#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gzr h GLU 31 N 0.00 0.01 -0.83 1.61 4.81 -2.04 -1.20 114.58 116.95 3gzr h GLU 31 Ca 0.00 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3gzr h GLU 31 Cb 0.00 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 3gzr h GLU 31 CO 0.00 0.01 0.48 0.78 -0.73 0.00 0.00 179.01 179.55 3gzr h GLY 32 N 0.01 1.22 0.84 1.92 0.00 -1.97 -0.02 103.07 105.07 3gzr h GLY 32 Ca 0.07 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 3gzr h GLY 32 CO -0.15 0.51 0.02 -0.91 0.00 0.00 0.00 176.54 176.01 3gzr h THR 33 N 1.15 1.24 -0.71 4.70 1.35 -1.79 -0.50 112.91 118.35 3gzr h THR 33 Ca 0.29 -0.82 0.02 0.00 -0.55 0.00 0.00 66.41 65.35 3gzr h THR 33 Cb -0.01 1.36 -0.04 0.00 -1.73 0.00 0.00 68.15 67.74 3gzr h THR 33 CO -0.05 0.26 0.46 0.44 -0.25 0.00 0.00 175.52 176.37 3gzr h ASP 34 N 0.15 0.77 -0.32 5.36 3.32 -1.04 -1.33 116.42 123.34 3gzr h ASP 34 Ca 0.06 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 3gzr h ASP 34 Cb 0.36 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3gzr h ASP 34 CO 0.01 0.55 0.12 0.00 -1.72 0.00 0.00 179.24 178.19 3gzr h ALA 35 N 1.28 0.42 -0.16 3.45 0.00 -0.83 -2.11 119.26 121.30 3gzr h ALA 35 Ca 0.27 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 3gzr h ALA 35 Cb -0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3gzr h ALA 35 CO -0.08 0.03 -0.49 0.97 0.00 0.00 0.00 179.25 179.69 3gzr h ILE 36 N 0.37 1.33 -0.76 0.00 2.10 -0.96 -1.07 117.51 118.51 3gzr h ILE 36 Ca 0.11 -1.70 0.05 0.00 1.08 0.00 0.00 64.86 64.39 3gzr h ILE 36 Cb 0.21 1.73 -0.05 0.00 -1.09 0.00 0.00 36.82 37.62 3gzr h ILE 36 CO -0.01 0.52 0.46 1.56 -1.08 0.00 0.00 178.15 179.60 3gzr h GLN 37 N 0.34 0.83 -0.56 2.19 4.20 -1.10 0.04 115.11 121.06 3gzr h GLN 37 Ca 0.02 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 3gzr h GLN 37 Cb 0.98 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.55 3gzr h GLN 37 CO 0.09 0.55 -0.07 0.00 -0.67 0.00 0.00 178.83 178.72 3gzr h ALA 38 N 1.36 0.76 -0.81 3.87 0.00 -0.97 -1.45 119.26 122.01 3gzr h ALA 38 Ca 0.33 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3gzr h ALA 38 Cb 0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 3gzr h ALA 38 CO -0.16 0.65 0.37 -0.07 0.00 0.00 0.00 179.25 180.04 3gzr h LEU 39 N 0.91 1.09 -0.32 0.00 3.38 -0.81 -1.17 115.31 118.39 3gzr h LEU 39 Ca 0.15 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3gzr h LEU 39 Cb 0.64 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3gzr h LEU 39 CO 0.04 0.93 0.13 0.40 0.09 0.00 0.00 178.44 180.03 3gzr h ILE 40 N 1.17 1.18 -0.70 1.22 2.04 -0.76 -0.38 117.51 121.27 3gzr h ILE 40 Ca 0.28 -0.56 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3gzr h ILE 40 Cb 0.15 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 3gzr h ILE 40 CO -0.03 0.19 0.43 1.56 0.00 0.00 0.00 178.15 180.31 3gzr h GLN 41 N 0.37 0.82 -0.86 2.37 1.08 -1.06 -1.23 115.11 116.61 3gzr h GLN 41 Ca 0.11 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.24 3gzr h GLN 41 Cb 0.18 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.38 3gzr h GLN 41 CO -0.01 0.54 0.48 0.00 -0.95 0.00 0.00 178.83 178.89 3gzr h ALA 42 N 1.30 1.10 -0.23 3.87 0.00 -0.80 -1.03 119.26 123.46 3gzr h ALA 42 Ca 0.28 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3gzr h ALA 42 Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3gzr h ALA 42 CO -0.11 0.61 0.13 -0.92 0.00 0.00 0.00 179.25 178.96 3gzr h TYR 43 N 1.20 0.32 0.00 0.00 5.03 -0.58 -1.70 116.97 121.23 3gzr h TYR 43 Ca 0.30 -0.01 -0.13 0.00 2.58 0.00 0.00 58.73 61.48 3gzr h TYR 43 Cb 0.02 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.18 3gzr h TYR 43 CO 0.01 0.27 -0.60 0.74 -1.32 0.00 0.00 178.16 177.25 3gzr h PHE 44 N 0.27 0.00 -0.27 -3.82 -1.00 -0.98 -1.24 116.94 109.91 3gzr h PHE 44 Ca 0.08 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.85 3gzr h PHE 44 Cb 0.05 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.60 3gzr h PHE 44 CO -0.04 0.60 0.14 1.15 -1.61 0.00 0.00 178.31 178.55 3gzr h THR 45 N 0.00 1.14 -0.78 -1.55 2.02 -1.02 0.34 112.91 113.07 3gzr h THR 45 Ca -0.01 -0.38 0.02 0.00 0.77 0.00 0.00 66.41 66.82 3gzr h THR 45 Cb 1.12 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 68.38 3gzr h THR 45 CO 0.08 0.14 0.50 0.00 0.37 0.00 0.00 175.52 176.61 3gzr h ALA 46 N 1.00 1.00 0.46 6.16 0.00 -0.99 -0.78 119.26 126.11 3gzr h ALA 46 Ca 0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3gzr h ALA 46 Cb 0.09 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3gzr h ALA 46 CO -0.01 0.35 -0.22 2.35 0.00 0.00 0.00 179.25 181.71 3gzr h TRP 47 N 1.00 -0.57 0.00 0.00 2.91 -1.01 0.26 115.95 118.55 3gzr h TRP 47 Ca 0.30 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.26 3gzr h TRP 47 Cb -0.05 0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.78 3gzr h TRP 47 CO -0.03 -0.26 -0.23 -0.91 -1.03 0.00 0.00 178.44 175.98 3gzr h ASN 48 N -0.82 0.00 -0.57 2.65 2.35 -0.82 -2.59 115.58 115.78 3gzr h ASN 48 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 3gzr h ASN 48 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 3gzr h ASN 48 CO 0.10 0.23 0.00 0.35 -1.65 0.00 0.00 177.43 176.46 3gzr n THR 49 N -3.55 0.76 -3.73 2.81 -2.24 -0.31 -4.97 114.28 103.06 3gzr n THR 49 Ca -0.01 -0.83 -0.22 0.00 -2.27 0.00 0.00 64.05 60.73 3gzr n THR 49 Cb 0.38 0.57 0.03 0.00 -2.10 0.00 0.00 70.33 69.20 3gzr n THR 49 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3gzr n ASN 50 N 1.40 -1.07 -3.15 3.42 3.02 -0.97 -4.93 115.26 112.98 3gzr n ASN 50 Ca 0.21 -0.84 -0.26 0.00 -0.03 0.00 0.00 54.58 53.66 3gzr n ASN 50 Cb 0.56 -3.95 -0.06 0.00 -0.61 0.00 0.00 39.78 35.72 3gzr n ASN 50 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gzr n ALA 51 N -4.29 4.26 0.29 5.41 0.00 0.05 -4.91 120.51 121.33 3gzr n ALA 51 Ca -0.30 -4.63 0.17 0.00 0.00 0.00 0.00 53.44 48.68 3gzr n ALA 51 Cb 0.68 -0.81 0.83 0.00 0.00 0.00 0.00 19.45 20.15 3gzr n ALA 51 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3gzr h PRO 52 N 3.48 0.00 0.00 0.00 0.13 -1.92 -0.81 132.00 132.87 3gzr h PRO 52 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3gzr h PRO 52 Cb 0.60 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.73 3gzr h PRO 52 CO 0.80 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.72 3gzr n GLU 53 N -2.77 0.03 0.00 0.86 0.00 -1.26 -2.20 120.64 115.30 3gzr n GLU 53 Ca -0.01 0.45 0.12 0.00 0.00 0.00 0.00 57.16 57.72 3gzr n GLU 53 Cb 0.15 -1.59 0.18 0.00 0.00 0.00 0.00 31.44 30.18 3gzr n GLU 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3gzr n ARG 54 N -1.65 1.00 -0.01 3.44 5.12 -0.31 -4.39 116.66 119.86 3gzr n ARG 54 Ca 0.01 -0.73 -0.16 0.00 -1.93 0.00 0.00 57.85 55.03 3gzr n ARG 54 Cb 0.06 -1.48 -0.06 0.00 -1.16 0.00 0.00 32.46 29.82 3gzr n ARG 54 CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 3gzr h PHE 55 N 1.79 1.00 -0.96 -1.55 0.04 -1.61 -3.35 116.94 112.30 3gzr h PHE 55 Ca 0.00 -0.44 0.10 0.00 2.80 0.00 0.00 57.97 60.42 3gzr h PHE 55 Cb 0.63 -0.15 -0.08 0.00 2.20 0.00 0.00 35.95 38.55 3gzr h PHE 55 CO 0.00 1.27 0.60 0.00 -0.60 0.00 0.00 178.31 179.58 3gzr h ALA 56 N 0.61 1.40 0.00 2.45 0.00 -1.78 -1.51 119.26 120.43 3gzr h ALA 56 Ca -0.05 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3gzr h ALA 56 Cb 1.40 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3gzr h ALA 56 CO 0.16 0.26 0.00 1.05 0.00 0.00 0.00 179.25 180.72 3gzr h GLU 57 N 1.00 0.00 -0.56 0.00 4.11 -1.87 -2.07 114.58 115.19 3gzr h GLU 57 Ca 0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.88 3gzr h GLU 57 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3gzr h GLU 57 CO -0.23 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.29 3gzr n ILE 58 N -2.46 0.82 -4.68 -1.06 -5.35 -0.57 -4.94 119.36 101.12 3gzr n ILE 58 Ca 0.01 -0.91 -0.28 0.00 -0.27 0.00 0.00 62.75 61.30 3gzr n ILE 58 Cb 0.18 0.67 -0.14 0.00 -1.74 0.00 0.00 39.64 38.61 3gzr n ILE 58 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3gzr s PHE 59 N -1.14 2.06 0.62 4.28 0.08 -0.78 -0.79 117.98 122.30 3gzr s PHE 59 Ca 0.42 -0.39 -0.16 0.00 0.12 0.00 0.00 56.93 56.91 3gzr s PHE 59 Cb 0.23 -1.21 -0.02 0.00 -0.57 0.00 0.00 43.02 41.44 3gzr s PHE 59 CO 0.30 0.14 1.09 -1.58 -0.10 0.00 0.00 175.22 175.08 3gzr s TRP 60 N -0.86 2.77 0.44 0.36 0.52 -0.33 -4.88 118.94 116.96 3gzr s TRP 60 Ca 0.10 1.54 0.12 0.00 0.02 0.00 0.00 56.10 57.88 3gzr s TRP 60 Cb -0.09 -3.12 1.02 0.00 -1.15 0.00 0.00 33.47 30.12 3gzr s TRP 60 CO 0.03 -1.44 2.03 -1.35 0.02 0.00 0.00 176.95 176.23 3gzr h PRO 61 N 0.36 0.38 -0.77 4.98 0.11 -1.93 -1.54 132.00 133.59 3gzr h PRO 61 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3gzr h PRO 61 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3gzr h PRO 61 CO 0.56 0.25 0.00 -0.40 -0.21 0.00 0.00 178.00 178.20 3gzr n ASP 62 N -4.47 2.85 -4.67 -2.05 5.75 -1.26 -1.09 116.55 111.60 3gzr n ASP 62 Ca 0.06 -2.35 -0.30 0.00 -0.01 0.00 0.00 54.79 52.19 3gzr n ASP 62 Cb 0.25 -0.54 0.16 0.00 -1.03 0.00 0.00 41.12 39.96 3gzr n ASP 62 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3gzr s GLY 63 N -0.39 1.62 0.18 6.12 0.00 -0.58 -4.71 107.32 109.56 3gzr s GLY 63 Ca 0.23 0.07 -0.05 0.00 0.00 0.00 0.00 44.72 44.97 3gzr s GLY 63 CO 0.07 0.58 0.22 -1.35 0.00 0.00 0.00 173.10 172.62 3gzr s SER 64 N -3.12 0.11 -0.05 1.64 1.04 -0.41 -0.44 113.70 112.45 3gzr s SER 64 Ca 0.65 -1.12 -0.23 0.00 0.48 0.00 0.00 55.95 55.73 3gzr s SER 64 Cb -0.20 0.41 0.05 0.00 0.10 0.00 0.00 66.02 66.38 3gzr s SER 64 CO 0.58 -0.88 0.51 0.86 0.98 0.00 0.00 173.24 175.29 3gzr s TRP 65 N -4.06 -0.46 -0.09 5.02 -0.11 -0.48 -2.37 118.94 116.40 3gzr s TRP 65 Ca 0.27 0.82 -0.01 0.00 1.22 0.00 0.00 56.10 58.40 3gzr s TRP 65 Cb 0.05 0.26 0.03 0.00 -1.50 0.00 0.00 33.47 32.30 3gzr s TRP 65 CO 0.06 -0.48 -0.04 0.08 -4.62 0.00 0.00 176.95 171.95 3gzr s VAL 66 N -1.06 0.68 0.57 5.86 1.01 -0.37 -0.61 120.40 126.48 3gzr s VAL 66 Ca -0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 3gzr s VAL 66 Cb -0.03 -0.77 0.12 0.00 0.00 0.00 0.00 36.38 35.70 3gzr s VAL 66 CO 0.07 0.31 0.78 -0.46 0.00 0.00 0.00 175.10 175.80 3gzr n ASN 67 N 4.96 0.95 0.27 3.32 6.94 -1.26 -1.43 115.26 129.02 3gzr n ASN 67 Ca -0.11 -1.83 0.18 0.00 -0.02 0.00 0.00 54.58 52.81 3gzr n ASN 67 Cb 0.50 -0.52 0.90 0.00 -2.36 0.00 0.00 39.78 38.30 3gzr n ASN 67 CO 0.00 0.00 0.00 -0.37 -1.03 0.00 0.00 177.26 175.86 3gzr h VAL 68 N -0.64 0.00 -0.44 3.53 -1.51 -1.96 -0.97 116.25 114.26 3gzr h VAL 68 Ca -0.26 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 65.05 3gzr h VAL 68 Cb 0.93 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 3gzr h VAL 68 CO 0.27 0.00 0.00 1.33 -1.23 0.00 0.00 177.57 177.94 3gzr n VAL 69 N -2.86 1.36 -1.12 7.19 0.24 -1.26 -4.69 118.33 117.19 3gzr n VAL 69 Ca -0.01 -1.18 0.00 0.00 -2.04 0.00 0.00 64.34 61.10 3gzr n VAL 69 Cb 0.15 0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.83 3gzr n VAL 69 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3gzr n GLY 70 N 0.60 -2.39 3.35 7.63 0.00 -0.37 -5.24 105.19 108.77 3gzr n GLY 70 Ca 0.17 -0.53 0.02 0.00 0.00 0.00 0.00 46.02 45.69 3gzr n GLY 70 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3gzr s HIS 72 N 0.00 -0.93 -0.16 1.61 2.46 -1.26 -4.79 115.29 112.23 3gzr s HIS 72 Ca 0.00 1.35 -0.05 0.00 0.47 0.00 0.00 55.06 56.84 3gzr s HIS 72 Cb 0.00 0.46 -0.03 0.00 -0.13 0.00 0.00 32.58 32.88 3gzr s HIS 72 CO 0.00 -0.48 -0.00 -1.58 -2.47 0.00 0.00 174.74 170.21 3gzr s TRP 73 N 2.70 3.11 -0.26 3.88 0.51 0.22 -4.99 118.94 124.11 3gzr s TRP 73 Ca 0.01 -0.13 -0.01 0.00 -2.12 0.00 0.00 56.10 53.85 3gzr s TRP 73 Cb -0.09 -1.98 0.03 0.00 -0.81 0.00 0.00 33.47 30.62 3gzr s TRP 73 CO -0.17 0.07 -0.06 1.03 -0.51 0.00 0.00 176.95 177.31 3gzr s ARG 74 N 0.23 2.68 0.00 4.98 0.52 -1.26 -1.38 118.95 124.73 3gzr s ARG 74 Ca -0.00 -1.08 0.00 0.00 -0.52 0.00 0.00 55.73 54.13 3gzr s ARG 74 Cb -0.13 -3.00 0.00 0.00 0.52 0.00 0.00 34.95 32.34 3gzr s ARG 74 CO 0.02 -0.46 0.00 0.41 0.02 0.00 0.00 175.30 175.29 3gzr n GLY 75 N 4.63 -0.65 0.37 -3.53 0.00 0.41 -4.38 105.19 102.04 3gzr n GLY 75 Ca -0.16 -1.51 0.02 0.00 0.00 0.00 0.00 46.02 44.38 3gzr n GLY 75 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3gzr h ARG 76 N 0.00 1.15 -0.82 1.61 2.43 -1.18 -2.45 114.38 115.12 3gzr h ARG 76 Ca 0.00 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 3gzr h ARG 76 Cb 0.00 -0.26 -0.04 0.00 -0.42 0.00 0.00 29.97 29.25 3gzr h ARG 76 CO 0.00 0.76 0.48 -0.44 -1.51 0.00 0.00 179.97 179.26 3gzr h ASP 77 N 1.18 0.99 -0.46 -3.80 3.32 -1.86 -0.29 116.42 115.51 3gzr h ASP 77 Ca 0.40 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 3gzr h ASP 77 Cb 0.09 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 3gzr h ASP 77 CO -0.14 0.78 0.18 1.56 -1.72 0.00 0.00 179.24 179.89 3gzr h GLN 78 N 1.13 0.69 -0.17 3.56 4.20 -1.68 -0.21 115.11 122.63 3gzr h GLN 78 Ca 0.29 -0.13 0.04 0.00 0.06 0.00 0.00 58.65 58.91 3gzr h GLN 78 Cb -0.02 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.61 3gzr h GLN 78 CO -0.05 0.63 -0.06 0.82 -0.67 0.00 0.00 178.83 179.50 3gzr h ILE 79 N 0.60 0.79 -0.34 2.54 2.04 -0.92 -0.97 117.51 121.26 3gzr h ILE 79 Ca 0.15 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.93 3gzr h ILE 79 Cb 0.21 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 3gzr h ILE 79 CO -0.01 0.00 -0.12 0.58 0.00 0.00 0.00 178.15 178.59 3gzr h VAL 80 N -0.02 1.28 -0.48 1.67 2.07 -1.01 -1.16 116.25 118.60 3gzr h VAL 80 Ca 0.09 -1.21 0.02 0.00 0.82 0.00 0.00 66.70 66.41 3gzr h VAL 80 Cb 0.15 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 3gzr h VAL 80 CO -0.19 0.40 0.29 0.15 0.02 0.00 0.00 177.57 178.24 3gzr h PHE 81 N 0.45 0.55 -0.18 1.57 3.04 -0.81 -0.31 116.94 121.25 3gzr h PHE 81 Ca 0.08 0.02 -0.12 0.00 3.98 0.00 0.00 57.97 61.93 3gzr h PHE 81 Cb 0.64 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.98 3gzr h PHE 81 CO 0.06 0.32 -0.34 0.00 -2.02 0.00 0.00 178.31 176.33 3gzr h ALA 82 N 1.20 0.29 -0.63 2.41 0.00 -1.10 -1.13 119.26 120.29 3gzr h ALA 82 Ca 0.19 -0.42 0.04 0.00 0.00 0.00 0.00 54.91 54.71 3gzr h ALA 82 Cb -0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3gzr h ALA 82 CO -0.07 0.34 0.37 0.45 0.00 0.00 0.00 179.25 180.33 3gzr h HIS 83 N 0.21 0.68 -0.31 0.00 3.86 -1.09 -1.61 115.15 116.90 3gzr h HIS 83 Ca 0.01 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 3gzr h HIS 83 Cb 0.93 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 29.17 3gzr h HIS 83 CO 0.09 0.36 0.16 1.15 0.86 0.00 0.00 177.93 180.54 3gzr h THR 84 N 0.70 1.14 -0.46 2.45 2.02 -0.98 -1.12 112.91 116.67 3gzr h THR 84 Ca 0.27 -0.40 0.01 0.00 0.77 0.00 0.00 66.41 67.06 3gzr h THR 84 Cb 0.10 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 3gzr h THR 84 CO -0.14 0.15 0.29 0.00 0.37 0.00 0.00 175.52 176.18 3gzr h ALA 85 N 1.02 0.59 0.01 6.16 0.00 -0.86 -1.87 119.26 124.31 3gzr h ALA 85 Ca 0.11 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.80 3gzr h ALA 85 Cb 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3gzr h ALA 85 CO -0.01 -0.01 -0.88 0.74 0.00 0.00 0.00 179.25 179.08 3gzr h PHE 86 N 0.58 0.22 0.00 0.00 0.04 -1.23 -2.84 116.94 113.72 3gzr h PHE 86 Ca 0.18 -0.13 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 3gzr h PHE 86 Cb -0.02 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.10 3gzr h PHE 86 CO -0.06 0.95 -0.15 -0.07 -0.60 0.00 0.00 178.31 178.38 3gzr h LEU 87 N 0.08 0.00 -0.49 1.54 3.38 -0.98 -0.40 115.31 118.44 3gzr h LEU 87 Ca -0.04 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 3gzr h LEU 87 Cb 1.52 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.25 3gzr h LEU 87 CO 0.13 0.15 -0.54 0.50 0.09 0.00 0.00 178.44 178.77 3gzr h LYS 88 N 0.00 0.00 0.00 1.13 1.63 -1.11 -2.99 116.57 115.23 3gzr h LYS 88 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3gzr h LYS 88 Cb 0.50 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 3gzr h LYS 88 CO 0.02 0.54 0.00 0.25 -3.45 0.00 0.00 179.45 176.81 3gzr n THR 89 N -3.44 0.00 0.22 1.00 -2.24 -0.93 -4.72 114.28 104.16 3gzr n THR 89 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 3gzr n THR 89 Cb 0.66 -0.02 0.50 0.00 -2.10 0.00 0.00 70.33 69.37 3gzr n THR 89 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 3gzr h ILE 90 N 0.00 1.05 -0.55 2.28 3.07 -1.72 -2.26 117.51 119.38 3gzr h ILE 90 Ca 0.00 -0.81 0.00 0.00 1.55 0.00 0.00 64.86 65.60 3gzr h ILE 90 Cb 0.00 1.45 0.00 0.00 -0.27 0.00 0.00 36.82 38.00 3gzr h ILE 90 CO 0.00 0.22 0.00 0.49 -1.05 0.00 0.00 178.15 177.81 3gzr n PHE 91 N -4.11 0.98 -0.27 0.16 3.72 -0.20 -4.55 117.46 113.19 3gzr n PHE 91 Ca -0.02 -0.57 0.06 0.00 -0.05 0.00 0.00 57.45 56.88 3gzr n PHE 91 Cb 0.29 -0.11 0.18 0.00 -0.94 0.00 0.00 39.48 38.90 3gzr n PHE 91 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3gzr h LYS 92 N 3.34 0.09 -0.34 -1.08 3.64 -1.25 -1.54 116.57 119.43 3gzr h LYS 92 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3gzr h LYS 92 Cb 1.10 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3gzr h LYS 92 CO 0.09 0.06 0.00 -0.25 -2.27 0.00 0.00 179.45 177.08 3gzr n ASP 93 N -5.37 3.27 -4.38 4.20 8.00 -1.26 -4.95 116.55 116.07 3gzr n ASP 93 Ca 0.15 -2.29 -0.45 0.00 0.71 0.00 0.00 54.79 52.91 3gzr n ASP 93 Cb 0.51 -0.33 -0.07 0.00 -0.02 0.00 0.00 41.12 41.22 3gzr n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gzr s LYS 95 N 1.85 4.08 0.06 0.00 -0.14 -1.26 -4.85 119.74 119.48 3gzr s LYS 95 Ca 0.06 0.84 0.08 0.00 -1.36 0.00 0.00 55.97 55.59 3gzr s LYS 95 Cb -0.25 -2.33 -0.03 0.00 -1.68 0.00 0.00 37.83 33.54 3gzr s LYS 95 CO 0.06 0.07 -0.20 -0.65 -0.76 0.00 0.00 175.35 173.87 3gzr s GLN 96 N -3.10 1.91 -0.09 1.68 -0.21 -1.26 -1.35 119.66 117.23 3gzr s GLN 96 Ca 0.57 -1.08 -0.00 0.00 0.02 0.00 0.00 55.36 54.87 3gzr s GLN 96 Cb -0.10 -2.11 0.02 0.00 1.00 0.00 0.00 33.01 31.83 3gzr s GLN 96 CO 0.16 0.52 -0.05 -2.00 -2.12 0.00 0.00 175.29 171.80 3gzr s GLU 97 N -1.60 1.20 0.19 2.91 2.12 0.09 -4.94 118.70 118.67 3gzr s GLU 97 Ca 0.15 -0.14 -0.31 0.00 0.36 0.00 0.00 54.97 55.03 3gzr s GLU 97 Cb -0.10 -1.32 -0.09 0.00 0.26 0.00 0.00 34.13 32.87 3gzr s GLU 97 CO 0.06 -0.24 1.42 -0.51 -0.54 0.00 0.00 175.26 175.45 3gzr s LEU 98 N 1.64 4.39 -0.13 2.70 1.43 -1.26 -0.66 118.68 126.78 3gzr s LEU 98 Ca 0.02 2.52 -0.11 0.00 -1.03 0.00 0.00 54.13 55.53 3gzr s LEU 98 Cb -0.13 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.43 3gzr s LEU 98 CO -0.06 -0.67 -0.23 0.52 0.23 0.00 0.00 176.35 176.14 3gzr n VAL 99 N 3.06 1.21 -3.87 -1.59 0.31 -0.00 -4.90 118.33 112.55 3gzr n VAL 99 Ca 0.09 -0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.30 3gzr n VAL 99 Cb 0.41 -1.92 -0.12 0.00 -0.91 0.00 0.00 33.84 31.29 3gzr n VAL 99 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3gzr s THR 100 N -2.47 0.03 -0.19 2.52 2.01 -0.96 -5.00 115.64 111.59 3gzr s THR 100 Ca -0.22 -0.28 0.01 0.00 0.31 0.00 0.00 61.69 61.51 3gzr s THR 100 Cb 0.06 -0.21 0.03 0.00 0.01 0.00 0.00 72.50 72.40 3gzr s THR 100 CO 0.30 -0.15 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.29 3gzr s ILE 101 N -0.47 1.89 -0.66 1.82 1.01 -1.26 -0.99 121.20 122.54 3gzr s ILE 101 Ca -0.05 -0.99 -0.07 0.00 0.00 0.00 0.00 60.65 59.54 3gzr s ILE 101 Cb -0.03 -1.81 0.17 0.00 0.01 0.00 0.00 42.46 40.79 3gzr s ILE 101 CO 0.00 0.36 0.51 -1.61 0.00 0.00 0.00 174.94 174.21 3gzr s GLU 102 N 1.32 2.82 0.00 2.79 2.02 -0.44 -4.98 118.70 122.24 3gzr s GLU 102 Ca 0.02 -2.41 0.01 0.00 0.02 0.00 0.00 54.97 52.60 3gzr s GLU 102 Cb -0.15 -3.94 -0.04 0.00 0.10 0.00 0.00 34.13 30.11 3gzr s GLU 102 CO -0.10 -1.21 0.05 0.00 0.02 0.00 0.00 175.26 174.02 3gzr s ALA 103 N 0.19 3.47 0.07 5.21 0.00 -1.26 -1.17 121.76 128.26 3gzr s ALA 103 Ca 0.16 -0.91 -0.17 0.00 0.00 0.00 0.00 51.96 51.03 3gzr s ALA 103 Cb -0.18 -1.48 0.04 0.00 0.00 0.00 0.00 23.12 21.50 3gzr s ALA 103 CO -0.05 0.68 0.41 -0.98 0.00 0.00 0.00 175.76 175.82 3gzr s ARG 104 N -1.72 0.96 -0.07 0.00 1.70 -0.04 -4.93 118.95 114.85 3gzr s ARG 104 Ca 0.22 -0.47 -0.26 0.00 -0.47 0.00 0.00 55.73 54.76 3gzr s ARG 104 Cb -0.12 0.43 -0.03 0.00 -0.57 0.00 0.00 34.95 34.66 3gzr s ARG 104 CO 0.13 -0.34 0.80 0.99 -1.08 0.00 0.00 175.30 175.80 3gzr s THR 105 N -2.87 4.97 -0.20 4.99 2.01 -1.26 -0.82 115.64 122.45 3gzr s THR 105 Ca -0.03 1.65 0.16 0.00 0.31 0.00 0.00 61.69 63.79 3gzr s THR 105 Cb 0.00 -4.14 -0.23 0.00 0.01 0.00 0.00 72.50 68.14 3gzr s THR 105 CO -0.05 0.18 0.43 2.30 -0.69 0.00 0.00 174.62 176.79 3gzr n ILE 106 N 4.00 0.00 -3.50 1.82 -5.35 -0.50 -4.95 119.36 110.87 3gzr n ILE 106 Ca 0.02 -0.31 -0.09 0.00 -0.27 0.00 0.00 62.75 62.10 3gzr n ILE 106 Cb 0.51 0.35 -0.02 0.00 -1.74 0.00 0.00 39.64 38.74 3gzr n ILE 106 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3gzr s ALA 107 N -2.96 -1.75 0.09 -1.28 0.00 -1.22 -5.03 121.76 109.63 3gzr s ALA 107 Ca -0.03 0.81 -0.33 0.00 0.00 0.00 0.00 51.96 52.41 3gzr s ALA 107 Cb 0.11 0.56 -0.12 0.00 0.00 0.00 0.00 23.12 23.66 3gzr s ALA 107 CO 0.66 -0.73 1.76 -2.30 0.00 0.00 0.00 175.76 175.15 3gzr n PRO 108 N -0.29 2.46 -0.95 0.00 -0.02 -1.26 -1.17 135.00 133.76 3gzr n PRO 108 Ca -0.11 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3gzr n PRO 108 Cb 0.62 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 3gzr n PRO 108 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gzr n GLY 109 N 4.00 0.50 2.81 -1.23 0.00 -1.26 -4.98 105.19 105.03 3gzr n GLY 109 Ca 0.19 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.79 3gzr n GLY 109 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gzr s SER 110 N -2.19 1.02 -0.03 1.61 0.15 -0.32 -0.48 113.70 113.45 3gzr s SER 110 Ca 0.00 -0.07 0.05 0.00 0.70 0.00 0.00 55.95 56.63 3gzr s SER 110 Cb 0.00 -0.35 -0.01 0.00 -1.71 0.00 0.00 66.02 63.95 3gzr s SER 110 CO 0.00 -0.13 -0.17 0.00 1.20 0.00 0.00 173.24 174.14 3gzr s ALA 111 N 1.41 1.47 -0.07 5.45 0.00 -0.18 -1.41 121.76 128.43 3gzr s ALA 111 Ca -0.04 -0.70 0.05 0.00 0.00 0.00 0.00 51.96 51.27 3gzr s ALA 111 Cb -0.13 -0.45 -0.00 0.00 0.00 0.00 0.00 23.12 22.53 3gzr s ALA 111 CO -0.03 0.30 -0.23 -1.17 0.00 0.00 0.00 175.76 174.63 3gzr s LEU 112 N -0.12 2.04 -0.00 0.00 2.96 -0.00 -0.91 118.68 122.64 3gzr s LEU 112 Ca 0.00 -0.50 0.06 0.00 -0.22 0.00 0.00 54.13 53.47 3gzr s LEU 112 Cb -0.10 -1.31 -0.02 0.00 0.50 0.00 0.00 46.19 45.26 3gzr s LEU 112 CO 0.01 0.19 -0.20 0.00 -1.32 0.00 0.00 176.35 175.03 3gzr s ALA 113 N 0.10 1.66 -0.27 5.97 0.00 0.32 -0.86 121.76 128.69 3gzr s ALA 113 Ca -0.10 -0.89 -0.04 0.00 0.00 0.00 0.00 51.96 50.92 3gzr s ALA 113 Cb -0.15 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.58 3gzr s ALA 113 CO 0.06 0.40 0.02 0.08 0.00 0.00 0.00 175.76 176.31 3gzr s VAL 114 N -0.53 3.48 -0.14 0.00 1.01 -0.32 -0.95 120.40 122.95 3gzr s VAL 114 Ca 0.08 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 3gzr s VAL 114 Cb -0.08 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 3gzr s VAL 114 CO -0.00 0.13 0.02 -0.69 0.00 0.00 0.00 175.10 174.56 3gzr s VAL 115 N 1.42 4.47 -0.19 2.92 1.01 0.62 -1.32 120.40 129.33 3gzr s VAL 115 Ca 0.01 -0.17 -0.05 0.00 0.00 0.00 0.00 61.98 61.77 3gzr s VAL 115 Cb -0.17 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 3gzr s VAL 115 CO -0.01 0.53 0.01 -0.89 0.00 0.00 0.00 175.10 174.74 3gzr s THR 116 N -0.16 4.15 0.14 3.92 2.01 -0.17 -0.72 115.64 124.82 3gzr s THR 116 Ca 0.06 -0.25 0.03 0.00 0.31 0.00 0.00 61.69 61.83 3gzr s THR 116 Cb -0.12 -2.87 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 3gzr s THR 116 CO 0.02 0.44 -0.06 -1.48 -0.69 0.00 0.00 174.62 172.85 3gzr s LEU 117 N 0.78 2.41 -0.21 4.42 2.34 -0.77 -0.82 118.68 126.83 3gzr s LEU 117 Ca 0.01 -1.06 -0.04 0.00 0.06 0.00 0.00 54.13 53.10 3gzr s LEU 117 Cb -0.14 -0.19 -0.01 0.00 -0.56 0.00 0.00 46.19 45.29 3gzr s LEU 117 CO 0.02 -0.44 -0.04 -0.63 -1.06 0.00 0.00 176.35 174.20 3gzr s ILE 118 N -3.50 3.45 -0.12 1.48 1.01 0.16 -0.87 121.20 122.81 3gzr s ILE 118 Ca 0.18 -0.48 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 3gzr s ILE 118 Cb 0.04 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 3gzr s ILE 118 CO 0.00 0.44 0.06 -1.58 0.00 0.00 0.00 174.94 173.86 3gzr s GLN 119 N 1.25 3.36 0.85 2.79 0.74 0.13 -0.73 119.66 128.05 3gzr s GLN 119 Ca 0.03 -0.29 -0.11 0.00 0.05 0.00 0.00 55.36 55.04 3gzr s GLN 119 Cb -0.14 -3.02 0.11 0.00 1.10 0.00 0.00 33.01 31.05 3gzr s GLN 119 CO -0.01 0.64 1.15 -0.51 -0.55 0.00 0.00 175.29 176.00 3gzr s ASP 120 N -0.67 3.49 0.73 6.67 1.01 -0.46 -1.98 116.67 125.46 3gzr s ASP 120 Ca 0.12 2.14 -0.16 0.00 0.71 0.00 0.00 52.55 55.36 3gzr s ASP 120 Cb -0.12 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.28 3gzr s ASP 120 CO 0.02 -2.73 1.14 0.00 0.21 0.00 0.00 175.17 173.82 3gzr n ALA 121 N -3.81 0.23 -3.68 5.23 0.00 -1.26 -4.55 120.51 112.67 3gzr n ALA 121 Ca 0.12 -0.19 -0.08 0.00 0.00 0.00 0.00 53.44 53.29 3gzr n ALA 121 Cb 0.52 -2.22 -0.03 0.00 0.00 0.00 0.00 19.45 17.72 3gzr n ALA 121 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3gzr s TYR 122 N -1.80 -0.04 -0.09 0.00 1.13 -1.26 -4.83 117.35 110.46 3gzr s TYR 122 Ca 0.76 -0.40 0.03 0.00 -1.41 0.00 0.00 57.07 56.05 3gzr s TYR 122 Cb -0.34 0.57 -0.01 0.00 -1.10 0.00 0.00 41.96 41.09 3gzr s TYR 122 CO 0.48 -1.18 -0.19 0.08 -2.51 0.00 0.00 175.55 172.22 3gzr s VAL 123 N -3.91 2.55 0.89 -3.49 1.01 -1.26 -4.53 120.40 111.65 3gzr s VAL 123 Ca 0.14 -0.86 -0.11 0.00 0.00 0.00 0.00 61.98 61.14 3gzr s VAL 123 Cb -0.05 -2.00 0.12 0.00 0.00 0.00 0.00 36.38 34.45 3gzr s VAL 123 CO 0.08 0.55 1.09 0.42 0.00 0.00 0.00 175.10 177.24 3gzr s THR 124 N 0.06 2.71 0.48 3.92 -4.23 -0.28 -4.77 115.64 113.54 3gzr s THR 124 Ca -0.08 0.23 0.18 0.00 -1.18 0.00 0.00 61.69 60.84 3gzr s THR 124 Cb -0.15 -2.70 0.34 0.00 1.34 0.00 0.00 72.50 71.33 3gzr s THR 124 CO 0.05 -0.30 2.01 -0.65 -0.54 0.00 0.00 174.62 175.20 3gzr h PRO 125 N -1.52 0.19 -0.69 3.99 0.11 -2.00 -0.91 132.00 131.17 3gzr h PRO 125 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3gzr h PRO 125 Cb 1.28 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3gzr h PRO 125 CO 0.54 0.13 0.00 -0.25 -0.21 0.00 0.00 178.00 178.20 3gzr n ASP 126 N -4.45 4.41 0.00 -2.05 10.43 -1.26 -4.95 116.55 118.68 3gzr n ASP 126 Ca 0.08 -2.65 0.00 0.00 2.57 0.00 0.00 54.79 54.79 3gzr n ASP 126 Cb 0.41 -0.62 0.00 0.00 1.84 0.00 0.00 41.12 42.74 3gzr n ASP 126 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3gzr n GLY 127 N 0.51 0.68 3.72 0.44 0.00 -0.35 -5.05 105.19 105.13 3gzr n GLY 127 Ca 0.20 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 3gzr n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gzr s ARG 128 N -0.46 4.49 0.60 1.61 0.52 -1.26 -4.79 118.95 119.66 3gzr s ARG 128 Ca 0.00 1.09 -0.10 0.00 -0.52 0.00 0.00 55.73 56.20 3gzr s ARG 128 Cb 0.00 -3.44 0.14 0.00 0.52 0.00 0.00 34.95 32.17 3gzr s ARG 128 CO 0.00 0.06 0.77 0.94 0.02 0.00 0.00 175.30 177.09 3gzr n GLN 129 N 3.66 -0.94 -4.17 3.54 -0.06 -1.26 -1.12 117.38 117.03 3gzr n GLN 129 Ca 0.01 -1.20 -0.11 0.00 -2.00 0.00 0.00 57.00 53.70 3gzr n GLN 129 Cb 0.51 -0.83 -0.10 0.00 -4.06 0.00 0.00 30.24 25.76 3gzr n GLN 129 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 3gzr s PRO 131 N -4.70 0.84 0.24 3.69 0.04 -1.26 -5.00 135.00 128.85 3gzr s PRO 131 Ca 0.44 -1.32 -0.31 0.00 0.04 0.00 0.00 61.00 59.85 3gzr s PRO 131 Cb -0.01 -0.24 -0.14 0.00 0.04 0.00 0.00 34.50 34.15 3gzr s PRO 131 CO 0.31 -0.01 1.36 -2.13 0.04 0.00 0.00 177.00 176.58 3gzr n ARG 132 N 0.00 1.94 -3.52 4.56 0.63 -1.26 -4.40 116.66 114.61 3gzr n ARG 132 Ca -0.12 0.69 -0.11 0.00 -0.92 0.00 0.00 57.85 57.38 3gzr n ARG 132 Cb 0.61 -2.32 -0.03 0.00 0.45 0.00 0.00 32.46 31.17 3gzr n ARG 132 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3gzr s ALA 133 N -0.19 -1.27 0.27 5.13 0.00 -0.84 -4.90 121.76 119.96 3gzr s ALA 133 Ca 0.67 0.23 -0.28 0.00 0.00 0.00 0.00 51.96 52.58 3gzr s ALA 133 Cb -0.66 0.79 -0.09 0.00 0.00 0.00 0.00 23.12 23.16 3gzr s ALA 133 CO 0.51 -0.71 0.92 -1.01 0.00 0.00 0.00 175.76 175.48 3gzr s HIS 134 N -3.77 3.85 0.15 0.00 3.76 -1.26 -0.69 115.29 117.33 3gzr s HIS 134 Ca 0.02 1.83 0.09 0.00 -0.15 0.00 0.00 55.06 56.85 3gzr s HIS 134 Cb 0.00 -2.93 -0.04 0.00 1.11 0.00 0.00 32.58 30.72 3gzr s HIS 134 CO -0.13 0.35 -0.13 -0.51 -0.85 0.00 0.00 174.74 173.48 3gzr s ASP 135 N -1.38 4.09 -0.26 1.40 1.01 -0.05 -0.53 116.67 120.94 3gzr s ASP 135 Ca 0.45 -0.58 0.01 0.00 0.71 0.00 0.00 52.55 53.14 3gzr s ASP 135 Cb -0.22 -0.64 0.05 0.00 1.01 0.00 0.00 42.92 43.12 3gzr s ASP 135 CO 0.28 0.13 -0.09 -0.60 0.21 0.00 0.00 175.17 175.11 3gzr s ARG 136 N -2.55 2.38 -0.19 8.23 6.06 0.13 -1.86 118.95 131.16 3gzr s ARG 136 Ca 0.22 -1.27 -0.00 0.00 -2.50 0.00 0.00 55.73 52.18 3gzr s ARG 136 Cb -0.09 -2.95 0.01 0.00 0.06 0.00 0.00 34.95 31.98 3gzr s ARG 136 CO 0.13 -0.55 -0.15 -1.17 -2.50 0.00 0.00 175.30 171.06 3gzr s LEU 137 N 1.17 2.36 -0.00 -0.88 2.96 0.10 -1.84 118.68 122.54 3gzr s LEU 137 Ca -0.07 -0.56 -0.23 0.00 -0.22 0.00 0.00 54.13 53.05 3gzr s LEU 137 Cb -0.19 -1.55 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 3gzr s LEU 137 CO -0.05 0.01 0.70 -0.89 -1.32 0.00 0.00 176.35 174.80 3gzr s THR 138 N 1.28 4.88 -0.03 3.68 2.01 0.48 -0.27 115.64 127.67 3gzr s THR 138 Ca 0.04 1.46 0.03 0.00 0.31 0.00 0.00 61.69 63.53 3gzr s THR 138 Cb -0.14 -4.04 -0.00 0.00 0.01 0.00 0.00 72.50 68.33 3gzr s THR 138 CO -0.09 0.34 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.30 3gzr s LEU 139 N 0.17 1.87 -0.11 4.42 1.43 -0.13 -1.25 118.68 125.08 3gzr s LEU 139 Ca 0.36 -0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 3gzr s LEU 139 Cb -0.19 -0.70 0.01 0.00 0.03 0.00 0.00 46.19 45.34 3gzr s LEU 139 CO 0.20 0.11 -0.22 -0.76 0.23 0.00 0.00 176.35 175.91 3gzr s LEU 140 N 0.04 2.04 -0.01 1.79 1.43 -0.25 -0.52 118.68 123.21 3gzr s LEU 140 Ca -0.01 -0.55 0.08 0.00 -1.03 0.00 0.00 54.13 52.61 3gzr s LEU 140 Cb -0.09 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.75 3gzr s LEU 140 CO 0.01 0.11 -0.24 0.00 0.23 0.00 0.00 176.35 176.46 3gzr s ALA 141 N 0.59 1.99 0.09 4.21 0.00 -0.09 -0.58 121.76 127.96 3gzr s ALA 141 Ca -0.13 -1.05 0.07 0.00 0.00 0.00 0.00 51.96 50.84 3gzr s ALA 141 Cb -0.17 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.43 3gzr s ALA 141 CO 0.04 0.48 -0.18 0.14 0.00 0.00 0.00 175.76 176.24 3gzr s VAL 142 N -0.60 1.49 -0.21 0.00 -7.23 -0.73 -1.01 120.40 112.11 3gzr s VAL 142 Ca 0.09 -1.48 -0.11 0.00 -1.81 0.00 0.00 61.98 58.67 3gzr s VAL 142 Cb -0.09 -1.40 -0.05 0.00 0.56 0.00 0.00 36.38 35.40 3gzr s VAL 142 CO -0.00 -0.14 0.16 -0.70 -0.31 0.00 0.00 175.10 174.10 3gzr s GLU 143 N -1.92 4.15 -0.05 4.82 2.12 0.36 -2.46 118.70 125.73 3gzr s GLU 143 Ca 0.04 -0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.16 3gzr s GLU 143 Cb -0.10 -3.47 0.03 0.00 0.26 0.00 0.00 34.13 30.85 3gzr s GLU 143 CO 0.04 0.19 -0.02 1.03 -0.54 0.00 0.00 175.26 175.96 3gzr s ARG 144 N 0.67 0.60 -1.50 4.30 0.52 0.28 -4.81 118.95 119.01 3gzr s ARG 144 Ca 0.08 0.02 -0.12 0.00 -0.52 0.00 0.00 55.73 55.19 3gzr s ARG 144 Cb -0.12 -0.78 0.08 0.00 0.52 0.00 0.00 34.95 34.65 3gzr s ARG 144 CO 0.01 -0.17 0.86 0.39 0.02 0.00 0.00 175.30 176.41 3gzr n GLU 145 N 4.45 -5.07 -0.99 3.54 -0.58 -1.26 -1.62 120.64 119.10 3gzr n GLU 145 Ca -0.19 0.60 0.00 0.00 -0.42 0.00 0.00 57.16 57.15 3gzr n GLU 145 Cb 0.50 -5.46 0.00 0.00 -0.57 0.00 0.00 31.44 25.91 3gzr n GLU 145 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3gzr n GLY 146 N -1.58 0.84 3.36 0.62 0.00 -1.26 -5.02 105.19 102.14 3gzr n GLY 146 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 3gzr n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gzr s VAL 147 N -3.36 2.49 -0.14 1.61 1.01 -0.64 -5.10 120.40 116.27 3gzr s VAL 147 Ca 0.00 -0.93 -0.04 0.00 0.00 0.00 0.00 61.98 61.01 3gzr s VAL 147 Cb 0.00 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 3gzr s VAL 147 CO 0.00 0.58 0.02 0.26 0.00 0.00 0.00 175.10 175.96 3gzr s TRP 148 N -0.45 3.18 0.14 5.22 0.52 -1.26 -0.56 118.94 125.73 3gzr s TRP 148 Ca 0.05 0.05 -0.04 0.00 0.02 0.00 0.00 56.10 56.18 3gzr s TRP 148 Cb -0.12 -1.93 -0.03 0.00 -1.15 0.00 0.00 33.47 30.24 3gzr s TRP 148 CO 0.01 0.26 0.14 1.03 0.02 0.00 0.00 176.95 178.41 3gzr s ARG 149 N -0.18 0.99 0.36 4.98 0.52 -1.03 -5.00 118.95 119.59 3gzr s ARG 149 Ca 0.06 -1.30 -0.27 0.00 -0.52 0.00 0.00 55.73 53.69 3gzr s ARG 149 Cb -0.12 0.30 -0.09 0.00 0.52 0.00 0.00 34.95 35.55 3gzr s ARG 149 CO 0.02 -0.31 1.23 -0.06 0.02 0.00 0.00 175.30 176.19 3gzr s PHE 150 N -4.00 3.11 -0.01 -0.53 0.08 0.03 -1.78 117.98 114.87 3gzr s PHE 150 Ca 0.20 1.51 0.08 0.00 0.12 0.00 0.00 56.93 58.84 3gzr s PHE 150 Cb 0.06 -3.52 -0.13 0.00 -0.57 0.00 0.00 43.02 38.86 3gzr s PHE 150 CO -0.00 -1.50 0.18 1.51 -0.10 0.00 0.00 175.22 175.31 3gzr n ILE 151 N 0.53 0.00 -3.58 0.64 0.13 0.25 -1.19 119.36 116.14 3gzr n ILE 151 Ca 0.02 -0.19 -0.14 0.00 -1.10 0.00 0.00 62.75 61.34 3gzr n ILE 151 Cb 0.44 0.30 -0.06 0.00 -0.84 0.00 0.00 39.64 39.48 3gzr n ILE 151 CO 0.00 0.00 0.00 -2.28 2.80 0.00 0.00 176.55 177.07 3gzr s HIS 152 N -2.58 -0.58 0.06 9.51 2.46 -1.15 -1.29 115.29 121.72 3gzr s HIS 152 Ca -0.03 1.17 0.03 0.00 0.47 0.00 0.00 55.06 56.70 3gzr s HIS 152 Cb 0.05 0.38 -0.03 0.00 -0.13 0.00 0.00 32.58 32.86 3gzr s HIS 152 CO 0.35 -0.43 -0.09 0.20 -2.47 0.00 0.00 174.74 172.30 3gzr s GLY 153 N -0.61 0.64 -0.18 1.59 0.00 -1.00 -1.09 107.32 106.68 3gzr s GLY 153 Ca -0.04 -0.93 -0.07 0.00 0.00 0.00 0.00 44.72 43.68 3gzr s GLY 153 CO 0.03 -0.99 0.39 -1.58 0.00 0.00 0.00 173.10 170.95 3gzr s HIS 154 N -1.80 -0.67 0.05 1.90 2.46 -0.38 -1.24 115.29 115.61 3gzr s HIS 154 Ca -0.04 1.35 0.08 0.00 0.47 0.00 0.00 55.06 56.93 3gzr s HIS 154 Cb -0.07 0.23 -0.03 0.00 -0.13 0.00 0.00 32.58 32.58 3gzr s HIS 154 CO -0.00 -0.42 -0.22 1.21 -2.47 0.00 0.00 174.74 172.84 3gzr s ASN 155 N 2.23 3.51 -0.01 9.88 2.47 -0.51 -0.38 114.94 132.13 3gzr s ASN 155 Ca -0.03 -0.52 -0.01 0.00 0.42 0.00 0.00 52.86 52.71 3gzr s ASN 155 Cb -0.11 -0.45 0.00 0.00 -1.45 0.00 0.00 41.25 39.24 3gzr s ASN 155 CO -0.12 0.25 0.03 -0.89 -3.72 0.00 0.00 177.10 172.65 3gzr s THR 156 N -0.90 -0.00 0.14 -5.21 2.01 -0.77 -3.53 115.64 107.38 3gzr s THR 156 Ca 0.14 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.84 3gzr s THR 156 Cb -0.10 -0.05 -0.07 0.00 0.01 0.00 0.00 72.50 72.29 3gzr s THR 156 CO 0.04 0.00 1.01 -0.63 -0.69 0.00 0.00 174.62 174.36 3gzr s ILE 157 N 0.02 4.26 -0.15 1.82 1.01 -1.26 -0.69 121.20 126.20 3gzr s ILE 157 Ca -0.00 1.90 -0.29 0.00 0.00 0.00 0.00 60.65 62.26 3gzr s ILE 157 Cb -0.00 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 38.25 3gzr s ILE 157 CO 0.00 0.31 1.04 -0.69 0.00 0.00 0.00 174.94 175.60 3gzr s VAL 158 N -0.11 4.70 -0.42 2.92 1.01 0.31 -4.88 120.40 123.93 3gzr s VAL 158 Ca 0.48 2.00 -0.25 0.00 0.00 0.00 0.00 61.98 64.21 3gzr s VAL 158 Cb -0.26 -4.29 0.02 0.00 0.00 0.00 0.00 36.38 31.86 3gzr s VAL 158 CO 0.32 -0.07 0.88 0.21 0.00 0.00 0.00 175.10 176.44 3gzr s ASN 159 N 1.18 6.53 0.51 3.32 3.84 -1.26 -4.61 114.94 124.46 3gzr s ASN 159 Ca 0.47 0.23 0.30 0.00 0.21 0.00 0.00 52.86 54.07 3gzr s ASN 159 Cb -0.18 -2.44 1.21 0.00 -0.55 0.00 0.00 41.25 39.30 3gzr s ASN 159 CO 0.14 -0.94 1.93 1.55 -2.79 0.00 0.00 177.10 176.99 3gzr h PRO 160 N 8.83 0.00 0.00 0.43 0.13 -1.96 -2.60 132.00 136.83 3gzr h PRO 160 Ca -0.24 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 3gzr h PRO 160 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3gzr h PRO 160 CO 0.99 0.09 -0.07 -0.44 -0.23 0.00 0.00 178.00 178.34 3gzr h ASP 161 N 0.00 0.00 0.67 1.44 3.32 -2.04 -3.22 116.42 116.59 3gzr h ASP 161 Ca -0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 3gzr h ASP 161 Cb 0.59 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 3gzr h ASP 161 CO 0.01 0.07 -1.36 0.00 -1.72 0.00 0.00 179.24 176.24 3gzr n ALA 162 N -2.12 2.44 -0.33 3.45 0.00 -0.99 -4.65 120.51 118.31 3gzr n ALA 162 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.06 3gzr n ALA 162 Cb 0.43 -0.96 0.17 0.00 0.00 0.00 0.00 19.45 19.09 3gzr n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gzr h ALA 163 N 1.85 1.38 0.00 0.00 0.00 -1.56 -1.49 119.26 119.45 3gzr h ALA 163 Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3gzr h ALA 163 Cb 1.16 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3gzr h ALA 163 CO 0.01 0.55 0.00 -0.91 0.00 0.00 0.00 179.25 178.90 3gzr h ASN 164 N 1.21 0.00 -0.42 0.00 2.35 -1.82 -2.26 115.58 114.63 3gzr h ASN 164 Ca 0.36 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.11 3gzr h ASN 164 Cb -0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3gzr h ASN 164 CO -0.10 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.27 3gzr n ASN 165 N -2.60 2.93 -4.65 5.81 3.02 -0.56 -4.90 115.26 114.32 3gzr n ASN 165 Ca 0.00 -2.19 -0.42 0.00 -0.03 0.00 0.00 54.58 51.94 3gzr n ASN 165 Cb 0.20 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 38.94 3gzr n ASN 165 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3gzr s ASP 166 N -0.83 6.46 0.54 6.41 -1.08 -0.85 -4.88 116.67 122.44 3gzr s ASP 166 Ca 0.32 2.18 0.26 0.00 -0.52 0.00 0.00 52.55 54.79 3gzr s ASP 166 Cb 0.19 -2.53 1.53 0.00 -1.46 0.00 0.00 42.92 40.65 3gzr s ASP 166 CO 0.17 -1.11 2.14 -0.65 0.52 0.00 0.00 175.17 176.24 3gzr h PRO 167 N 10.47 0.00 0.00 4.34 0.11 -1.92 -2.55 132.00 142.45 3gzr h PRO 167 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3gzr h PRO 167 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3gzr h PRO 167 CO 0.96 0.07 0.00 -0.39 -0.21 0.00 0.00 178.00 178.44 3gzr h VAL 168 N 0.00 0.00 0.00 3.15 -1.51 -1.99 -2.27 116.25 113.63 3gzr h VAL 168 Ca -0.00 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 3gzr h VAL 168 Cb 0.18 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.52 3gzr h VAL 168 CO 0.01 0.00 0.00 -0.07 -1.23 0.00 0.00 177.57 176.28 3gzr h LEU 169 N 0.00 0.00 -7.56 4.19 3.38 -1.85 -3.45 115.31 110.02 3gzr h LEU 169 Ca 0.00 0.00 -0.77 0.00 0.09 0.00 0.00 57.88 57.20 3gzr h LEU 169 Cb 0.28 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 40.80 3gzr h LEU 169 CO 0.00 0.00 0.88 -2.11 0.09 0.00 0.00 178.44 177.30 3gzr n ARG 170 N -3.07 3.52 0.00 1.13 1.85 -0.86 -5.16 116.66 114.07 3gzr n ARG 170 Ca -0.02 -4.19 0.00 0.00 -1.00 0.00 0.00 57.85 52.63 3gzr n ARG 170 Cb 0.10 -2.75 0.00 0.00 -1.05 0.00 0.00 32.46 28.76 3gzr n ARG 170 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79