#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gdt n HIS 2 N 0.00 -2.97 -3.63 1.61 -0.00 -1.09 -4.91 115.22 104.23 2gdt n HIS 2 Ca 0.00 1.09 -0.19 0.00 -0.00 0.00 0.00 57.72 58.61 2gdt n HIS 2 Cb 0.00 -1.92 -0.16 0.00 -0.00 0.00 0.00 29.99 27.91 2gdt n HIS 2 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 2gdt s VAL 3 N -1.40 -0.21 0.34 1.59 -7.23 -0.22 -4.58 120.40 108.70 2gdt s VAL 3 Ca 0.00 0.21 -0.28 0.00 -1.81 0.00 0.00 61.98 60.10 2gdt s VAL 3 Cb 0.00 -0.37 -0.10 0.00 0.56 0.00 0.00 36.38 36.47 2gdt s VAL 3 CO 0.00 0.03 1.30 -1.58 -0.31 0.00 0.00 175.10 174.54 2gdt s GLN 4 N 2.24 4.32 -0.09 4.82 0.74 -1.26 -0.70 119.66 129.73 2gdt s GLN 4 Ca 0.04 2.19 -0.03 0.00 0.05 0.00 0.00 55.36 57.61 2gdt s GLN 4 Cb -0.13 -3.04 0.04 0.00 1.10 0.00 0.00 33.01 30.98 2gdt s GLN 4 CO -0.07 -0.21 0.06 -0.51 -0.55 0.00 0.00 175.29 174.02 2gdt s LEU 5 N -1.86 0.33 0.69 3.68 1.43 0.42 -4.90 118.68 118.47 2gdt s LEU 5 Ca 0.50 -0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 53.28 2gdt s LEU 5 Cb -0.39 -0.24 0.01 0.00 0.03 0.00 0.00 46.19 45.59 2gdt s LEU 5 CO 0.52 -0.28 1.08 -0.44 0.23 0.00 0.00 176.35 177.46 2gdt s SER 6 N 2.11 5.55 0.02 2.29 0.01 -1.26 -0.98 113.70 121.44 2gdt s SER 6 Ca 0.04 1.24 -0.06 0.00 1.31 0.00 0.00 55.95 58.48 2gdt s SER 6 Cb -0.14 -2.10 -0.00 0.00 0.21 0.00 0.00 66.02 63.99 2gdt s SER 6 CO -0.05 -1.29 0.11 -0.76 0.41 0.00 0.00 173.24 171.65 2gdt s LEU 7 N -5.36 1.71 0.78 2.44 1.43 0.45 -4.94 118.68 115.18 2gdt s LEU 7 Ca 0.58 -0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.23 2gdt s LEU 7 Cb -0.11 0.59 0.06 0.00 0.03 0.00 0.00 46.19 46.75 2gdt s LEU 7 CO 0.53 -0.40 1.09 -2.16 0.23 0.00 0.00 176.35 175.64 2gdt s PRO 8 N -1.75 2.22 -0.11 1.29 0.04 -1.26 -0.36 135.00 135.07 2gdt s PRO 8 Ca -0.12 1.16 -0.00 0.00 0.04 0.00 0.00 61.00 62.08 2gdt s PRO 8 Cb -0.06 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 2gdt s PRO 8 CO -0.00 -1.67 -0.09 0.08 0.04 0.00 0.00 177.00 175.36 2gdt s VAL 9 N -2.90 3.46 -0.02 -0.36 1.01 0.85 -0.54 120.40 121.90 2gdt s VAL 9 Ca 0.61 -0.53 0.05 0.00 0.00 0.00 0.00 61.98 62.11 2gdt s VAL 9 Cb -0.17 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 2gdt s VAL 9 CO 0.56 0.54 -0.17 -0.76 0.00 0.00 0.00 175.10 175.27 2gdt s LEU 10 N -0.07 1.99 0.46 3.92 1.43 -0.55 -2.57 118.68 123.29 2gdt s LEU 10 Ca -0.00 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.53 2gdt s LEU 10 Cb -0.14 -0.90 -0.07 0.00 0.03 0.00 0.00 46.19 45.11 2gdt s LEU 10 CO 0.03 0.19 1.32 -1.10 0.23 0.00 0.00 176.35 177.02 2gdt s GLN 11 N -0.25 3.68 0.00 1.70 -1.52 -1.26 -4.61 119.66 117.40 2gdt s GLN 11 Ca 0.03 2.16 0.14 0.00 -1.95 0.00 0.00 55.36 55.75 2gdt s GLN 11 Cb -0.08 -2.56 0.83 0.00 -0.22 0.00 0.00 33.01 30.98 2gdt s GLN 11 CO 0.00 -0.73 1.25 1.55 -0.25 0.00 0.00 175.29 177.11 2gdt n VAL 12 N -0.31 0.00 0.55 1.09 3.14 -1.26 -0.94 118.33 120.60 2gdt n VAL 12 Ca 0.06 0.00 0.06 0.00 -2.96 0.00 0.00 64.34 61.50 2gdt n VAL 12 Cb 0.44 -0.73 -0.06 0.00 -1.06 0.00 0.00 33.84 32.43 2gdt n VAL 12 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2gdt n ARG 13 N -0.97 2.99 -0.05 1.45 1.74 -1.26 -4.62 116.66 115.94 2gdt n ARG 13 Ca 0.10 -0.07 -0.20 0.00 -0.77 0.00 0.00 57.85 56.91 2gdt n ARG 13 Cb 0.05 -1.07 -0.13 0.00 -1.02 0.00 0.00 32.46 30.29 2gdt n ARG 13 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2gdt n ASP 14 N -1.16 2.07 -3.42 0.55 8.00 -0.12 -4.75 116.55 117.71 2gdt n ASP 14 Ca 0.03 0.07 -0.28 0.00 0.71 0.00 0.00 54.79 55.32 2gdt n ASP 14 Cb 0.19 -0.69 -0.07 0.00 -0.02 0.00 0.00 41.12 40.53 2gdt n ASP 14 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2gdt n VAL 15 N -3.41 0.00 -0.37 2.53 0.31 -0.70 -4.79 118.33 111.90 2gdt n VAL 15 Ca -0.38 -0.04 0.01 0.00 -0.01 0.00 0.00 64.34 63.92 2gdt n VAL 15 Cb 1.02 -1.62 0.07 0.00 -0.91 0.00 0.00 33.84 32.40 2gdt n VAL 15 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2gdt n LEU 16 N 7.25 -0.55 -4.54 7.52 4.77 -1.26 -4.13 117.00 126.05 2gdt n LEU 16 Ca 0.29 1.72 -0.43 0.00 -0.03 0.00 0.00 56.01 57.56 2gdt n LEU 16 Cb 0.28 -0.43 -0.01 0.00 -2.33 0.00 0.00 43.42 40.93 2gdt n LEU 16 CO 0.89 -1.57 1.71 -0.69 -1.33 0.00 0.00 177.39 176.40 2gdt s VAL 17 N -6.03 4.33 -1.87 4.08 1.01 -1.26 -4.76 120.40 115.90 2gdt s VAL 17 Ca -0.14 -1.89 0.31 0.00 0.00 0.00 0.00 61.98 60.27 2gdt s VAL 17 Cb 0.22 -5.09 0.81 0.00 0.00 0.00 0.00 36.38 32.32 2gdt s VAL 17 CO 0.73 -1.89 2.18 0.54 0.00 0.00 0.00 175.10 176.65 2gdt n ARG 18 N 7.74 0.88 -3.52 2.72 5.12 -1.26 -4.29 116.66 124.06 2gdt n ARG 18 Ca 0.42 -0.02 -0.08 0.00 -1.93 0.00 0.00 57.85 56.25 2gdt n ARG 18 Cb 0.46 -1.50 -0.08 0.00 -1.16 0.00 0.00 32.46 30.18 2gdt n ARG 18 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2gdt s GLY 19 N -2.14 -0.44 0.47 -0.13 0.00 -1.26 -3.62 107.32 100.21 2gdt s GLY 19 Ca 0.43 1.35 0.16 0.00 0.00 0.00 0.00 44.72 46.66 2gdt s GLY 19 CO 0.39 2.59 2.05 0.74 0.00 0.00 0.00 173.10 178.87 2gdt h PHE 20 N 8.16 0.00 -2.52 1.90 0.04 -1.83 -3.47 116.94 119.22 2gdt h PHE 20 Ca -0.18 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.58 2gdt h PHE 20 Cb 1.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.28 2gdt h PHE 20 CO 0.21 0.13 0.15 0.41 -0.60 0.00 0.00 178.31 178.61 2gdt n GLY 21 N -1.15 1.44 0.86 -1.45 0.00 -1.26 -4.75 105.19 98.88 2gdt n GLY 21 Ca -0.03 -1.14 0.01 0.00 0.00 0.00 0.00 46.02 44.86 2gdt n GLY 21 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2gdt n ASP 22 N -1.28 2.22 -3.73 1.61 2.03 -1.26 -4.61 116.55 111.53 2gdt n ASP 22 Ca -0.05 -3.83 -0.10 0.00 0.52 0.00 0.00 54.79 51.33 2gdt n ASP 22 Cb 0.32 -0.49 -0.05 0.00 -0.72 0.00 0.00 41.12 40.18 2gdt n ASP 22 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2gdt s SER 23 N -3.28 -0.20 0.19 1.67 0.01 -1.26 -5.01 113.70 105.83 2gdt s SER 23 Ca 0.40 -0.47 -0.12 0.00 1.31 0.00 0.00 55.95 57.06 2gdt s SER 23 Cb 0.38 0.51 0.11 0.00 0.21 0.00 0.00 66.02 67.22 2gdt s SER 23 CO -0.05 -0.94 1.86 -0.37 0.41 0.00 0.00 173.24 174.14 2gdt h VAL 24 N 2.33 1.16 -0.27 3.43 -1.51 -1.91 -1.39 116.25 118.08 2gdt h VAL 24 Ca -0.31 -0.29 -0.13 0.00 -1.23 0.00 0.00 66.70 64.74 2gdt h VAL 24 Cb 1.25 0.24 -0.01 0.00 -2.13 0.00 0.00 31.29 30.64 2gdt h VAL 24 CO 0.43 0.15 -0.35 -0.33 -1.23 0.00 0.00 177.57 176.25 2gdt h GLU 25 N 0.84 0.60 0.56 5.19 5.08 -1.97 -0.51 114.58 124.38 2gdt h GLU 25 Ca 0.23 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2gdt h GLU 25 Cb -0.09 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 2gdt h GLU 25 CO -0.05 0.87 -0.33 0.93 -1.00 0.00 0.00 179.01 179.42 2gdt h GLU 26 N 0.51 -0.81 -0.74 2.33 4.39 -1.90 -1.87 114.58 116.49 2gdt h GLU 26 Ca 0.05 0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 2gdt h GLU 26 Cb 0.84 0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 29.64 2gdt h GLU 26 CO 0.07 -0.54 0.30 0.00 -1.16 0.00 0.00 179.01 177.68 2gdt h ALA 27 N -0.45 1.13 -0.22 3.43 0.00 -0.87 -0.96 119.26 121.31 2gdt h ALA 27 Ca -0.07 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 2gdt h ALA 27 Cb 0.68 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2gdt h ALA 27 CO 0.08 0.63 -0.36 1.25 0.00 0.00 0.00 179.25 180.85 2gdt h LEU 28 N 1.07 0.50 0.70 0.00 6.46 -1.09 -0.76 115.31 122.19 2gdt h LEU 28 Ca 0.25 -0.20 -0.03 0.00 -0.12 0.00 0.00 57.88 57.77 2gdt h LEU 28 Cb 0.20 -0.14 0.01 0.00 -0.73 0.00 0.00 40.66 39.99 2gdt h LEU 28 CO -0.02 0.82 -0.33 0.28 -0.62 0.00 0.00 178.44 178.56 2gdt h SER 29 N 0.41 -0.79 -0.64 1.25 0.02 -0.52 -2.44 113.55 110.84 2gdt h SER 29 Ca 0.04 -0.00 0.07 0.00 -0.84 0.00 0.00 61.79 61.07 2gdt h SER 29 Cb 0.81 0.20 -0.06 0.00 0.14 0.00 0.00 62.40 63.50 2gdt h SER 29 CO 0.07 -0.46 0.32 -0.33 -1.14 0.00 0.00 176.83 175.28 2gdt h GLU 30 N -1.12 0.55 -0.11 3.45 4.39 -1.21 -1.19 114.58 119.35 2gdt h GLU 30 Ca -0.10 -0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.60 2gdt h GLU 30 Cb 0.75 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.22 2gdt h GLU 30 CO 0.16 0.37 -0.46 0.00 -1.16 0.00 0.00 179.01 177.91 2gdt h ALA 31 N 1.37 -0.83 0.00 3.43 0.00 -1.18 0.17 119.26 122.22 2gdt h ALA 31 Ca 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2gdt h ALA 31 Cb 0.27 0.94 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2gdt h ALA 31 CO -0.23 -1.00 0.00 0.54 0.00 0.00 0.00 179.25 178.56 2gdt n ARG 32 N -4.99 0.08 0.03 0.00 1.74 -0.53 -0.71 116.66 112.27 2gdt n ARG 32 Ca -0.05 0.58 -0.22 0.00 -0.77 0.00 0.00 57.85 57.39 2gdt n ARG 32 Cb 0.32 -1.77 -0.14 0.00 -1.02 0.00 0.00 32.46 29.85 2gdt n ARG 32 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2gdt h GLU 33 N 0.00 0.28 0.00 5.56 5.08 -0.36 -3.33 114.58 121.82 2gdt h GLU 33 Ca 0.00 -0.48 -0.14 0.00 -1.00 0.00 0.00 59.36 57.73 2gdt h GLU 33 Cb 0.01 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2gdt h GLU 33 CO 0.00 1.23 -0.68 0.45 -1.00 0.00 0.00 179.01 179.01 2gdt h HIS 34 N -0.24 0.00 -0.37 4.33 3.86 0.15 -2.20 115.15 120.68 2gdt h HIS 34 Ca -0.29 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.92 2gdt h HIS 34 Cb 1.81 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 30.26 2gdt h HIS 34 CO 0.13 0.68 0.23 -0.07 0.86 0.00 0.00 177.93 179.76 2gdt h LEU 35 N 0.00 0.44 -0.65 2.43 4.07 -1.11 0.40 115.31 120.88 2gdt h LEU 35 Ca -0.01 -0.04 -0.09 0.00 0.08 0.00 0.00 57.88 57.83 2gdt h LEU 35 Cb 1.39 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 43.00 2gdt h LEU 35 CO 0.09 0.35 0.07 0.50 -1.08 0.00 0.00 178.44 178.37 2gdt h LYS 36 N 0.49 1.11 -0.12 1.13 3.11 -1.54 -2.70 116.57 118.05 2gdt h LYS 36 Ca 0.13 -0.32 -0.19 0.00 -2.81 0.00 0.00 60.65 57.47 2gdt h LYS 36 Cb -0.01 -0.12 0.01 0.00 -1.00 0.00 0.00 32.23 31.11 2gdt h LYS 36 CO -0.03 1.03 -0.67 -0.91 -2.81 0.00 0.00 179.45 176.07 2gdt h ASN 37 N 1.02 0.79 0.00 4.20 2.35 -1.42 -3.49 115.58 119.04 2gdt h ASN 37 Ca 0.19 -0.65 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 2gdt h ASN 37 Cb 0.49 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.62 2gdt h ASN 37 CO 0.02 1.31 0.00 0.61 -1.65 0.00 0.00 177.43 177.72 2gdt n GLY 38 N 0.74 1.80 2.28 2.83 0.00 0.11 -5.03 105.19 107.92 2gdt n GLY 38 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 2gdt n GLY 38 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gdt n THR 39 N -1.04 3.45 -4.41 2.61 -2.24 0.73 -4.96 114.28 108.41 2gdt n THR 39 Ca 0.00 -3.15 -0.27 0.00 -2.27 0.00 0.00 64.05 58.35 2gdt n THR 39 Cb 0.00 -1.16 -0.12 0.00 -2.10 0.00 0.00 70.33 66.95 2gdt n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gdt s GLY 41 N -2.50 2.00 0.10 0.00 0.00 0.32 -4.42 107.32 102.82 2gdt s GLY 41 Ca 0.19 -1.87 0.09 0.00 0.00 0.00 0.00 44.72 43.13 2gdt s GLY 41 CO 0.09 -1.31 -0.20 -2.27 0.00 0.00 0.00 173.10 169.41 2gdt s LEU 42 N -3.31 2.61 -0.15 0.66 2.96 0.30 -1.45 118.68 120.30 2gdt s LEU 42 Ca 0.37 -0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 53.72 2gdt s LEU 42 Cb 0.02 -1.49 0.04 0.00 0.50 0.00 0.00 46.19 45.26 2gdt s LEU 42 CO 0.24 0.20 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.74 2gdt s VAL 43 N -1.07 0.94 0.62 1.68 1.01 0.42 -1.48 120.40 122.52 2gdt s VAL 43 Ca 0.16 -0.48 -0.18 0.00 0.00 0.00 0.00 61.98 61.49 2gdt s VAL 43 Cb -0.10 -1.13 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 2gdt s VAL 43 CO 0.08 0.15 1.18 -1.61 0.00 0.00 0.00 175.10 174.89 2gdt s GLU 44 N 1.71 2.87 0.30 2.72 2.02 -1.26 -0.32 118.70 126.74 2gdt s GLU 44 Ca 0.02 1.70 -0.11 0.00 0.02 0.00 0.00 54.97 56.60 2gdt s GLU 44 Cb -0.15 -1.93 -0.08 0.00 0.10 0.00 0.00 34.13 32.08 2gdt s GLU 44 CO -0.07 -1.25 0.66 -0.51 0.02 0.00 0.00 175.26 174.10 2gdt s LEU 45 N -4.34 4.05 0.00 1.80 1.43 -1.24 -4.77 118.68 115.61 2gdt s LEU 45 Ca 0.74 1.07 -0.02 0.00 -1.03 0.00 0.00 54.13 54.89 2gdt s LEU 45 Cb -0.27 -3.88 0.01 0.00 0.03 0.00 0.00 46.19 42.08 2gdt s LEU 45 CO 0.35 -0.20 0.29 -0.62 0.23 0.00 0.00 176.35 176.41 2gdt n GLU 46 N -0.52 0.42 0.05 1.70 1.02 -1.26 -5.02 120.64 117.03 2gdt n GLU 46 Ca 0.02 -1.40 -0.13 0.00 -0.02 0.00 0.00 57.16 55.63 2gdt n GLU 46 Cb 0.53 1.42 -0.09 0.00 -0.02 0.00 0.00 31.44 33.28 2gdt n GLU 46 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2gdt h LYS 47 N 0.00 -0.13 -0.65 3.49 1.63 -2.04 -3.39 116.57 115.49 2gdt h LYS 47 Ca -0.15 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 2gdt h LYS 47 Cb 0.63 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.29 2gdt h LYS 47 CO 0.20 0.22 0.00 0.41 -3.45 0.00 0.00 179.45 176.83 2gdt n GLY 48 N -0.19 2.63 0.10 5.01 0.00 -1.26 -4.30 105.19 107.17 2gdt n GLY 48 Ca -0.08 -0.74 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 2gdt n GLY 48 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2gdt h VAL 49 N 3.82 0.73 -0.90 1.61 2.07 -1.93 -3.38 116.25 118.28 2gdt h VAL 49 Ca 0.00 -1.36 0.15 0.00 0.82 0.00 0.00 66.70 66.31 2gdt h VAL 49 Cb 1.04 1.32 -0.15 0.00 -1.52 0.00 0.00 31.29 31.98 2gdt h VAL 49 CO 0.05 0.23 -0.34 -0.07 0.02 0.00 0.00 177.57 177.45 2gdt h LEU 50 N -0.97 -1.25 -3.41 2.57 3.38 -1.82 -0.76 115.31 113.05 2gdt h LEU 50 Ca -0.01 0.29 -0.07 0.00 0.09 0.00 0.00 57.88 58.17 2gdt h LEU 50 Cb 0.46 0.68 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 2gdt h LEU 50 CO 0.02 -0.30 -0.14 -0.81 0.09 0.00 0.00 178.44 177.30 2gdt n PRO 51 N -5.49 1.36 0.00 1.13 -0.04 -1.26 -1.85 135.00 128.85 2gdt n PRO 51 Ca 0.10 -0.38 0.00 0.00 -0.04 0.00 0.00 63.50 63.18 2gdt n PRO 51 Cb 0.41 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 2gdt n PRO 51 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2gdt n GLN 52 N 1.90 0.91 -1.84 0.54 6.02 -0.30 -5.09 117.38 119.52 2gdt n GLN 52 Ca 0.16 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.85 2gdt n GLN 52 Cb 0.65 -0.42 0.02 0.00 1.02 0.00 0.00 30.24 31.51 2gdt n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2gdt s LEU 53 N -0.82 3.13 0.00 1.08 2.01 -0.77 -5.04 118.68 118.26 2gdt s LEU 53 Ca 0.00 1.37 0.00 0.00 0.01 0.00 0.00 54.13 55.51 2gdt s LEU 53 Cb 0.00 -4.33 0.00 0.00 0.01 0.00 0.00 46.19 41.87 2gdt s LEU 53 CO 0.00 -1.06 0.16 -0.62 1.01 0.00 0.00 176.35 175.84 2gdt n GLU 54 N -2.86 0.00 0.17 1.70 -0.58 -1.24 -5.02 120.64 112.81 2gdt n GLU 54 Ca 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 2gdt n GLU 54 Cb 0.55 -0.62 0.00 0.00 -0.57 0.00 0.00 31.44 30.79 2gdt n GLU 54 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2gdt n GLN 55 N -0.18 0.00 -2.40 3.49 1.13 -1.26 -4.89 117.38 113.27 2gdt n GLN 55 Ca 0.00 0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.69 2gdt n GLN 55 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.32 2gdt n GLN 55 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2gdt s PRO 56 N -1.74 3.32 -0.51 -1.09 0.04 -1.26 -0.67 135.00 133.09 2gdt s PRO 56 Ca 0.00 -1.08 -0.29 0.00 0.04 0.00 0.00 61.00 59.68 2gdt s PRO 56 Cb 0.00 -5.31 0.03 0.00 0.04 0.00 0.00 34.50 29.26 2gdt s PRO 56 CO 0.00 -2.65 1.22 0.71 0.04 0.00 0.00 177.00 176.32 2gdt s TYR 57 N 6.59 2.65 -0.66 0.56 2.02 -0.15 -4.68 117.35 123.68 2gdt s TYR 57 Ca 0.55 0.60 -0.27 0.00 -0.37 0.00 0.00 57.07 57.59 2gdt s TYR 57 Cb -0.01 -4.45 -0.00 0.00 -0.40 0.00 0.00 41.96 37.10 2gdt s TYR 57 CO -0.03 -1.53 1.67 0.08 -1.57 0.00 0.00 175.55 174.18 2gdt s VAL 58 N 4.89 3.47 0.62 0.71 1.01 -1.26 -2.26 120.40 127.58 2gdt s VAL 58 Ca 0.49 0.26 -0.05 0.00 0.00 0.00 0.00 61.98 62.68 2gdt s VAL 58 Cb -0.08 -4.26 0.03 0.00 0.00 0.00 0.00 36.38 32.07 2gdt s VAL 58 CO 0.30 -1.22 0.92 -0.36 0.00 0.00 0.00 175.10 174.73 2gdt s PHE 59 N 8.00 3.06 -0.19 5.22 0.08 -0.18 -0.15 117.98 133.82 2gdt s PHE 59 Ca 0.57 0.44 0.01 0.00 0.12 0.00 0.00 56.93 58.07 2gdt s PHE 59 Cb -0.11 -2.90 0.03 0.00 -0.57 0.00 0.00 43.02 39.47 2gdt s PHE 59 CO 0.19 -1.04 -0.15 0.96 -0.10 0.00 0.00 175.22 175.07 2gdt s ILE 60 N -3.04 1.87 0.29 0.64 -4.36 -0.71 -0.99 121.20 114.91 2gdt s ILE 60 Ca 0.57 -1.00 0.12 0.00 -0.26 0.00 0.00 60.65 60.08 2gdt s ILE 60 Cb -0.11 -1.81 -0.05 0.00 1.25 0.00 0.00 42.46 41.75 2gdt s ILE 60 CO 0.44 0.35 -0.18 -1.59 0.24 0.00 0.00 174.94 174.19 2gdt s LYS 61 N 1.33 1.70 0.00 0.37 -2.85 -0.78 -0.76 119.74 118.76 2gdt s LYS 61 Ca 0.01 -1.79 0.00 0.00 -1.00 0.00 0.00 55.97 53.19 2gdt s LYS 61 Cb -0.15 -1.76 0.00 0.00 -2.06 0.00 0.00 37.83 33.86 2gdt s LYS 61 CO -0.10 0.31 0.91 0.54 0.10 0.00 0.00 175.35 177.10 2gdt n ARG 62 N -0.64 0.48 0.00 1.78 1.74 -0.90 -0.26 116.66 118.86 2gdt n ARG 62 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 2gdt n ARG 62 Cb 0.60 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 2gdt n ARG 62 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2gdt n SER 63 N 1.64 0.00 0.00 0.55 2.88 -1.26 -4.63 113.62 112.80 2gdt n SER 63 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2gdt n SER 63 Cb 0.24 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 2gdt n SER 63 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2gdt n ASP 64 N 1.99 0.00 -1.01 -3.46 2.03 -1.26 -4.46 116.55 110.39 2gdt n ASP 64 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2gdt n ASP 64 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2gdt n ASP 64 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2gdt n ALA 65 N 0.00 2.15 -3.80 -1.67 0.00 -1.26 -4.86 120.51 111.06 2gdt n ALA 65 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2gdt n ALA 65 Cb 0.00 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 18.45 2gdt n ALA 65 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2gdt n LEU 66 N 0.70 -0.06 -0.08 0.00 -0.00 -1.26 -4.82 117.00 111.47 2gdt n LEU 66 Ca 0.00 -0.44 -0.02 0.00 -0.00 0.00 0.00 56.01 55.55 2gdt n LEU 66 Cb 0.31 -0.54 -0.02 0.00 -0.00 0.00 0.00 43.42 43.18 2gdt n LEU 66 CO 0.00 0.28 0.12 -0.24 -0.00 0.00 0.00 177.39 177.54 2gdt n SER 67 N -0.13 -0.21 -4.19 1.45 2.88 -1.26 -4.59 113.62 107.57 2gdt n SER 67 Ca -0.04 0.40 -0.12 0.00 -1.33 0.00 0.00 58.87 57.78 2gdt n SER 67 Cb 0.19 -0.07 -0.10 0.00 -0.75 0.00 0.00 64.21 63.49 2gdt n SER 67 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2gdt s THR 68 N -4.77 0.01 0.00 2.46 -4.23 -1.26 -5.10 115.64 102.75 2gdt s THR 68 Ca -0.02 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 2gdt s THR 68 Cb 0.02 -2.46 0.00 0.00 1.34 0.00 0.00 72.50 71.41 2gdt s THR 68 CO 0.12 -0.03 0.49 -3.20 -0.54 0.00 0.00 174.62 171.47 2gdt n ASN 69 N -0.26 0.00 -3.55 3.99 2.85 -1.26 -4.79 115.26 112.23 2gdt n ASN 69 Ca 0.01 0.49 -0.12 0.00 -0.11 0.00 0.00 54.58 54.86 2gdt n ASN 69 Cb 0.66 -0.19 -0.05 0.00 1.24 0.00 0.00 39.78 41.43 2gdt n ASN 69 CO 0.00 0.00 0.00 -2.28 -2.11 0.00 0.00 177.26 172.87 2gdt s HIS 70 N -2.30 -0.44 -0.41 1.20 5.65 -1.26 -5.12 115.29 112.61 2gdt s HIS 70 Ca 0.00 0.67 0.02 0.00 0.25 0.00 0.00 55.06 56.00 2gdt s HIS 70 Cb 0.00 0.46 0.26 0.00 -1.18 0.00 0.00 32.58 32.12 2gdt s HIS 70 CO 0.00 -0.45 1.07 0.41 -0.65 0.00 0.00 174.74 175.13 2gdt n GLY 71 N 0.59 -0.82 7.00 1.59 0.00 -1.26 -4.92 105.19 107.37 2gdt n GLY 71 Ca -0.12 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2gdt n GLY 71 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2gdt n HIS 72 N 1.51 -0.79 -1.24 1.61 8.25 -1.26 -3.87 115.22 119.43 2gdt n HIS 72 Ca 0.05 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.14 2gdt n HIS 72 Cb 0.67 0.15 -0.08 0.00 1.12 0.00 0.00 29.99 31.85 2gdt n HIS 72 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2gdt n LYS 73 N -0.11 0.97 -1.89 -0.41 3.00 -1.26 -4.96 118.16 113.50 2gdt n LYS 73 Ca 0.00 -1.75 -0.38 0.00 -0.00 0.00 0.00 58.31 56.17 2gdt n LYS 73 Cb 0.00 -3.11 0.03 0.00 0.00 0.00 0.00 35.03 31.94 2gdt n LYS 73 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2gdt s VAL 74 N 8.32 2.30 0.34 3.15 1.01 -1.25 -4.23 120.40 130.04 2gdt s VAL 74 Ca 0.66 0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.94 2gdt s VAL 74 Cb 0.09 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 2gdt s VAL 74 CO 0.19 0.01 0.25 0.68 0.00 0.00 0.00 175.10 176.23 2gdt s VAL 75 N -1.33 0.07 0.19 2.92 -7.23 -1.25 -4.30 120.40 109.47 2gdt s VAL 75 Ca 0.68 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.77 2gdt s VAL 75 Cb -0.39 -2.47 -0.01 0.00 0.56 0.00 0.00 36.38 34.07 2gdt s VAL 75 CO 0.47 0.00 0.29 -1.61 -0.31 0.00 0.00 175.10 173.94 2gdt s GLU 76 N -3.50 1.24 0.32 4.82 2.02 0.65 -4.56 118.70 119.68 2gdt s GLU 76 Ca 0.38 -1.28 -0.29 0.00 0.02 0.00 0.00 54.97 53.80 2gdt s GLU 76 Cb 0.02 0.37 -0.11 0.00 0.10 0.00 0.00 34.13 34.52 2gdt s GLU 76 CO 0.25 -0.46 1.46 -0.51 0.02 0.00 0.00 175.26 176.03 2gdt s LEU 77 N -3.01 4.36 0.29 1.80 1.43 -1.26 -1.86 118.68 120.42 2gdt s LEU 77 Ca 0.22 2.87 0.02 0.00 -1.03 0.00 0.00 54.13 56.22 2gdt s LEU 77 Cb 0.03 -3.65 -0.05 0.00 0.03 0.00 0.00 46.19 42.55 2gdt s LEU 77 CO 0.04 -0.78 0.09 -0.69 0.23 0.00 0.00 176.35 175.25 2gdt s VAL 78 N -0.64 0.69 0.03 -1.59 1.01 -0.16 -4.91 120.40 114.83 2gdt s VAL 78 Ca 0.56 -2.00 0.01 0.00 0.00 0.00 0.00 61.98 60.54 2gdt s VAL 78 Cb -0.44 -2.65 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 2gdt s VAL 78 CO 0.53 0.00 -0.05 0.00 0.00 0.00 0.00 175.10 175.59 2gdt s ALA 79 N -3.61 0.33 -0.16 5.51 0.00 -1.26 -1.01 121.76 121.57 2gdt s ALA 79 Ca 0.37 -0.74 -0.18 0.00 0.00 0.00 0.00 51.96 51.40 2gdt s ALA 79 Cb 0.08 0.13 0.05 0.00 0.00 0.00 0.00 23.12 23.38 2gdt s ALA 79 CO 0.14 -0.15 0.49 -1.21 0.00 0.00 0.00 175.76 175.04 2gdt s GLU 80 N -1.88 0.62 0.10 0.00 0.41 -0.96 -4.92 118.70 112.08 2gdt s GLU 80 Ca -0.10 0.57 -0.30 0.00 -0.41 0.00 0.00 54.97 54.73 2gdt s GLU 80 Cb -0.07 0.30 -0.06 0.00 -1.78 0.00 0.00 34.13 32.52 2gdt s GLU 80 CO -0.02 -0.10 1.03 0.00 -0.49 0.00 0.00 175.26 175.68 2gdt s MET 81 N 0.00 4.62 -0.38 1.61 0.23 -1.26 -0.98 119.30 123.14 2gdt s MET 81 Ca -0.02 1.55 0.00 0.00 -1.03 0.00 0.00 55.69 56.19 2gdt s MET 81 Cb -0.03 -3.36 0.00 0.00 -1.53 0.00 0.00 34.83 29.90 2gdt s MET 81 CO 0.02 0.08 0.00 -3.47 -2.03 0.00 0.00 175.02 169.61 2gdt n ASP 82 N 3.02 -2.52 -0.26 -1.18 2.03 0.15 -2.34 116.55 115.45 2gdt n ASP 82 Ca 0.04 0.09 -0.03 0.00 0.52 0.00 0.00 54.79 55.40 2gdt n ASP 82 Cb 0.48 -2.04 -0.01 0.00 -0.72 0.00 0.00 41.12 38.83 2gdt n ASP 82 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2gdt n GLY 83 N 0.20 0.62 0.00 0.27 0.00 -1.05 -4.93 105.19 100.29 2gdt n GLY 83 Ca -0.04 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2gdt n GLY 83 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2gdt n ILE 84 N -2.72 0.00 -0.09 -0.61 5.41 -0.99 -0.02 119.36 120.34 2gdt n ILE 84 Ca -0.03 0.13 -0.16 0.00 1.00 0.00 0.00 62.75 63.69 2gdt n ILE 84 Cb 0.20 -0.21 -0.08 0.00 -0.71 0.00 0.00 39.64 38.84 2gdt n ILE 84 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 2gdt h GLN 85 N 0.00 0.00 -0.80 0.38 4.20 -1.91 -3.38 115.11 113.59 2gdt h GLN 85 Ca 0.00 0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.85 2gdt h GLN 85 Cb 0.00 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.72 2gdt h GLN 85 CO 0.00 0.68 0.53 1.88 -0.67 0.00 0.00 178.83 181.25 2gdt h TYR 86 N -1.00 0.62 -3.94 2.96 -1.99 -1.97 -3.39 116.97 108.26 2gdt h TYR 86 Ca -0.23 0.02 -0.54 0.00 2.00 0.00 0.00 58.73 59.99 2gdt h TYR 86 Cb 1.03 -0.20 0.10 0.00 2.00 0.00 0.00 36.73 39.66 2gdt h TYR 86 CO 0.01 0.24 0.72 0.20 -0.00 0.00 0.00 178.16 179.32 2gdt s GLY 87 N -3.74 2.95 0.00 3.88 0.00 0.97 -2.58 107.32 108.79 2gdt s GLY 87 Ca -0.09 1.45 0.00 0.00 0.00 0.00 0.00 44.72 46.09 2gdt s GLY 87 CO 0.77 2.10 0.00 -2.13 0.00 0.00 0.00 173.10 173.85 2gdt n ARG 88 N 0.34 -0.70 -1.99 2.90 0.63 -1.26 -4.96 116.66 111.61 2gdt n ARG 88 Ca 0.02 0.14 -0.40 0.00 -0.92 0.00 0.00 57.85 56.69 2gdt n ARG 88 Cb 0.41 -4.06 -0.01 0.00 0.45 0.00 0.00 32.46 29.25 2gdt n ARG 88 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2gdt s SER 89 N -1.61 6.37 0.00 6.15 0.01 -1.07 -4.91 113.70 118.65 2gdt s SER 89 Ca 0.00 2.77 0.19 0.00 1.31 0.00 0.00 55.95 60.22 2gdt s SER 89 Cb 0.00 -2.65 0.86 0.00 0.21 0.00 0.00 66.02 64.44 2gdt s SER 89 CO 0.00 -0.82 1.60 0.61 0.41 0.00 0.00 173.24 175.04 2gdt n GLY 90 N 0.65 -1.08 0.22 3.44 0.00 -1.26 -0.98 105.19 106.18 2gdt n GLY 90 Ca 0.02 -0.07 0.06 0.00 0.00 0.00 0.00 46.02 46.03 2gdt n GLY 90 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2gdt h ILE 91 N 0.00 1.03 -3.66 -0.61 2.10 -1.91 -3.44 117.51 111.03 2gdt h ILE 91 Ca 0.00 -0.75 -0.62 0.00 1.08 0.00 0.00 64.86 64.57 2gdt h ILE 91 Cb 0.28 1.42 -0.14 0.00 -1.09 0.00 0.00 36.82 37.29 2gdt h ILE 91 CO 0.00 0.21 -0.24 -0.89 -1.08 0.00 0.00 178.15 176.14 2gdt s THR 92 N -4.44 5.19 -0.16 2.19 2.01 -0.15 -2.13 115.64 118.14 2gdt s THR 92 Ca -0.03 0.58 -0.21 0.00 0.31 0.00 0.00 61.69 62.34 2gdt s THR 92 Cb 0.15 -3.69 -0.18 0.00 0.01 0.00 0.00 72.50 68.79 2gdt s THR 92 CO 0.68 0.19 0.36 -0.07 -0.69 0.00 0.00 174.62 175.09 2gdt h LEU 93 N 8.31 0.00 0.00 4.42 3.38 -1.23 -3.46 115.31 126.73 2gdt h LEU 93 Ca -0.33 -0.58 -0.12 0.00 0.09 0.00 0.00 57.88 56.94 2gdt h LEU 93 Cb 1.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2gdt h LEU 93 CO 0.66 1.12 0.01 0.61 0.09 0.00 0.00 178.44 180.94 2gdt n GLY 94 N 1.56 2.02 3.95 0.83 0.00 -1.25 -3.72 105.19 108.56 2gdt n GLY 94 Ca -0.18 -1.38 -0.21 0.00 0.00 0.00 0.00 46.02 44.25 2gdt n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gdt s VAL 95 N -2.58 5.00 0.15 1.61 1.01 0.56 -1.73 120.40 124.42 2gdt s VAL 95 Ca 0.15 -1.06 0.10 0.00 0.00 0.00 0.00 61.98 61.17 2gdt s VAL 95 Cb -0.02 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2gdt s VAL 95 CO 0.11 -0.31 -0.19 -0.76 0.00 0.00 0.00 175.10 173.95 2gdt s LEU 96 N -3.98 2.65 0.03 3.92 1.43 0.79 -0.44 118.68 123.08 2gdt s LEU 96 Ca 0.35 -0.66 -0.04 0.00 -1.03 0.00 0.00 54.13 52.75 2gdt s LEU 96 Cb -0.09 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 2gdt s LEU 96 CO 0.29 0.15 0.05 0.68 0.23 0.00 0.00 176.35 177.75 2gdt s VAL 97 N -1.38 0.13 -0.10 -1.59 -7.23 -0.53 -4.47 120.40 105.24 2gdt s VAL 97 Ca 0.20 -1.10 -0.30 0.00 -1.81 0.00 0.00 61.98 58.97 2gdt s VAL 97 Cb -0.09 -0.77 -0.04 0.00 0.56 0.00 0.00 36.38 36.04 2gdt s VAL 97 CO 0.11 -0.60 1.49 -2.16 -0.31 0.00 0.00 175.10 173.62 2gdt s PRO 98 N -2.36 4.21 -0.54 4.82 0.05 -1.26 -0.52 135.00 139.39 2gdt s PRO 98 Ca -0.07 1.97 -0.28 0.00 0.05 0.00 0.00 61.00 62.67 2gdt s PRO 98 Cb -0.03 -3.88 0.00 0.00 0.05 0.00 0.00 34.50 30.65 2gdt s PRO 98 CO -0.04 -0.78 1.53 -1.58 0.05 0.00 0.00 177.00 176.18 2gdt s HIS 99 N 3.74 2.14 -0.51 0.56 2.46 0.30 -4.76 115.29 119.21 2gdt s HIS 99 Ca 0.65 0.54 0.04 0.00 0.47 0.00 0.00 55.06 56.77 2gdt s HIS 99 Cb -0.29 -4.31 0.40 0.00 -0.13 0.00 0.00 32.58 28.24 2gdt s HIS 99 CO 0.23 -2.14 1.15 1.33 -2.47 0.00 0.00 174.74 172.85 2gdt n VAL 100 N 6.98 2.70 -0.97 0.89 0.24 -1.26 -4.56 118.33 122.35 2gdt n VAL 100 Ca 0.15 -5.06 0.00 0.00 -2.04 0.00 0.00 64.34 57.38 2gdt n VAL 100 Cb 0.49 -1.30 0.00 0.00 -1.47 0.00 0.00 33.84 31.56 2gdt n VAL 100 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2gdt n GLY 101 N -0.42 0.66 0.00 7.63 0.00 -1.26 -4.91 105.19 106.89 2gdt n GLY 101 Ca 0.38 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.41 2gdt n GLY 101 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gdt n GLU 102 N -2.25 0.07 -2.31 1.61 1.02 -1.26 -4.89 120.64 112.63 2gdt n GLU 102 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 2gdt n GLU 102 Cb 0.03 -1.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.00 2gdt n GLU 102 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2gdt n THR 103 N -0.92-10.07 -1.54 2.62 -1.04 -1.26 -4.87 114.28 97.20 2gdt n THR 103 Ca 0.01 1.91 -0.29 0.00 -2.04 0.00 0.00 64.05 63.64 2gdt n THR 103 Cb 0.01 -5.82 0.12 0.00 -1.82 0.00 0.00 70.33 62.82 2gdt n THR 103 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2gdt s PRO 104 N -0.85 1.45 -0.06 -2.82 0.04 -1.26 -4.80 135.00 126.69 2gdt s PRO 104 Ca -0.17 0.41 0.08 0.00 0.04 0.00 0.00 61.00 61.36 2gdt s PRO 104 Cb 0.01 -1.86 -0.12 0.00 0.04 0.00 0.00 34.50 32.57 2gdt s PRO 104 CO 0.58 -2.01 0.08 0.44 0.04 0.00 0.00 177.00 176.13 2gdt n ILE 105 N -3.66 0.41 -3.93 0.56 -0.00 -1.06 -5.04 119.36 106.63 2gdt n ILE 105 Ca 0.07 -0.32 -0.12 0.00 -0.00 0.00 0.00 62.75 62.38 2gdt n ILE 105 Cb 0.58 -0.44 -0.00 0.00 -0.00 0.00 0.00 39.64 39.78 2gdt n ILE 105 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2gdt s ALA 106 N -2.34 -0.01 0.16 -1.28 0.00 -1.24 -5.03 121.76 112.02 2gdt s ALA 106 Ca -0.04 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.85 2gdt s ALA 106 Cb 0.04 0.89 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 2gdt s ALA 106 CO 0.36 -0.90 -0.14 0.71 0.00 0.00 0.00 175.76 175.80 2gdt s TYR 107 N -2.54 1.54 0.00 0.00 1.51 -1.26 -0.11 117.35 116.50 2gdt s TYR 107 Ca 0.23 -0.59 0.03 0.00 -1.01 0.00 0.00 57.07 55.73 2gdt s TYR 107 Cb -0.03 -0.76 -0.01 0.00 -0.11 0.00 0.00 41.96 41.05 2gdt s TYR 107 CO 0.16 0.23 -0.09 0.50 -1.11 0.00 0.00 175.55 175.24 2gdt s ARG 108 N -3.24 0.73 -0.11 -0.62 6.06 0.52 -4.84 118.95 117.44 2gdt s ARG 108 Ca 0.16 -0.39 -0.02 0.00 -2.50 0.00 0.00 55.73 52.98 2gdt s ARG 108 Cb -0.02 -0.70 -0.03 0.00 0.06 0.00 0.00 34.95 34.26 2gdt s ARG 108 CO 0.04 0.19 -0.05 1.21 -2.50 0.00 0.00 175.30 174.19 2gdt s ASN 109 N -0.39 4.79 0.26 -2.12 3.84 -1.26 -0.42 114.94 119.65 2gdt s ASN 109 Ca 0.02 -0.05 0.03 0.00 0.21 0.00 0.00 52.86 53.07 2gdt s ASN 109 Cb -0.04 -1.51 -0.04 0.00 -0.55 0.00 0.00 41.25 39.12 2gdt s ASN 109 CO -0.00 0.27 0.20 0.68 -2.79 0.00 0.00 177.10 175.46 2gdt s VAL 110 N -0.27 0.01 0.14 -5.21 -7.23 -0.15 -4.97 120.40 102.73 2gdt s VAL 110 Ca 0.04 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.30 2gdt s VAL 110 Cb -0.13 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2gdt s VAL 110 CO 0.02 0.00 -0.11 -0.76 -0.31 0.00 0.00 175.10 173.94 2gdt s LEU 111 N -3.27 2.94 0.17 1.32 2.01 -1.26 -0.44 118.68 120.16 2gdt s LEU 111 Ca 0.40 -0.51 0.10 0.00 0.01 0.00 0.00 54.13 54.12 2gdt s LEU 111 Cb 0.05 -1.69 -0.04 0.00 0.01 0.00 0.00 46.19 44.51 2gdt s LEU 111 CO 0.19 0.14 -0.17 -0.22 1.01 0.00 0.00 176.35 177.31 2gdt s LEU 112 N -2.51 2.72 0.35 1.79 0.20 0.13 -3.77 118.68 117.59 2gdt s LEU 112 Ca 0.22 -0.69 -0.29 0.00 0.69 0.00 0.00 54.13 54.07 2gdt s LEU 112 Cb -0.10 -1.45 -0.11 0.00 -0.43 0.00 0.00 46.19 44.10 2gdt s LEU 112 CO 0.14 0.12 1.49 0.00 -0.29 0.00 0.00 176.35 177.81 2gdt s ARG 113 N -2.65 4.14 -0.03 1.98 3.03 -1.26 -1.05 118.95 123.11 2gdt s ARG 113 Ca 0.22 2.53 -0.01 0.00 2.03 0.00 0.00 55.73 60.49 2gdt s ARG 113 Cb -0.09 -3.00 0.02 0.00 -1.03 0.00 0.00 34.95 30.86 2gdt s ARG 113 CO 0.12 -0.51 0.06 0.15 -1.13 0.00 0.00 175.30 173.99 2gdt s LYS 114 N -1.65 0.02 0.02 3.89 1.02 -1.26 -4.71 119.74 117.07 2gdt s LYS 114 Ca 0.55 0.18 0.00 0.00 0.02 0.00 0.00 55.97 56.72 2gdt s LYS 114 Cb -0.46 -0.13 0.00 0.00 -0.52 0.00 0.00 37.83 36.72 2gdt s LYS 114 CO 0.58 -0.11 0.00 0.27 -0.92 0.00 0.00 175.35 175.17 2gdt n ASN 115 N 3.76 0.26 0.00 2.83 0.23 -1.26 -2.68 115.26 118.40 2gdt n ASN 115 Ca -0.22 0.03 0.00 0.00 -0.53 0.00 0.00 54.58 53.87 2gdt n ASN 115 Cb 0.54 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 38.16 2gdt n ASN 115 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94