#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gyc s GLN 2 N 0.00 3.40 0.14 2.12 -0.21 -1.26 -1.28 119.66 122.57 2gyc s GLN 2 Ca 0.00 1.72 0.06 0.00 0.02 0.00 0.00 55.36 57.17 2gyc s GLN 2 Cb 0.00 -4.22 -0.04 0.00 1.00 0.00 0.00 33.01 29.75 2gyc s GLN 2 CO 0.00 -1.78 -0.15 0.54 -2.12 0.00 0.00 175.29 171.79 2gyc s VAL 3 N 6.87 1.44 -0.41 1.09 0.11 -0.13 -2.37 120.40 127.00 2gyc s VAL 3 Ca 0.85 -1.80 -0.17 0.00 -2.93 0.00 0.00 61.98 57.94 2gyc s VAL 3 Cb -0.27 -1.63 0.02 0.00 -1.53 0.00 0.00 36.38 32.96 2gyc s VAL 3 CO 0.34 -0.42 0.40 -0.63 -3.33 0.00 0.00 175.10 171.46 2gyc s ILE 4 N -2.21 5.13 -0.13 7.04 1.01 0.11 -0.89 121.20 131.26 2gyc s ILE 4 Ca 0.11 -0.34 -0.29 0.00 0.00 0.00 0.00 60.65 60.13 2gyc s ILE 4 Cb -0.05 -3.99 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 2gyc s ILE 4 CO 0.04 -0.36 1.21 -0.76 0.00 0.00 0.00 174.94 175.07 2gyc s LEU 5 N 2.05 4.21 -0.02 2.97 1.43 -0.53 -1.64 118.68 127.15 2gyc s LEU 5 Ca 0.11 1.70 0.04 0.00 -1.03 0.00 0.00 54.13 54.95 2gyc s LEU 5 Cb -0.17 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.44 2gyc s LEU 5 CO 0.13 -0.67 0.06 0.18 0.23 0.00 0.00 176.35 176.28 2gyc n LEU 6 N 5.96 0.00 0.00 1.79 4.77 -1.08 -4.19 117.00 124.26 2gyc n LEU 6 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2gyc n LEU 6 Cb 0.46 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2gyc n LEU 6 CO 0.55 0.04 0.00 0.47 -1.33 0.00 0.00 177.39 177.12 2gyc n ASP 7 N -1.83 0.00 -4.60 -1.43 9.92 -1.09 -1.83 116.55 115.68 2gyc n ASP 7 Ca -0.03 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.81 2gyc n ASP 7 Cb 0.31 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.74 2gyc n ASP 7 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2gyc s LYS 8 N 0.20 3.87 0.09 -1.24 2.20 -1.26 -3.13 119.74 120.47 2gyc s LYS 8 Ca 0.00 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 56.16 2gyc s LYS 8 Cb 0.00 -3.78 0.00 0.00 -1.51 0.00 0.00 37.83 32.54 2gyc s LYS 8 CO 0.00 -0.84 0.00 0.28 -0.36 0.00 0.00 175.35 174.43 2gyc n VAL 9 N 5.78 0.00 -2.76 4.02 0.31 -1.26 -4.98 118.33 119.45 2gyc n VAL 9 Ca 0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.29 2gyc n VAL 9 Cb 0.48 -0.18 0.07 0.00 -0.91 0.00 0.00 33.84 33.30 2gyc n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gyc n ALA 10 N -2.71 -0.91 0.00 3.52 0.00 -1.26 -4.95 120.51 114.20 2gyc n ALA 10 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 53.44 51.93 2gyc n ALA 10 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.23 2gyc n ALA 10 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gyc n ASN 11 N 0.85 0.00 -3.73 0.00 3.02 -1.26 -4.74 115.26 109.39 2gyc n ASN 11 Ca 0.08 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.50 2gyc n ASN 11 Cb 0.67 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.73 2gyc n ASN 11 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2gyc s LEU 12 N 0.00 0.44 -0.16 3.41 2.01 -1.26 -4.82 118.68 118.30 2gyc s LEU 12 Ca 0.00 0.76 0.23 0.00 0.01 0.00 0.00 54.13 55.13 2gyc s LEU 12 Cb 0.00 1.25 0.47 0.00 0.01 0.00 0.00 46.19 47.92 2gyc s LEU 12 CO 0.00 -0.14 1.14 0.61 1.01 0.00 0.00 176.35 178.97 2gyc n GLY 13 N 3.26 1.88 1.62 -3.19 0.00 -0.76 -4.79 105.19 103.21 2gyc n GLY 13 Ca -0.16 -1.08 -0.03 0.00 0.00 0.00 0.00 46.02 44.75 2gyc n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gyc n SER 14 N -0.21 5.35 0.00 1.61 3.41 -1.07 -3.64 113.62 119.07 2gyc n SER 14 Ca 0.09 -2.44 0.00 0.00 -0.26 0.00 0.00 58.87 56.26 2gyc n SER 14 Cb 0.94 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2gyc n SER 14 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2gyc n LEU 15 N 1.69 0.00 0.00 1.04 7.99 -1.26 -5.08 117.00 121.38 2gyc n LEU 15 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.10 2gyc n LEU 15 Cb 0.59 -0.07 0.00 0.00 -0.11 0.00 0.00 43.42 43.83 2gyc n LEU 15 CO 0.03 -0.14 0.00 0.61 -1.51 0.00 0.00 177.39 176.38 2gyc n GLY 16 N 3.07 -1.92 3.28 -0.72 0.00 -1.26 -4.94 105.19 102.70 2gyc n GLY 16 Ca 0.00 0.91 -0.45 0.00 0.00 0.00 0.00 46.02 46.49 2gyc n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gyc s ASP 17 N 0.00 6.27 -0.18 1.61 1.01 -1.26 -5.02 116.67 119.10 2gyc s ASP 17 Ca 0.00 -2.32 -0.27 0.00 0.71 0.00 0.00 52.55 50.67 2gyc s ASP 17 Cb 0.00 -2.14 -0.01 0.00 1.01 0.00 0.00 42.92 41.78 2gyc s ASP 17 CO 0.00 -0.66 0.90 0.00 0.21 0.00 0.00 175.17 175.62 2gyc s GLN 18 N 0.75 4.30 -0.02 8.23 0.00 -1.26 -1.45 119.66 130.20 2gyc s GLN 18 Ca 0.11 1.13 -0.02 0.00 -0.00 0.00 0.00 55.36 56.59 2gyc s GLN 18 Cb -0.20 -3.59 0.01 0.00 0.00 0.00 0.00 33.01 29.23 2gyc s GLN 18 CO -0.04 -0.41 0.06 0.08 0.00 0.00 0.00 175.29 174.98 2gyc s VAL 19 N 2.42 -0.01 -0.44 3.63 1.01 -0.07 -4.93 120.40 122.01 2gyc s VAL 19 Ca 0.41 0.05 -0.27 0.00 0.00 0.00 0.00 61.98 62.16 2gyc s VAL 19 Cb -0.16 -0.09 0.03 0.00 0.00 0.00 0.00 36.38 36.15 2gyc s VAL 19 CO 0.11 0.02 1.02 0.54 0.00 0.00 0.00 175.10 176.80 2gyc s ASN 20 N 0.28 6.62 0.00 3.32 4.22 -1.26 -0.96 114.94 127.16 2gyc s ASN 20 Ca -0.02 0.41 0.00 0.00 -2.14 0.00 0.00 52.86 51.11 2gyc s ASN 20 Cb -0.03 -2.50 0.00 0.00 1.28 0.00 0.00 41.25 40.00 2gyc s ASN 20 CO -0.01 -1.09 0.00 1.33 -2.04 0.00 0.00 177.10 175.30 2gyc n VAL 21 N 6.47 0.00 -2.46 3.54 0.24 -0.40 -4.72 118.33 121.00 2gyc n VAL 21 Ca 0.09 0.00 -0.40 0.00 -2.04 0.00 0.00 64.34 61.99 2gyc n VAL 21 Cb 0.48 -0.59 -0.04 0.00 -1.47 0.00 0.00 33.84 32.23 2gyc n VAL 21 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2gyc s LYS 22 N -0.42 4.61 0.20 7.34 1.02 -1.26 -2.27 119.74 128.95 2gyc s LYS 22 Ca 0.00 1.82 -0.28 0.00 0.02 0.00 0.00 55.97 57.53 2gyc s LYS 22 Cb 0.00 -3.20 -0.08 0.00 -0.52 0.00 0.00 37.83 34.02 2gyc s LYS 22 CO 0.00 0.14 0.87 0.00 -0.92 0.00 0.00 175.35 175.45 2gyc s ALA 23 N -0.90 3.38 0.00 5.17 0.00 -1.26 -3.31 121.76 124.84 2gyc s ALA 23 Ca 0.46 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2gyc s ALA 23 Cb -0.32 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 19.69 2gyc s ALA 23 CO 0.40 0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.81 2gyc n GLY 24 N 1.56 2.13 0.15 0.00 0.00 -1.26 -4.68 105.19 103.11 2gyc n GLY 24 Ca -0.03 -0.01 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 2gyc n GLY 24 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2gyc h TYR 25 N 0.00 0.29 0.10 1.61 3.20 -1.99 -3.05 116.97 117.14 2gyc h TYR 25 Ca 0.00 -0.13 -0.28 0.00 3.14 0.00 0.00 58.73 61.46 2gyc h TYR 25 Cb 0.00 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 2gyc h TYR 25 CO 0.00 0.85 -1.35 0.00 -1.64 0.00 0.00 178.16 176.01 2gyc h ALA 26 N 1.12 0.23 0.00 1.82 0.00 -1.82 -2.71 119.26 117.90 2gyc h ALA 26 Ca -0.02 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 53.88 2gyc h ALA 26 Cb 1.25 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2gyc h ALA 26 CO 0.11 1.11 0.00 0.54 0.00 0.00 0.00 179.25 181.01 2gyc n ARG 27 N -3.45 0.65 -0.01 0.00 5.12 -1.21 -0.72 116.66 117.04 2gyc n ARG 27 Ca -0.11 0.01 0.00 0.00 -1.93 0.00 0.00 57.85 55.82 2gyc n ARG 27 Cb 1.02 -1.50 -0.03 0.00 -1.16 0.00 0.00 32.46 30.80 2gyc n ARG 27 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2gyc n ASN 28 N -1.03 4.21 0.00 0.55 2.85 -1.16 -4.66 115.26 116.03 2gyc n ASN 28 Ca 0.16 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.63 2gyc n ASN 28 Cb 0.09 0.87 0.00 0.00 1.24 0.00 0.00 39.78 41.98 2gyc n ASN 28 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 2gyc n PHE 29 N -1.87 0.00 -0.35 1.20 3.72 -1.02 -4.60 117.46 114.53 2gyc n PHE 29 Ca -0.03 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.30 2gyc n PHE 29 Cb 0.35 0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 38.85 2gyc n PHE 29 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2gyc n LEU 30 N -1.35 -0.81 0.17 4.37 4.32 -1.04 0.00 117.00 122.67 2gyc n LEU 30 Ca 0.00 1.53 -0.14 0.00 -0.02 0.00 0.00 56.01 57.38 2gyc n LEU 30 Cb 0.00 -0.24 -0.08 0.00 -1.62 0.00 0.00 43.42 41.48 2gyc n LEU 30 CO 0.00 -1.28 0.59 0.58 -1.22 0.00 0.00 177.39 176.05 2gyc h VAL 31 N 0.00 0.70 -0.46 4.08 2.07 -1.11 0.36 116.25 121.89 2gyc h VAL 31 Ca 0.19 -0.49 0.08 0.00 0.82 0.00 0.00 66.70 67.29 2gyc h VAL 31 Cb 0.40 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 31.06 2gyc h VAL 31 CO -0.83 0.10 0.08 -0.65 0.02 0.00 0.00 177.57 176.29 2gyc h PRO 32 N -0.71 0.20 0.00 1.57 0.11 -1.54 0.18 132.00 131.81 2gyc h PRO 32 Ca -0.04 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2gyc h PRO 32 Cb 0.49 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.55 2gyc h PRO 32 CO 0.07 0.13 0.00 0.00 -0.21 0.00 0.00 178.00 177.99 2gyc n GLN 33 N -5.12 0.19 -2.44 1.05 10.64 0.10 -4.93 117.38 116.87 2gyc n GLN 33 Ca 0.04 0.10 -0.01 0.00 -1.83 0.00 0.00 57.00 55.30 2gyc n GLN 33 Cb 0.22 -1.50 0.01 0.00 -0.86 0.00 0.00 30.24 28.11 2gyc n GLN 33 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2gyc n GLY 34 N 0.66 -0.77 0.00 2.61 0.00 0.05 -5.00 105.19 102.75 2gyc n GLY 34 Ca 0.08 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2gyc n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2gyc n LYS 35 N -1.63 2.26 -3.63 1.61 4.81 0.12 -4.93 118.16 116.77 2gyc n LYS 35 Ca -0.01 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.32 2gyc n LYS 35 Cb 0.51 -0.89 -0.05 0.00 0.02 0.00 0.00 35.03 34.62 2gyc n LYS 35 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2gyc s ALA 36 N -1.68 -0.95 -0.04 3.14 0.00 -1.22 -2.62 121.76 118.38 2gyc s ALA 36 Ca 0.00 0.02 0.03 0.00 0.00 0.00 0.00 51.96 52.01 2gyc s ALA 36 Cb 0.00 0.64 0.01 0.00 0.00 0.00 0.00 23.12 23.76 2gyc s ALA 36 CO 0.00 -0.61 -0.12 0.08 0.00 0.00 0.00 175.76 175.10 2gyc s VAL 37 N -3.59 1.08 0.38 0.00 1.01 -0.65 -4.30 120.40 114.33 2gyc s VAL 37 Ca 0.02 -0.49 -0.25 0.00 0.00 0.00 0.00 61.98 61.26 2gyc s VAL 37 Cb 0.01 -0.96 -0.12 0.00 0.00 0.00 0.00 36.38 35.31 2gyc s VAL 37 CO -0.10 0.33 0.80 -2.65 0.00 0.00 0.00 175.10 173.47 2gyc n PRO 38 N 3.46 0.95 -3.36 2.72 -0.02 -1.26 0.09 135.00 137.58 2gyc n PRO 38 Ca -0.20 0.34 -0.46 0.00 -2.02 0.00 0.00 63.50 61.16 2gyc n PRO 38 Cb 0.53 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.26 2gyc n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gyc s ALA 39 N -1.28 3.98 0.00 3.55 0.00 -1.00 -4.67 121.76 122.34 2gyc s ALA 39 Ca 0.62 -3.20 0.00 0.00 0.00 0.00 0.00 51.96 49.38 2gyc s ALA 39 Cb -0.63 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.08 2gyc s ALA 39 CO 0.58 -2.23 0.00 0.25 0.00 0.00 0.00 175.76 174.36 2gyc n THR 40 N 4.12 0.00 -0.02 0.00 -2.24 -1.26 -4.93 114.28 109.95 2gyc n THR 40 Ca 0.09 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.92 2gyc n THR 40 Cb 0.45 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.54 2gyc n THR 40 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2gyc n LYS 41 N 0.00 0.66 0.09 -0.78 5.02 -1.26 -4.03 118.16 117.87 2gyc n LYS 41 Ca 0.00 -0.09 -0.22 0.00 -2.02 0.00 0.00 58.31 55.97 2gyc n LYS 41 Cb 0.00 -1.57 -0.14 0.00 -0.02 0.00 0.00 35.03 33.31 2gyc n LYS 41 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2gyc h LYS 42 N 0.00 0.57 0.11 1.97 6.56 -2.05 -2.95 116.57 120.78 2gyc h LYS 42 Ca -0.15 -0.81 -0.01 0.00 -1.06 0.00 0.00 60.65 58.63 2gyc h LYS 42 Cb 1.36 0.27 0.00 0.00 -0.57 0.00 0.00 32.23 33.30 2gyc h LYS 42 CO 0.01 1.37 -0.05 -0.91 -2.06 0.00 0.00 179.45 177.81 2gyc h ASN 43 N 0.17 -0.13 -0.22 0.86 4.21 -1.99 -0.64 115.58 117.85 2gyc h ASN 43 Ca -0.19 -0.26 0.06 0.00 1.21 0.00 0.00 56.30 57.12 2gyc h ASN 43 Cb 1.91 0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 39.13 2gyc h ASN 43 CO 0.23 0.20 0.18 -0.29 -1.29 0.00 0.00 177.43 176.46 2gyc h ILE 44 N -0.46 0.74 0.00 2.81 6.09 -1.70 0.42 117.51 125.40 2gyc h ILE 44 Ca -0.02 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.47 2gyc h ILE 44 Cb 0.38 0.87 0.00 0.00 0.47 0.00 0.00 36.82 38.54 2gyc h ILE 44 CO 0.03 0.00 -0.32 -0.08 -3.07 0.00 0.00 178.15 174.70 2gyc h GLU 45 N 0.00 0.00 0.00 2.19 4.81 -1.31 -2.84 114.58 117.43 2gyc h GLU 45 Ca 0.10 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.23 2gyc h GLU 45 Cb 0.46 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 2gyc h GLU 45 CO -0.00 0.00 -0.66 0.35 -0.73 0.00 0.00 179.01 177.97 2gyc h PHE 46 N 0.00 0.00 -0.14 0.92 3.04 0.13 -3.25 116.94 117.64 2gyc h PHE 46 Ca 0.00 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.93 2gyc h PHE 46 Cb 0.94 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.45 2gyc h PHE 46 CO 0.00 0.94 0.01 0.74 -2.02 0.00 0.00 178.31 177.99 2gyc h PHE 47 N -1.00 0.26 0.00 0.41 -1.00 -0.94 -2.51 116.94 112.16 2gyc h PHE 47 Ca -0.16 -0.04 -0.00 0.00 2.81 0.00 0.00 57.97 60.58 2gyc h PHE 47 Cb 0.95 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 40.44 2gyc h PHE 47 CO 0.08 0.44 -0.01 0.93 -1.61 0.00 0.00 178.31 178.14 2gyc h GLU 48 N -0.00 0.00 -0.01 1.51 4.39 -1.71 0.77 114.58 119.53 2gyc h GLU 48 Ca 0.04 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.66 2gyc h GLU 48 Cb 0.33 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2gyc h GLU 48 CO 0.00 0.01 -0.39 0.00 -1.16 0.00 0.00 179.01 177.47 2gyc h ALA 49 N 1.99 1.34 -0.04 3.43 0.00 -1.48 -2.23 119.26 122.27 2gyc h ALA 49 Ca -0.00 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 2gyc h ALA 49 Cb 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2gyc h ALA 49 CO 0.00 0.50 -0.26 0.00 0.00 0.00 0.00 179.25 179.49 2gyc h ARG 50 N 0.01 0.07 0.41 0.00 3.08 -0.81 -0.24 114.38 116.90 2gyc h ARG 50 Ca -0.00 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2gyc h ARG 50 Cb 0.70 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.75 2gyc h ARG 50 CO 0.05 0.33 -0.20 0.00 -1.07 0.00 0.00 179.97 179.08 2gyc h ARG 51 N 0.06 -0.53 -0.68 0.04 3.08 -1.44 0.37 114.38 115.28 2gyc h ARG 51 Ca 0.01 0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 2gyc h ARG 51 Cb 0.50 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.64 2gyc h ARG 51 CO 0.04 -0.29 0.33 0.00 -1.07 0.00 0.00 179.97 178.97 2gyc h ALA 52 N -0.13 0.88 -0.23 0.04 0.00 -1.49 -2.08 119.26 116.25 2gyc h ALA 52 Ca -0.06 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2gyc h ALA 52 Cb 0.49 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2gyc h ALA 52 CO 0.09 0.45 -0.12 1.49 0.00 0.00 0.00 179.25 181.16 2gyc h GLU 53 N 0.95 0.37 -0.31 0.00 4.81 -0.92 0.49 114.58 119.97 2gyc h GLU 53 Ca 0.23 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 2gyc h GLU 53 Cb 0.12 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2gyc h GLU 53 CO -0.03 0.50 0.04 1.25 -0.73 0.00 0.00 179.01 180.03 2gyc h LEU 54 N 0.35 0.51 -0.03 1.64 5.85 0.36 0.59 115.31 124.58 2gyc h LEU 54 Ca 0.07 -0.27 -0.10 0.00 0.84 0.00 0.00 57.88 58.42 2gyc h LEU 54 Cb 0.42 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2gyc h LEU 54 CO 0.02 0.65 -0.45 1.05 -0.34 0.00 0.00 178.44 179.38 2gyc h GLU 55 N 0.34 0.00 0.25 1.25 4.11 -1.11 -2.63 114.58 116.79 2gyc h GLU 55 Ca 0.09 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.51 2gyc h GLU 55 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2gyc h GLU 55 CO 0.01 0.45 -0.12 0.00 0.07 0.00 0.00 179.01 179.42 2gyc h ALA 56 N 1.55 -0.34 0.00 1.06 0.00 0.16 -3.15 119.26 118.54 2gyc h ALA 56 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2gyc h ALA 56 Cb 1.34 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 2gyc h ALA 56 CO 0.06 -0.38 -0.05 0.87 0.00 0.00 0.00 179.25 179.75 2gyc h LYS 57 N -0.96 0.00 -6.72 0.00 1.79 -0.99 -3.48 116.57 106.20 2gyc h LYS 57 Ca -0.03 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.93 2gyc h LYS 57 Cb 0.48 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 2gyc h LYS 57 CO 0.06 0.05 0.45 -1.17 -1.08 0.00 0.00 179.45 177.75 2gyc s LEU 58 N -6.98 4.54 0.00 2.94 2.96 -0.99 -4.60 118.68 116.55 2gyc s LEU 58 Ca -0.04 2.11 0.00 0.00 -0.22 0.00 0.00 54.13 55.98 2gyc s LEU 58 Cb 0.13 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 43.21 2gyc s LEU 58 CO 0.52 -0.12 0.00 0.00 -1.32 0.00 0.00 176.35 175.44 2gyc n ALA 59 N 1.84 0.00 -0.28 5.97 0.00 -1.26 -5.01 120.51 121.76 2gyc n ALA 59 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 2gyc n ALA 59 Cb 0.46 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.97 2gyc n ALA 59 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2gyc h GLU 60 N 0.00 1.18 0.00 0.00 4.39 -1.99 0.55 114.58 118.72 2gyc h GLU 60 Ca 0.00 -0.23 -0.11 0.00 0.34 0.00 0.00 59.36 59.36 2gyc h GLU 60 Cb 0.00 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 2gyc h GLU 60 CO 0.00 0.98 -0.52 -0.39 -1.16 0.00 0.00 179.01 177.92 2gyc h VAL 61 N 1.14 0.97 0.00 3.13 -1.51 -1.95 -2.34 116.25 115.70 2gyc h VAL 61 Ca 0.25 -2.11 -0.03 0.00 -1.23 0.00 0.00 66.70 63.58 2gyc h VAL 61 Cb 0.27 2.30 -0.00 0.00 -2.13 0.00 0.00 31.29 31.72 2gyc h VAL 61 CO -0.01 0.51 -0.18 -0.07 -1.23 0.00 0.00 177.57 176.58 2gyc h LEU 62 N 0.00 0.00 -0.93 4.19 4.07 -1.89 -2.49 115.31 118.26 2gyc h LEU 62 Ca -0.01 -0.76 0.06 0.00 0.08 0.00 0.00 57.88 57.25 2gyc h LEU 62 Cb 1.26 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.93 2gyc h LEU 62 CO 0.07 0.99 0.59 0.00 -1.08 0.00 0.00 178.44 179.01 2gyc h ALA 63 N -0.24 1.28 -0.05 1.53 0.00 0.00 0.13 119.26 121.91 2gyc h ALA 63 Ca -0.05 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2gyc h ALA 63 Cb 0.89 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2gyc h ALA 63 CO -0.03 0.37 -0.53 0.00 0.00 0.00 0.00 179.25 179.07 2gyc h ALA 64 N 1.42 1.03 -0.01 0.00 0.00 -1.55 -2.00 119.26 118.15 2gyc h ALA 64 Ca 0.40 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2gyc h ALA 64 Cb 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2gyc h ALA 64 CO -0.17 0.67 -0.01 0.00 0.00 0.00 0.00 179.25 179.75 2gyc h ALA 65 N 1.36 0.02 -0.90 0.00 0.00 -0.61 1.00 119.26 120.13 2gyc h ALA 65 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2gyc h ALA 65 Cb 0.97 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 2gyc h ALA 65 CO 0.08 -0.25 0.56 -0.91 0.00 0.00 0.00 179.25 178.73 2gyc h ASN 66 N -0.39 1.06 0.25 0.00 2.35 -0.80 0.37 115.58 118.42 2gyc h ASN 66 Ca 0.00 -0.05 -0.11 0.00 -0.55 0.00 0.00 56.30 55.59 2gyc h ASN 66 Cb 0.44 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 2gyc h ASN 66 CO 0.00 0.80 -0.45 0.00 -1.65 0.00 0.00 177.43 176.13 2gyc h ALA 67 N 1.31 1.05 -0.17 -0.83 0.00 -1.32 0.25 119.26 119.55 2gyc h ALA 67 Ca 0.33 -0.44 -0.21 0.00 0.00 0.00 0.00 54.91 54.58 2gyc h ALA 67 Cb -0.09 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.62 2gyc h ALA 67 CO -0.06 0.62 -0.73 -0.09 0.00 0.00 0.00 179.25 178.98 2gyc h ARG 68 N 0.20 0.79 -0.23 0.00 9.65 0.17 -2.89 114.38 122.08 2gyc h ARG 68 Ca 0.01 -0.63 -0.14 0.00 -1.10 0.00 0.00 59.98 58.12 2gyc h ARG 68 Cb 0.88 0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 29.57 2gyc h ARG 68 CO 0.07 1.24 -0.44 0.00 2.80 0.00 0.00 179.97 183.64 2gyc h ALA 69 N 0.56 0.79 0.00 2.80 0.00 -0.15 -2.58 119.26 120.69 2gyc h ALA 69 Ca -0.04 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 2gyc h ALA 69 Cb 1.36 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2gyc h ALA 69 CO 0.15 0.66 -0.10 1.49 0.00 0.00 0.00 179.25 181.45 2gyc h GLU 70 N 0.47 0.00 0.00 0.00 4.81 -0.92 -0.33 114.58 118.60 2gyc h GLU 70 Ca 0.03 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.17 2gyc h GLU 70 Cb 0.96 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 2gyc h GLU 70 CO 0.09 0.10 -0.44 -0.22 -0.73 0.00 0.00 179.01 177.81 2gyc h LYS 71 N 0.00 0.00 0.00 1.92 3.64 -1.24 -3.10 116.57 117.78 2gyc h LYS 71 Ca -0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 2gyc h LYS 71 Cb 0.24 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 2gyc h LYS 71 CO 0.01 0.44 -0.29 0.82 -2.27 0.00 0.00 179.45 178.16 2gyc h ILE 72 N 0.00 1.15 0.00 2.00 1.08 -0.86 -1.62 117.51 119.26 2gyc h ILE 72 Ca -0.00 -1.03 0.00 0.00 -0.39 0.00 0.00 64.86 63.44 2gyc h ILE 72 Cb 1.26 1.56 0.00 0.00 -3.07 0.00 0.00 36.82 36.58 2gyc h ILE 72 CO 0.06 0.29 0.00 0.59 -0.69 0.00 0.00 178.15 178.40 2gyc n ASN 73 N -4.10 0.10 -0.00 1.72 3.02 -1.17 -0.95 115.26 113.88 2gyc n ASN 73 Ca -0.02 -1.11 0.01 0.00 -0.03 0.00 0.00 54.58 53.43 2gyc n ASN 73 Cb 0.35 -0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.45 2gyc n ASN 73 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gyc n ALA 74 N -0.37 2.27 -0.12 5.41 0.00 -0.61 -4.69 120.51 122.39 2gyc n ALA 74 Ca 0.00 -0.07 -0.24 0.00 0.00 0.00 0.00 53.44 53.13 2gyc n ALA 74 Cb 0.03 -0.09 -0.11 0.00 0.00 0.00 0.00 19.45 19.27 2gyc n ALA 74 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2gyc n LEU 75 N -1.21 2.41 -1.01 0.00 4.77 -0.12 -5.12 117.00 116.72 2gyc n LEU 75 Ca 0.00 0.14 0.05 0.00 -0.03 0.00 0.00 56.01 56.17 2gyc n LEU 75 Cb 0.05 -0.89 -0.03 0.00 -2.33 0.00 0.00 43.42 40.23 2gyc n LEU 75 CO 0.05 0.72 -0.37 -0.62 -1.33 0.00 0.00 177.39 175.85 2gyc n GLU 76 N -3.81 -2.54 -1.23 3.23 4.71 -0.82 -5.05 120.64 115.13 2gyc n GLU 76 Ca -0.48 2.01 0.04 0.00 -0.01 0.00 0.00 57.16 58.71 2gyc n GLU 76 Cb 0.93 -2.64 -0.02 0.00 -1.01 0.00 0.00 31.44 28.70 2gyc n GLU 76 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2gyc n THR 77 N -2.76 -1.23 -2.93 2.62 -2.24 -1.26 -4.98 114.28 101.50 2gyc n THR 77 Ca -0.03 0.72 -0.14 0.00 -2.27 0.00 0.00 64.05 62.33 2gyc n THR 77 Cb 0.38 -1.16 -0.00 0.00 -2.10 0.00 0.00 70.33 67.44 2gyc n THR 77 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2gyc n VAL 78 N -2.90 -0.30 -1.49 2.28 0.31 -1.24 -5.01 118.33 109.99 2gyc n VAL 78 Ca -0.02 -2.47 -0.49 0.00 -0.01 0.00 0.00 64.34 61.35 2gyc n VAL 78 Cb 0.32 0.09 -0.04 0.00 -0.91 0.00 0.00 33.84 33.30 2gyc n VAL 78 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2gyc n THR 79 N 1.67 1.45 -3.66 2.52 5.66 -1.26 -3.76 114.28 116.90 2gyc n THR 79 Ca 0.15 -0.36 -0.19 0.00 -3.05 0.00 0.00 64.05 60.60 2gyc n THR 79 Cb 0.58 -0.37 -0.16 0.00 -1.55 0.00 0.00 70.33 68.83 2gyc n THR 79 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2gyc s ILE 80 N -0.68 -0.20 0.04 1.09 -1.09 0.11 -4.92 121.20 115.55 2gyc s ILE 80 Ca 0.69 0.32 -0.09 0.00 -2.23 0.00 0.00 60.65 59.34 2gyc s ILE 80 Cb -0.92 -0.28 -0.05 0.00 -1.58 0.00 0.00 42.46 39.62 2gyc s ILE 80 CO 0.56 0.11 0.35 0.00 -1.23 0.00 0.00 174.94 174.73 2gyc s ALA 81 N 2.24 3.76 -0.08 9.38 0.00 -1.26 -0.04 121.76 135.75 2gyc s ALA 81 Ca 0.04 -0.42 -0.30 0.00 0.00 0.00 0.00 51.96 51.27 2gyc s ALA 81 Cb -0.12 -2.21 0.08 0.00 0.00 0.00 0.00 23.12 20.86 2gyc s ALA 81 CO -0.05 0.58 0.72 -1.12 0.00 0.00 0.00 175.76 175.89 2gyc s SER 82 N -1.60 -0.63 0.36 0.00 0.01 -1.04 -4.94 113.70 105.85 2gyc s SER 82 Ca 0.29 0.75 -0.27 0.00 1.31 0.00 0.00 55.95 58.03 2gyc s SER 82 Cb -0.14 0.60 -0.12 0.00 0.21 0.00 0.00 66.02 66.57 2gyc s SER 82 CO 0.16 -0.55 1.19 0.29 0.41 0.00 0.00 173.24 174.74 2gyc n LYS 83 N 1.06 1.82 -3.51 12.44 4.76 -1.26 -1.02 118.16 132.46 2gyc n LYS 83 Ca -0.18 0.64 -0.10 0.00 -2.87 0.00 0.00 58.31 55.80 2gyc n LYS 83 Cb 0.57 -2.20 -0.02 0.00 -1.84 0.00 0.00 35.03 31.54 2gyc n LYS 83 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2gyc s ALA 84 N -1.13 -1.57 0.00 7.82 0.00 -1.26 -3.22 121.76 122.40 2gyc s ALA 84 Ca 0.58 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2gyc s ALA 84 Cb -0.58 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.35 2gyc s ALA 84 CO 0.60 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.96 2gyc n GLY 85 N -0.38 0.00 2.36 0.00 0.00 -0.85 -4.77 105.19 101.55 2gyc n GLY 85 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 2gyc n GLY 85 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gyc n ASP 86 N 0.00 7.33 -3.53 1.61 8.00 -1.06 -4.56 116.55 124.33 2gyc n ASP 86 Ca 0.00 -2.48 -0.24 0.00 0.71 0.00 0.00 54.79 52.77 2gyc n ASP 86 Cb 0.00 -1.40 0.04 0.00 -0.02 0.00 0.00 41.12 39.74 2gyc n ASP 86 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2gyc n GLU 87 N 3.63 -1.46 0.00 -1.24 2.13 -1.26 -2.40 120.64 120.04 2gyc n GLU 87 Ca 0.65 0.67 0.00 0.00 0.66 0.00 0.00 57.16 59.15 2gyc n GLU 87 Cb 0.27 -4.54 0.00 0.00 0.27 0.00 0.00 31.44 27.44 2gyc n GLU 87 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2gyc n GLY 88 N -1.59 2.79 3.76 8.31 0.00 -1.26 -5.03 105.19 112.17 2gyc n GLY 88 Ca -0.09 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.89 2gyc n GLY 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gyc s LYS 89 N 0.00 1.75 0.31 1.61 -0.14 -1.01 -2.89 119.74 119.38 2gyc s LYS 89 Ca 0.00 0.79 0.08 0.00 -1.36 0.00 0.00 55.97 55.48 2gyc s LYS 89 Cb 0.00 -1.87 -0.03 0.00 -1.68 0.00 0.00 37.83 34.25 2gyc s LYS 89 CO 0.00 -1.89 0.21 -0.51 -0.76 0.00 0.00 175.35 172.40 2gyc s LEU 90 N -5.99 3.53 0.00 3.17 1.02 -0.96 -2.00 118.68 117.44 2gyc s LEU 90 Ca 0.62 -0.52 0.26 0.00 0.02 0.00 0.00 54.13 54.51 2gyc s LEU 90 Cb -0.16 -2.09 1.18 0.00 0.02 0.00 0.00 46.19 45.14 2gyc s LEU 90 CO 0.56 -0.24 1.86 0.49 0.02 0.00 0.00 176.35 179.04 2gyc n PHE 91 N -1.24 0.00 -0.33 0.29 3.72 -1.20 -4.87 117.46 113.84 2gyc n PHE 91 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 2gyc n PHE 91 Cb 0.60 -0.45 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2gyc n PHE 91 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gyc n GLY 92 N 1.17 5.59 3.56 1.37 0.00 -1.26 -5.12 105.19 110.50 2gyc n GLY 92 Ca 0.08 -0.91 -0.16 0.00 0.00 0.00 0.00 46.02 45.03 2gyc n GLY 92 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gyc s SER 93 N 1.04 -0.63 -0.74 1.61 1.04 -1.26 -4.87 113.70 109.88 2gyc s SER 93 Ca 0.00 0.84 -0.21 0.00 0.48 0.00 0.00 55.95 57.07 2gyc s SER 93 Cb 0.00 0.73 0.10 0.00 0.10 0.00 0.00 66.02 66.95 2gyc s SER 93 CO 0.00 -0.47 0.98 -0.63 0.98 0.00 0.00 173.24 174.10 2gyc s ILE 94 N -0.75 4.56 0.86 -1.02 -1.09 -1.24 -5.03 121.20 117.48 2gyc s ILE 94 Ca -0.07 -0.91 -0.12 0.00 -2.23 0.00 0.00 60.65 57.33 2gyc s ILE 94 Cb -0.01 -4.68 0.11 0.00 -1.58 0.00 0.00 42.46 36.29 2gyc s ILE 94 CO 0.06 -1.42 1.10 -0.83 -1.23 0.00 0.00 174.94 172.62 2gyc s GLY 95 N 3.64 1.62 0.26 6.18 0.00 -1.26 -4.76 107.32 113.00 2gyc s GLY 95 Ca 0.24 -0.16 -0.04 0.00 0.00 0.00 0.00 44.72 44.76 2gyc s GLY 95 CO 0.02 0.31 1.63 0.00 0.00 0.00 0.00 173.10 175.06 2gyc h THR 96 N -1.36 0.31 -0.40 0.90 1.03 -1.95 0.46 112.91 111.90 2gyc h THR 96 Ca -0.49 -0.04 0.09 0.00 -0.01 0.00 0.00 66.41 65.96 2gyc h THR 96 Cb 1.28 0.17 -0.02 0.00 -1.07 0.00 0.00 68.15 68.51 2gyc h THR 96 CO 0.57 0.02 0.28 0.03 -0.01 0.00 0.00 175.52 176.41 2gyc h ARG 97 N 0.13 0.14 -0.11 0.00 3.08 -1.92 -0.90 114.38 114.81 2gyc h ARG 97 Ca 0.47 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.40 2gyc h ARG 97 Cb 0.87 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.89 2gyc h ARG 97 CO -0.68 0.10 -0.34 -0.44 -1.07 0.00 0.00 179.97 177.53 2gyc h ASP 98 N 0.15 0.49 0.02 7.04 3.32 -0.42 -2.06 116.42 124.96 2gyc h ASP 98 Ca 0.19 -0.61 -0.00 0.00 0.02 0.00 0.00 57.03 56.63 2gyc h ASP 98 Cb 0.55 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2gyc h ASP 98 CO -0.03 1.01 -0.01 0.40 -1.72 0.00 0.00 179.24 178.90 2gyc h ILE 99 N -0.01 0.99 -0.43 0.35 5.03 -0.82 0.28 117.51 122.90 2gyc h ILE 99 Ca -0.01 -0.03 0.05 0.00 -0.12 0.00 0.00 64.86 64.75 2gyc h ILE 99 Cb 0.97 1.01 -0.04 0.00 -3.03 0.00 0.00 36.82 35.72 2gyc h ILE 99 CO 0.07 0.01 0.18 0.00 -0.68 0.00 0.00 178.15 177.73 2gyc h ALA 100 N 0.95 0.53 0.00 1.87 0.00 -1.26 0.85 119.26 122.20 2gyc h ALA 100 Ca -0.00 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2gyc h ALA 100 Cb 0.03 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2gyc h ALA 100 CO 0.00 -0.20 -0.11 0.22 0.00 0.00 0.00 179.25 179.17 2gyc h ASP 101 N 0.36 0.00 0.02 0.00 3.58 -1.14 -1.90 116.42 117.34 2gyc h ASP 101 Ca 0.20 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.46 2gyc h ASP 101 Cb 0.16 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 2gyc h ASP 101 CO -0.18 0.11 -1.02 0.00 -2.88 0.00 0.00 179.24 175.27 2gyc h ALA 102 N 1.89 0.20 -0.11 -0.78 0.00 0.73 -3.26 119.26 117.94 2gyc h ALA 102 Ca -0.00 -1.05 -0.05 0.00 0.00 0.00 0.00 54.91 53.81 2gyc h ALA 102 Cb 0.67 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2gyc h ALA 102 CO 0.01 0.58 -0.16 0.28 0.00 0.00 0.00 179.25 179.96 2gyc h VAL 103 N -0.90 1.18 0.00 0.00 2.07 0.64 -2.09 116.25 117.14 2gyc h VAL 103 Ca -0.27 -0.81 -0.11 0.00 0.82 0.00 0.00 66.70 66.34 2gyc h VAL 103 Cb 1.30 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 2gyc h VAL 103 CO -0.13 0.25 -0.50 0.00 0.02 0.00 0.00 177.57 177.20 2gyc h THR 104 N 0.17 1.32 0.00 2.57 1.03 -1.39 -2.21 112.91 114.40 2gyc h THR 104 Ca 0.03 -1.74 0.00 0.00 -0.01 0.00 0.00 66.41 64.69 2gyc h THR 104 Cb 0.40 1.95 0.00 0.00 -1.07 0.00 0.00 68.15 69.42 2gyc h THR 104 CO 0.03 0.49 0.00 0.00 -0.01 0.00 0.00 175.52 176.03 2gyc n ALA 105 N -2.43 1.79 0.05 0.00 0.00 -0.79 -2.81 120.51 116.32 2gyc n ALA 105 Ca -0.01 -0.03 -0.21 0.00 0.00 0.00 0.00 53.44 53.19 2gyc n ALA 105 Cb 0.52 -1.31 -0.15 0.00 0.00 0.00 0.00 19.45 18.52 2gyc n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gyc h ALA 106 N 2.53 -0.06 0.00 0.00 0.00 -1.36 -3.48 119.26 116.90 2gyc h ALA 106 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2gyc h ALA 106 Cb 0.33 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2gyc h ALA 106 CO 0.00 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.13 2gyc n GLY 107 N 1.68 0.00 2.83 0.00 0.00 -1.12 -5.15 105.19 103.43 2gyc n GLY 107 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 2gyc n GLY 107 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gyc s VAL 108 N 0.00 -0.04 -0.51 1.61 -7.23 -1.24 -5.08 120.40 107.91 2gyc s VAL 108 Ca 0.00 0.14 -0.24 0.00 -1.81 0.00 0.00 61.98 60.07 2gyc s VAL 108 Cb 0.00 -0.09 0.04 0.00 0.56 0.00 0.00 36.38 36.89 2gyc s VAL 108 CO 0.00 0.06 0.90 -1.61 -0.31 0.00 0.00 175.10 174.14 2gyc s GLU 109 N 0.73 3.39 -0.02 4.82 0.41 -1.26 -3.56 118.70 123.20 2gyc s GLU 109 Ca -0.06 -0.15 0.01 0.00 -0.41 0.00 0.00 54.97 54.36 2gyc s GLU 109 Cb -0.08 -4.00 0.01 0.00 -1.78 0.00 0.00 34.13 28.27 2gyc s GLU 109 CO -0.02 -1.35 -0.05 0.54 -0.49 0.00 0.00 175.26 173.89 2gyc s VAL 110 N 3.74 0.45 0.74 2.63 0.11 -1.26 -5.09 120.40 121.71 2gyc s VAL 110 Ca 0.31 -0.16 -0.07 0.00 -2.93 0.00 0.00 61.98 59.13 2gyc s VAL 110 Cb -0.12 -0.43 0.09 0.00 -1.53 0.00 0.00 36.38 34.39 2gyc s VAL 110 CO 0.21 0.16 1.04 0.00 -3.33 0.00 0.00 175.10 173.19 2gyc s ALA 111 N 0.36 3.15 0.15 1.54 0.00 -1.26 -4.79 121.76 120.91 2gyc s ALA 111 Ca -0.04 -1.10 0.14 0.00 0.00 0.00 0.00 51.96 50.96 2gyc s ALA 111 Cb -0.08 -2.51 0.40 0.00 0.00 0.00 0.00 23.12 20.93 2gyc s ALA 111 CO -0.00 -1.46 1.61 1.57 0.00 0.00 0.00 175.76 177.48 2gyc h LYS 112 N -0.70 0.00 0.00 0.00 2.10 -1.95 -3.00 116.57 113.02 2gyc h LYS 112 Ca -0.43 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.14 2gyc h LYS 112 Cb 1.30 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.62 2gyc h LYS 112 CO 0.54 0.54 -0.36 0.77 -2.00 0.00 0.00 179.45 178.94 2gyc h SER 113 N 0.00 0.00 0.90 7.07 0.02 -1.96 -2.13 113.55 117.45 2gyc h SER 113 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2gyc h SER 113 Cb 1.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.66 2gyc h SER 113 CO 0.07 0.36 0.00 -0.62 -1.14 0.00 0.00 176.83 175.50 2gyc n GLU 114 N -3.79 0.10 -3.00 3.45 1.02 -1.13 -4.55 120.64 112.74 2gyc n GLU 114 Ca -0.01 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.69 2gyc n GLU 114 Cb 0.44 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.33 2gyc n GLU 114 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2gyc s VAL 115 N -2.90 4.79 -0.66 2.62 1.01 -0.80 0.36 120.40 124.81 2gyc s VAL 115 Ca 0.17 -1.39 -0.26 0.00 0.00 0.00 0.00 61.98 60.50 2gyc s VAL 115 Cb 0.19 -4.67 -0.02 0.00 0.00 0.00 0.00 36.38 31.87 2gyc s VAL 115 CO 0.51 -1.37 1.85 -0.60 0.00 0.00 0.00 175.10 175.49 2gyc s ARG 116 N 2.59 2.64 -0.43 2.72 3.52 -0.80 -4.89 118.95 124.29 2gyc s ARG 116 Ca 0.25 0.43 0.02 0.00 -0.13 0.00 0.00 55.73 56.30 2gyc s ARG 116 Cb -0.11 -4.49 0.15 0.00 -1.56 0.00 0.00 34.95 28.93 2gyc s ARG 116 CO -0.03 -2.81 0.27 -1.17 -0.81 0.00 0.00 175.30 170.74 2gyc s LEU 117 N 9.10 2.19 0.17 -0.88 2.96 -1.26 -4.22 118.68 126.74 2gyc s LEU 117 Ca 0.66 -2.70 -0.15 0.00 -0.22 0.00 0.00 54.13 51.72 2gyc s LEU 117 Cb -0.11 -0.81 0.12 0.00 0.50 0.00 0.00 46.19 45.89 2gyc s LEU 117 CO 0.17 -0.24 1.71 -0.65 -1.32 0.00 0.00 176.35 176.02 2gyc h PRO 118 N 6.48 0.16 -3.72 0.98 0.11 -1.97 -3.44 132.00 130.62 2gyc h PRO 118 Ca 0.07 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 66.01 2gyc h PRO 118 Cb 0.92 -0.04 -0.21 0.00 0.11 0.00 0.00 31.00 31.78 2gyc h PRO 118 CO 0.42 0.11 -0.59 -0.80 -0.21 0.00 0.00 178.00 176.93 2gyc s ASN 119 N -5.29 0.11 -0.49 -2.05 0.01 -1.26 -5.09 114.94 100.88 2gyc s ASN 119 Ca -0.13 -0.30 -0.27 0.00 -0.71 0.00 0.00 52.86 51.45 2gyc s ASN 119 Cb 0.14 0.16 -0.08 0.00 0.41 0.00 0.00 41.25 41.88 2gyc s ASN 119 CO 0.71 -0.31 2.41 0.61 -1.51 0.00 0.00 177.10 179.02 2gyc n GLY 120 N 1.66 0.24 0.08 0.66 0.00 -1.26 -4.76 105.19 101.81 2gyc n GLY 120 Ca -0.22 0.72 -0.08 0.00 0.00 0.00 0.00 46.02 46.43 2gyc n GLY 120 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2gyc n VAL 121 N 7.92 1.56 -2.07 1.61 3.14 -1.26 -4.72 118.33 124.51 2gyc n VAL 121 Ca 0.39 -0.80 -0.28 0.00 -2.96 0.00 0.00 64.34 60.69 2gyc n VAL 121 Cb 0.49 -0.96 -0.05 0.00 -1.06 0.00 0.00 33.84 32.26 2gyc n VAL 121 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2gyc s LEU 122 N -6.00 3.16 0.00 6.55 1.43 -1.26 -4.41 118.68 118.15 2gyc s LEU 122 Ca -0.05 -0.94 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 2gyc s LEU 122 Cb 0.08 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.73 2gyc s LEU 122 CO 0.83 -2.76 0.00 0.54 0.23 0.00 0.00 176.35 175.18 2gyc n ARG 123 N 8.72 3.07 -4.11 1.70 5.12 -1.26 -3.66 116.66 126.24 2gyc n ARG 123 Ca 0.41 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 56.10 2gyc n ARG 123 Cb 0.47 -0.62 -0.07 0.00 -1.16 0.00 0.00 32.46 31.09 2gyc n ARG 123 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2gyc s THR 124 N -0.92 2.87 -0.41 0.55 -4.23 -1.26 -2.28 115.64 109.96 2gyc s THR 124 Ca 0.00 -1.71 -0.14 0.00 -1.18 0.00 0.00 61.69 58.66 2gyc s THR 124 Cb 0.00 -2.96 0.02 0.00 1.34 0.00 0.00 72.50 70.90 2gyc s THR 124 CO 0.00 -0.15 0.29 0.42 -0.54 0.00 0.00 174.62 174.63 2gyc s THR 125 N -2.46 5.13 -2.24 3.99 -4.23 -1.14 -4.79 115.64 109.89 2gyc s THR 125 Ca 0.38 -0.71 0.00 0.00 -1.18 0.00 0.00 61.69 60.18 2gyc s THR 125 Cb -0.01 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 69.96 2gyc s THR 125 CO 0.22 -0.31 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 2gyc n GLY 126 N 5.13 -0.67 3.63 3.99 0.00 -0.73 -4.94 105.19 111.60 2gyc n GLY 126 Ca -0.11 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 2gyc n GLY 126 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2gyc s GLU 127 N -0.93 4.04 0.15 1.61 -6.30 -1.26 -0.47 118.70 115.54 2gyc s GLU 127 Ca 0.00 -0.15 0.07 0.00 -2.50 0.00 0.00 54.97 52.38 2gyc s GLU 127 Cb 0.00 -3.59 -0.04 0.00 0.00 0.00 0.00 34.13 30.49 2gyc s GLU 127 CO 0.00 -0.09 -0.15 -1.01 0.02 0.00 0.00 175.26 174.04 2gyc s HIS 128 N 1.49 1.54 -0.43 5.30 3.76 0.12 -4.99 115.29 122.07 2gyc s HIS 128 Ca 0.11 -0.56 0.02 0.00 -0.15 0.00 0.00 55.06 54.48 2gyc s HIS 128 Cb -0.15 -0.77 0.12 0.00 1.11 0.00 0.00 32.58 32.89 2gyc s HIS 128 CO 0.08 0.22 0.17 -1.83 -0.85 0.00 0.00 174.74 172.53 2gyc s GLU 129 N -3.00 1.81 0.38 1.40 -1.05 -1.26 -0.34 118.70 116.62 2gyc s GLU 129 Ca 0.14 -2.16 -0.24 0.00 -0.15 0.00 0.00 54.97 52.56 2gyc s GLU 129 Cb -0.03 -3.34 -0.10 0.00 -0.44 0.00 0.00 34.13 30.21 2gyc s GLU 129 CO 0.04 -1.03 0.98 0.08 0.95 0.00 0.00 175.26 176.28 2gyc s VAL 130 N 0.48 4.10 -0.10 1.83 1.01 -0.37 -4.85 120.40 122.49 2gyc s VAL 130 Ca 0.13 1.57 -0.03 0.00 0.00 0.00 0.00 61.98 63.66 2gyc s VAL 130 Cb -0.22 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2gyc s VAL 130 CO -0.05 -0.03 0.01 -0.94 0.00 0.00 0.00 175.10 174.09 2gyc s SER 131 N -1.76 5.25 0.36 3.32 1.04 -1.26 -0.58 113.70 120.07 2gyc s SER 131 Ca 0.56 0.12 0.09 0.00 0.48 0.00 0.00 55.95 57.20 2gyc s SER 131 Cb -0.17 -1.55 -0.06 0.00 0.10 0.00 0.00 66.02 64.34 2gyc s SER 131 CO 0.22 0.34 -0.01 -0.36 0.98 0.00 0.00 173.24 174.41 2gyc s PHE 132 N -0.68 2.50 -0.41 5.02 0.40 0.62 -1.91 117.98 123.52 2gyc s PHE 132 Ca 0.11 -0.52 0.02 0.00 -0.60 0.00 0.00 56.93 55.94 2gyc s PHE 132 Cb -0.12 -1.55 0.15 0.00 0.51 0.00 0.00 43.02 42.01 2gyc s PHE 132 CO 0.02 0.48 0.26 -1.14 0.70 0.00 0.00 175.22 175.55 2gyc s GLN 133 N -3.70 0.95 0.37 0.44 0.74 0.16 -2.26 119.66 116.35 2gyc s GLN 133 Ca 0.35 -1.81 0.06 0.00 0.05 0.00 0.00 55.36 54.01 2gyc s GLN 133 Cb 0.03 -1.74 0.70 0.00 1.10 0.00 0.00 33.01 33.10 2gyc s GLN 133 CO 0.18 -1.24 1.93 0.28 -0.55 0.00 0.00 175.29 175.89 2gyc h VAL 134 N 4.97 1.17 -3.15 1.34 2.07 -1.62 -3.41 116.25 117.61 2gyc h VAL 134 Ca 0.09 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 2gyc h VAL 134 Cb 0.93 0.88 -0.11 0.00 -1.52 0.00 0.00 31.29 31.47 2gyc h VAL 134 CO 0.37 0.22 0.11 -2.28 0.02 0.00 0.00 177.57 176.02 2gyc s HIS 135 N -5.06 -0.31 -1.42 1.57 5.65 -0.12 -4.94 115.29 110.66 2gyc s HIS 135 Ca -0.07 0.02 0.02 0.00 0.25 0.00 0.00 55.06 55.28 2gyc s HIS 135 Cb 0.16 0.48 0.12 0.00 -1.18 0.00 0.00 32.58 32.16 2gyc s HIS 135 CO 0.75 -0.90 0.89 -1.13 -0.65 0.00 0.00 174.74 173.70 2gyc n SER 136 N -0.36 0.00 0.00 9.88 3.41 -1.26 -1.75 113.62 123.54 2gyc n SER 136 Ca -0.13 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2gyc n SER 136 Cb 0.63 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 2gyc n SER 136 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gyc n GLU 137 N -1.29 1.56 -4.20 4.33 1.02 -1.26 -5.02 120.64 115.78 2gyc n GLU 137 Ca 0.01 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.81 2gyc n GLU 137 Cb 0.02 -0.87 -0.14 0.00 -0.02 0.00 0.00 31.44 30.42 2gyc n GLU 137 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2gyc s VAL 138 N -1.51 3.04 0.35 2.62 1.01 -0.72 -5.11 120.40 120.09 2gyc s VAL 138 Ca 0.00 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.41 2gyc s VAL 138 Cb 0.00 -2.34 -0.07 0.00 0.00 0.00 0.00 36.38 33.97 2gyc s VAL 138 CO 0.00 0.47 0.03 -0.36 0.00 0.00 0.00 175.10 175.24 2gyc s PHE 139 N 1.11 2.17 0.21 5.22 0.40 -1.26 -0.95 117.98 124.89 2gyc s PHE 139 Ca 0.01 -0.82 -0.11 0.00 -0.60 0.00 0.00 56.93 55.40 2gyc s PHE 139 Cb -0.14 -1.45 0.04 0.00 0.51 0.00 0.00 43.02 41.98 2gyc s PHE 139 CO -0.02 0.20 0.58 0.00 0.70 0.00 0.00 175.22 176.68 2gyc n ALA 140 N -0.78 -1.40 -3.17 5.36 0.00 -0.96 -4.88 120.51 114.68 2gyc n ALA 140 Ca -0.04 -0.78 -0.13 0.00 0.00 0.00 0.00 53.44 52.49 2gyc n ALA 140 Cb 0.66 0.57 -0.08 0.00 0.00 0.00 0.00 19.45 20.60 2gyc n ALA 140 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2gyc s LYS 141 N -2.05 0.79 -0.01 0.00 -2.85 -1.26 -0.28 119.74 114.09 2gyc s LYS 141 Ca 0.12 -0.29 0.02 0.00 -1.00 0.00 0.00 55.97 54.82 2gyc s LYS 141 Cb -0.03 0.35 -0.00 0.00 -2.06 0.00 0.00 37.83 36.09 2gyc s LYS 141 CO 0.06 -0.25 -0.08 0.08 0.10 0.00 0.00 175.35 175.27 2gyc s VAL 142 N -1.94 0.63 -0.19 1.79 1.01 0.26 -4.95 120.40 117.01 2gyc s VAL 142 Ca -0.09 -0.32 -0.24 0.00 0.00 0.00 0.00 61.98 61.33 2gyc s VAL 142 Cb -0.03 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 2gyc s VAL 142 CO 0.01 0.19 0.78 -0.51 0.00 0.00 0.00 175.10 175.57 2gyc s ILE 143 N -0.03 4.91 0.03 2.22 -1.16 -1.26 -1.24 121.20 124.67 2gyc s ILE 143 Ca 0.01 1.50 0.07 0.00 -0.51 0.00 0.00 60.65 61.72 2gyc s ILE 143 Cb -0.05 -4.08 -0.03 0.00 0.61 0.00 0.00 42.46 38.91 2gyc s ILE 143 CO -0.00 0.03 -0.19 -0.69 -2.81 0.00 0.00 174.94 171.29 2gyc s VAL 144 N 2.18 2.74 -0.32 4.00 1.01 0.53 -3.58 120.40 126.96 2gyc s VAL 144 Ca 0.35 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 61.18 2gyc s VAL 144 Cb -0.16 -2.14 0.09 0.00 0.00 0.00 0.00 36.38 34.16 2gyc s VAL 144 CO 0.11 0.36 0.02 0.21 0.00 0.00 0.00 175.10 175.80 2gyc s ASN 145 N -1.37 4.77 -0.41 3.32 2.47 -1.25 -0.71 114.94 121.77 2gyc s ASN 145 Ca 0.14 -1.85 -0.28 0.00 0.42 0.00 0.00 52.86 51.30 2gyc s ASN 145 Cb -0.10 -1.65 0.02 0.00 -1.45 0.00 0.00 41.25 38.07 2gyc s ASN 145 CO 0.05 -0.34 1.05 -0.69 -3.72 0.00 0.00 177.10 173.44 2gyc s VAL 146 N 1.02 4.40 0.01 -5.21 1.01 0.38 -0.71 120.40 121.32 2gyc s VAL 146 Ca 0.04 1.30 -0.09 0.00 0.00 0.00 0.00 61.98 63.23 2gyc s VAL 146 Cb -0.20 -4.47 -0.05 0.00 0.00 0.00 0.00 36.38 31.66 2gyc s VAL 146 CO -0.06 -0.74 0.32 -0.69 0.00 0.00 0.00 175.10 173.93 2gyc s VAL 147 N 3.93 5.21 0.07 2.92 1.01 0.93 -1.78 120.40 132.71 2gyc s VAL 147 Ca 0.44 0.37 -0.30 0.00 0.00 0.00 0.00 61.98 62.49 2gyc s VAL 147 Cb -0.10 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 2gyc s VAL 147 CO 0.24 0.41 1.15 0.00 0.00 0.00 0.00 175.10 176.89 2gyc s ALA 148 N -1.26 3.35 -0.35 5.51 0.00 -1.26 -2.51 121.76 125.24 2gyc s ALA 148 Ca 0.27 0.80 0.03 0.00 0.00 0.00 0.00 51.96 53.06 2gyc s ALA 148 Cb -0.14 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.59 2gyc s ALA 148 CO 0.15 -0.37 0.59 -1.91 0.00 0.00 0.00 175.76 174.22