -0.13 0.00 -1.03 0.00 0.00 54.13 52.61 2gkp s LEU 120 Cb -0.14 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 2gkp s LEU 120 CO 0.08 -0.25 0.25 -0.75 0.23 0.00 0.00 176.35 175.91 2gkp s LYS 121 N 1.66 3.33 -0.30 1.70 2.20 0.14 -1.23 119.74 127.24 2gkp s LYS 121 Ca 0.05 -0.76 -0.03 0.00 -0.36 0.00 0.00 55.97 54.87 2gkp s LYS 121 Cb -0.18 -3.83 0.04 0.00 -1.51 0.00 0.00 37.83 32.36 2gkp s LYS 121 CO 0.08 -0.53 0.02 0.42 -0.36 0.00 0.00 175.35 174.99 2gkp s ILE 122 N 1.70 3.25 -0.16 5.43 1.01 -0.12 -1.16 121.20 131.14 2gkp s ILE 122 Ca 0.06 -1.20 -0.00 0.00 0.00 0.00 0.00 60.65 59.51 2gkp s ILE 122 Cb -0.18 -2.81 -0.00 0.00 0.01 0.00 0.00 42.46 39.48 2gkp s ILE 122 CO 0.10 -0.05 -0.14 -0.44 0.00 0.00 0.00 174.94 174.41 2gkp s SER 123 N 1.32 3.77 1.07 3.58 0.01 -0.11 -0.28 113.70 123.06 2gkp s SER 123 Ca -0.03 -0.45 -0.16 0.00 1.31 0.00 0.00 55.95 56.62 2gkp s SER 123 Cb -0.19 -1.59 0.22 0.00 0.21 0.00 0.00 66.02 64.67 2gkp s SER 123 CO -0.00 0.07 1.13 -0.81 0.41 0.00 0.00 173.24 174.04 2gkp n PRO 124 N 4.14 -1.72 -3.91 12.44 -0.04 -1.26 -1.39 135.00 143.26 2gkp n PRO 124 Ca -0.19 -1.76 -0.08 0.00 -0.04 0.00 0.00 63.50 61.43 2gkp n PRO 124 Cb 0.52 -1.31 -0.04 0.00 -0.04 0.00 0.00 33.50 32.63 2gkp n PRO 124 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2gkp s SER 125 N -4.99 -0.18 -0.18 3.54 1.04 -1.21 -4.29 113.70 107.42 2gkp s SER 125 Ca 0.66 -0.75 -0.07 0.00 0.48 0.00 0.00 55.95 56.27 2gkp s SER 125 Cb -0.03 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 2gkp s SER 125 CO 0.48 -1.21 0.06 -0.60 0.98 0.00 0.00 173.24 172.95 2gkp s ARG 126 N -3.96 3.98 -1.29 4.02 6.06 0.75 -1.58 118.95 126.92 2gkp s ARG 126 Ca 0.16 -0.34 -0.18 0.00 -2.50 0.00 0.00 55.73 52.87 2gkp s ARG 126 Cb -0.03 -3.21 0.05 0.00 0.06 0.00 0.00 34.95 31.81 2gkp s ARG 126 CO 0.07 0.27 1.80 1.58 -2.50 0.00 0.00 175.30 176.52 2gkp n HIS 127 N 3.53 4.32 0.08 5.12 -0.00 0.34 -1.23 115.22 127.37 2gkp n HIS 127 Ca -0.17 -2.66 -0.12 0.00 -0.00 0.00 0.00 57.72 54.77 2gkp n HIS 127 Cb 0.52 -2.62 -0.05 0.00 -0.00 0.00 0.00 29.99 27.84 2gkp n HIS 127 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.34 176.10 2gkp h VAL 128 N 5.53 1.46 -3.32 3.57 3.04 -1.82 -3.46 116.25 121.25 2gkp h VAL 128 Ca 0.43 -2.63 -0.40 0.00 -1.01 0.00 0.00 66.70 63.09 2gkp h VAL 128 Cb 0.86 2.52 -0.14 0.00 -2.01 0.00 0.00 31.29 32.52 2gkp h VAL 128 CO 1.46 0.77 -0.63 -0.54 -1.01 0.00 0.00 177.57 177.63 2gkp s LYS 129 N -3.14 1.46 0.23 4.17 1.02 -1.08 -5.01 119.74 117.38 2gkp s LYS 129 Ca -0.04 -1.78 -0.08 0.00 0.02 0.00 0.00 55.97 54.08 2gkp s LYS 129 Cb 0.09 -0.57 0.36 0.00 -0.52 0.00 0.00 37.83 37.19 2gkp s LYS 129 CO 0.85 -0.19 1.68 -0.07 -0.92 0.00 0.00 175.35 176.69 2gkp h LEU 130 N 2.33 -0.14 -3.41 3.17 3.38 -1.96 -2.56 115.31 116.12 2gkp h LEU 130 Ca -0.39 0.15 -0.26 0.00 0.09 0.00 0.00 57.88 57.47 2gkp h LEU 130 Cb 1.24 0.23 -0.22 0.00 0.09 0.00 0.00 40.66 42.00 2gkp h LEU 130 CO 0.65 -0.07 -0.68 -0.62 0.09 0.00 0.00 178.44 177.81 2gkp n GLU 131 N -5.22 2.43 -3.76 1.13 1.02 -1.26 -4.78 120.64 110.20 2gkp n GLU 131 Ca 0.11 -3.65 -0.13 0.00 -0.02 0.00 0.00 57.16 53.48 2gkp n GLU 131 Cb 0.39 -1.85 -0.08 0.00 -0.02 0.00 0.00 31.44 29.88 2gkp n GLU 131 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gkp s ALA 132 N -3.30 -0.76 -0.02 0.62 0.00 -0.97 -5.13 121.76 112.20 2gkp s ALA 132 Ca 0.43 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.65 2gkp s ALA 132 Cb 0.39 0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.66 2gkp s ALA 132 CO -0.02 -0.30 -0.05 -1.58 0.00 0.00 0.00 175.76 173.80 2gkp s TRP 133 N -1.66 0.60 0.22 0.00 0.51 -1.26 -2.60 118.94 114.75 2gkp s TRP 133 Ca -0.11 -0.13 0.10 0.00 -2.12 0.00 0.00 56.10 53.84 2gkp s TRP 133 Cb -0.04 -0.47 -0.05 0.00 -0.81 0.00 0.00 33.47 32.10 2gkp s TRP 133 CO 0.02 -0.08 -0.19 -0.51 -0.51 0.00 0.00 176.95 175.68 2gkp s ASP 134 N 0.33 3.12 0.59 2.95 1.01 -0.37 -4.92 116.67 119.39 2gkp s ASP 134 Ca -0.04 -0.96 -0.19 0.00 0.71 0.00 0.00 52.55 52.07 2gkp s ASP 134 Cb -0.08 -0.22 -0.04 0.00 1.01 0.00 0.00 42.92 43.59 2gkp s ASP 134 CO -0.00 -0.01 1.23 0.00 0.21 0.00 0.00 175.17 176.60 2gkp s ALA 135 N -2.34 2.56 0.29 5.23 0.00 -1.26 -0.18 121.76 126.07 2gkp s ALA 135 Ca 0.23 1.06 0.02 0.00 0.00 0.00 0.00 51.96 53.27 2gkp s ALA 135 Cb -0.05 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.62 2gkp s ALA 135 CO 0.10 -1.21 0.18 0.44 0.00 0.00 0.00 175.76 175.27 2gkp n ILE 136 N -1.54 0.00 -3.73 0.00 -5.35 -1.26 -4.63 119.36 102.85 2gkp n ILE 136 Ca 0.13 -1.19 -0.37 0.00 -0.27 0.00 0.00 62.75 61.06 2gkp n ILE 136 Cb 0.49 -0.15 -0.12 0.00 -1.74 0.00 0.00 39.64 38.12 2gkp n ILE 136 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2gkp s ASP 137 N -2.68 5.46 -1.46 7.28 1.01 -1.26 -4.63 116.67 120.39 2gkp s ASP 137 Ca 0.13 -0.12 -0.08 0.00 0.71 0.00 0.00 52.55 53.20 2gkp s ASP 137 Cb -0.01 -1.99 0.03 0.00 1.01 0.00 0.00 42.92 41.96 2gkp s ASP 137 CO 0.08 -0.02 0.78 0.00 0.21 0.00 0.00 175.17 176.22 2gkp n ALA 138 N 4.83 -1.12 -0.75 5.23 0.00 -1.26 -4.89 120.51 122.56 2gkp n ALA 138 Ca -0.15 0.26 0.07 0.00 0.00 0.00 0.00 53.44 53.62 2gkp n ALA 138 Cb 0.52 -4.14 0.16 0.00 0.00 0.00 0.00 19.45 15.98 2gkp n ALA 138 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2gkp n ASP 139 N -2.64 2.90 -4.76 0.00 8.00 -1.26 -5.07 116.55 113.71 2gkp n ASP 139 Ca -0.04 -2.74 -0.36 0.00 0.71 0.00 0.00 54.79 52.36 2gkp n ASP 139 Cb 0.57 -0.37 0.02 0.00 -0.02 0.00 0.00 41.12 41.32 2gkp n ASP 139 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2gkp s ASP 140 N -2.00 5.45 -0.26 -2.24 1.01 -1.26 -4.60 116.67 112.77 2gkp s ASP 140 Ca 0.29 2.30 -0.09 0.00 0.71 0.00 0.00 52.55 55.77 2gkp s ASP 140 Cb 0.23 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.54 2gkp s ASP 140 CO 0.06 -1.41 0.11 -0.69 0.21 0.00 0.00 175.17 173.45 2gkp s VAL 141 N -1.66 4.68 -0.26 -1.27 1.01 0.61 -4.96 120.40 118.55 2gkp s VAL 141 Ca 0.75 -0.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.62 2gkp s VAL 141 Cb -0.28 -3.20 -0.00 0.00 0.00 0.00 0.00 36.38 32.90 2gkp s VAL 141 CO 0.31 0.31 0.04 -0.63 0.00 0.00 0.00 175.10 175.13 2gkp s ILE 142 N 1.60 3.81 0.00 2.22 -1.09 -1.26 -0.95 121.20 125.54 2gkp s ILE 142 Ca 0.06 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 57.93 2gkp s ILE 142 Cb -0.15 -2.87 0.00 0.00 -1.58 0.00 0.00 42.46 37.86 2gkp s ILE 142 CO 0.06 0.23 0.00 0.18 -1.23 0.00 0.00 174.94 174.18 2gkp n LEU 143 N 4.85 0.00 -3.91 2.97 4.77 -0.36 -5.00 117.00 120.32 2gkp n LEU 143 Ca -0.16 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.73 2gkp n LEU 143 Cb 0.49 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.57 2gkp n LEU 143 CO 0.30 0.00 0.38 -0.94 -1.33 0.00 0.00 177.39 175.81 2gkp s SER 144 N -0.26 0.09 0.00 -1.43 1.04 -1.26 -0.81 113.70 111.07 2gkp s SER 144 Ca 0.00 -1.04 0.16 0.00 0.48 0.00 0.00 55.95 55.55 2gkp s SER 144 Cb 0.00 0.74 0.82 0.00 0.10 0.00 0.00 66.02 67.69 2gkp s SER 144 CO 0.00 -1.44 1.46 0.18 0.98 0.00 0.00 173.24 174.42 2gkp n LEU 145 N -0.49 0.00 0.19 2.42 4.77 -0.00 -1.22 117.00 122.67 2gkp n LEU 145 Ca -0.04 0.27 0.04 0.00 -0.03 0.00 0.00 56.01 56.24 2gkp n LEU 145 Cb 0.60 -0.27 0.44 0.00 -2.33 0.00 0.00 43.42 41.86 2gkp n LEU 145 CO 0.24 -0.13 0.84 0.44 -1.33 0.00 0.00 177.39 177.45 2gkp h ASP 146 N 0.00 0.04 -3.92 -1.43 3.32 -1.95 -3.45 116.42 109.04 2gkp h ASP 146 Ca 0.00 -0.01 -0.49 0.00 0.02 0.00 0.00 57.03 56.55 2gkp h ASP 146 Cb 0.14 -0.01 0.02 0.00 0.22 0.00 0.00 39.33 39.70 2gkp h ASP 146 CO 0.00 0.28 0.43 0.20 -1.72 0.00 0.00 179.24 178.43 2gkp s ASN 147 N -6.96 6.86 0.71 6.45 -0.87 -0.35 -5.04 114.94 115.73 2gkp s ASN 147 Ca -0.04 2.12 -0.11 0.00 -1.57 0.00 0.00 52.86 53.26 2gkp s ASN 147 Cb 0.15 -2.60 0.02 0.00 -0.02 0.00 0.00 41.25 38.81 2gkp s ASN 147 CO 0.71 -0.42 1.08 -0.94 -2.57 0.00 0.00 177.10 174.95 2gkp s SER 148 N -1.36 5.04 0.37 -1.22 1.04 -1.26 -4.80 113.70 111.51 2gkp s SER 148 Ca 0.54 1.75 0.15 0.00 0.48 0.00 0.00 55.95 58.87 2gkp s SER 148 Cb -0.25 -2.51 1.02 0.00 0.10 0.00 0.00 66.02 64.37 2gkp s SER 148 CO 0.32 -1.67 1.75 -0.65 0.98 0.00 0.00 173.24 173.97 2gkp h PRO 149 N -0.71 0.46 -0.07 4.02 0.11 -1.92 -0.51 132.00 133.38 2gkp h PRO 149 Ca -0.44 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.67 2gkp h PRO 149 Cb 1.22 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 2gkp h PRO 149 CO 0.54 0.30 -0.12 1.49 -0.21 0.00 0.00 178.00 180.00 2gkp h GLU 150 N 0.47 -0.17 -0.63 1.05 4.57 -1.82 -0.34 114.58 117.71 2gkp h GLU 150 Ca 0.62 0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.74 2gkp h GLU 150 Cb 1.40 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 30.00 2gkp h GLU 150 CO -0.37 -0.11 0.11 0.93 -1.18 0.00 0.00 179.01 178.39 2gkp h GLU 151 N -0.18 1.03 -0.55 1.92 5.08 -1.68 -1.20 114.58 119.00 2gkp h GLU 151 Ca 0.07 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2gkp h GLU 151 Cb 0.27 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2gkp h GLU 151 CO -0.17 0.95 0.29 0.82 -1.00 0.00 0.00 179.01 179.89 2gkp h ILE 152 N 0.97 1.19 -0.82 3.13 2.04 -0.89 -1.64 117.51 121.49 2gkp h ILE 152 Ca 0.20 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2gkp h ILE 152 Cb 0.41 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.96 2gkp h ILE 152 CO 0.01 0.21 0.52 1.23 0.00 0.00 0.00 178.15 180.13 2gkp h GLY 153 N 0.75 1.19 1.00 5.37 0.00 -0.64 0.50 103.07 111.23 2gkp h GLY 153 Ca 0.19 -0.40 0.01 0.00 0.00 0.00 0.00 47.33 47.13 2gkp h GLY 153 CO -0.03 0.34 0.49 0.00 0.00 0.00 0.00 176.54 177.34 2gkp h ALA 154 N 1.34 0.94 -0.03 3.60 0.00 -0.97 -1.32 119.26 122.82 2gkp h ALA 154 Ca 0.33 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 2gkp h ALA 154 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2gkp h ALA 154 CO -0.11 0.35 -0.57 0.78 0.00 0.00 0.00 179.25 179.70 2gkp h GLY 155 N 1.00 0.11 0.92 0.00 0.00 -0.52 -1.07 103.07 103.51 2gkp h GLY 155 Ca 0.27 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.44 2gkp h GLY 155 CO -0.06 0.12 0.11 1.41 0.00 0.00 0.00 176.54 178.11 2gkp h LEU 156 N 0.08 0.53 -0.94 3.11 3.38 -0.48 -0.69 115.31 120.31 2gkp h LEU 156 Ca -0.00 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 2gkp h LEU 156 Cb 1.02 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 2gkp h LEU 156 CO 0.08 0.61 -0.05 0.11 0.09 0.00 0.00 178.44 179.28 2gkp h LYS 157 N 0.44 0.72 -0.31 1.13 1.57 -1.08 -0.53 116.57 118.51 2gkp h LYS 157 Ca 0.12 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2gkp h LYS 157 Cb 0.27 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2gkp h LYS 157 CO -0.00 0.77 0.15 1.25 -0.57 0.00 0.00 179.45 181.04 2gkp h LEU 158 N 0.67 0.41 -0.67 2.94 5.85 -1.00 -0.72 115.31 122.79 2gkp h LEU 158 Ca 0.13 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2gkp h LEU 158 Cb 0.49 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 2gkp h LEU 158 CO 0.03 0.42 0.23 0.00 -0.34 0.00 0.00 178.44 178.77 2gkp h ALA 159 N 1.00 0.87 -0.89 1.25 0.00 -0.75 -2.14 119.26 118.61 2gkp h ALA 159 Ca 0.11 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.87 2gkp h ALA 159 Cb 0.12 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 2gkp h ALA 159 CO -0.01 0.53 0.56 1.25 0.00 0.00 0.00 179.25 181.57 2gkp h LEU 160 N 0.96 0.89 -2.71 0.00 5.85 -0.84 -1.48 115.31 117.97 2gkp h LEU 160 Ca 0.22 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 2gkp h LEU 160 Cb 0.27 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 2gkp h LEU 160 CO -0.01 0.57 -0.01 0.77 -0.34 0.00 0.00 178.44 179.42 2gkp h SER 161 N 1.02 0.00 0.41 1.25 4.64 -0.48 -1.11 113.55 119.29 2gkp h SER 161 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 2gkp h SER 161 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2gkp h SER 161 CO -0.17 0.01 -0.33 0.54 -0.87 0.00 0.00 176.83 176.01 2gkp n ARG 162 N -3.25 0.40 -2.01 4.77 1.74 -0.57 -4.92 116.66 112.81 2gkp n ARG 162 Ca -0.03 -0.22 -0.34 0.00 -0.77 0.00 0.00 57.85 56.50 2gkp n ARG 162 Cb 0.10 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.07 2gkp n ARG 162 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11