#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gch s VAL 17 N 0.00 4.82 -0.07 1.39 1.01 -1.26 -4.16 120.40 122.13 3gch s VAL 17 Ca 0.00 1.90 -0.00 0.00 0.00 0.00 0.00 61.98 63.88 3gch s VAL 17 Cb 0.00 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.13 3gch s VAL 17 CO 0.00 0.01 0.00 -3.20 0.00 0.00 0.00 175.10 171.92 3gch n ASN 18 N 5.09 -1.29 -4.89 3.32 2.85 -1.26 -5.08 115.26 114.00 3gch n ASN 18 Ca 0.07 -0.00 -0.24 0.00 -0.11 0.00 0.00 54.58 54.30 3gch n ASN 18 Cb 0.49 -0.67 -0.01 0.00 1.24 0.00 0.00 39.78 40.82 3gch n ASN 18 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 3gch s GLY 19 N -2.97 2.25 0.21 8.20 0.00 -1.26 -5.15 107.32 108.61 3gch s GLY 19 Ca 0.00 -1.59 0.05 0.00 0.00 0.00 0.00 44.72 43.18 3gch s GLY 19 CO 0.00 -1.85 -0.05 -0.54 0.00 0.00 0.00 173.10 170.66 3gch s GLU 20 N -4.23 1.28 0.26 2.90 2.02 -1.26 -5.12 118.70 114.55 3gch s GLU 20 Ca 0.41 -1.61 -0.30 0.00 0.02 0.00 0.00 54.97 53.49 3gch s GLU 20 Cb -0.02 -0.74 -0.10 0.00 0.10 0.00 0.00 34.13 33.37 3gch s GLU 20 CO 0.25 0.00 1.40 -2.00 0.02 0.00 0.00 175.26 174.92 3gch s GLU 21 N -3.79 4.30 0.89 1.61 2.12 -1.26 -5.01 118.70 117.56 3gch s GLU 21 Ca 0.24 2.25 -0.12 0.00 0.36 0.00 0.00 54.97 57.70 3gch s GLU 21 Cb 0.04 -3.12 0.13 0.00 0.26 0.00 0.00 34.13 31.44 3gch s GLU 21 CO 0.06 -0.35 1.15 0.00 -0.54 0.00 0.00 175.26 175.58 3gch s ALA 22 N -0.19 1.96 -0.07 6.30 0.00 -1.26 -5.06 121.76 123.43 3gch s ALA 22 Ca 0.57 -0.55 -0.22 0.00 0.00 0.00 0.00 51.96 51.76 3gch s ALA 22 Cb -0.41 -3.02 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 3gch s ALA 22 CO 0.44 -2.16 0.66 0.08 0.00 0.00 0.00 175.76 174.79 3gch s VAL 23 N -3.34 5.07 -0.42 0.00 1.01 -1.26 -5.01 120.40 116.45 3gch s VAL 23 Ca 0.63 1.36 -0.27 0.00 0.00 0.00 0.00 61.98 63.71 3gch s VAL 23 Cb -0.14 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 3gch s VAL 23 CO 0.52 0.27 2.25 -2.84 0.00 0.00 0.00 175.10 175.30 3gch s PRO 24 N 0.74 2.52 0.00 2.72 0.02 -1.26 -2.15 135.00 137.59 3gch s PRO 24 Ca 0.35 1.48 0.00 0.00 0.02 0.00 0.00 61.00 62.85 3gch s PRO 24 Cb -0.17 -4.48 0.00 0.00 0.02 0.00 0.00 34.50 29.87 3gch s PRO 24 CO 0.17 -2.81 0.00 0.41 -0.33 0.00 0.00 177.00 174.44 3gch n GLY 25 N 5.86 0.80 0.02 0.52 0.00 -1.26 -4.98 105.19 106.15 3gch n GLY 25 Ca 0.32 -0.09 0.15 0.00 0.00 0.00 0.00 46.02 46.40 3gch n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gch n SER 26 N 0.16 0.06 -3.19 1.61 3.41 -0.91 -3.73 113.62 111.03 3gch n SER 26 Ca 0.00 -1.10 -0.22 0.00 -0.26 0.00 0.00 58.87 57.29 3gch n SER 26 Cb 0.00 -0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.89 3gch n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3gch n TRP 27 N -0.91 -0.10 0.53 7.33 7.02 -1.26 -5.00 117.44 125.04 3gch n TRP 27 Ca 0.22 -3.67 0.05 0.00 -1.02 0.00 0.00 57.50 53.08 3gch n TRP 27 Cb 0.11 -0.38 0.26 0.00 -2.42 0.00 0.00 31.31 28.88 3gch n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 3gch n PRO 28 N 0.96 0.24 0.00 -0.99 -0.04 -1.24 -2.33 135.00 131.60 3gch n PRO 28 Ca 0.23 0.06 0.11 0.00 -0.04 0.00 0.00 63.50 63.85 3gch n PRO 28 Cb 0.58 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.52 3gch n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3gch n TRP 29 N -1.08 0.05 -2.09 0.54 2.14 -1.23 -0.88 117.44 114.88 3gch n TRP 29 Ca 0.06 0.01 -0.42 0.00 2.07 0.00 0.00 57.50 59.23 3gch n TRP 29 Cb 0.04 -0.17 -0.03 0.00 -0.81 0.00 0.00 31.31 30.34 3gch n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 3gch s GLN 30 N -3.07 4.29 0.33 -2.67 2.00 -0.98 -1.16 119.66 118.39 3gch s GLN 30 Ca 0.07 2.17 0.09 0.00 -2.00 0.00 0.00 55.36 55.69 3gch s GLN 30 Cb 0.16 -3.21 -0.05 0.00 0.80 0.00 0.00 33.01 30.70 3gch s GLN 30 CO 0.82 -0.48 -0.02 0.14 -0.50 0.00 0.00 175.29 175.26 3gch s VAL 31 N 1.05 2.65 -0.07 1.34 -7.23 -0.94 -4.52 120.40 112.68 3gch s VAL 31 Ca 0.66 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 58.83 3gch s VAL 31 Cb -0.39 -2.75 0.01 0.00 0.56 0.00 0.00 36.38 33.82 3gch s VAL 31 CO 0.31 -0.23 -0.13 -0.55 -0.31 0.00 0.00 175.10 174.19 3gch s SER 32 N -3.69 1.92 -0.14 4.85 0.15 -0.80 -2.35 113.70 113.65 3gch s SER 32 Ca 0.34 -0.32 -0.13 0.00 0.70 0.00 0.00 55.95 56.53 3gch s SER 32 Cb -0.01 -0.88 -0.05 0.00 -1.71 0.00 0.00 66.02 63.38 3gch s SER 32 CO 0.19 0.03 0.29 -0.76 1.20 0.00 0.00 173.24 174.19 3gch s LEU 33 N 0.74 4.28 0.01 3.45 1.43 -0.71 -0.45 118.68 127.43 3gch s LEU 33 Ca -0.13 0.55 0.01 0.00 -1.03 0.00 0.00 54.13 53.53 3gch s LEU 33 Cb -0.16 -2.37 -0.01 0.00 0.03 0.00 0.00 46.19 43.69 3gch s LEU 33 CO 0.03 0.15 -0.04 -1.10 0.23 0.00 0.00 176.35 175.62 3gch s GLN 34 N 0.16 0.34 0.64 1.70 -0.21 -0.26 -1.77 119.66 120.25 3gch s GLN 34 Ca 0.17 -0.34 -0.06 0.00 0.02 0.00 0.00 55.36 55.15 3gch s GLN 34 Cb -0.13 -0.22 0.03 0.00 1.00 0.00 0.00 33.01 33.69 3gch s GLN 34 CO 0.05 0.05 0.95 0.16 -2.12 0.00 0.00 175.29 174.38 3gch s ASP 35 N -0.63 5.25 0.65 5.90 3.84 -0.34 0.36 116.67 131.70 3gch s ASP 35 Ca -0.04 0.59 0.16 0.00 -0.00 0.00 0.00 52.55 53.26 3gch s ASP 35 Cb -0.05 -1.43 0.82 0.00 -1.38 0.00 0.00 42.92 40.89 3gch s ASP 35 CO -0.00 -1.30 1.44 0.07 -0.00 0.00 0.00 175.17 175.39 3gch h LYS 36 N -0.35 0.00 -0.09 2.11 2.10 -1.93 0.97 116.57 119.38 3gch h LYS 36 Ca -0.45 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.00 3gch h LYS 36 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 3gch h LYS 36 CO 0.60 0.00 -0.76 1.15 -2.00 0.00 0.00 179.45 178.44 3gch h THR 37 N 0.00 1.35 0.00 0.07 2.02 -1.94 -3.46 112.91 110.94 3gch h THR 37 Ca 0.08 -2.11 0.00 0.00 0.77 0.00 0.00 66.41 65.15 3gch h THR 37 Cb 1.57 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 70.08 3gch h THR 37 CO -0.00 0.64 0.00 0.61 0.37 0.00 0.00 175.52 177.14 3gch n GLY 38 N 0.63 1.20 3.65 2.16 0.00 0.33 -5.05 105.19 108.11 3gch n GLY 38 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 3gch n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3gch s PHE 39 N -2.00 3.34 -0.19 1.61 5.36 -1.23 -4.84 117.98 120.04 3gch s PHE 39 Ca 0.00 0.93 -0.29 0.00 -0.96 0.00 0.00 56.93 56.61 3gch s PHE 39 Cb 0.00 -2.85 -0.00 0.00 -0.34 0.00 0.00 43.02 39.83 3gch s PHE 39 CO 0.00 -0.25 1.14 -1.58 -1.46 0.00 0.00 175.22 173.08 3gch s HIS 40 N 2.19 3.13 0.00 10.12 5.65 -1.26 -1.20 115.29 133.92 3gch s HIS 40 Ca 0.29 1.26 0.00 0.00 0.25 0.00 0.00 55.06 56.86 3gch s HIS 40 Cb -0.16 -3.37 0.00 0.00 -1.18 0.00 0.00 32.58 27.87 3gch s HIS 40 CO 0.10 -1.04 0.06 1.97 -0.65 0.00 0.00 174.74 175.18 3gch n PHE 41 N 6.32 0.00 -3.57 3.88 1.16 -0.73 -5.00 117.46 119.51 3gch n PHE 41 Ca 0.13 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.62 3gch n PHE 41 Cb 0.46 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.31 3gch n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3gch s GLY 43 N -2.74 2.07 0.26 0.00 0.00 -1.26 -1.74 107.32 103.91 3gch s GLY 43 Ca 0.06 -1.90 0.02 0.00 0.00 0.00 0.00 44.72 42.90 3gch s GLY 43 CO -0.06 -1.78 0.21 -0.32 0.00 0.00 0.00 173.10 171.16 3gch s GLY 44 N -3.91 1.79 -0.00 0.20 0.00 -0.99 -4.66 107.32 99.74 3gch s GLY 44 Ca 0.40 -1.83 0.01 0.00 0.00 0.00 0.00 44.72 43.30 3gch s GLY 44 CO 0.24 -1.39 -0.02 -0.56 0.00 0.00 0.00 173.10 171.36 3gch s SER 45 N -3.25 0.21 -0.17 1.64 0.01 0.30 -2.20 113.70 110.24 3gch s SER 45 Ca 0.39 -0.03 -0.29 0.00 1.31 0.00 0.00 55.95 57.33 3gch s SER 45 Cb 0.05 -0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.24 3gch s SER 45 CO 0.19 0.02 1.13 -0.76 0.41 0.00 0.00 173.24 174.23 3gch s LEU 46 N -0.00 4.17 -0.00 2.44 1.43 -0.31 0.39 118.68 126.80 3gch s LEU 46 Ca 0.00 1.57 0.12 0.00 -1.03 0.00 0.00 54.13 54.79 3gch s LEU 46 Cb -0.01 -3.54 -0.14 0.00 0.03 0.00 0.00 46.19 42.53 3gch s LEU 46 CO -0.00 -0.66 0.50 2.30 0.23 0.00 0.00 176.35 178.72 3gch n ILE 47 N 5.14 0.00 -1.29 -0.59 -5.35 -1.11 -0.02 119.36 116.14 3gch n ILE 47 Ca 0.12 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 3gch n ILE 47 Cb 0.46 0.94 0.00 0.00 -1.74 0.00 0.00 39.64 39.30 3gch n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3gch n ASN 48 N -1.34 0.00 -0.39 7.28 2.04 -1.25 -4.58 115.26 117.03 3gch n ASN 48 Ca 0.02 0.00 0.04 0.00 -0.44 0.00 0.00 54.58 54.20 3gch n ASN 48 Cb 0.20 0.00 0.12 0.00 -2.53 0.00 0.00 39.78 37.57 3gch n ASN 48 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 3gch n GLU 49 N -0.12 1.49 0.00 -3.83 0.00 -1.26 -3.77 120.64 113.14 3gch n GLU 49 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 57.16 56.41 3gch n GLU 49 Cb 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 31.44 30.26 3gch n GLU 49 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3gch n ASN 50 N 0.10 0.79 -3.68 -1.84 3.02 -1.26 -0.81 115.26 111.57 3gch n ASN 50 Ca 0.08 -1.27 -0.09 0.00 -0.03 0.00 0.00 54.58 53.27 3gch n ASN 50 Cb 0.18 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.25 3gch n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3gch s TRP 51 N -0.27 -0.72 0.21 3.10 0.52 -1.25 -2.00 118.94 118.53 3gch s TRP 51 Ca 0.00 1.49 0.08 0.00 0.02 0.00 0.00 56.10 57.69 3gch s TRP 51 Cb 0.00 0.35 -0.04 0.00 -1.15 0.00 0.00 33.47 32.63 3gch s TRP 51 CO 0.00 -0.40 0.02 0.08 0.02 0.00 0.00 176.95 176.67 3gch s VAL 52 N 1.56 3.69 -0.13 4.03 1.01 0.65 -2.74 120.40 128.48 3gch s VAL 52 Ca -0.09 -1.59 0.02 0.00 0.00 0.00 0.00 61.98 60.32 3gch s VAL 52 Cb -0.08 -2.91 0.01 0.00 0.00 0.00 0.00 36.38 33.40 3gch s VAL 52 CO -0.14 -0.22 -0.19 0.68 0.00 0.00 0.00 175.10 175.22 3gch s VAL 53 N -1.96 1.84 0.00 2.92 -7.23 0.16 -0.43 120.40 115.70 3gch s VAL 53 Ca 0.29 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.62 3gch s VAL 53 Cb -0.08 -1.64 0.00 0.00 0.56 0.00 0.00 36.38 35.22 3gch s VAL 53 CO 0.20 0.51 0.00 1.07 -0.31 0.00 0.00 175.10 176.56 3gch n THR 54 N 4.13 0.00 -3.37 5.32 5.66 -1.12 0.11 114.28 125.01 3gch n THR 54 Ca -0.20 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.48 3gch n THR 54 Cb 0.51 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 3gch n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3gch s ALA 55 N -2.00 3.52 0.22 1.79 0.00 -1.26 -1.18 121.76 122.86 3gch s ALA 55 Ca 0.00 -0.22 -0.07 0.00 0.00 0.00 0.00 51.96 51.67 3gch s ALA 55 Cb 0.00 -2.49 0.19 0.00 0.00 0.00 0.00 23.12 20.82 3gch s ALA 55 CO 0.00 0.48 1.81 0.00 0.00 0.00 0.00 175.76 178.05 3gch h ALA 56 N 2.52 1.10 0.00 0.00 0.00 -1.75 -1.42 119.26 119.71 3gch h ALA 56 Ca -0.47 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.20 3gch h ALA 56 Cb 1.17 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3gch h ALA 56 CO 0.68 0.66 -0.32 1.12 0.00 0.00 0.00 179.25 181.40 3gch h HIS 57 N 1.19 0.00 -0.93 0.00 2.07 -1.94 -2.91 115.15 112.63 3gch h HIS 57 Ca 0.28 0.00 0.24 0.00 -2.85 0.00 0.00 60.37 58.04 3gch h HIS 57 Cb 0.16 0.00 -0.17 0.00 2.57 0.00 0.00 27.41 29.97 3gch h HIS 57 CO 0.02 0.32 0.01 0.00 -3.07 0.00 0.00 177.93 175.20 3gch n GLY 59 N -1.49 0.54 3.76 0.00 0.00 -1.10 -5.04 105.19 101.86 3gch n GLY 59 Ca 0.20 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 3gch n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gch s VAL 60 N -2.74 2.90 0.51 1.61 1.01 -1.26 -5.05 120.40 117.37 3gch s VAL 60 Ca 0.00 0.83 0.02 0.00 0.00 0.00 0.00 61.98 62.84 3gch s VAL 60 Cb 0.00 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 3gch s VAL 60 CO 0.00 0.17 0.06 0.42 0.00 0.00 0.00 175.10 175.75 3gch s THR 61 N -0.65 1.29 -2.10 3.92 -4.23 -1.26 -4.95 115.64 107.64 3gch s THR 61 Ca 0.52 -1.92 0.16 0.00 -1.18 0.00 0.00 61.69 59.27 3gch s THR 61 Cb -0.39 -2.21 0.42 0.00 1.34 0.00 0.00 72.50 71.66 3gch s THR 61 CO 0.47 0.00 1.39 0.35 -0.54 0.00 0.00 174.62 176.28 3gch n THR 62 N -1.32 0.51 1.03 3.99 -2.24 -1.26 -3.21 114.28 111.78 3gch n THR 62 Ca -0.16 -0.56 0.11 0.00 -2.27 0.00 0.00 64.05 61.17 3gch n THR 62 Cb 0.67 0.38 0.01 0.00 -2.10 0.00 0.00 70.33 69.29 3gch n THR 62 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3gch n SER 63 N 0.77 1.41 -4.90 3.42 7.64 -1.26 -4.46 113.62 116.25 3gch n SER 63 Ca 0.16 -1.15 -0.28 0.00 1.01 0.00 0.00 58.87 58.60 3gch n SER 63 Cb 0.39 0.62 -0.01 0.00 -1.01 0.00 0.00 64.21 64.20 3gch n SER 63 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3gch s ASP 64 N -2.72 6.32 -0.04 6.43 -0.00 -1.20 -4.06 116.67 121.40 3gch s ASP 64 Ca 0.15 1.03 0.07 0.00 -0.00 0.00 0.00 52.55 53.79 3gch s ASP 64 Cb 0.17 -2.29 -0.01 0.00 -0.00 0.00 0.00 42.92 40.79 3gch s ASP 64 CO 0.69 -0.56 -0.25 0.54 -0.00 0.00 0.00 175.17 175.59 3gch s VAL 65 N -2.69 2.02 -0.06 -1.27 0.11 0.16 -4.24 120.40 114.42 3gch s VAL 65 Ca 0.49 -1.07 -0.22 0.00 -2.93 0.00 0.00 61.98 58.25 3gch s VAL 65 Cb -0.10 -1.69 -0.04 0.00 -1.53 0.00 0.00 36.38 33.01 3gch s VAL 65 CO 0.42 0.57 0.64 -0.69 -3.33 0.00 0.00 175.10 172.71 3gch s VAL 66 N -0.35 5.03 -0.10 2.04 1.01 -0.56 -1.10 120.40 126.37 3gch s VAL 66 Ca 0.02 1.33 0.01 0.00 0.00 0.00 0.00 61.98 63.34 3gch s VAL 66 Cb -0.12 -3.98 0.02 0.00 0.00 0.00 0.00 36.38 32.29 3gch s VAL 66 CO 0.02 0.30 -0.12 -0.69 0.00 0.00 0.00 175.10 174.61 3gch s VAL 67 N 0.55 1.25 0.10 2.92 1.01 0.41 0.47 120.40 127.10 3gch s VAL 67 Ca 0.34 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.89 3gch s VAL 67 Cb -0.17 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 3gch s VAL 67 CO 0.17 0.39 -0.13 0.00 0.00 0.00 0.00 175.10 175.53 3gch s ALA 68 N 1.15 1.28 0.00 5.51 0.00 -0.96 -1.90 121.76 126.84 3gch s ALA 68 Ca -0.04 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.76 3gch s ALA 68 Cb -0.14 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 22.92 3gch s ALA 68 CO -0.03 0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.24 3gch n GLY 69 N 0.83 0.65 3.75 0.00 0.00 -1.26 0.20 105.19 109.35 3gch n GLY 69 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 3gch n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3gch s GLU 70 N -0.77 2.49 0.13 1.61 2.12 -1.26 -4.73 118.70 118.29 3gch s GLU 70 Ca 0.00 1.49 0.00 0.00 0.36 0.00 0.00 54.97 56.82 3gch s GLU 70 Cb 0.00 -1.90 0.00 0.00 0.26 0.00 0.00 34.13 32.49 3gch s GLU 70 CO 0.00 -1.51 0.00 0.34 -0.54 0.00 0.00 175.26 173.55 3gch n PHE 71 N -2.66 -1.14 -3.70 5.30 7.35 -1.26 -4.89 117.46 116.47 3gch n PHE 71 Ca 0.11 0.20 -0.39 0.00 -0.76 0.00 0.00 57.45 56.62 3gch n PHE 71 Cb 0.52 0.49 -0.12 0.00 0.35 0.00 0.00 39.48 40.72 3gch n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3gch s ASP 72 N -5.05 5.44 0.56 -2.13 3.68 -1.26 -4.96 116.67 112.95 3gch s ASP 72 Ca 0.00 -1.28 0.25 0.00 2.13 0.00 0.00 52.55 53.65 3gch s ASP 72 Cb 0.00 -1.91 1.56 0.00 -1.45 0.00 0.00 42.92 41.12 3gch s ASP 72 CO 0.00 -0.40 2.15 1.56 0.13 0.00 0.00 175.17 178.61 3gch h GLN 73 N 8.28 0.00 -0.56 4.34 4.20 -2.02 -2.54 115.11 126.80 3gch h GLN 73 Ca -0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.48 3gch h GLN 73 Cb 1.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.86 3gch h GLN 73 CO 0.65 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 179.22 3gch n GLY 74 N -1.45 1.68 3.71 3.46 0.00 -1.26 -4.93 105.19 106.41 3gch n GLY 74 Ca -0.00 -0.58 -0.35 0.00 0.00 0.00 0.00 46.02 45.08 3gch n GLY 74 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gch s SER 75 N -0.90 5.67 0.13 1.61 0.15 -0.96 -5.00 113.70 114.40 3gch s SER 75 Ca 0.36 0.20 0.21 0.00 0.70 0.00 0.00 55.95 57.42 3gch s SER 75 Cb 0.21 -1.82 -0.09 0.00 -1.71 0.00 0.00 66.02 62.61 3gch s SER 75 CO 0.21 0.30 0.88 -1.54 1.20 0.00 0.00 173.24 174.30 3gch n SER 76 N 2.66 0.68 -0.59 5.45 3.41 -1.26 -4.40 113.62 119.57 3gch n SER 76 Ca -0.18 0.27 0.06 0.00 -0.26 0.00 0.00 58.87 58.76 3gch n SER 76 Cb 0.53 0.69 0.19 0.00 -0.26 0.00 0.00 64.21 65.37 3gch n SER 76 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3gch n SER 77 N -2.64 1.73 -4.49 4.04 3.41 -1.26 -4.82 113.62 109.59 3gch n SER 77 Ca -0.03 -1.94 -0.43 0.00 -0.26 0.00 0.00 58.87 56.22 3gch n SER 77 Cb 0.62 -0.20 -0.09 0.00 -0.26 0.00 0.00 64.21 64.28 3gch n SER 77 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3gch s GLU 78 N -1.61 3.14 0.00 4.33 2.12 -1.26 -4.97 118.70 120.45 3gch s GLU 78 Ca 0.24 -0.75 -0.02 0.00 0.36 0.00 0.00 54.97 54.80 3gch s GLU 78 Cb 0.13 -3.95 -0.02 0.00 0.26 0.00 0.00 34.13 30.54 3gch s GLU 78 CO 0.17 -0.80 0.74 1.17 -0.54 0.00 0.00 175.26 176.00 3gch n LYS 79 N 5.51 0.00 -2.37 4.30 4.81 -1.26 -4.92 118.16 124.23 3gch n LYS 79 Ca -0.08 -0.37 -0.30 0.00 -0.87 0.00 0.00 58.31 56.69 3gch n LYS 79 Cb 0.48 -1.72 -0.01 0.00 0.02 0.00 0.00 35.03 33.80 3gch n LYS 79 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 3gch s ILE 80 N 3.92 4.76 -0.41 3.15 -4.36 -1.26 -4.90 121.20 122.09 3gch s ILE 80 Ca 0.04 0.68 -0.10 0.00 -0.26 0.00 0.00 60.65 61.02 3gch s ILE 80 Cb 0.01 -3.82 0.07 0.00 1.25 0.00 0.00 42.46 39.97 3gch s ILE 80 CO 0.02 -0.87 0.25 -1.10 0.24 0.00 0.00 174.94 173.48 3gch s GLN 81 N -4.62 2.67 -0.78 0.37 -0.21 0.52 -4.96 119.66 112.65 3gch s GLN 81 Ca 0.53 -1.36 -0.25 0.00 0.02 0.00 0.00 55.36 54.29 3gch s GLN 81 Cb -0.10 -3.77 0.05 0.00 1.00 0.00 0.00 33.01 30.18 3gch s GLN 81 CO 0.43 -0.89 1.24 0.15 -2.12 0.00 0.00 175.29 174.10 3gch s LYS 82 N 1.46 3.26 -0.06 2.91 1.02 -1.26 -2.28 119.74 124.80 3gch s LYS 82 Ca 0.03 -0.59 -0.17 0.00 0.02 0.00 0.00 55.97 55.26 3gch s LYS 82 Cb -0.22 -4.43 -0.05 0.00 -0.52 0.00 0.00 37.83 32.61 3gch s LYS 82 CO 0.03 -2.07 0.45 -0.51 -0.92 0.00 0.00 175.35 172.33 3gch s LEU 83 N 5.12 4.37 0.35 3.17 1.43 0.18 -4.92 118.68 128.37 3gch s LEU 83 Ca 0.34 0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 54.22 3gch s LEU 83 Cb -0.08 -2.65 -0.07 0.00 0.03 0.00 0.00 46.19 43.41 3gch s LEU 83 CO 0.08 0.16 0.72 -0.54 0.23 0.00 0.00 176.35 177.00 3gch s LYS 84 N -0.19 3.85 -0.36 1.70 1.02 -1.26 -1.50 119.74 123.01 3gch s LYS 84 Ca 0.25 0.49 -0.18 0.00 0.02 0.00 0.00 55.97 56.55 3gch s LYS 84 Cb -0.16 -2.45 -0.00 0.00 -0.52 0.00 0.00 37.83 34.70 3gch s LYS 84 CO 0.12 0.09 0.49 0.42 -0.92 0.00 0.00 175.35 175.55 3gch s ILE 85 N -2.14 5.03 -0.01 2.17 1.01 -1.26 -1.93 121.20 124.07 3gch s ILE 85 Ca 0.51 0.25 -0.22 0.00 0.00 0.00 0.00 60.65 61.20 3gch s ILE 85 Cb -0.10 -3.96 -0.12 0.00 0.01 0.00 0.00 42.46 38.29 3gch s ILE 85 CO 0.25 -0.23 0.90 0.00 0.00 0.00 0.00 174.94 175.86 3gch h ALA 86 N 8.49 -0.79 -3.53 9.38 0.00 -0.57 -3.43 119.26 128.81 3gch h ALA 86 Ca -0.28 -0.17 -0.34 0.00 0.00 0.00 0.00 54.91 54.12 3gch h ALA 86 Cb 1.13 0.30 -0.33 0.00 0.00 0.00 0.00 17.79 18.88 3gch h ALA 86 CO 0.77 -0.73 -0.75 0.15 0.00 0.00 0.00 179.25 178.69 3gch s LYS 87 N -4.08 0.32 -0.14 0.00 1.02 -0.75 -4.98 119.74 111.12 3gch s LYS 87 Ca -0.11 0.04 -0.17 0.00 0.02 0.00 0.00 55.97 55.75 3gch s LYS 87 Cb 0.01 -0.47 -0.04 0.00 -0.52 0.00 0.00 37.83 36.81 3gch s LYS 87 CO 0.34 -0.11 0.44 0.08 -0.92 0.00 0.00 175.35 175.18 3gch s VAL 88 N 0.88 5.20 -0.61 3.17 1.01 -1.26 -1.85 120.40 126.93 3gch s VAL 88 Ca -0.09 0.85 0.01 0.00 0.00 0.00 0.00 61.98 62.75 3gch s VAL 88 Cb -0.12 -3.77 0.15 0.00 0.00 0.00 0.00 36.38 32.64 3gch s VAL 88 CO -0.01 0.31 0.40 -0.36 0.00 0.00 0.00 175.10 175.44 3gch s PHE 89 N 0.78 3.36 0.07 5.22 0.40 0.32 -5.02 117.98 123.11 3gch s PHE 89 Ca 0.23 -3.02 -0.30 0.00 -0.60 0.00 0.00 56.93 53.24 3gch s PHE 89 Cb -0.15 -2.98 -0.05 0.00 0.51 0.00 0.00 43.02 40.36 3gch s PHE 89 CO 0.09 -0.75 1.06 0.21 0.70 0.00 0.00 175.22 176.53 3gch s LYS 90 N -0.45 4.56 0.45 0.44 2.20 -1.26 0.40 119.74 126.08 3gch s LYS 90 Ca 0.19 1.58 -0.24 0.00 -0.36 0.00 0.00 55.97 57.14 3gch s LYS 90 Cb -0.20 -3.38 -0.09 0.00 -1.51 0.00 0.00 37.83 32.65 3gch s LYS 90 CO -0.04 -0.04 1.14 -1.71 -0.36 0.00 0.00 175.35 174.35 3gch n ASN 91 N 3.41 1.86 -0.03 1.43 2.85 -0.82 -4.86 115.26 119.09 3gch n ASN 91 Ca 0.05 1.03 0.14 0.00 -0.11 0.00 0.00 54.58 55.69 3gch n ASN 91 Cb 0.48 -1.44 0.55 0.00 1.24 0.00 0.00 39.78 40.61 3gch n ASN 91 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3gch n SER 92 N 0.10 0.24 -0.09 1.20 3.41 -1.26 -2.57 113.62 114.65 3gch n SER 92 Ca 0.09 -0.02 0.13 0.00 -0.26 0.00 0.00 58.87 58.81 3gch n SER 92 Cb 0.41 -0.19 0.33 0.00 -0.26 0.00 0.00 64.21 64.49 3gch n SER 92 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3gch n LYS 93 N -1.34 0.31 -1.65 4.33 4.76 -1.26 -4.89 118.16 118.42 3gch n LYS 93 Ca 0.09 -0.17 -0.52 0.00 -2.87 0.00 0.00 58.31 54.84 3gch n LYS 93 Cb 0.31 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.95 3gch n LYS 93 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 3gch n TYR 94 N -1.20 1.88 -3.91 2.13 9.36 -1.06 -4.69 117.16 119.67 3gch n TYR 94 Ca 0.08 0.48 -0.30 0.00 3.32 0.00 0.00 57.90 61.48 3gch n TYR 94 Cb 0.34 -2.44 -0.14 0.00 -0.63 0.00 0.00 39.34 36.47 3gch n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3gch s ASN 95 N 1.90 4.25 0.35 2.98 3.84 -0.44 -4.96 114.94 122.86 3gch s ASN 95 Ca 0.89 -2.83 0.14 0.00 0.21 0.00 0.00 52.86 51.27 3gch s ASN 95 Cb -0.92 -1.52 0.99 0.00 -0.55 0.00 0.00 41.25 39.25 3gch s ASN 95 CO 0.52 -0.26 1.74 -1.28 -2.79 0.00 0.00 177.10 175.03 3gch h SER 96 N 6.69 0.57 1.62 -4.21 0.87 -1.92 4.59 113.55 121.77 3gch h SER 96 Ca -0.07 0.11 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 3gch h SER 96 Cb 0.91 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.89 3gch h SER 96 CO 0.63 0.09 -0.38 -0.07 -0.53 0.00 0.00 176.83 176.57 3gch h LEU 97 N 0.49 0.00 0.00 2.23 4.07 -1.97 -3.34 115.31 116.79 3gch h LEU 97 Ca 0.63 0.00 -0.33 0.00 0.08 0.00 0.00 57.88 58.25 3gch h LEU 97 Cb 1.38 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 43.05 3gch h LEU 97 CO -0.40 0.34 -2.26 0.35 -1.08 0.00 0.00 178.44 175.39 3gch n THR 98 N -3.17 1.26 -2.26 0.22 -2.24 -0.16 -4.98 114.28 102.95 3gch n THR 98 Ca 0.02 -0.69 -0.10 0.00 -2.27 0.00 0.00 64.05 61.01 3gch n THR 98 Cb 0.67 -0.74 -0.00 0.00 -2.10 0.00 0.00 70.33 68.16 3gch n THR 98 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3gch n ILE 99 N -2.81 -0.56 -3.15 2.28 5.41 1.49 -5.04 119.36 116.98 3gch n ILE 99 Ca -0.33 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.03 3gch n ILE 99 Cb 1.05 -1.77 -0.05 0.00 -0.71 0.00 0.00 39.64 38.15 3gch n ILE 99 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 3gch s ASN 100 N -2.60 6.97 -0.67 4.38 3.04 -1.07 -4.43 114.94 120.55 3gch s ASN 100 Ca 0.02 1.15 -0.02 0.00 0.04 0.00 0.00 52.86 54.06 3gch s ASN 100 Cb -0.01 -2.38 0.00 0.00 -1.54 0.00 0.00 41.25 37.32 3gch s ASN 100 CO 0.03 0.02 0.57 0.59 -3.04 0.00 0.00 177.10 175.27 3gch n ASN 101 N 3.14 -3.00 -3.78 -4.21 3.02 -1.26 -1.33 115.26 107.85 3gch n ASN 101 Ca -0.05 -0.31 -0.42 0.00 -0.03 0.00 0.00 54.58 53.77 3gch n ASN 101 Cb 0.51 -2.94 0.01 0.00 -0.61 0.00 0.00 39.78 36.74 3gch n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3gch n ASP 102 N -1.62 6.35 -3.85 6.41 4.64 -1.26 -3.72 116.55 123.51 3gch n ASP 102 Ca -0.09 -3.25 -0.20 0.00 -1.38 0.00 0.00 54.79 49.87 3gch n ASP 102 Cb 0.57 -1.37 -0.17 0.00 -1.04 0.00 0.00 41.12 39.11 3gch n ASP 102 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 3gch s ILE 103 N -1.22 0.43 -0.02 5.18 2.07 -1.26 -3.58 121.20 122.79 3gch s ILE 103 Ca 0.41 -0.02 0.04 0.00 -1.41 0.00 0.00 60.65 59.68 3gch s ILE 103 Cb 0.12 -0.50 -0.01 0.00 0.13 0.00 0.00 42.46 42.20 3gch s ILE 103 CO -0.01 0.22 -0.16 0.42 -1.91 0.00 0.00 174.94 173.50 3gch s THR 104 N 1.22 1.27 0.04 4.00 -4.23 -0.32 -1.95 115.64 115.67 3gch s THR 104 Ca -0.06 -0.66 -0.00 0.00 -1.18 0.00 0.00 61.69 59.78 3gch s THR 104 Cb -0.14 -1.08 -0.04 0.00 1.34 0.00 0.00 72.50 72.59 3gch s THR 104 CO -0.02 0.37 0.17 -0.76 -0.54 0.00 0.00 174.62 173.84 3gch s LEU 105 N -0.18 4.24 -0.11 4.79 1.43 0.16 -2.79 118.68 126.22 3gch s LEU 105 Ca 0.02 0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 3gch s LEU 105 Cb -0.08 -2.76 0.01 0.00 0.03 0.00 0.00 46.19 43.38 3gch s LEU 105 CO 0.00 0.20 -0.21 -0.76 0.23 0.00 0.00 176.35 175.81 3gch s LEU 106 N -2.31 2.00 -0.30 1.79 1.43 0.43 -0.52 118.68 121.20 3gch s LEU 106 Ca 0.32 -0.53 -0.11 0.00 -1.03 0.00 0.00 54.13 52.77 3gch s LEU 106 Cb -0.13 -1.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.74 3gch s LEU 106 CO 0.24 0.10 0.19 -0.75 0.23 0.00 0.00 176.35 176.36 3gch s LYS 107 N 0.62 3.71 0.12 1.70 2.47 -0.77 -0.25 119.74 127.33 3gch s LYS 107 Ca -0.13 -0.48 -0.30 0.00 -1.56 0.00 0.00 55.97 53.50 3gch s LYS 107 Cb -0.17 -3.67 -0.06 0.00 -1.46 0.00 0.00 37.83 32.47 3gch s LYS 107 CO 0.03 -0.29 1.01 -0.51 0.16 0.00 0.00 175.35 175.75 3gch s LEU 108 N 1.72 4.48 0.32 5.43 1.43 -0.85 0.12 118.68 131.34 3gch s LEU 108 Ca 0.06 1.88 0.16 0.00 -1.03 0.00 0.00 54.13 55.20 3gch s LEU 108 Cb -0.16 -3.59 0.43 0.00 0.03 0.00 0.00 46.19 42.90 3gch s LEU 108 CO 0.10 -0.14 1.62 0.77 0.23 0.00 0.00 176.35 178.92 3gch h SER 109 N 5.60 0.00 -3.33 2.29 4.64 -1.66 -3.42 113.55 117.67 3gch h SER 109 Ca -0.43 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.46 3gch h SER 109 Cb 1.21 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.94 3gch h SER 109 CO 0.73 0.47 -0.77 0.28 -0.87 0.00 0.00 176.83 176.67 3gch s THR 110 N -3.37 0.50 0.29 2.95 -1.32 -1.26 -4.97 115.64 108.47 3gch s THR 110 Ca 0.01 -0.02 -0.30 0.00 -1.21 0.00 0.00 61.69 60.18 3gch s THR 110 Cb 0.10 -0.59 -0.13 0.00 -1.51 0.00 0.00 72.50 70.37 3gch s THR 110 CO 0.72 0.25 1.39 0.00 -2.21 0.00 0.00 174.62 174.77 3gch n ALA 111 N 4.66 1.47 -1.78 11.08 0.00 -1.26 -4.63 120.51 130.05 3gch n ALA 111 Ca -0.15 0.38 -0.35 0.00 0.00 0.00 0.00 53.44 53.32 3gch n ALA 111 Cb 0.50 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.63 3gch n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gch s ALA 112 N -0.51 2.87 -0.32 0.00 0.00 0.01 -4.99 121.76 118.81 3gch s ALA 112 Ca 0.62 0.75 -0.13 0.00 0.00 0.00 0.00 51.96 53.20 3gch s ALA 112 Cb -0.58 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.20 3gch s ALA 112 CO 0.55 -0.50 0.27 0.45 0.00 0.00 0.00 175.76 176.53 3gch s SER 113 N -1.73 6.10 0.28 0.00 0.15 -1.26 -4.87 113.70 112.37 3gch s SER 113 Ca 0.67 -0.25 -0.26 0.00 0.70 0.00 0.00 55.95 56.81 3gch s SER 113 Cb -0.22 -2.16 -0.09 0.00 -1.71 0.00 0.00 66.02 61.84 3gch s SER 113 CO 0.26 -0.23 0.90 -0.36 1.20 0.00 0.00 173.24 175.02 3gch s PHE 114 N 1.83 3.77 0.00 3.44 0.08 -1.26 -4.72 117.98 121.13 3gch s PHE 114 Ca 0.08 1.75 0.00 0.00 0.12 0.00 0.00 56.93 58.89 3gch s PHE 114 Cb -0.17 -2.89 0.00 0.00 -0.57 0.00 0.00 43.02 39.40 3gch s PHE 114 CO 0.11 0.31 0.00 -1.13 -0.10 0.00 0.00 175.22 174.41 3gch n SER 115 N 0.87 0.00 0.15 1.36 3.41 -0.51 -4.93 113.62 113.97 3gch n SER 115 Ca -0.00 -0.36 0.13 0.00 -0.26 0.00 0.00 58.87 58.38 3gch n SER 115 Cb 0.49 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 64.93 3gch n SER 115 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 3gch h GLN 116 N 0.00 0.00 -0.00 4.33 4.15 -1.97 -3.11 115.11 118.51 3gch h GLN 116 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3gch h GLN 116 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 3gch h GLN 116 CO 0.00 0.00 -0.00 0.25 -1.93 0.00 0.00 178.83 177.15 3gch n THR 117 N -2.39 0.00 -3.90 2.39 -2.24 -1.26 -4.89 114.28 101.99 3gch n THR 117 Ca 0.03 -0.50 -0.29 0.00 -2.27 0.00 0.00 64.05 61.02 3gch n THR 117 Cb 0.30 1.02 -0.16 0.00 -2.10 0.00 0.00 70.33 69.39 3gch n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3gch s VAL 118 N -0.07 1.26 0.27 2.28 1.01 -1.18 -4.38 120.40 119.59 3gch s VAL 118 Ca 0.01 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 3gch s VAL 118 Cb 0.01 -1.50 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 3gch s VAL 118 CO 0.01 -0.00 0.33 -0.94 0.00 0.00 0.00 175.10 174.50 3gch s SER 119 N 1.54 0.52 0.25 3.32 1.04 -0.06 -1.43 113.70 118.88 3gch s SER 119 Ca -0.02 -1.36 -0.10 0.00 0.48 0.00 0.00 55.95 54.95 3gch s SER 119 Cb -0.17 0.53 -0.07 0.00 0.10 0.00 0.00 66.02 66.41 3gch s SER 119 CO -0.07 -1.07 0.57 0.00 0.98 0.00 0.00 173.24 173.65 3gch s ALA 120 N -3.72 3.55 0.26 5.32 0.00 -1.26 -3.57 121.76 122.34 3gch s ALA 120 Ca 0.33 -0.27 0.04 0.00 0.00 0.00 0.00 51.96 52.05 3gch s ALA 120 Cb 0.02 -2.46 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 3gch s ALA 120 CO 0.16 0.46 0.41 0.54 0.00 0.00 0.00 175.76 177.32 3gch s VAL 121 N -1.87 5.22 -0.01 0.00 0.11 0.97 -4.90 120.40 119.92 3gch s VAL 121 Ca 0.48 -0.82 -0.21 0.00 -2.93 0.00 0.00 61.98 58.50 3gch s VAL 121 Cb -0.11 -3.85 -0.05 0.00 -1.53 0.00 0.00 36.38 30.84 3gch s VAL 121 CO 0.22 -0.38 0.60 0.00 -3.33 0.00 0.00 175.10 172.21 3gch s LEU 123 N -0.07 4.49 0.89 0.00 1.43 -1.26 -5.11 118.68 119.05 3gch s LEU 123 Ca 0.31 1.08 -0.11 0.00 -1.03 0.00 0.00 54.13 54.39 3gch s LEU 123 Cb -0.18 -2.72 0.19 0.00 0.03 0.00 0.00 46.19 43.51 3gch s LEU 123 CO 0.17 0.29 1.22 -2.16 0.23 0.00 0.00 176.35 176.10 3gch s PRO 124 N -1.00 0.86 0.43 1.29 0.04 -1.26 -5.09 135.00 130.27 3gch s PRO 124 Ca 0.26 -0.75 -0.19 0.00 0.04 0.00 0.00 61.00 60.36 3gch s PRO 124 Cb -0.18 -2.01 -0.10 0.00 0.04 0.00 0.00 34.50 32.25 3gch s PRO 124 CO 0.15 -2.17 0.92 -1.12 0.04 0.00 0.00 177.00 174.82 3gch s SER 125 N -4.88 6.83 0.47 6.66 0.01 -1.26 -4.89 113.70 116.64 3gch s SER 125 Ca 0.73 1.58 0.12 0.00 1.31 0.00 0.00 55.95 59.68 3gch s SER 125 Cb -0.03 -2.50 1.08 0.00 0.21 0.00 0.00 66.02 64.78 3gch s SER 125 CO 0.50 -0.38 2.10 0.00 0.41 0.00 0.00 173.24 175.87 3gch h ALA 126 N 1.73 1.86 -0.65 1.44 0.00 -2.05 0.33 119.26 121.91 3gch h ALA 126 Ca -0.48 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 3gch h ALA 126 Cb 1.18 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 3gch h ALA 126 CO 0.62 0.13 0.30 0.66 0.00 0.00 0.00 179.25 180.96 3gch h SER 127 N 0.25 0.86 -0.82 0.00 4.64 -2.04 -3.46 113.55 112.97 3gch h SER 127 Ca 0.07 -0.14 -0.63 0.00 -0.47 0.00 0.00 61.79 60.61 3gch h SER 127 Cb -0.02 -0.22 0.05 0.00 -0.31 0.00 0.00 62.40 61.90 3gch h SER 127 CO -0.01 0.76 -0.03 0.47 -0.87 0.00 0.00 176.83 177.15 3gch n ASP 128 N -4.46 -0.18 -4.71 4.97 10.43 0.11 -4.96 116.55 117.75 3gch n ASP 128 Ca 0.05 0.95 -0.33 0.00 2.57 0.00 0.00 54.79 58.03 3gch n ASP 128 Cb 0.14 -0.76 -0.08 0.00 1.84 0.00 0.00 41.12 42.25 3gch n ASP 128 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3gch s ASP 129 N -0.14 5.28 -0.38 -2.24 2.15 -1.26 -4.89 116.67 115.20 3gch s ASP 129 Ca 0.71 0.04 0.04 0.00 0.43 0.00 0.00 52.55 53.77 3gch s ASP 129 Cb -1.00 -1.42 0.16 0.00 -0.30 0.00 0.00 42.92 40.36 3gch s ASP 129 CO 0.47 0.28 0.40 -0.36 -0.17 0.00 0.00 175.17 175.79 3gch s PHE 130 N -1.10 -0.39 0.47 -5.34 0.40 -1.26 -5.13 117.98 105.63 3gch s PHE 130 Ca 0.20 -0.77 -0.21 0.00 -0.60 0.00 0.00 56.93 55.55 3gch s PHE 130 Cb -0.12 -0.36 -0.09 0.00 0.51 0.00 0.00 43.02 42.97 3gch s PHE 130 CO 0.11 -0.99 1.03 0.00 0.70 0.00 0.00 175.22 176.08 3gch s ALA 131 N 1.43 2.91 0.26 5.36 0.00 -1.26 -5.04 121.76 125.42 3gch s ALA 131 Ca 0.17 0.61 -0.30 0.00 0.00 0.00 0.00 51.96 52.44 3gch s ALA 131 Cb -0.15 -3.25 -0.10 0.00 0.00 0.00 0.00 23.12 19.63 3gch s ALA 131 CO -0.03 -0.27 1.38 0.00 0.00 0.00 0.00 175.76 176.84 3gch s ALA 132 N -1.95 3.57 0.00 0.00 0.00 -1.26 -2.23 121.76 119.89 3gch s ALA 132 Ca 0.66 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.88 3gch s ALA 132 Cb -0.17 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.43 3gch s ALA 132 CO 0.20 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 175.70 3gch n GLY 133 N 1.83 0.86 3.70 0.00 0.00 -1.26 -5.04 105.19 105.28 3gch n GLY 133 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3gch n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gch s THR 134 N -3.08 4.04 -0.35 2.61 2.01 -0.95 -5.00 115.64 114.93 3gch s THR 134 Ca 0.00 1.42 -0.29 0.00 0.31 0.00 0.00 61.69 63.13 3gch s THR 134 Cb 0.00 -3.91 0.01 0.00 0.01 0.00 0.00 72.50 68.61 3gch s THR 134 CO 0.00 0.04 1.16 -0.89 -0.69 0.00 0.00 174.62 174.24 3gch s THR 135 N 1.85 4.33 0.49 -0.82 2.01 -1.26 -5.01 115.64 117.23 3gch s THR 135 Ca 0.59 1.49 0.01 0.00 0.31 0.00 0.00 61.69 64.08 3gch s THR 135 Cb -0.28 -4.37 0.01 0.00 0.01 0.00 0.00 72.50 67.87 3gch s THR 135 CO 0.25 -0.59 0.06 0.00 -0.69 0.00 0.00 174.62 173.66 3gch s VAL 137 N -2.71 -0.04 0.07 0.00 1.01 -1.26 -5.16 120.40 112.31 3gch s VAL 137 Ca 0.05 0.13 0.09 0.00 0.00 0.00 0.00 61.98 62.25 3gch s VAL 137 Cb -0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 36.13 3gch s VAL 137 CO 0.03 0.05 -0.24 0.28 0.00 0.00 0.00 175.10 175.22 3gch s THR 138 N 0.86 1.98 0.23 3.92 -1.32 -1.26 -5.15 115.64 114.91 3gch s THR 138 Ca -0.07 -1.43 0.00 0.00 -1.21 0.00 0.00 61.69 58.98 3gch s THR 138 Cb -0.09 -1.73 -0.04 0.00 -1.51 0.00 0.00 72.50 69.13 3gch s THR 138 CO -0.04 0.21 0.12 0.42 -2.21 0.00 0.00 174.62 173.12 3gch s THR 139 N -0.90 0.26 -5.00 5.08 -4.23 -1.26 -5.10 115.64 104.49 3gch s THR 139 Ca 0.10 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 3gch s THR 139 Cb -0.10 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.18 3gch s THR 139 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 3gch n GLY 140 N -0.38 -0.52 2.55 3.99 0.00 -1.26 -5.00 105.19 104.57 3gch n GLY 140 Ca 0.01 -1.59 -0.23 0.00 0.00 0.00 0.00 46.02 44.21 3gch n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3gch n TRP 141 N 5.10 2.92 -2.71 1.61 8.01 -1.26 -4.87 117.44 126.24 3gch n TRP 141 Ca 0.00 -3.14 -0.27 0.00 -1.31 0.00 0.00 57.50 52.79 3gch n TRP 141 Cb 0.00 -0.18 0.00 0.00 -2.01 0.00 0.00 31.31 29.12 3gch n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 3gch s GLY 142 N -3.42 1.50 0.18 6.99 0.00 -1.26 -5.01 107.32 106.30 3gch s GLY 142 Ca 0.43 -0.62 -0.29 0.00 0.00 0.00 0.00 44.72 44.24 3gch s GLY 142 CO -0.14 -0.45 0.58 1.04 0.00 0.00 0.00 173.10 174.14 3gch n LEU 143 N -2.24 -1.10 -0.00 0.66 4.77 -1.26 -3.63 117.00 114.19 3gch n LEU 143 Ca 0.01 1.13 0.08 0.00 -0.03 0.00 0.00 56.01 57.20 3gch n LEU 143 Cb 0.56 -0.95 -0.11 0.00 -2.33 0.00 0.00 43.42 40.59 3gch n LEU 143 CO 0.52 -2.87 -0.33 0.35 -1.33 0.00 0.00 177.39 173.74 3gch n THR 144 N 0.16 0.00 -3.88 -5.08 -2.24 -1.26 -0.18 114.28 101.80 3gch n THR 144 Ca 0.18 -0.24 -0.11 0.00 -2.27 0.00 0.00 64.05 61.62 3gch n THR 144 Cb 0.23 0.61 -0.11 0.00 -2.10 0.00 0.00 70.33 68.97 3gch n THR 144 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3gch s ARG 145 N -2.78 0.40 0.00 -0.78 0.52 -1.26 -4.21 118.95 110.83 3gch s ARG 145 Ca 0.01 -0.33 0.29 0.00 -0.52 0.00 0.00 55.73 55.18 3gch s ARG 145 Cb 0.11 0.16 1.27 0.00 0.52 0.00 0.00 34.95 37.02 3gch s ARG 145 CO 0.67 -0.09 1.87 0.98 0.02 0.00 0.00 175.30 178.75