#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gdt s ALA 4 N 0.00 0.85 0.80 7.82 0.00 -1.26 -5.01 121.76 124.96 3gdt s ALA 4 Ca 0.00 -0.61 -0.11 0.00 0.00 0.00 0.00 51.96 51.24 3gdt s ALA 4 Cb 0.00 -3.02 0.07 0.00 0.00 0.00 0.00 23.12 20.17 3gdt s ALA 4 CO 0.00 -3.11 1.09 0.95 0.00 0.00 0.00 175.76 174.69 3gdt s THR 5 N -3.01 3.19 0.28 0.00 -4.23 -1.26 -4.82 115.64 105.78 3gdt s THR 5 Ca 0.67 0.38 -0.03 0.00 -1.18 0.00 0.00 61.69 61.54 3gdt s THR 5 Cb -0.15 -3.04 0.23 0.00 1.34 0.00 0.00 72.50 70.88 3gdt s THR 5 CO 0.57 -0.50 1.92 1.88 -0.54 0.00 0.00 174.62 177.94 3gdt h TYR 6 N -1.13 1.04 -0.39 3.99 0.05 -1.95 -1.18 116.97 117.41 3gdt h TYR 6 Ca -0.47 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.30 3gdt h TYR 6 Cb 1.26 -0.34 -0.02 0.00 1.01 0.00 0.00 36.73 38.64 3gdt h TYR 6 CO 0.50 0.71 0.24 -0.22 -1.05 0.00 0.00 178.16 178.33 3gdt h LYS 7 N 1.09 0.53 -0.64 4.88 3.64 -1.92 -1.70 116.57 122.45 3gdt h LYS 7 Ca 0.28 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.55 3gdt h LYS 7 Cb -0.01 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 3gdt h LYS 7 CO -0.05 0.40 0.17 0.93 -2.27 0.00 0.00 179.45 178.63 3gdt h GLU 8 N 0.52 1.02 -0.18 1.90 5.08 -1.81 -2.87 114.58 118.23 3gdt h GLU 8 Ca 0.14 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 3gdt h GLU 8 Cb 0.00 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 3gdt h GLU 8 CO -0.03 0.91 -0.20 0.00 -1.00 0.00 0.00 179.01 178.69 3gdt h ARG 9 N 0.94 0.32 -0.40 2.33 3.08 -1.01 -2.77 114.38 116.86 3gdt h ARG 9 Ca 0.20 -0.10 -0.09 0.00 0.07 0.00 0.00 59.98 60.06 3gdt h ARG 9 Cb 0.34 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 3gdt h ARG 9 CO 0.00 0.52 -0.14 0.00 -1.07 0.00 0.00 179.97 179.28 3gdt h ALA 10 N 1.50 1.01 0.00 0.04 0.00 -1.10 -1.77 119.26 118.94 3gdt h ALA 10 Ca 0.05 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3gdt h ALA 10 Cb 0.53 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3gdt h ALA 10 CO 0.04 0.59 -0.05 0.00 0.00 0.00 0.00 179.25 179.83 3gdt h ALA 11 N 1.19 1.00 -0.02 0.00 0.00 -1.31 -3.26 119.26 116.87 3gdt h ALA 11 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3gdt h ALA 11 Cb 0.61 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3gdt h ALA 11 CO 0.04 0.06 0.00 0.25 0.00 0.00 0.00 179.25 179.60 3gdt n THR 12 N -3.15 0.14 -2.47 0.00 -2.24 -1.15 -5.04 114.28 100.37 3gdt n THR 12 Ca 0.01 -0.57 -0.41 0.00 -2.27 0.00 0.00 64.05 60.80 3gdt n THR 12 Cb 0.35 0.98 -0.04 0.00 -2.10 0.00 0.00 70.33 69.53 3gdt n THR 12 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3gdt s HIS 13 N -0.35 3.52 0.23 4.78 2.46 -0.68 -4.94 115.29 120.32 3gdt s HIS 13 Ca 0.04 1.49 0.30 0.00 0.47 0.00 0.00 55.06 57.36 3gdt s HIS 13 Cb 0.02 -3.34 1.34 0.00 -0.13 0.00 0.00 32.58 30.48 3gdt s HIS 13 CO 0.04 -0.88 1.99 -1.00 -2.47 0.00 0.00 174.74 172.42 3gdt h PRO 14 N 5.59 0.00 -5.19 2.88 0.13 -1.91 -3.43 132.00 130.07 3gdt h PRO 14 Ca -0.44 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.07 3gdt h PRO 14 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 3gdt h PRO 14 CO 0.75 0.10 -0.31 0.45 -0.23 0.00 0.00 178.00 178.76 3gdt s SER 15 N -5.91 6.25 0.45 1.44 0.15 -1.26 -4.80 113.70 110.03 3gdt s SER 15 Ca -0.00 0.29 0.11 0.00 0.70 0.00 0.00 55.95 57.04 3gdt s SER 15 Cb 0.11 -2.19 1.00 0.00 -1.71 0.00 0.00 66.02 63.23 3gdt s SER 15 CO 0.57 -0.09 2.07 -0.65 1.20 0.00 0.00 173.24 176.35 3gdt h PRO 16 N 7.82 0.30 -0.23 5.44 0.11 -1.83 -0.37 132.00 143.24 3gdt h PRO 16 Ca -0.35 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.64 3gdt h PRO 16 Cb 1.17 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3gdt h PRO 16 CO 0.66 0.23 -0.24 0.28 -0.21 0.00 0.00 178.00 178.72 3gdt h VAL 17 N 0.31 1.32 -0.55 3.15 2.07 -1.91 -0.80 116.25 119.84 3gdt h VAL 17 Ca 0.08 -1.41 -0.08 0.00 0.82 0.00 0.00 66.70 66.11 3gdt h VAL 17 Cb 0.02 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 3gdt h VAL 17 CO -0.01 0.44 0.02 0.00 0.02 0.00 0.00 177.57 178.04 3gdt h ALA 18 N 0.66 0.74 -0.47 1.67 0.00 -1.85 -0.13 119.26 119.88 3gdt h ALA 18 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3gdt h ALA 18 Cb 0.80 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3gdt h ALA 18 CO 0.06 0.54 0.30 0.00 0.00 0.00 0.00 179.25 180.15 3gdt h ALA 19 N 0.97 0.60 -0.55 0.00 0.00 -1.03 0.95 119.26 120.19 3gdt h ALA 19 Ca 0.16 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3gdt h ALA 19 Cb 0.51 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3gdt h ALA 19 CO 0.02 0.07 0.33 -0.22 0.00 0.00 0.00 179.25 179.45 3gdt h LYS 20 N 0.64 0.76 -0.25 0.00 3.64 -0.84 -1.73 116.57 118.78 3gdt h LYS 20 Ca 0.17 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 3gdt h LYS 20 Cb -0.04 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 3gdt h LYS 20 CO -0.03 0.56 0.06 1.25 -2.27 0.00 0.00 179.45 179.01 3gdt h LEU 21 N 0.74 0.39 -1.27 5.20 5.85 -0.56 -1.63 115.31 124.03 3gdt h LEU 21 Ca 0.20 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.69 3gdt h LEU 21 Cb 0.00 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 3gdt h LEU 21 CO -0.04 0.53 0.50 -0.26 -0.34 0.00 0.00 178.44 178.83 3gdt h PHE 22 N 0.23 0.93 -0.34 1.25 0.04 -0.67 -0.73 116.94 117.65 3gdt h PHE 22 Ca 0.08 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.75 3gdt h PHE 22 Cb 0.29 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 3gdt h PHE 22 CO 0.01 0.57 -0.29 -0.91 -0.60 0.00 0.00 178.31 177.10 3gdt h ASN 23 N 0.99 0.74 -0.45 2.17 -0.26 -1.13 -1.71 115.58 115.94 3gdt h ASN 23 Ca 0.28 -0.29 -0.04 0.00 -0.56 0.00 0.00 56.30 55.69 3gdt h ASN 23 Cb -0.08 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 36.96 3gdt h ASN 23 CO -0.07 0.99 0.14 0.40 -1.06 0.00 0.00 177.43 177.83 3gdt h ILE 24 N 0.61 1.22 -0.52 2.81 2.04 -0.51 -0.21 117.51 122.97 3gdt h ILE 24 Ca 0.07 -0.75 0.01 0.00 1.00 0.00 0.00 64.86 65.19 3gdt h ILE 24 Cb 0.80 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3gdt h ILE 24 CO 0.07 0.27 0.33 0.24 0.00 0.00 0.00 178.15 179.06 3gdt h MET 25 N 0.59 0.66 -0.06 2.37 2.86 -0.95 -0.54 114.93 119.85 3gdt h MET 25 Ca 0.14 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 3gdt h MET 25 Cb 0.27 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 3gdt h MET 25 CO -0.00 0.43 0.00 1.25 1.06 0.00 0.00 176.91 179.65 3gdt h HIS 26 N 0.68 0.12 -0.52 -0.22 -0.00 -1.12 0.35 115.15 114.44 3gdt h HIS 26 Ca 0.20 -0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.49 3gdt h HIS 26 Cb -0.05 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.30 3gdt h HIS 26 CO -0.05 0.36 0.11 0.93 -0.00 0.00 0.00 177.93 179.29 3gdt h GLU 27 N -0.16 0.81 -0.02 5.26 5.08 -0.87 -2.92 114.58 121.75 3gdt h GLU 27 Ca 0.02 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 3gdt h GLU 27 Cb 0.32 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3gdt h GLU 27 CO 0.00 0.74 -0.18 1.63 -1.00 0.00 0.00 179.01 180.21 3gdt n LYS 28 N -4.27 1.84 -3.68 2.33 5.02 -0.22 -4.98 118.16 114.20 3gdt n LYS 28 Ca 0.04 -1.49 -0.22 0.00 -2.02 0.00 0.00 58.31 54.62 3gdt n LYS 28 Cb 0.24 -1.47 0.03 0.00 -0.02 0.00 0.00 35.03 33.81 3gdt n LYS 28 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3gdt n GLN 29 N 0.72 -4.30 -3.82 1.97 6.02 0.03 -5.00 117.38 113.00 3gdt n GLN 29 Ca 0.13 0.61 -0.12 0.00 -0.01 0.00 0.00 57.00 57.60 3gdt n GLN 29 Cb 0.53 -5.09 -0.12 0.00 1.02 0.00 0.00 30.24 26.58 3gdt n GLN 29 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3gdt s THR 30 N -3.64 0.00 -0.12 5.09 -1.32 -0.69 -4.82 115.64 110.15 3gdt s THR 30 Ca 0.08 -0.03 0.14 0.00 -1.21 0.00 0.00 61.69 60.67 3gdt s THR 30 Cb -0.02 -0.25 0.32 0.00 -1.51 0.00 0.00 72.50 71.03 3gdt s THR 30 CO 0.81 -0.02 1.16 -0.46 -2.21 0.00 0.00 174.62 173.91 3gdt n ASN 31 N 2.92 1.54 -4.75 8.08 0.23 -1.26 -4.27 115.26 117.74 3gdt n ASN 31 Ca -0.13 -3.05 -0.37 0.00 -0.53 0.00 0.00 54.58 50.50 3gdt n ASN 31 Cb 0.59 -0.41 -0.06 0.00 -2.08 0.00 0.00 39.78 37.81 3gdt n ASN 31 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 3gdt s LEU 32 N -2.10 4.31 -0.14 -4.53 2.96 -1.26 -1.43 118.68 116.49 3gdt s LEU 32 Ca 0.30 0.74 0.01 0.00 -0.22 0.00 0.00 54.13 54.96 3gdt s LEU 32 Cb 0.29 -2.55 0.00 0.00 0.50 0.00 0.00 46.19 44.43 3gdt s LEU 32 CO -0.05 0.11 -0.18 0.00 -1.32 0.00 0.00 176.35 174.91 3gdt s ALA 34 N 0.68 3.56 -0.45 0.00 0.00 -0.71 -1.32 121.76 123.52 3gdt s ALA 34 Ca -0.09 -0.58 -0.12 0.00 0.00 0.00 0.00 51.96 51.17 3gdt s ALA 34 Cb -0.16 -2.74 0.08 0.00 0.00 0.00 0.00 23.12 20.30 3gdt s ALA 34 CO 0.02 -0.50 0.34 0.45 0.00 0.00 0.00 175.76 176.06 3gdt s SER 35 N 1.30 5.90 -0.20 0.00 0.15 0.45 -0.32 113.70 120.97 3gdt s SER 35 Ca 0.20 -1.46 -0.06 0.00 0.70 0.00 0.00 55.95 55.33 3gdt s SER 35 Cb -0.15 -2.09 -0.03 0.00 -1.71 0.00 0.00 66.02 62.04 3gdt s SER 35 CO 0.09 -0.61 0.02 -0.76 1.20 0.00 0.00 173.24 173.18 3gdt s LEU 36 N 1.53 3.40 -0.60 3.45 1.43 -0.78 -4.30 118.68 122.80 3gdt s LEU 36 Ca 0.04 -0.14 0.06 0.00 -1.03 0.00 0.00 54.13 53.05 3gdt s LEU 36 Cb -0.24 -1.87 0.24 0.00 0.03 0.00 0.00 46.19 44.35 3gdt s LEU 36 CO 0.04 0.07 0.69 -0.90 0.23 0.00 0.00 176.35 176.48 3gdt n ASP 37 N 4.19 3.02 -4.82 2.29 5.75 -1.26 -3.63 116.55 122.10 3gdt n ASP 37 Ca -0.17 -3.28 -0.23 0.00 -0.01 0.00 0.00 54.79 51.10 3gdt n ASP 37 Cb 0.52 -0.67 -0.05 0.00 -1.03 0.00 0.00 41.12 39.89 3gdt n ASP 37 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3gdt s VAL 38 N -2.15 4.48 0.17 2.12 -7.23 -1.26 -5.05 120.40 111.49 3gdt s VAL 38 Ca 0.38 -1.30 0.03 0.00 -1.81 0.00 0.00 61.98 59.28 3gdt s VAL 38 Cb 0.14 -3.38 -0.14 0.00 0.56 0.00 0.00 36.38 33.56 3gdt s VAL 38 CO -0.04 -0.28 1.40 0.03 -0.31 0.00 0.00 175.10 175.90 3gdt h ARG 39 N 1.76 0.18 -6.78 4.82 -0.00 -1.98 -3.38 114.38 109.00 3gdt h ARG 39 Ca -0.48 -0.19 -0.69 0.00 -0.50 0.00 0.00 59.98 58.12 3gdt h ARG 39 Cb 1.23 0.05 -0.21 0.00 0.00 0.00 0.00 29.97 31.04 3gdt h ARG 39 CO 0.61 0.92 -0.84 0.95 0.00 0.00 0.00 179.97 181.62 3gdt s THR 40 N -3.26 2.50 0.42 2.04 -4.23 -1.26 -0.34 115.64 111.51 3gdt s THR 40 Ca -0.03 -1.55 0.08 0.00 -1.18 0.00 0.00 61.69 59.01 3gdt s THR 40 Cb 0.10 -2.10 0.25 0.00 1.34 0.00 0.00 72.50 72.10 3gdt s THR 40 CO 0.82 0.16 2.05 0.74 -0.54 0.00 0.00 174.62 177.85 3gdt h THR 41 N 3.82 1.10 0.23 3.99 2.02 -1.90 -1.73 112.91 120.45 3gdt h THR 41 Ca -0.50 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.42 3gdt h THR 41 Cb 1.16 0.65 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 3gdt h THR 41 CO 0.43 0.11 -0.11 0.50 0.37 0.00 0.00 175.52 176.82 3gdt h LYS 42 N 0.46 -0.30 -0.70 6.66 3.64 -1.95 -0.56 116.57 123.82 3gdt h LYS 42 Ca 0.12 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 3gdt h LYS 42 Cb 0.00 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 3gdt h LYS 42 CO -0.02 -0.17 0.31 1.49 -2.27 0.00 0.00 179.45 178.79 3gdt h GLU 43 N -0.35 1.03 -0.11 1.90 4.81 -1.91 -1.88 114.58 118.07 3gdt h GLU 43 Ca -0.03 -0.17 0.03 0.00 -0.13 0.00 0.00 59.36 59.06 3gdt h GLU 43 Cb 0.27 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 3gdt h GLU 43 CO 0.05 0.84 -0.11 1.25 -0.73 0.00 0.00 179.01 180.31 3gdt h LEU 44 N 0.99 -0.33 -1.12 1.64 5.85 -1.09 -0.93 115.31 120.33 3gdt h LEU 44 Ca 0.24 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.98 3gdt h LEU 44 Cb 0.17 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 3gdt h LEU 44 CO -0.02 -0.14 0.15 -0.07 -0.34 0.00 0.00 178.44 178.02 3gdt h LEU 45 N -0.13 0.72 -0.02 2.25 3.38 -0.92 -0.66 115.31 119.92 3gdt h LEU 45 Ca 0.08 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 3gdt h LEU 45 Cb 0.24 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3gdt h LEU 45 CO -0.19 0.69 0.01 -0.33 0.09 0.00 0.00 178.44 178.71 3gdt h GLU 46 N 0.76 0.03 -0.55 1.13 5.08 -0.86 -2.01 114.58 118.17 3gdt h GLU 46 Ca 0.17 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 3gdt h GLU 46 Cb 0.24 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 3gdt h GLU 46 CO -0.01 0.14 0.27 -0.07 -1.00 0.00 0.00 179.01 178.34 3gdt h LEU 47 N -0.09 0.71 -0.98 1.33 3.38 -0.87 -2.30 115.31 116.50 3gdt h LEU 47 Ca 0.01 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 3gdt h LEU 47 Cb 0.12 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3gdt h LEU 47 CO -0.00 0.63 0.22 0.58 0.09 0.00 0.00 178.44 179.97 3gdt h VAL 48 N 0.73 1.23 -0.33 1.22 2.07 -1.07 0.87 116.25 120.97 3gdt h VAL 48 Ca 0.19 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 3gdt h VAL 48 Cb 0.11 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 3gdt h VAL 48 CO -0.02 0.31 0.17 -0.08 0.02 0.00 0.00 177.57 177.96 3gdt h GLU 49 N 0.94 0.48 -0.63 1.57 4.57 -1.14 0.54 114.58 120.90 3gdt h GLU 49 Ca 0.21 -0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 58.26 3gdt h GLU 49 Cb 0.24 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.71 3gdt h GLU 49 CO -0.01 0.42 0.13 0.00 -1.18 0.00 0.00 179.01 178.37 3gdt h ALA 50 N 1.03 0.83 0.00 2.92 0.00 -0.92 -3.18 119.26 119.93 3gdt h ALA 50 Ca 0.12 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3gdt h ALA 50 Cb 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3gdt h ALA 50 CO -0.02 0.56 -0.49 -0.07 0.00 0.00 0.00 179.25 179.23 3gdt h LEU 51 N 0.93 0.00 -0.98 0.00 3.38 -0.62 -3.40 115.31 114.62 3gdt h LEU 51 Ca 0.19 -0.05 0.17 0.00 0.09 0.00 0.00 57.88 58.28 3gdt h LEU 51 Cb 0.39 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.97 3gdt h LEU 51 CO 0.01 0.03 -0.34 1.23 0.09 0.00 0.00 178.44 179.45 3gdt h GLY 52 N 4.20 0.27 2.00 0.83 0.00 0.10 0.27 103.07 110.74 3gdt h GLY 52 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.79 3gdt h GLY 52 CO 0.00 -0.26 0.00 -2.55 0.00 0.00 0.00 176.54 173.73 3gdt h PRO 53 N -0.01 0.00 0.00 4.80 0.11 -1.81 -3.17 132.00 131.92 3gdt h PRO 53 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 3gdt h PRO 53 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.74 3gdt h PRO 53 CO -0.99 0.00 -1.05 1.63 -0.21 0.00 0.00 178.00 177.39 3gdt n LYS 54 N -2.92 0.12 -4.35 1.05 4.76 0.06 -5.01 118.16 111.88 3gdt n LYS 54 Ca -0.00 -0.02 -0.24 0.00 -2.87 0.00 0.00 58.31 55.18 3gdt n LYS 54 Cb 0.20 -1.52 -0.08 0.00 -1.84 0.00 0.00 35.03 31.80 3gdt n LYS 54 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 3gdt s ILE 55 N -3.09 3.14 -0.23 -0.18 -4.36 -1.06 -4.58 121.20 110.84 3gdt s ILE 55 Ca 0.06 -2.04 0.14 0.00 -0.26 0.00 0.00 60.65 58.55 3gdt s ILE 55 Cb 0.16 -2.66 -0.20 0.00 1.25 0.00 0.00 42.46 41.01 3gdt s ILE 55 CO 0.84 -0.36 0.40 0.00 0.24 0.00 0.00 174.94 176.06 3gdt s LEU 57 N -3.54 0.20 -0.17 0.00 2.96 -1.22 -1.95 118.68 114.97 3gdt s LEU 57 Ca -0.02 0.85 -0.00 0.00 -0.22 0.00 0.00 54.13 54.75 3gdt s LEU 57 Cb 0.09 1.65 0.00 0.00 0.50 0.00 0.00 46.19 48.43 3gdt s LEU 57 CO 0.58 -0.22 -0.15 -0.22 -1.32 0.00 0.00 176.35 175.02 3gdt s LEU 58 N 0.01 2.44 -0.41 -0.68 2.96 -0.26 -1.74 118.68 120.99 3gdt s LEU 58 Ca -0.02 -0.51 -0.15 0.00 -0.22 0.00 0.00 54.13 53.23 3gdt s LEU 58 Cb -0.03 -1.56 0.02 0.00 0.50 0.00 0.00 46.19 45.11 3gdt s LEU 58 CO 0.02 0.05 0.32 -0.75 -1.32 0.00 0.00 176.35 174.66 3gdt s LYS 59 N 1.04 3.00 0.57 1.98 2.20 0.56 -0.66 119.74 128.43 3gdt s LYS 59 Ca -0.01 -0.97 -0.05 0.00 -0.36 0.00 0.00 55.97 54.58 3gdt s LYS 59 Cb -0.15 -3.97 0.00 0.00 -1.51 0.00 0.00 37.83 32.21 3gdt s LYS 59 CO -0.04 -0.75 0.86 0.95 -0.36 0.00 0.00 175.35 176.01 3gdt s THR 60 N 1.74 3.78 -0.40 3.43 -4.23 0.42 -1.87 115.64 118.50 3gdt s THR 60 Ca 0.06 -0.05 0.07 0.00 -1.18 0.00 0.00 61.69 60.59 3gdt s THR 60 Cb -0.19 -3.48 0.23 0.00 1.34 0.00 0.00 72.50 70.40 3gdt s THR 60 CO 0.10 -0.47 0.48 1.41 -0.54 0.00 0.00 174.62 175.60 3gdt n HIS 61 N -2.50 -0.46 0.27 3.99 8.25 -1.24 -1.28 115.22 122.25 3gdt n HIS 61 Ca 0.04 -3.51 0.12 0.00 -0.26 0.00 0.00 57.72 54.11 3gdt n HIS 61 Cb 0.57 -0.20 0.73 0.00 1.12 0.00 0.00 29.99 32.21 3gdt n HIS 61 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 3gdt h VAL 62 N 2.64 0.68 0.00 1.59 -1.51 -1.96 -2.82 116.25 114.88 3gdt h VAL 62 Ca 0.12 -0.38 -0.01 0.00 -1.23 0.00 0.00 66.70 65.20 3gdt h VAL 62 Cb 0.88 1.23 -0.00 0.00 -2.13 0.00 0.00 31.29 31.27 3gdt h VAL 62 CO 0.44 0.09 -0.06 0.44 -1.23 0.00 0.00 177.57 177.26 3gdt h ASP 63 N 0.00 0.00 0.06 4.19 3.32 -1.99 -2.42 116.42 119.58 3gdt h ASP 63 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gdt h ASP 63 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3gdt h ASP 63 CO 0.01 0.06 -0.36 2.30 -1.72 0.00 0.00 179.24 179.53 3gdt n ILE 64 N -3.35 0.00 -2.26 0.35 -5.35 -1.06 -4.92 119.36 102.76 3gdt n ILE 64 Ca -0.01 -0.23 -0.41 0.00 -0.27 0.00 0.00 62.75 61.82 3gdt n ILE 64 Cb 0.21 0.98 -0.03 0.00 -1.74 0.00 0.00 39.64 39.06 3gdt n ILE 64 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 3gdt s LEU 65 N -2.44 4.43 0.13 7.28 1.43 -0.91 -4.56 118.68 124.04 3gdt s LEU 65 Ca 0.22 2.38 0.24 0.00 -1.03 0.00 0.00 54.13 55.94 3gdt s LEU 65 Cb 0.19 -3.61 0.28 0.00 0.03 0.00 0.00 46.19 43.07 3gdt s LEU 65 CO 0.53 -0.47 1.27 0.71 0.23 0.00 0.00 176.35 178.62 3gdt h THR 66 N 3.64 0.00 -0.70 5.49 1.35 -1.00 -3.38 112.91 118.31 3gdt h THR 66 Ca -0.45 -0.55 -0.36 0.00 -0.55 0.00 0.00 66.41 64.49 3gdt h THR 66 Cb 1.22 1.11 -0.41 0.00 -1.73 0.00 0.00 68.15 68.33 3gdt h THR 66 CO 0.75 0.00 -1.04 -0.90 -0.25 0.00 0.00 175.52 174.08 3gdt n ASP 67 N -2.18 2.55 -4.77 5.36 5.68 -1.26 -5.10 116.55 116.83 3gdt n ASP 67 Ca 0.03 -2.67 -0.41 0.00 -0.50 0.00 0.00 54.79 51.24 3gdt n ASP 67 Cb 0.45 -0.46 -0.02 0.00 -1.14 0.00 0.00 41.12 39.95 3gdt n ASP 67 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 3gdt s PHE 68 N -3.61 3.08 -0.11 2.11 5.36 -1.26 -4.75 117.98 118.79 3gdt s PHE 68 Ca 0.34 1.41 -0.28 0.00 -0.96 0.00 0.00 56.93 57.44 3gdt s PHE 68 Cb 0.37 -3.66 0.07 0.00 -0.34 0.00 0.00 43.02 39.46 3gdt s PHE 68 CO -0.02 -1.81 0.67 -1.54 -1.46 0.00 0.00 175.22 171.06 3gdt s SER 69 N -0.46 -0.66 0.20 6.13 1.04 -1.26 -5.00 113.70 113.69 3gdt s SER 69 Ca 0.49 0.90 -0.09 0.00 0.48 0.00 0.00 55.95 57.73 3gdt s SER 69 Cb -0.39 0.80 0.13 0.00 0.10 0.00 0.00 66.02 66.66 3gdt s SER 69 CO 0.52 -0.49 1.78 0.24 0.98 0.00 0.00 173.24 176.26 3gdt h MET 70 N 3.64 1.08 0.05 4.02 2.86 -1.95 0.18 114.93 124.81 3gdt h MET 70 Ca -0.28 -0.18 -0.25 0.00 -2.06 0.00 0.00 59.70 56.93 3gdt h MET 70 Cb 1.15 -0.18 0.01 0.00 0.06 0.00 0.00 31.60 32.63 3gdt h MET 70 CO 0.29 0.87 -1.07 1.49 1.06 0.00 0.00 176.91 179.55 3gdt h GLU 71 N 1.05 0.42 0.00 1.72 4.57 -1.97 -0.88 114.58 119.50 3gdt h GLU 71 Ca 0.25 -0.53 -0.01 0.00 -1.18 0.00 0.00 59.36 57.89 3gdt h GLU 71 Cb 0.17 0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.92 3gdt h GLU 71 CO -0.03 1.19 -1.35 0.41 -1.18 0.00 0.00 179.01 178.06 3gdt n GLY 72 N 1.17 -1.30 0.61 1.92 0.00 -1.20 -4.24 105.19 102.14 3gdt n GLY 72 Ca -0.09 -0.32 -0.04 0.00 0.00 0.00 0.00 46.02 45.58 3gdt n GLY 72 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3gdt n THR 73 N -2.56 1.36 -0.12 2.61 -1.04 0.63 -4.63 114.28 110.53 3gdt n THR 73 Ca -0.02 0.29 -0.10 0.00 -2.04 0.00 0.00 64.05 62.18 3gdt n THR 73 Cb 0.58 -1.94 -0.02 0.00 -1.82 0.00 0.00 70.33 67.13 3gdt n THR 73 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3gdt h VAL 74 N -0.46 1.21 0.27 12.58 2.07 -1.39 -2.04 116.25 128.49 3gdt h VAL 74 Ca -0.00 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.83 3gdt h VAL 74 Cb 0.46 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 3gdt h VAL 74 CO -0.00 0.24 -0.31 0.50 0.02 0.00 0.00 177.57 178.02 3gdt h LYS 75 N 0.42 -0.60 -0.02 1.57 3.64 -1.33 0.95 116.57 121.20 3gdt h LYS 75 Ca 0.11 0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.47 3gdt h LYS 75 Cb 0.26 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3gdt h LYS 75 CO -0.00 -0.40 -0.27 -1.00 -2.27 0.00 0.00 179.45 175.51 3gdt h PRO 76 N -0.62 0.04 -0.57 1.90 0.13 -1.77 -1.89 132.00 129.22 3gdt h PRO 76 Ca -0.00 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 3gdt h PRO 76 Cb 0.58 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.69 3gdt h PRO 76 CO -0.09 0.31 -0.05 1.25 -0.23 0.00 0.00 178.00 179.20 3gdt h LEU 77 N 0.04 1.03 -0.77 1.56 5.85 -0.89 -0.57 115.31 121.55 3gdt h LEU 77 Ca 0.00 -0.33 -0.12 0.00 0.84 0.00 0.00 57.88 58.28 3gdt h LEU 77 Cb 0.50 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 3gdt h LEU 77 CO 0.04 1.11 -0.34 0.11 -0.34 0.00 0.00 178.44 179.02 3gdt h LYS 78 N 0.93 0.54 -0.52 1.25 1.79 -0.44 -0.90 116.57 119.21 3gdt h LYS 78 Ca 0.16 -0.24 -0.07 0.00 -2.18 0.00 0.00 60.65 58.32 3gdt h LYS 78 Cb 0.61 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.23 3gdt h LYS 78 CO 0.04 0.81 0.07 0.00 -1.08 0.00 0.00 179.45 179.29 3gdt h ALA 79 N 1.18 0.70 -0.56 3.86 0.00 -1.00 -1.35 119.26 122.09 3gdt h ALA 79 Ca 0.05 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 3gdt h ALA 79 Cb 0.81 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3gdt h ALA 79 CO 0.07 0.45 0.04 -0.07 0.00 0.00 0.00 179.25 179.74 3gdt h LEU 80 N 0.76 0.88 -0.86 0.00 3.38 -0.86 -0.00 115.31 118.61 3gdt h LEU 80 Ca 0.16 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 3gdt h LEU 80 Cb 0.42 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3gdt h LEU 80 CO 0.01 0.92 0.47 -1.28 0.09 0.00 0.00 178.44 178.65 3gdt h SER 81 N 0.86 1.07 -0.09 -0.43 0.87 -0.86 -0.45 113.55 114.52 3gdt h SER 81 Ca 0.17 -0.10 -0.20 0.00 -1.23 0.00 0.00 61.79 60.43 3gdt h SER 81 Cb 0.45 -0.27 0.01 0.00 -0.44 0.00 0.00 62.40 62.15 3gdt h SER 81 CO 0.02 0.86 -0.74 0.00 -0.53 0.00 0.00 176.83 176.44 3gdt h ALA 82 N 1.25 0.21 -0.52 6.23 0.00 -0.92 -0.88 119.26 124.63 3gdt h ALA 82 Ca 0.30 -0.59 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 3gdt h ALA 82 Cb 0.03 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3gdt h ALA 82 CO -0.05 0.56 -0.12 -0.22 0.00 0.00 0.00 179.25 179.42 3gdt h LYS 83 N 0.32 1.01 -0.02 0.00 3.64 -0.81 -3.26 116.57 117.45 3gdt h LYS 83 Ca -0.07 -0.39 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 3gdt h LYS 83 Cb 1.39 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 3gdt h LYS 83 CO 0.15 1.07 -0.41 0.66 -2.27 0.00 0.00 179.45 178.65 3gdt n TYR 84 N -4.16 0.00 -2.92 1.91 4.01 -0.20 -5.04 117.16 110.76 3gdt n TYR 84 Ca 0.01 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.72 3gdt n TYR 84 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 3gdt n TYR 84 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3gdt n ASN 85 N 0.06 -7.59 -3.75 7.72 5.15 -0.37 -4.67 115.26 111.81 3gdt n ASN 85 Ca 0.09 0.13 -0.10 0.00 -0.60 0.00 0.00 54.58 54.10 3gdt n ASN 85 Cb 0.45 -5.15 -0.06 0.00 -0.53 0.00 0.00 39.78 34.49 3gdt n ASN 85 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 3gdt s PHE 86 N -2.85 -0.04 0.37 1.20 -0.12 -1.01 -4.83 117.98 110.70 3gdt s PHE 86 Ca 0.08 -0.29 0.05 0.00 -0.05 0.00 0.00 56.93 56.72 3gdt s PHE 86 Cb -0.02 0.10 -0.01 0.00 -0.63 0.00 0.00 43.02 42.46 3gdt s PHE 86 CO 0.72 -0.60 0.53 -0.51 -0.05 0.00 0.00 175.22 175.31 3gdt s LEU 87 N -2.69 3.87 -0.14 -1.99 1.43 -0.82 -4.71 118.68 113.62 3gdt s LEU 87 Ca 0.02 -0.06 -0.03 0.00 -1.03 0.00 0.00 54.13 53.02 3gdt s LEU 87 Cb 0.03 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.36 3gdt s LEU 87 CO -0.10 -0.52 -0.02 -0.76 0.23 0.00 0.00 176.35 175.17 3gdt s LEU 88 N -4.29 3.35 -0.20 1.79 1.43 -1.26 -1.10 118.68 118.40 3gdt s LEU 88 Ca 0.46 -0.06 -0.00 0.00 -1.03 0.00 0.00 54.13 53.50 3gdt s LEU 88 Cb -0.10 -1.80 0.05 0.00 0.03 0.00 0.00 46.19 44.38 3gdt s LEU 88 CO 0.33 0.22 -0.03 0.12 0.23 0.00 0.00 176.35 177.21 3gdt s PHE 89 N 0.09 1.88 0.04 0.29 5.36 0.17 -1.18 117.98 124.62 3gdt s PHE 89 Ca 0.00 -1.35 -0.20 0.00 -0.96 0.00 0.00 56.93 54.42 3gdt s PHE 89 Cb -0.13 -1.38 -0.06 0.00 -0.34 0.00 0.00 43.02 41.11 3gdt s PHE 89 CO 0.02 -0.69 0.60 -2.00 -1.46 0.00 0.00 175.22 171.69 3gdt s GLU 90 N 1.57 4.29 0.20 10.12 2.56 -1.02 -0.44 118.70 135.98 3gdt s GLU 90 Ca -0.03 0.77 -0.11 0.00 0.00 0.00 0.00 54.97 55.60 3gdt s GLU 90 Cb -0.17 -3.29 0.17 0.00 2.00 0.00 0.00 34.13 32.84 3gdt s GLU 90 CO -0.07 0.50 1.83 -0.97 -0.56 0.00 0.00 175.26 175.98 3gdt h ASN 91 N 5.08 0.61 0.00 -1.70 -1.24 -1.54 -3.39 115.58 113.40 3gdt h ASN 91 Ca -0.47 0.01 -0.25 0.00 0.71 0.00 0.00 56.30 56.30 3gdt h ASN 91 Cb 1.21 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 40.12 3gdt h ASN 91 CO 0.67 0.42 0.45 -1.14 -1.29 0.00 0.00 177.43 176.53 3gdt n ARG 92 N -4.74 0.00 -2.85 6.67 3.00 -1.26 -4.78 116.66 112.70 3gdt n ARG 92 Ca 0.06 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.48 3gdt n ARG 92 Cb 0.10 -0.50 -0.02 0.00 0.00 0.00 0.00 32.46 32.05 3gdt n ARG 92 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3gdt s LYS 93 N 2.05 3.71 0.34 -0.14 1.02 -1.26 -4.30 119.74 121.16 3gdt s LYS 93 Ca 0.40 -1.83 -0.28 0.00 0.02 0.00 0.00 55.97 54.28 3gdt s LYS 93 Cb -0.49 -5.05 -0.12 0.00 -0.52 0.00 0.00 37.83 31.65 3gdt s LYS 93 CO 0.21 -1.87 1.39 1.19 -0.92 0.00 0.00 175.35 175.35 3gdt n PHE 94 N 6.86 2.56 -2.69 3.18 3.72 -1.05 -4.73 117.46 125.31 3gdt n PHE 94 Ca 0.29 0.49 -0.07 0.00 -0.05 0.00 0.00 57.45 58.11 3gdt n PHE 94 Cb 0.48 -2.47 0.09 0.00 -0.94 0.00 0.00 39.48 36.64 3gdt n PHE 94 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3gdt n ALA 95 N 0.62 1.99 -3.80 4.37 0.00 -1.26 -0.89 120.51 121.54 3gdt n ALA 95 Ca 0.04 -1.81 -0.09 0.00 0.00 0.00 0.00 53.44 51.58 3gdt n ALA 95 Cb 0.37 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 3gdt n ALA 95 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3gdt n ASP 96 N -0.53 -1.29 -3.62 0.00 -0.08 -1.26 -4.92 116.55 104.85 3gdt n ASP 96 Ca -0.01 -2.48 -0.23 0.00 -1.51 0.00 0.00 54.79 50.56 3gdt n ASP 96 Cb 0.84 2.32 -0.07 0.00 2.34 0.00 0.00 41.12 46.55 3gdt n ASP 96 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 3gdt n ILE 97 N -0.46 0.00 -4.46 5.18 -5.35 -1.26 -4.49 119.36 108.52 3gdt n ILE 97 Ca -0.01 -2.32 0.00 0.00 -0.27 0.00 0.00 62.75 60.15 3gdt n ILE 97 Cb 0.48 0.92 0.00 0.00 -1.74 0.00 0.00 39.64 39.30 3gdt n ILE 97 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3gdt n GLY 98 N -0.69 0.98 0.27 3.28 0.00 -1.26 -2.71 105.19 105.06 3gdt n GLY 98 Ca -0.02 -0.68 0.12 0.00 0.00 0.00 0.00 46.02 45.44 3gdt n GLY 98 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3gdt h ASN 99 N 5.28 0.00 0.24 1.61 2.35 -1.98 -1.57 115.58 121.51 3gdt h ASN 99 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3gdt h ASN 99 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3gdt h ASN 99 CO 0.00 0.05 -0.11 0.74 -1.65 0.00 0.00 177.43 176.45 3gdt h THR 100 N 0.00 0.80 -0.08 2.81 2.02 -1.97 -0.83 112.91 115.66 3gdt h THR 100 Ca -0.00 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 66.84 3gdt h THR 100 Cb 0.10 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 3gdt h THR 100 CO 0.01 0.05 -0.43 1.62 0.37 0.00 0.00 175.52 177.14 3gdt h VAL 101 N -0.44 1.32 -0.37 3.16 3.04 -1.25 -1.31 116.25 120.40 3gdt h VAL 101 Ca -0.03 -1.56 -0.01 0.00 -1.01 0.00 0.00 66.70 64.08 3gdt h VAL 101 Cb 0.33 1.74 -0.02 0.00 -2.01 0.00 0.00 31.29 31.34 3gdt h VAL 101 CO 0.05 0.46 0.17 0.11 -1.01 0.00 0.00 177.57 177.36 3gdt h LYS 102 N 0.15 0.54 0.00 4.17 1.57 -1.13 -2.25 116.57 119.62 3gdt h LYS 102 Ca 0.01 -0.08 -0.13 0.00 -1.87 0.00 0.00 60.65 58.58 3gdt h LYS 102 Cb 0.83 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 3gdt h LYS 102 CO 0.06 0.49 -0.63 -0.07 -0.57 0.00 0.00 179.45 178.74 3gdt h LEU 103 N 0.46 0.00 -1.33 2.94 3.38 -0.99 0.12 115.31 119.89 3gdt h LEU 103 Ca 0.13 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 3gdt h LEU 103 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3gdt h LEU 103 CO -0.02 0.63 -0.33 1.56 0.09 0.00 0.00 178.44 180.37 3gdt h GLN 104 N 0.00 0.00 0.12 1.13 4.20 -1.06 0.78 115.11 120.28 3gdt h GLN 104 Ca -0.01 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.35 3gdt h GLN 104 Cb 1.20 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.96 3gdt h GLN 104 CO 0.08 0.33 -1.89 -0.92 -0.67 0.00 0.00 178.83 175.76 3gdt h TYR 105 N 0.00 0.46 0.01 2.96 3.20 -1.18 -3.42 116.97 119.00 3gdt h TYR 105 Ca -0.00 -0.33 -0.32 0.00 3.14 0.00 0.00 58.73 61.21 3gdt h TYR 105 Cb 0.62 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.82 3gdt h TYR 105 CO 0.00 1.64 -1.94 -1.13 -1.64 0.00 0.00 178.16 175.09 3gdt n SER 106 N -3.44 0.82 0.00 -2.11 3.41 0.38 -0.62 113.62 112.06 3gdt n SER 106 Ca -0.28 0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 3gdt n SER 106 Cb 1.05 0.11 0.00 0.00 -0.26 0.00 0.00 64.21 65.11 3gdt n SER 106 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gdt n ALA 107 N -2.67 0.00 -0.29 7.33 0.00 0.26 -4.46 120.51 120.67 3gdt n ALA 107 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.20 3gdt n ALA 107 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.53 3gdt n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gdt n GLY 108 N 5.00 -1.36 0.12 0.00 0.00 -1.26 -1.58 105.19 106.11 3gdt n GLY 108 Ca 0.00 -1.25 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 3gdt n GLY 108 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3gdt h VAL 109 N 0.00 1.51 0.00 1.61 2.07 -1.97 -3.33 116.25 116.13 3gdt h VAL 109 Ca 0.00 -2.85 -0.14 0.00 0.82 0.00 0.00 66.70 64.53 3gdt h VAL 109 Cb 0.00 2.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 3gdt h VAL 109 CO 0.00 0.83 -0.65 1.88 0.02 0.00 0.00 177.57 179.65 3gdt h TYR 110 N 0.10 0.00 -6.83 1.57 0.05 -1.97 -3.45 116.97 106.44 3gdt h TYR 110 Ca -0.08 0.00 -0.48 0.00 0.05 0.00 0.00 58.73 58.22 3gdt h TYR 110 Cb 1.73 0.00 -0.10 0.00 1.01 0.00 0.00 36.73 39.37 3gdt h TYR 110 CO 0.04 0.65 -0.77 0.54 -1.05 0.00 0.00 178.16 177.57 3gdt n ARG 111 N -3.38 -0.69 -0.24 4.88 1.74 -0.61 -4.81 116.66 113.55 3gdt n ARG 111 Ca 0.01 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.13 3gdt n ARG 111 Cb 0.75 -2.29 0.16 0.00 -1.02 0.00 0.00 32.46 30.05 3gdt n ARG 111 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3gdt h ILE 112 N -1.28 0.47 -0.04 0.55 2.04 -1.74 -1.60 117.51 115.91 3gdt h ILE 112 Ca -0.54 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.27 3gdt h ILE 112 Cb 1.10 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3gdt h ILE 112 CO 0.49 0.04 0.09 0.00 0.00 0.00 0.00 178.15 178.76 3gdt h ALA 113 N 1.62 1.31 0.00 1.87 0.00 -1.15 -0.41 119.26 122.50 3gdt h ALA 113 Ca 0.39 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.24 3gdt h ALA 113 Cb 0.68 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3gdt h ALA 113 CO -0.55 -0.11 -0.30 0.93 0.00 0.00 0.00 179.25 179.22 3gdt h GLU 114 N 0.00 0.00 0.00 0.00 5.08 -1.55 -3.39 114.58 114.71 3gdt h GLU 114 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3gdt h GLU 114 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3gdt h GLU 114 CO -0.00 0.30 -0.42 -2.67 -1.00 0.00 0.00 179.01 175.21 3gdt n TRP 115 N -3.48 0.00 -2.77 4.33 4.27 -0.74 -5.04 117.44 114.00 3gdt n TRP 115 Ca -0.00 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.18 3gdt n TRP 115 Cb 0.46 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.38 3gdt n TRP 115 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3gdt s ALA 116 N -0.98 3.50 0.22 -1.67 0.00 -0.24 -4.79 121.76 117.79 3gdt s ALA 116 Ca 0.00 -0.25 -0.07 0.00 0.00 0.00 0.00 51.96 51.64 3gdt s ALA 116 Cb 0.00 -3.52 0.18 0.00 0.00 0.00 0.00 23.12 19.78 3gdt s ALA 116 CO 0.00 -1.40 1.76 -0.44 0.00 0.00 0.00 175.76 175.68 3gdt h ASP 117 N 8.16 1.06 -4.29 0.00 3.32 -1.48 -3.44 116.42 119.75 3gdt h ASP 117 Ca -0.22 -0.19 -0.52 0.00 0.02 0.00 0.00 57.03 56.12 3gdt h ASP 117 Cb 1.08 -0.28 -0.28 0.00 0.22 0.00 0.00 39.33 40.07 3gdt h ASP 117 CO 0.97 0.97 -0.82 -0.63 -1.72 0.00 0.00 179.24 178.01 3gdt s ILE 118 N -5.42 1.31 0.32 0.35 1.01 -0.42 -0.99 121.20 117.36 3gdt s ILE 118 Ca -0.12 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.72 3gdt s ILE 118 Cb 0.15 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 3gdt s ILE 118 CO 0.84 0.25 0.17 0.42 0.00 0.00 0.00 174.94 176.63 3gdt s THR 119 N -0.56 0.29 0.04 2.92 -4.23 -0.83 -2.42 115.64 110.86 3gdt s THR 119 Ca 0.05 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.56 3gdt s THR 119 Cb -0.07 -2.49 -0.03 0.00 1.34 0.00 0.00 72.50 71.25 3gdt s THR 119 CO 0.00 0.00 -0.04 0.54 -0.54 0.00 0.00 174.62 174.59 3gdt s ASN 120 N -3.39 0.45 0.02 3.99 2.20 -1.26 -0.92 114.94 116.03 3gdt s ASN 120 Ca 0.35 -0.74 0.01 0.00 -0.94 0.00 0.00 52.86 51.54 3gdt s ASN 120 Cb 0.04 0.14 -0.02 0.00 -2.00 0.00 0.00 41.25 39.41 3gdt s ASN 120 CO 0.19 -0.43 -0.04 0.00 -2.94 0.00 0.00 177.10 173.87 3gdt s ALA 121 N -2.61 0.27 0.16 3.54 0.00 -0.17 -2.51 121.76 120.44 3gdt s ALA 121 Ca -0.04 -0.59 -0.29 0.00 0.00 0.00 0.00 51.96 51.04 3gdt s ALA 121 Cb -0.02 0.09 -0.07 0.00 0.00 0.00 0.00 23.12 23.13 3gdt s ALA 121 CO -0.05 -0.09 0.92 -1.01 0.00 0.00 0.00 175.76 175.53 3gdt s HIS 122 N -1.27 3.88 -0.79 0.00 3.76 -0.07 -1.05 115.29 119.75 3gdt s HIS 122 Ca -0.12 1.80 0.27 0.00 -0.15 0.00 0.00 55.06 56.86 3gdt s HIS 122 Cb -0.09 -2.98 0.84 0.00 1.11 0.00 0.00 32.58 31.46 3gdt s HIS 122 CO -0.00 0.33 1.74 0.41 -0.85 0.00 0.00 174.74 176.37 3gdt n GLY 123 N 1.93 -1.61 0.43 -2.22 0.00 -1.26 -4.16 105.19 98.30 3gdt n GLY 123 Ca -0.00 -0.08 0.24 0.00 0.00 0.00 0.00 46.02 46.17 3gdt n GLY 123 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3gdt h VAL 124 N 0.00 0.56 0.00 1.61 3.04 -1.94 -0.65 116.25 118.86 3gdt h VAL 124 Ca 0.00 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.59 3gdt h VAL 124 Cb 0.67 0.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.18 3gdt h VAL 124 CO 0.00 0.06 0.00 1.33 -1.01 0.00 0.00 177.57 177.95 3gdt n VAL 125 N -4.50 0.11 0.00 1.51 0.24 -1.26 -5.03 118.33 109.41 3gdt n VAL 125 Ca 0.23 0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.56 3gdt n VAL 125 Cb 0.88 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 32.68 3gdt n VAL 125 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3gdt n GLY 126 N 1.15 0.78 0.16 7.63 0.00 -0.25 -4.59 105.19 110.07 3gdt n GLY 126 Ca 0.11 -1.96 0.10 0.00 0.00 0.00 0.00 46.02 44.26 3gdt n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3gdt n PRO 127 N 1.12 0.12 0.30 1.61 -0.04 -1.26 -2.27 135.00 134.58 3gdt n PRO 127 Ca 0.00 0.62 0.16 0.00 -0.04 0.00 0.00 63.50 64.24 3gdt n PRO 127 Cb 0.00 -2.00 0.94 0.00 -0.04 0.00 0.00 33.50 32.40 3gdt n PRO 127 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3gdt h GLY 128 N 0.00 0.00 1.67 0.55 0.00 -1.96 -1.09 103.07 102.24 3gdt h GLY 128 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 3gdt h GLY 128 CO 0.00 0.00 -0.62 1.19 0.00 0.00 0.00 176.54 177.11 3gdt h ILE 129 N 0.00 1.37 0.10 2.60 2.10 -1.68 -1.06 117.51 120.94 3gdt h ILE 129 Ca -0.00 -1.98 -0.00 0.00 1.08 0.00 0.00 64.86 63.95 3gdt h ILE 129 Cb 0.07 1.98 0.00 0.00 -1.09 0.00 0.00 36.82 37.79 3gdt h ILE 129 CO 0.00 0.59 -0.05 0.58 -1.08 0.00 0.00 178.15 178.20 3gdt h VAL 130 N 0.25 1.13 -0.46 2.19 2.07 -1.43 -1.64 116.25 118.36 3gdt h VAL 130 Ca -0.01 -1.01 -0.06 0.00 0.82 0.00 0.00 66.70 66.44 3gdt h VAL 130 Cb 1.15 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.66 3gdt h VAL 130 CO 0.10 0.24 0.04 0.77 0.02 0.00 0.00 177.57 178.74 3gdt h SER 131 N -0.61 0.68 -0.04 0.57 4.64 -1.46 -0.57 113.55 116.76 3gdt h SER 131 Ca -0.01 -0.14 -0.01 0.00 -0.47 0.00 0.00 61.79 61.16 3gdt h SER 131 Cb 0.49 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3gdt h SER 131 CO 0.02 0.73 -0.01 1.23 -0.87 0.00 0.00 176.83 177.93 3gdt h GLY 132 N 0.94 0.09 1.45 -0.77 0.00 -1.21 -1.39 103.07 102.17 3gdt h GLY 132 Ca 0.14 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.34 3gdt h GLY 132 CO 0.01 0.06 0.02 1.41 0.00 0.00 0.00 176.54 178.05 3gdt h LEU 133 N -0.26 0.64 -0.05 3.11 3.38 -1.19 -1.88 115.31 119.06 3gdt h LEU 133 Ca 0.01 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 3gdt h LEU 133 Cb 0.38 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3gdt h LEU 133 CO 0.00 0.70 0.03 0.50 0.09 0.00 0.00 178.44 179.77 3gdt h LYS 134 N 0.65 0.07 -0.28 1.13 3.64 -1.02 -0.56 116.57 120.19 3gdt h LYS 134 Ca 0.13 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.54 3gdt h LYS 134 Cb 0.37 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 3gdt h LYS 134 CO 0.01 0.10 0.08 1.96 -2.27 0.00 0.00 179.45 179.34 3gdt h GLN 135 N 0.02 0.19 -0.59 1.90 4.20 -0.97 -2.05 115.11 117.81 3gdt h GLN 135 Ca 0.02 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.73 3gdt h GLN 135 Cb 0.05 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.75 3gdt h GLN 135 CO -0.00 0.13 0.38 0.00 -0.67 0.00 0.00 178.83 178.67 3gdt h ALA 136 N 1.19 0.76 -0.67 3.87 0.00 -1.17 -2.27 119.26 120.97 3gdt h ALA 136 Ca 0.13 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.06 3gdt h ALA 136 Cb 0.11 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 3gdt h ALA 136 CO -0.15 0.15 0.39 0.00 0.00 0.00 0.00 179.25 179.64 3gdt h ALA 137 N 1.24 0.90 -0.16 0.00 0.00 -0.68 -0.98 119.26 119.57 3gdt h ALA 137 Ca 0.23 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 3gdt h ALA 137 Cb -0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3gdt h ALA 137 CO -0.07 0.09 -0.23 0.93 0.00 0.00 0.00 179.25 179.96 3gdt h GLU 138 N 0.73 0.28 0.05 0.00 5.08 -0.98 -2.71 114.58 117.03 3gdt h GLU 138 Ca 0.29 -0.09 -0.24 0.00 -1.00 0.00 0.00 59.36 58.32 3gdt h GLU 138 Cb 0.14 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3gdt h GLU 138 CO -0.16 0.51 -1.13 0.93 -1.00 0.00 0.00 179.01 178.16 3gdt h GLU 139 N 0.26 0.11 0.01 2.33 5.08 -0.92 -3.37 114.58 118.07 3gdt h GLU 139 Ca 0.04 -0.18 -0.16 0.00 -1.00 0.00 0.00 59.36 58.06 3gdt h GLU 139 Cb 0.56 0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.89 3gdt h GLU 139 CO 0.04 1.07 -0.63 0.28 -1.00 0.00 0.00 179.01 178.77 3gdt h VAL 140 N 0.03 1.43 -3.43 3.13 2.07 -1.06 -3.48 116.25 114.93 3gdt h VAL 140 Ca -0.07 -2.11 -0.10 0.00 0.82 0.00 0.00 66.70 65.23 3gdt h VAL 140 Cb 1.86 2.63 -0.17 0.00 -1.52 0.00 0.00 31.29 34.09 3gdt h VAL 140 CO 0.16 0.61 -0.32 0.28 0.02 0.00 0.00 177.57 178.32 3gdt s THR 141 N -3.17 0.10 -0.28 2.57 -1.32 -1.04 -4.98 115.64 107.53 3gdt s THR 141 Ca -0.13 -0.78 0.20 0.00 -1.21 0.00 0.00 61.69 59.77 3gdt s THR 141 Cb 0.03 -0.92 0.23 0.00 -1.51 0.00 0.00 72.50 70.33 3gdt s THR 141 CO 0.83 -0.43 1.57 0.07 -2.21 0.00 0.00 174.62 174.44 3gdt h LYS 142 N 3.35 0.00 -6.93 7.08 2.10 -1.86 -3.42 116.57 116.89 3gdt h LYS 142 Ca -0.32 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.80 3gdt h LYS 142 Cb 1.20 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.61 3gdt h LYS 142 CO 0.47 0.21 0.67 -1.21 -2.00 0.00 0.00 179.45 177.59 3gdt s GLU 143 N -3.15 4.06 0.59 0.07 0.41 -1.26 -4.96 118.70 114.46 3gdt s GLU 143 Ca 0.05 2.31 -0.19 0.00 -0.41 0.00 0.00 54.97 56.73 3gdt s GLU 143 Cb 0.06 -2.88 -0.04 0.00 -1.78 0.00 0.00 34.13 29.50 3gdt s GLU 143 CO 0.69 -0.47 1.19 -1.25 -0.49 0.00 0.00 175.26 174.93 3gdt s PRO 144 N -2.12 3.02 0.08 0.39 0.04 -1.26 -4.99 135.00 130.16 3gdt s PRO 144 Ca 0.54 1.76 0.03 0.00 0.04 0.00 0.00 61.00 63.38 3gdt s PRO 144 Cb -0.41 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.15 3gdt s PRO 144 CO 0.54 -1.15 -0.10 1.03 0.04 0.00 0.00 177.00 177.37 3gdt s ARG 145 N -3.37 0.75 0.08 4.56 1.81 -1.26 -4.86 118.95 116.67 3gdt s ARG 145 Ca 0.76 -1.01 0.03 0.00 -1.72 0.00 0.00 55.73 53.78 3gdt s ARG 145 Cb -0.29 -0.51 -0.03 0.00 -0.45 0.00 0.00 34.95 33.67 3gdt s ARG 145 CO 0.32 0.09 -0.08 0.20 -0.68 0.00 0.00 175.30 175.15 3gdt s GLY 146 N -2.09 0.72 -0.03 -3.53 0.00 -0.16 -4.80 107.32 97.43 3gdt s GLY 146 Ca -0.00 -1.13 0.04 0.00 0.00 0.00 0.00 44.72 43.63 3gdt s GLY 146 CO 0.00 -1.21 -0.15 -2.27 0.00 0.00 0.00 173.10 169.46 3gdt s LEU 147 N -2.44 1.94 -0.08 0.66 2.96 0.14 -1.96 118.68 119.91 3gdt s LEU 147 Ca 0.04 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.65 3gdt s LEU 147 Cb -0.02 -0.85 -0.03 0.00 0.50 0.00 0.00 46.19 45.80 3gdt s LEU 147 CO -0.02 0.16 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.33 3gdt s LEU 148 N -0.12 3.06 -0.06 -0.68 1.43 -0.10 -1.05 118.68 121.17 3gdt s LEU 148 Ca 0.01 -0.09 -0.12 0.00 -1.03 0.00 0.00 54.13 52.91 3gdt s LEU 148 Cb -0.09 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.42 3gdt s LEU 148 CO 0.01 0.33 0.29 -0.04 0.23 0.00 0.00 176.35 177.17 3gdt s MET 149 N -0.61 3.74 -1.26 1.70 -1.94 -0.55 -1.00 119.30 119.38 3gdt s MET 149 Ca 0.09 0.18 -0.16 0.00 -1.71 0.00 0.00 55.69 54.09 3gdt s MET 149 Cb -0.12 -3.22 0.11 0.00 2.01 0.00 0.00 34.83 33.62 3gdt s MET 149 CO 0.02 0.71 1.62 -0.51 -0.01 0.00 0.00 175.02 176.84 3gdt s LEU 150 N -0.98 4.34 0.13 -0.03 1.43 -0.21 -1.64 118.68 121.70 3gdt s LEU 150 Ca 0.20 -2.68 -0.08 0.00 -1.03 0.00 0.00 54.13 50.54 3gdt s LEU 150 Cb -0.15 -2.51 -0.08 0.00 0.03 0.00 0.00 46.19 43.48 3gdt s LEU 150 CO 0.09 -0.99 1.33 0.00 0.23 0.00 0.00 176.35 177.01 3gdt h ALA 151 N 7.39 0.39 -3.17 4.21 0.00 -1.78 -3.42 119.26 122.88 3gdt h ALA 151 Ca 0.40 -0.63 -0.42 0.00 0.00 0.00 0.00 54.91 54.25 3gdt h ALA 151 Cb 0.87 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 18.24 3gdt h ALA 151 CO 1.37 0.73 -0.75 -1.21 0.00 0.00 0.00 179.25 179.40 3gdt s GLU 152 N -3.57 0.03 0.34 0.00 2.02 -0.92 -4.37 118.70 112.23 3gdt s GLU 152 Ca -0.08 0.12 -0.06 0.00 0.02 0.00 0.00 54.97 54.96 3gdt s GLU 152 Cb 0.09 -1.24 -0.05 0.00 0.10 0.00 0.00 34.13 33.02 3gdt s GLU 152 CO 0.88 -0.51 0.64 -0.51 0.02 0.00 0.00 175.26 175.77 3gdt s LEU 153 N 2.14 3.96 0.00 1.80 1.43 -1.26 -4.10 118.68 122.64 3gdt s LEU 153 Ca 0.03 0.85 0.18 0.00 -1.03 0.00 0.00 54.13 54.16 3gdt s LEU 153 Cb -0.14 -3.70 -0.07 0.00 0.03 0.00 0.00 46.19 42.31 3gdt s LEU 153 CO -0.06 -0.29 0.88 -1.54 0.23 0.00 0.00 176.35 175.56 3gdt n SER 154 N -1.17 1.47 -4.76 2.29 3.41 -1.26 -4.93 113.62 108.67 3gdt n SER 154 Ca -0.00 -1.23 -0.36 0.00 -0.26 0.00 0.00 58.87 57.01 3gdt n SER 154 Cb 0.54 0.65 0.03 0.00 -0.26 0.00 0.00 64.21 65.16 3gdt n SER 154 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gdt n LYS 156 N -1.37 2.66 -1.14 0.00 5.02 -1.26 -2.33 118.16 119.74 3gdt n LYS 156 Ca 0.12 0.96 -0.05 0.00 -2.02 0.00 0.00 58.31 57.33 3gdt n LYS 156 Cb 0.49 -2.80 -0.02 0.00 -0.02 0.00 0.00 35.03 32.68 3gdt n LYS 156 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gdt n GLY 157 N 3.91 0.74 3.73 0.72 0.00 -1.26 -5.00 105.19 108.03 3gdt n GLY 157 Ca 0.17 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 3gdt n GLY 157 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gdt s SER 158 N -2.61 4.44 -0.05 1.61 1.04 -0.98 -4.92 113.70 112.22 3gdt s SER 158 Ca 0.00 2.45 0.20 0.00 0.48 0.00 0.00 55.95 59.08 3gdt s SER 158 Cb 0.00 -2.60 0.64 0.00 0.10 0.00 0.00 66.02 64.16 3gdt s SER 158 CO 0.00 -2.11 1.55 0.18 0.98 0.00 0.00 173.24 173.84 3gdt n LEU 159 N -2.33 4.19 -3.48 2.42 4.77 -1.26 -4.74 117.00 116.57 3gdt n LEU 159 Ca 0.14 -2.20 -0.40 0.00 -0.03 0.00 0.00 56.01 53.52 3gdt n LEU 159 Cb 0.49 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 3gdt n LEU 159 CO 0.47 0.89 2.97 0.00 -1.33 0.00 0.00 177.39 180.39 3gdt n ALA 160 N 1.28 6.82 -2.52 -1.18 0.00 -1.26 -4.75 120.51 118.89 3gdt n ALA 160 Ca 0.24 -3.76 -0.26 0.00 0.00 0.00 0.00 53.44 49.65 3gdt n ALA 160 Cb 0.72 -3.28 -0.08 0.00 0.00 0.00 0.00 19.45 16.80 3gdt n ALA 160 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3gdt s THR 161 N 1.71 0.62 0.00 0.00 -4.23 -1.26 -4.47 115.64 108.01 3gdt s THR 161 Ca 0.60 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 3gdt s THR 161 Cb 0.17 -2.34 0.00 0.00 1.34 0.00 0.00 72.50 71.66 3gdt s THR 161 CO -0.07 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 3gdt n GLY 162 N -0.93 0.71 0.24 3.99 0.00 -1.26 -0.08 105.19 107.87 3gdt n GLY 162 Ca -0.06 0.26 0.05 0.00 0.00 0.00 0.00 46.02 46.27 3gdt n GLY 162 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3gdt h GLU 163 N 0.00 0.09 -0.28 1.61 4.39 -1.97 -2.12 114.58 116.29 3gdt h GLU 163 Ca 0.00 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 3gdt h GLU 163 Cb 0.00 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 3gdt h GLU 163 CO 0.00 0.17 -0.02 -0.92 -1.16 0.00 0.00 179.01 177.09 3gdt h TYR 164 N 0.09 0.55 -0.46 4.33 3.20 -0.79 0.14 116.97 124.03 3gdt h TYR 164 Ca 0.02 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 3gdt h TYR 164 Cb 0.20 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 3gdt h TYR 164 CO 0.00 0.67 0.20 1.15 -1.64 0.00 0.00 178.16 178.53 3gdt h THR 165 N 0.28 1.20 -0.83 1.81 2.02 -1.21 -0.62 112.91 115.56 3gdt h THR 165 Ca 0.08 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.65 3gdt h THR 165 Cb 0.46 0.74 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 3gdt h THR 165 CO 0.02 0.23 0.52 0.50 0.37 0.00 0.00 175.52 177.16 3gdt h LYS 166 N 0.60 1.11 -0.10 6.66 3.64 -1.25 -0.44 116.57 126.79 3gdt h LYS 166 Ca 0.16 -0.09 -0.09 0.00 -1.27 0.00 0.00 60.65 59.36 3gdt h LYS 166 Cb 0.17 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3gdt h LYS 166 CO -0.01 0.76 -0.34 0.78 -2.27 0.00 0.00 179.45 178.36 3gdt h GLY 167 N 1.13 0.22 1.26 5.01 0.00 -0.63 -1.73 103.07 108.32 3gdt h GLY 167 Ca 0.30 -0.19 -0.17 0.00 0.00 0.00 0.00 47.33 47.28 3gdt h GLY 167 CO -0.06 0.17 -0.48 -0.84 0.00 0.00 0.00 176.54 175.33 3gdt h THR 168 N 0.18 1.29 -0.69 4.70 2.02 -0.36 -2.16 112.91 117.89 3gdt h THR 168 Ca 0.02 -1.67 -0.07 0.00 0.77 0.00 0.00 66.41 65.47 3gdt h THR 168 Cb 0.70 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.64 3gdt h THR 168 CO 0.05 0.54 0.17 0.58 0.37 0.00 0.00 175.52 177.23 3gdt h VAL 169 N 0.63 1.26 -0.64 3.16 2.07 -0.82 -2.02 116.25 119.90 3gdt h VAL 169 Ca 0.03 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.55 3gdt h VAL 169 Cb 1.06 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 3gdt h VAL 169 CO 0.10 0.37 0.23 0.44 0.02 0.00 0.00 177.57 178.73 3gdt h ASP 170 N 1.03 0.87 -0.78 0.57 3.32 -1.18 -2.01 116.42 118.24 3gdt h ASP 170 Ca 0.22 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 3gdt h ASP 170 Cb 0.37 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3gdt h ASP 170 CO 0.00 0.80 0.40 0.40 -1.72 0.00 0.00 179.24 179.13 3gdt h ILE 171 N 0.93 1.24 -0.55 0.35 1.08 -0.98 -2.30 117.51 117.29 3gdt h ILE 171 Ca 0.21 -0.64 -0.00 0.00 -0.39 0.00 0.00 64.86 64.04 3gdt h ILE 171 Cb 0.22 0.23 -0.03 0.00 -3.07 0.00 0.00 36.82 34.17 3gdt h ILE 171 CO -0.01 0.28 0.34 0.00 -0.69 0.00 0.00 178.15 178.06 3gdt h ALA 172 N 1.21 1.57 0.00 1.87 0.00 -0.67 -1.85 119.26 121.38 3gdt h ALA 172 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3gdt h ALA 172 Cb 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3gdt h ALA 172 CO -0.04 0.38 0.00 0.87 0.00 0.00 0.00 179.25 180.46 3gdt h LYS 173 N 0.74 0.00 0.00 0.00 1.57 -0.88 -2.61 116.57 115.40 3gdt h LYS 173 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3gdt h LYS 173 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3gdt h LYS 173 CO -0.04 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.50 3gdt h SER 174 N 0.00 0.00 -1.21 0.86 4.64 -1.36 -3.39 113.55 113.09 3gdt h SER 174 Ca 0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 3gdt h SER 174 Cb 0.13 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.00 3gdt h SER 174 CO 0.00 0.00 -0.50 -0.62 -0.87 0.00 0.00 176.83 174.84 3gdt s ASP 175 N -4.62 -0.95 0.19 4.97 -1.08 -0.98 -4.99 116.67 109.19 3gdt s ASP 175 Ca 0.03 -0.88 0.24 0.00 -0.52 0.00 0.00 52.55 51.42 3gdt s ASP 175 Cb 0.09 1.67 0.91 0.00 -1.46 0.00 0.00 42.92 44.12 3gdt s ASP 175 CO 0.42 -0.20 1.74 2.29 0.52 0.00 0.00 175.17 179.94 3gdt n LYS 176 N 4.46 0.18 0.10 4.34 2.85 -1.26 -1.07 118.16 127.75 3gdt n LYS 176 Ca 0.10 0.28 -0.15 0.00 -1.05 0.00 0.00 58.31 57.49 3gdt n LYS 176 Cb 0.54 -1.77 -0.14 0.00 -0.65 0.00 0.00 35.03 33.01 3gdt n LYS 176 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 3gdt h ASP 177 N 0.00 0.39 0.00 -5.58 3.32 -1.94 -3.39 116.42 109.22 3gdt h ASP 177 Ca 0.00 -0.43 -0.39 0.00 0.02 0.00 0.00 57.03 56.23 3gdt h ASP 177 Cb 0.52 -0.13 -0.07 0.00 0.22 0.00 0.00 39.33 39.88 3gdt h ASP 177 CO 0.00 1.34 -2.46 0.33 -1.72 0.00 0.00 179.24 176.73 3gdt n PHE 178 N -3.51 0.00 -2.91 4.55 7.35 -1.17 -4.40 117.46 117.38 3gdt n PHE 178 Ca -0.09 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.17 3gdt n PHE 178 Cb 1.02 -0.98 -0.05 0.00 0.35 0.00 0.00 39.48 39.82 3gdt n PHE 178 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 3gdt s VAL 179 N -2.51 4.52 -0.92 -2.13 1.01 -0.24 -0.68 120.40 119.45 3gdt s VAL 179 Ca -0.35 0.23 0.25 0.00 0.00 0.00 0.00 61.98 62.11 3gdt s VAL 179 Cb 0.09 -4.45 -0.01 0.00 0.00 0.00 0.00 36.38 32.01 3gdt s VAL 179 CO 0.59 -0.97 1.35 2.30 0.00 0.00 0.00 175.10 178.37 3gdt n ILE 180 N 6.12 0.06 -1.19 2.22 -5.35 -0.22 -4.62 119.36 116.38 3gdt n ILE 180 Ca 0.01 -0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 3gdt n ILE 180 Cb 0.47 0.23 0.00 0.00 -1.74 0.00 0.00 39.64 38.60 3gdt n ILE 180 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3gdt n GLY 181 N 1.47 -0.58 3.12 3.28 0.00 -1.24 -0.96 105.19 110.27 3gdt n GLY 181 Ca 0.05 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.30 3gdt n GLY 181 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gdt s PHE 182 N -3.67 0.53 -0.34 1.61 0.08 0.24 -1.49 117.98 114.94 3gdt s PHE 182 Ca 0.00 -1.04 -0.13 0.00 0.12 0.00 0.00 56.93 55.88 3gdt s PHE 182 Cb 0.00 -0.36 -0.02 0.00 -0.57 0.00 0.00 43.02 42.07 3gdt s PHE 182 CO 0.00 -0.43 0.24 0.42 -0.10 0.00 0.00 175.22 175.36 3gdt s ILE 183 N -3.93 5.28 0.28 0.64 -1.09 -0.65 -1.23 121.20 120.50 3gdt s ILE 183 Ca 0.10 -0.21 -0.17 0.00 -2.23 0.00 0.00 60.65 58.14 3gdt s ILE 183 Cb 0.07 -3.72 0.01 0.00 -1.58 0.00 0.00 42.46 37.25 3gdt s ILE 183 CO -0.08 -0.01 0.62 0.00 -1.23 0.00 0.00 174.94 174.24 3gdt s ALA 184 N 1.73 -0.74 -1.90 9.38 0.00 -0.82 -2.17 121.76 127.24 3gdt s ALA 184 Ca 0.06 -0.60 0.17 0.00 0.00 0.00 0.00 51.96 51.59 3gdt s ALA 184 Cb -0.17 0.93 0.26 0.00 0.00 0.00 0.00 23.12 24.14 3gdt s ALA 184 CO 0.11 -0.96 1.17 1.04 0.00 0.00 0.00 175.76 177.12 3gdt n GLN 185 N -0.44 1.89 -3.78 0.00 1.13 -1.26 -3.94 117.38 110.99 3gdt n GLN 185 Ca -0.03 -1.82 -0.07 0.00 -1.94 0.00 0.00 57.00 53.14 3gdt n GLN 185 Cb 0.60 -1.36 -0.02 0.00 0.11 0.00 0.00 30.24 29.57 3gdt n GLN 185 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 3gdt s ARG 186 N -1.28 1.55 0.39 -1.09 1.70 -1.26 -4.94 118.95 114.02 3gdt s ARG 186 Ca 0.26 -0.83 -0.27 0.00 -0.47 0.00 0.00 55.73 54.41 3gdt s ARG 186 Cb 0.16 0.55 -0.10 0.00 -0.57 0.00 0.00 34.95 34.98 3gdt s ARG 186 CO 0.23 -0.71 1.47 0.34 -1.08 0.00 0.00 175.30 175.55 3gdt s ASP 187 N -2.89 6.26 -0.05 -2.89 2.15 -1.24 -4.91 116.67 113.09 3gdt s ASP 187 Ca 0.10 3.01 0.15 0.00 0.43 0.00 0.00 52.55 56.24 3gdt s ASP 187 Cb -0.04 -2.66 0.47 0.00 -0.30 0.00 0.00 42.92 40.38 3gdt s ASP 187 CO 0.03 -0.93 1.39 0.23 -0.17 0.00 0.00 175.17 175.73 3gdt n MET 188 N 0.33 3.03 0.00 4.34 2.81 -1.26 -5.08 117.12 121.29 3gdt n MET 188 Ca 0.02 -2.43 0.00 0.00 -1.81 0.00 0.00 57.70 53.47 3gdt n MET 188 Cb 0.40 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 3gdt n MET 188 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gdt n GLY 189 N 0.58 1.98 1.00 3.03 0.00 -1.26 -4.94 105.19 105.58 3gdt n GLY 189 Ca 0.18 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.68 3gdt n GLY 189 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gdt n GLY 190 N 0.00 2.16 0.31 -0.02 0.00 -1.26 -4.74 105.19 101.63 3gdt n GLY 190 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3gdt n GLY 190 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gdt h ARG 191 N 2.91 1.02 -0.12 1.61 3.08 -1.91 -1.48 114.38 119.49 3gdt h ARG 191 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3gdt h ARG 191 Cb 0.00 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 29.82 3gdt h ARG 191 CO 0.00 0.68 0.00 -0.25 -1.07 0.00 0.00 179.97 179.33 3gdt n ASP 192 N -4.55 0.12 0.00 7.04 8.00 -1.26 -2.29 116.55 123.62 3gdt n ASP 192 Ca 0.08 -1.64 0.00 0.00 0.71 0.00 0.00 54.79 53.94 3gdt n ASP 192 Cb 0.03 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 3gdt n ASP 192 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3gdt n GLU 193 N -0.41 0.99 -0.54 -1.24 1.02 -0.72 -5.00 120.64 114.73 3gdt n GLU 193 Ca 0.00 -0.87 0.00 0.00 -0.02 0.00 0.00 57.16 56.27 3gdt n GLU 193 Cb 0.03 -0.86 0.00 0.00 -0.02 0.00 0.00 31.44 30.59 3gdt n GLU 193 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gdt n GLY 194 N -0.21 0.72 3.76 0.62 0.00 -0.97 -5.06 105.19 104.05 3gdt n GLY 194 Ca 0.00 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 3gdt n GLY 194 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gdt s TYR 195 N -2.00 3.31 -0.51 1.61 2.02 -0.64 -5.02 117.35 116.12 3gdt s TYR 195 Ca 0.00 0.29 0.04 0.00 -0.37 0.00 0.00 57.07 57.02 3gdt s TYR 195 Cb 0.00 -1.82 0.16 0.00 -0.40 0.00 0.00 41.96 39.90 3gdt s TYR 195 CO 0.00 0.56 0.35 0.34 -1.57 0.00 0.00 175.55 175.23 3gdt s ASP 196 N -1.14 3.31 0.12 2.29 2.15 -1.26 -3.28 116.67 118.86 3gdt s ASP 196 Ca 0.16 -3.13 -0.20 0.00 0.43 0.00 0.00 52.55 49.81 3gdt s ASP 196 Cb -0.12 -1.02 -0.07 0.00 -0.30 0.00 0.00 42.92 41.41 3gdt s ASP 196 CO 0.06 -0.18 0.63 0.26 -0.17 0.00 0.00 175.17 175.76 3gdt s TRP 197 N -0.27 3.78 -0.08 -5.34 0.51 -1.26 -4.90 118.94 111.38 3gdt s TRP 197 Ca 0.25 1.34 -0.28 0.00 -2.12 0.00 0.00 56.10 55.28 3gdt s TRP 197 Cb -0.10 -2.55 -0.02 0.00 -0.81 0.00 0.00 33.47 29.99 3gdt s TRP 197 CO -0.11 0.52 0.92 -0.51 -0.51 0.00 0.00 176.95 177.26 3gdt s LEU 198 N -1.34 4.28 -0.35 2.99 1.43 -0.13 -4.92 118.68 120.64 3gdt s LEU 198 Ca 0.33 1.45 -0.09 0.00 -1.03 0.00 0.00 54.13 54.79 3gdt s LEU 198 Cb -0.19 -3.43 0.02 0.00 0.03 0.00 0.00 46.19 42.62 3gdt s LEU 198 CO 0.21 -0.34 0.17 -0.63 0.23 0.00 0.00 176.35 175.99 3gdt s ILE 199 N 1.57 4.37 -0.21 -0.59 -1.09 -1.26 -0.60 121.20 123.40 3gdt s ILE 199 Ca 0.46 -0.82 -0.05 0.00 -2.23 0.00 0.00 60.65 58.01 3gdt s ILE 199 Cb -0.19 -3.39 -0.02 0.00 -1.58 0.00 0.00 42.46 37.28 3gdt s ILE 199 CO 0.20 -0.14 -0.00 -0.04 -1.23 0.00 0.00 174.94 173.72 3gdt s MET 200 N 1.53 3.56 -0.19 2.79 -1.94 -0.36 -0.18 119.30 124.50 3gdt s MET 200 Ca 0.02 -0.54 0.01 0.00 -1.71 0.00 0.00 55.69 53.46 3gdt s MET 200 Cb -0.19 -3.09 0.02 0.00 2.01 0.00 0.00 34.83 33.59 3gdt s MET 200 CO 0.05 -0.06 -0.18 0.99 -0.01 0.00 0.00 175.02 175.81 3gdt s THR 201 N 1.19 2.18 0.48 2.05 2.01 -0.20 -1.95 115.64 121.40 3gdt s THR 201 Ca 0.03 -0.99 -0.01 0.00 0.31 0.00 0.00 61.69 61.02 3gdt s THR 201 Cb -0.15 -1.96 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 3gdt s THR 201 CO 0.01 0.46 0.72 -2.16 -0.69 0.00 0.00 174.62 172.96 3gdt s PRO 202 N 1.28 3.10 -0.08 4.92 0.04 -1.26 -0.54 135.00 142.47 3gdt s PRO 202 Ca 0.03 -0.32 -0.00 0.00 0.04 0.00 0.00 61.00 60.75 3gdt s PRO 202 Cb -0.14 -2.49 -0.00 0.00 0.04 0.00 0.00 34.50 31.91 3gdt s PRO 202 CO -0.11 -0.33 0.07 0.41 0.04 0.00 0.00 177.00 177.08 3gdt n GLY 203 N -2.18 0.23 3.15 0.56 0.00 -1.17 -4.91 105.19 100.87 3gdt n GLY 203 Ca 0.02 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 3gdt n GLY 203 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gdt s VAL 204 N -3.02 1.24 0.38 1.61 1.01 -1.26 -3.74 120.40 116.62 3gdt s VAL 204 Ca 0.02 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.19 3gdt s VAL 204 Cb -0.00 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 3gdt s VAL 204 CO 0.07 0.20 0.17 -0.83 0.00 0.00 0.00 175.10 174.70 3gdt s GLY 205 N -0.76 2.49 -0.06 4.51 0.00 0.08 -4.85 107.32 108.73 3gdt s GLY 205 Ca 0.05 -1.48 0.10 0.00 0.00 0.00 0.00 44.72 43.39 3gdt s GLY 205 CO 0.00 -1.72 1.16 1.04 0.00 0.00 0.00 173.10 173.58 3gdt n LEU 206 N -0.81 2.57 -3.76 0.66 4.77 -1.26 -1.76 117.00 117.41 3gdt n LEU 206 Ca -0.02 -2.46 -0.23 0.00 -0.03 0.00 0.00 56.01 53.27 3gdt n LEU 206 Cb 0.64 -0.25 0.02 0.00 -2.33 0.00 0.00 43.42 41.51 3gdt n LEU 206 CO 0.34 0.63 -0.07 -0.67 -1.33 0.00 0.00 177.39 176.29 3gdt n ASP 207 N -0.57 -1.43 -4.77 -1.43 -0.08 -1.26 -4.90 116.55 102.11 3gdt n ASP 207 Ca 0.10 -0.84 -0.40 0.00 -1.51 0.00 0.00 54.79 52.14 3gdt n ASP 207 Cb 0.49 -3.88 -0.03 0.00 2.34 0.00 0.00 41.12 40.04 3gdt n ASP 207 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 3gdt s ASP 208 N -4.25 6.87 0.07 1.67 1.01 -1.26 -4.93 116.67 115.86 3gdt s ASP 208 Ca 0.08 2.46 -0.35 0.00 0.71 0.00 0.00 52.55 55.45 3gdt s ASP 208 Cb -0.04 -2.63 -0.14 0.00 1.01 0.00 0.00 42.92 41.11 3gdt s ASP 208 CO 0.83 -0.44 1.59 1.17 0.21 0.00 0.00 175.17 178.52 3gdt n LYS 209 N 0.75 1.86 -0.83 8.23 4.81 -1.26 -1.49 118.16 130.22 3gdt n LYS 209 Ca 0.01 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.12 3gdt n LYS 209 Cb 0.44 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.07 3gdt n LYS 209 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gdt n GLY 210 N 3.43 0.59 3.40 3.14 0.00 -1.26 -4.95 105.19 109.55 3gdt n GLY 210 Ca 0.19 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.76 3gdt n GLY 210 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gdt s ASP 211 N -2.56 6.97 0.23 1.61 2.15 -0.56 -4.85 116.67 119.66 3gdt s ASP 211 Ca 0.00 -2.86 -0.07 0.00 0.43 0.00 0.00 52.55 50.05 3gdt s ASP 211 Cb 0.00 -2.31 0.20 0.00 -0.30 0.00 0.00 42.92 40.51 3gdt s ASP 211 CO 0.00 -0.67 1.83 0.00 -0.17 0.00 0.00 175.17 176.16 3gdt h ALA 212 N 7.56 1.13 -0.04 3.66 0.00 -1.92 -1.33 119.26 128.31 3gdt h ALA 212 Ca 0.20 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3gdt h ALA 212 Cb 0.94 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3gdt h ALA 212 CO 1.06 0.67 -0.09 1.25 0.00 0.00 0.00 179.25 182.13 3gdt h LEU 213 N 1.22 -0.28 -1.14 0.00 5.85 -1.98 -2.46 115.31 116.52 3gdt h LEU 213 Ca 0.30 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.98 3gdt h LEU 213 Cb 0.10 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 3gdt h LEU 213 CO -0.04 -0.13 -0.40 1.23 -0.34 0.00 0.00 178.44 178.76 3gdt h GLY 214 N -0.14 0.00 1.48 3.75 0.00 -1.91 -2.70 103.07 103.54 3gdt h GLY 214 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3gdt h GLY 214 CO -0.13 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.35 3gdt n GLN 215 N -3.84 0.30 0.16 4.80 6.02 -0.52 -1.95 117.38 122.35 3gdt n GLN 215 Ca -0.01 0.10 0.13 0.00 -0.01 0.00 0.00 57.00 57.21 3gdt n GLN 215 Cb 0.46 -1.50 0.40 0.00 1.02 0.00 0.00 30.24 30.61 3gdt n GLN 215 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 3gdt h GLN 216 N 0.00 0.00 -6.03 -1.09 4.20 -1.31 -3.45 115.11 107.43 3gdt h GLN 216 Ca 0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 3gdt h GLN 216 Cb 0.14 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 3gdt h GLN 216 CO 0.00 0.00 -0.48 0.71 -0.67 0.00 0.00 178.83 178.39 3gdt s TYR 217 N -3.25 3.46 0.64 2.96 2.02 -0.82 -5.09 117.35 117.27 3gdt s TYR 217 Ca 0.07 0.13 -0.17 0.00 -0.37 0.00 0.00 57.07 56.74 3gdt s TYR 217 Cb 0.09 -1.67 -0.01 0.00 -0.40 0.00 0.00 41.96 39.97 3gdt s TYR 217 CO 0.57 0.53 1.17 1.03 -1.57 0.00 0.00 175.55 177.28 3gdt s ARG 218 N -3.07 2.79 0.66 -0.62 0.52 -1.24 -4.48 118.95 113.51 3gdt s ARG 218 Ca 0.34 1.65 -0.10 0.00 -0.52 0.00 0.00 55.73 57.10 3gdt s ARG 218 Cb -0.11 -1.93 0.00 0.00 0.52 0.00 0.00 34.95 33.43 3gdt s ARG 218 CO 0.28 -1.31 1.03 0.95 0.02 0.00 0.00 175.30 176.28 3gdt s THR 219 N -1.93 3.80 0.13 0.02 -4.23 -1.26 -0.74 115.64 111.44 3gdt s THR 219 Ca 0.73 0.45 -0.19 0.00 -1.18 0.00 0.00 61.69 61.50 3gdt s THR 219 Cb -0.26 -3.56 -0.04 0.00 1.34 0.00 0.00 72.50 69.98 3gdt s THR 219 CO 0.37 -0.70 1.75 0.58 -0.54 0.00 0.00 174.62 176.08 3gdt h VAL 220 N -0.47 0.95 -0.99 2.29 2.07 -1.71 -1.97 116.25 116.43 3gdt h VAL 220 Ca -0.45 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 67.02 3gdt h VAL 220 Cb 1.24 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 3gdt h VAL 220 CO 0.63 0.04 0.65 -0.78 0.02 0.00 0.00 177.57 178.13 3gdt h ASP 221 N 0.20 1.12 0.16 0.57 3.58 -1.87 -1.09 116.42 119.09 3gdt h ASP 221 Ca 0.10 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.52 3gdt h ASP 221 Cb 0.07 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 40.85 3gdt h ASP 221 CO -0.10 0.79 -0.08 -0.78 -2.88 0.00 0.00 179.24 176.19 3gdt h ASP 222 N 1.31 -0.18 -0.27 2.28 3.58 -1.79 0.61 116.42 121.96 3gdt h ASP 222 Ca 0.37 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.69 3gdt h ASP 222 Cb -0.11 0.05 -0.00 0.00 1.72 0.00 0.00 39.33 40.99 3gdt h ASP 222 CO -0.09 -0.12 -0.34 -0.37 -2.88 0.00 0.00 179.24 175.44 3gdt h VAL 223 N -0.22 1.31 -0.48 2.25 -1.51 -1.18 -2.57 116.25 113.84 3gdt h VAL 223 Ca -0.02 -1.52 -0.12 0.00 -1.23 0.00 0.00 66.70 63.80 3gdt h VAL 223 Cb 0.17 1.66 -0.01 0.00 -2.13 0.00 0.00 31.29 30.97 3gdt h VAL 223 CO 0.04 0.48 -0.19 0.58 -1.23 0.00 0.00 177.57 177.26 3gdt h VAL 224 N 0.43 1.27 -0.03 7.19 2.07 -1.23 -1.30 116.25 124.65 3gdt h VAL 224 Ca 0.03 -1.34 0.01 0.00 0.82 0.00 0.00 66.70 66.22 3gdt h VAL 224 Cb 0.92 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.80 3gdt h VAL 224 CO 0.08 0.46 0.02 -1.28 0.02 0.00 0.00 177.57 176.88 3gdt h SER 225 N 0.83 0.00 -0.63 0.57 0.87 -0.85 -2.66 113.55 111.69 3gdt h SER 225 Ca 0.11 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.59 3gdt h SER 225 Cb 0.76 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.67 3gdt h SER 225 CO 0.06 0.00 0.11 0.35 -0.53 0.00 0.00 176.83 176.82 3gdt n THR 226 N -4.50 2.83 0.00 2.23 -2.24 -0.97 -4.93 114.28 106.70 3gdt n THR 226 Ca -0.02 -1.53 0.00 0.00 -2.27 0.00 0.00 64.05 60.23 3gdt n THR 226 Cb 0.12 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 3gdt n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gdt n GLY 227 N 0.27 1.48 3.74 3.38 0.00 -1.00 -3.69 105.19 109.36 3gdt n GLY 227 Ca 0.33 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.94 3gdt n GLY 227 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gdt s SER 228 N -1.93 6.95 -0.13 1.61 0.01 -0.53 -4.57 113.70 115.11 3gdt s SER 228 Ca 0.00 2.35 0.09 0.00 1.31 0.00 0.00 55.95 59.70 3gdt s SER 228 Cb 0.00 -2.61 -0.23 0.00 0.21 0.00 0.00 66.02 63.39 3gdt s SER 228 CO 0.00 -0.48 0.31 0.47 0.41 0.00 0.00 173.24 173.95 3gdt n ASP 229 N 2.61 0.98 -3.98 2.44 8.00 0.74 -4.47 116.55 122.87 3gdt n ASP 229 Ca 0.06 0.18 -0.21 0.00 0.71 0.00 0.00 54.79 55.53 3gdt n ASP 229 Cb 0.43 0.07 -0.16 0.00 -0.02 0.00 0.00 41.12 41.44 3gdt n ASP 229 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gdt s ILE 230 N -2.55 0.77 -0.22 0.53 1.01 -0.68 -4.82 121.20 115.24 3gdt s ILE 230 Ca -0.13 -0.33 -0.12 0.00 0.00 0.00 0.00 60.65 60.07 3gdt s ILE 230 Cb 0.07 -0.70 -0.05 0.00 0.01 0.00 0.00 42.46 41.79 3gdt s ILE 230 CO 0.79 0.25 0.21 0.27 0.00 0.00 0.00 174.94 176.46 3gdt s ILE 231 N 0.37 5.33 -0.41 2.92 -4.36 -0.51 -1.03 121.20 123.51 3gdt s ILE 231 Ca -0.06 0.31 -0.14 0.00 -0.26 0.00 0.00 60.65 60.51 3gdt s ILE 231 Cb -0.10 -3.55 0.03 0.00 1.25 0.00 0.00 42.46 40.09 3gdt s ILE 231 CO 0.01 0.35 0.28 -0.63 0.24 0.00 0.00 174.94 175.18 3gdt s ILE 232 N 0.95 4.99 -0.11 8.37 1.01 0.30 -0.92 121.20 135.80 3gdt s ILE 232 Ca 0.10 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 59.93 3gdt s ILE 232 Cb -0.13 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 3gdt s ILE 232 CO 0.04 -0.33 -0.02 -0.69 0.00 0.00 0.00 174.94 173.94 3gdt s VAL 233 N 1.62 4.08 0.00 2.92 1.01 -0.44 -3.02 120.40 126.58 3gdt s VAL 233 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.70 3gdt s VAL 233 Cb -0.20 -2.74 0.00 0.00 0.00 0.00 0.00 36.38 33.44 3gdt s VAL 233 CO 0.08 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.35 3gdt n GLY 234 N 2.71 0.65 0.36 4.51 0.00 -1.26 -0.41 105.19 111.75 3gdt n GLY 234 Ca -0.18 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.02 3gdt n GLY 234 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gdt h ARG 235 N 0.00 0.00 0.00 1.61 2.47 -1.99 -1.48 114.38 114.99 3gdt h ARG 235 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3gdt h ARG 235 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3gdt h ARG 235 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.94 3gdt n GLY 236 N -1.35 -0.72 0.09 0.04 0.00 -1.26 -0.91 105.19 101.09 3gdt n GLY 236 Ca 0.02 0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.15 3gdt n GLY 236 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gdt n LEU 237 N -1.72 0.69 0.00 0.99 4.77 -0.56 -4.78 117.00 116.40 3gdt n LEU 237 Ca 0.00 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 3gdt n LEU 237 Cb 0.05 0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3gdt n LEU 237 CO 0.06 -0.02 0.00 2.22 -1.33 0.00 0.00 177.39 178.31 3gdt n PHE 238 N -2.69 0.00 -1.16 -1.77 1.16 -0.77 -3.56 117.46 108.68 3gdt n PHE 238 Ca -0.05 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.24 3gdt n PHE 238 Cb 0.67 0.00 0.19 0.00 -1.61 0.00 0.00 39.48 38.73 3gdt n PHE 238 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3gdt s ALA 239 N 0.00 0.87 -1.51 1.98 0.00 -0.08 -3.43 121.76 119.58 3gdt s ALA 239 Ca 0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 51.96 51.49 3gdt s ALA 239 Cb 0.00 -3.09 0.01 0.00 0.00 0.00 0.00 23.12 20.04 3gdt s ALA 239 CO 0.00 -2.95 0.38 1.63 0.00 0.00 0.00 175.76 174.82 3gdt n LYS 240 N -4.25 -3.60 -1.17 0.00 4.76 -1.26 -2.06 118.16 110.57 3gdt n LYS 240 Ca 0.06 0.83 -0.06 0.00 -2.87 0.00 0.00 58.31 56.27 3gdt n LYS 240 Cb 0.58 -5.59 -0.02 0.00 -1.84 0.00 0.00 35.03 28.15 3gdt n LYS 240 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gdt n GLY 241 N -1.27 0.79 3.76 0.72 0.00 -1.26 -5.01 105.19 102.93 3gdt n GLY 241 Ca -0.13 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 3gdt n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gdt s ARG 242 N -2.08 2.30 -0.48 1.61 0.52 -0.88 -4.99 118.95 114.96 3gdt s ARG 242 Ca 0.00 1.30 -0.18 0.00 -0.52 0.00 0.00 55.73 56.34 3gdt s ARG 242 Cb 0.00 -1.89 0.06 0.00 0.52 0.00 0.00 34.95 33.63 3gdt s ARG 242 CO 0.00 -1.62 0.52 0.34 0.02 0.00 0.00 175.30 174.56 3gdt s ASP 243 N -3.01 6.19 0.29 0.23 3.68 -1.26 -4.78 116.67 118.01 3gdt s ASP 243 Ca 0.64 -1.04 0.04 0.00 2.13 0.00 0.00 52.55 54.32 3gdt s ASP 243 Cb -0.19 -2.24 0.72 0.00 -1.45 0.00 0.00 42.92 39.76 3gdt s ASP 243 CO 0.51 -0.77 1.69 0.00 0.13 0.00 0.00 175.17 176.74 3gdt h ALA 244 N 8.88 1.42 -0.51 3.66 0.00 -1.90 0.08 119.26 130.88 3gdt h ALA 244 Ca -0.28 0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 3gdt h ALA 244 Cb 1.10 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 3gdt h ALA 244 CO 0.91 -0.35 -0.07 -0.22 0.00 0.00 0.00 179.25 179.53 3gdt h LYS 245 N 0.38 0.95 -0.01 0.00 3.64 -1.86 0.22 116.57 119.89 3gdt h LYS 245 Ca 0.56 -0.34 -0.00 0.00 -1.27 0.00 0.00 60.65 59.60 3gdt h LYS 245 Cb 1.06 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.81 3gdt h LYS 245 CO -0.54 1.00 0.00 0.28 -2.27 0.00 0.00 179.45 177.93 3gdt h VAL 246 N 0.81 1.16 -0.44 2.00 2.07 -1.55 -1.83 116.25 118.47 3gdt h VAL 246 Ca 0.14 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 3gdt h VAL 246 Cb 0.61 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 3gdt h VAL 246 CO 0.04 0.13 0.00 -0.33 0.02 0.00 0.00 177.57 177.43 3gdt h GLU 247 N -0.18 0.72 -0.68 1.57 4.39 -0.99 -1.47 114.58 117.94 3gdt h GLU 247 Ca 0.00 -0.18 0.03 0.00 0.34 0.00 0.00 59.36 59.56 3gdt h GLU 247 Cb 0.20 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 3gdt h GLU 247 CO -0.00 0.73 0.42 0.78 -1.16 0.00 0.00 179.01 179.78 3gdt h GLY 248 N 0.95 0.98 1.07 -3.84 0.00 -0.34 -0.82 103.07 101.07 3gdt h GLY 248 Ca 0.14 -0.31 -0.12 0.00 0.00 0.00 0.00 47.33 47.03 3gdt h GLY 248 CO 0.02 0.26 -0.17 -2.09 0.00 0.00 0.00 176.54 174.55 3gdt h GLU 249 N 0.81 0.95 -0.08 4.80 4.57 -0.92 -0.39 114.58 124.32 3gdt h GLU 249 Ca 0.28 -0.39 0.02 0.00 -1.18 0.00 0.00 59.36 58.09 3gdt h GLU 249 Cb 0.04 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 3gdt h GLU 249 CO -0.12 1.05 -0.06 0.00 -1.18 0.00 0.00 179.01 178.71 3gdt h ARG 250 N 0.80 -0.06 -0.21 1.92 3.08 -0.67 0.88 114.38 120.12 3gdt h ARG 250 Ca 0.11 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.02 3gdt h ARG 250 Cb 0.74 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 3gdt h ARG 250 CO 0.06 -0.04 -0.49 1.88 -1.07 0.00 0.00 179.97 180.30 3gdt h TYR 251 N -0.06 0.70 -0.19 3.04 -1.99 -1.15 -1.75 116.97 115.58 3gdt h TYR 251 Ca 0.05 -0.23 -0.01 0.00 2.00 0.00 0.00 58.73 60.54 3gdt h TYR 251 Cb 0.14 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 3gdt h TYR 251 CO -0.16 0.95 0.08 -0.09 -0.00 0.00 0.00 178.16 178.94 3gdt h ARG 252 N 0.45 0.28 -0.18 4.88 2.43 -0.81 0.20 114.38 121.63 3gdt h ARG 252 Ca 0.02 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.15 3gdt h ARG 252 Cb 1.03 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 3gdt h ARG 252 CO 0.09 0.32 0.09 -0.22 -1.51 0.00 0.00 179.97 178.75 3gdt h LYS 253 N 0.16 0.19 -0.27 0.20 3.64 -0.78 -0.30 116.57 119.42 3gdt h LYS 253 Ca 0.06 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3gdt h LYS 253 Cb 0.15 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 3gdt h LYS 253 CO -0.01 0.13 0.16 0.00 -2.27 0.00 0.00 179.45 177.46 3gdt h ALA 254 N 1.09 0.35 -0.74 5.00 0.00 -1.16 -0.32 119.26 123.47 3gdt h ALA 254 Ca 0.07 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3gdt h ALA 254 Cb 0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3gdt h ALA 254 CO -0.04 -0.14 0.25 0.78 0.00 0.00 0.00 179.25 180.09 3gdt h GLY 255 N 0.34 1.21 0.86 0.00 0.00 -0.78 -1.68 103.07 103.02 3gdt h GLY 255 Ca 0.10 -0.70 -0.09 0.00 0.00 0.00 0.00 47.33 46.64 3gdt h GLY 255 CO -0.02 0.65 -0.21 -0.25 0.00 0.00 0.00 176.54 176.72 3gdt h TRP 256 N 1.08 0.64 -0.92 5.60 2.91 -0.85 -1.60 115.95 122.81 3gdt h TRP 256 Ca 0.24 -0.19 -0.00 0.00 1.13 0.00 0.00 58.89 60.07 3gdt h TRP 256 Cb 0.27 -0.14 -0.04 0.00 -0.51 0.00 0.00 29.16 28.74 3gdt h TRP 256 CO 0.02 0.87 0.57 0.93 -1.03 0.00 0.00 178.44 179.80 3gdt h GLU 257 N 0.23 1.24 -0.55 2.65 5.08 -0.99 0.25 114.58 122.49 3gdt h GLU 257 Ca 0.04 -0.10 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 3gdt h GLU 257 Cb 0.76 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 3gdt h GLU 257 CO 0.05 0.85 -0.08 0.00 -1.00 0.00 0.00 179.01 178.83 3gdt h ALA 258 N 1.36 0.82 -0.37 3.43 0.00 -1.24 -1.67 119.26 121.59 3gdt h ALA 258 Ca 0.33 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3gdt h ALA 258 Cb -0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3gdt h ALA 258 CO -0.06 0.66 0.21 -0.92 0.00 0.00 0.00 179.25 179.14 3gdt h TYR 259 N 0.90 0.50 -0.30 0.00 3.20 -0.39 -1.51 116.97 119.36 3gdt h TYR 259 Ca 0.15 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 3gdt h TYR 259 Cb 0.64 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 3gdt h TYR 259 CO 0.04 0.37 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.84 3gdt h LEU 260 N 0.47 0.44 -1.14 2.82 3.38 -0.83 -1.45 115.31 119.01 3gdt h LEU 260 Ca 0.13 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3gdt h LEU 260 Cb 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3gdt h LEU 260 CO -0.02 0.53 0.07 -0.09 0.09 0.00 0.00 178.44 179.01 3gdt h ARG 261 N 0.45 0.67 0.00 1.13 2.43 -0.83 -3.51 114.38 114.72 3gdt h ARG 261 Ca 0.10 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3gdt h ARG 261 Cb 0.33 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3gdt h ARG 261 CO 0.01 0.64 0.00 -2.13 -1.51 0.00 0.00 179.97 176.99