#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5gch s VAL 17 N 0.00 5.05 0.00 1.39 1.01 -1.26 -4.20 120.40 122.40 5gch s VAL 17 Ca 0.00 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.05 5gch s VAL 17 Cb 0.00 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.48 5gch s VAL 17 CO 0.00 0.13 0.00 -3.20 0.00 0.00 0.00 175.10 172.03 5gch n ASN 18 N 5.03 -0.85 -3.32 3.32 2.85 -1.25 -5.07 115.26 115.96 5gch n ASN 18 Ca -0.03 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.33 5gch n ASN 18 Cb 0.50 -0.37 0.01 0.00 1.24 0.00 0.00 39.78 41.16 5gch n ASN 18 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 5gch n GLY 19 N -0.90 2.68 3.36 8.20 0.00 -1.26 -5.14 105.19 112.13 5gch n GLY 19 Ca 0.00 -2.22 -0.18 0.00 0.00 0.00 0.00 46.02 43.62 5gch n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 5gch s GLU 20 N -3.09 1.38 0.28 1.61 2.02 -1.26 -5.13 118.70 114.52 5gch s GLU 20 Ca 0.18 -1.68 -0.30 0.00 0.02 0.00 0.00 54.97 53.18 5gch s GLU 20 Cb -0.01 -0.86 -0.12 0.00 0.10 0.00 0.00 34.13 33.24 5gch s GLU 20 CO 0.11 -0.00 1.61 -1.91 0.02 0.00 0.00 175.26 175.09 5gch n GLU 21 N -0.45 2.69 -1.62 1.61 2.13 -1.26 -5.02 120.64 118.71 5gch n GLU 21 Ca -0.06 0.96 -0.30 0.00 0.66 0.00 0.00 57.16 58.42 5gch n GLU 21 Cb 0.63 -2.75 0.07 0.00 0.27 0.00 0.00 31.44 29.66 5gch n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 5gch s ALA 22 N 0.20 2.49 0.02 4.31 0.00 -1.26 -5.04 121.76 122.48 5gch s ALA 22 Ca 0.66 -0.15 -0.28 0.00 0.00 0.00 0.00 51.96 52.19 5gch s ALA 22 Cb -0.50 -3.11 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 5gch s ALA 22 CO 0.46 -1.47 0.91 0.08 0.00 0.00 0.00 175.76 175.74 5gch s VAL 23 N -3.16 4.79 -0.55 0.00 1.01 -1.26 -4.92 120.40 116.31 5gch s VAL 23 Ca 0.59 1.92 -0.31 0.00 0.00 0.00 0.00 61.98 64.18 5gch s VAL 23 Cb -0.14 -4.26 -0.13 0.00 0.00 0.00 0.00 36.38 31.86 5gch s VAL 23 CO 0.54 0.24 2.38 -2.65 0.00 0.00 0.00 175.10 175.61 5gch n PRO 24 N 3.48 0.81 -0.51 2.72 -0.02 -1.26 -1.68 135.00 138.54 5gch n PRO 24 Ca 0.03 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 5gch n PRO 24 Cb 0.50 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 5gch n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 5gch n GLY 25 N 6.37 0.72 0.02 -1.23 0.00 -1.26 -4.94 105.19 104.87 5gch n GLY 25 Ca 0.46 -0.23 0.14 0.00 0.00 0.00 0.00 46.02 46.38 5gch n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 5gch n SER 26 N 0.42 0.21 -3.48 1.61 3.41 -0.68 -4.18 113.62 110.93 5gch n SER 26 Ca 0.00 0.07 -0.27 0.00 -0.26 0.00 0.00 58.87 58.41 5gch n SER 26 Cb 0.00 -0.22 -0.10 0.00 -0.26 0.00 0.00 64.21 63.63 5gch n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 5gch n TRP 27 N -1.39 -0.06 0.87 7.33 7.02 -1.26 -4.99 117.44 124.96 5gch n TRP 27 Ca 0.09 -3.52 0.08 0.00 -1.02 0.00 0.00 57.50 53.13 5gch n TRP 27 Cb 0.32 0.06 0.44 0.00 -2.42 0.00 0.00 31.31 29.71 5gch n TRP 27 CO 0.00 0.00 0.00 -2.30 -2.02 0.00 0.00 177.69 173.37 5gch n PRO 28 N 2.59 0.35 0.00 -0.99 -0.02 -1.26 -2.49 135.00 133.18 5gch n PRO 28 Ca 0.28 0.08 0.07 0.00 -2.02 0.00 0.00 63.50 61.90 5gch n PRO 28 Cb 0.46 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.40 5gch n PRO 28 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 5gch n TRP 29 N -1.17 0.00 -2.12 6.00 2.14 -1.24 0.25 117.44 121.30 5gch n TRP 29 Ca 0.10 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.24 5gch n TRP 29 Cb 0.10 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.57 5gch n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 5gch s GLN 30 N -1.98 4.25 0.48 -2.67 2.00 -1.04 -0.20 119.66 120.50 5gch s GLN 30 Ca 0.09 2.10 0.03 0.00 -2.00 0.00 0.00 55.36 55.58 5gch s GLN 30 Cb 0.11 -3.57 -0.03 0.00 0.80 0.00 0.00 33.01 30.33 5gch s GLN 30 CO 0.45 -0.63 0.04 0.14 -0.50 0.00 0.00 175.29 174.79 5gch s VAL 31 N 2.42 1.44 -0.02 1.34 -7.23 -0.78 -4.53 120.40 113.04 5gch s VAL 31 Ca 0.67 -1.96 0.03 0.00 -1.81 0.00 0.00 61.98 58.92 5gch s VAL 31 Cb -0.35 -2.40 -0.00 0.00 0.56 0.00 0.00 36.38 34.20 5gch s VAL 31 CO 0.29 0.00 -0.11 -0.55 -0.31 0.00 0.00 175.10 174.42 5gch s SER 32 N -3.86 1.37 -0.24 4.85 0.15 0.10 -2.52 113.70 113.55 5gch s SER 32 Ca 0.16 -0.21 -0.13 0.00 0.70 0.00 0.00 55.95 56.47 5gch s SER 32 Cb 0.03 -0.32 -0.04 0.00 -1.71 0.00 0.00 66.02 63.98 5gch s SER 32 CO 0.08 0.10 0.27 -0.76 1.20 0.00 0.00 173.24 174.13 5gch s LEU 33 N 0.06 4.09 0.04 3.45 1.43 -0.33 -0.13 118.68 127.30 5gch s LEU 33 Ca -0.01 0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.37 5gch s LEU 33 Cb -0.08 -2.28 -0.02 0.00 0.03 0.00 0.00 46.19 43.83 5gch s LEU 33 CO 0.00 -0.05 -0.14 -1.10 0.23 0.00 0.00 176.35 175.30 5gch s GLN 34 N 1.47 0.92 0.81 1.70 -0.21 -0.78 -2.42 119.66 121.15 5gch s GLN 34 Ca 0.12 -0.77 -0.12 0.00 0.02 0.00 0.00 55.36 54.61 5gch s GLN 34 Cb -0.15 -0.93 0.08 0.00 1.00 0.00 0.00 33.01 33.02 5gch s GLN 34 CO 0.08 0.23 1.18 0.16 -2.12 0.00 0.00 175.29 174.82 5gch s ASP 35 N -1.19 4.46 0.02 5.90 3.84 -0.96 -1.79 116.67 126.95 5gch s ASP 35 Ca 0.01 0.77 0.01 0.00 -0.00 0.00 0.00 52.55 53.34 5gch s ASP 35 Cb -0.08 -1.26 0.04 0.00 -1.38 0.00 0.00 42.92 40.25 5gch s ASP 35 CO 0.01 -1.93 0.87 2.29 -0.00 0.00 0.00 175.17 176.41 5gch n LYS 36 N -3.33 0.01 0.04 2.11 2.85 -1.26 0.19 118.16 118.76 5gch n LYS 36 Ca 0.08 0.36 0.00 0.00 -1.05 0.00 0.00 58.31 57.70 5gch n LYS 36 Cb 0.61 -1.67 -0.08 0.00 -0.65 0.00 0.00 35.03 33.24 5gch n LYS 36 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 5gch h THR 37 N 0.00 0.51 0.00 0.58 2.02 -1.94 -3.48 112.91 110.60 5gch h THR 37 Ca 0.00 -2.00 0.00 0.00 0.77 0.00 0.00 66.41 65.18 5gch h THR 37 Cb 0.31 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.77 5gch h THR 37 CO 0.00 0.29 0.00 0.61 0.37 0.00 0.00 175.52 176.79 5gch n GLY 38 N 1.39 0.86 3.67 2.16 0.00 0.51 -5.04 105.19 108.74 5gch n GLY 38 Ca -0.09 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 5gch n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 5gch s PHE 39 N -2.00 3.38 -0.12 1.61 5.36 -1.25 -4.82 117.98 120.14 5gch s PHE 39 Ca 0.00 1.48 -0.29 0.00 -0.96 0.00 0.00 56.93 57.17 5gch s PHE 39 Cb 0.00 -3.24 -0.01 0.00 -0.34 0.00 0.00 43.02 39.43 5gch s PHE 39 CO 0.00 -0.41 0.97 -1.58 -1.46 0.00 0.00 175.22 172.74 5gch s HIS 40 N 2.90 3.49 0.00 10.12 5.65 -1.26 -2.27 115.29 133.91 5gch s HIS 40 Ca 0.45 1.52 0.00 0.00 0.25 0.00 0.00 55.06 57.28 5gch s HIS 40 Cb -0.16 -3.16 0.00 0.00 -1.18 0.00 0.00 32.58 28.09 5gch s HIS 40 CO 0.09 -0.24 0.00 1.97 -0.65 0.00 0.00 174.74 175.91 5gch n PHE 41 N 5.10 0.00 -3.83 3.88 1.16 -1.02 -5.02 117.46 117.74 5gch n PHE 41 Ca 0.08 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.57 5gch n PHE 41 Cb 0.49 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.31 5gch n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 5gch s GLY 43 N -2.92 1.88 0.31 0.00 0.00 -1.26 -1.18 107.32 104.15 5gch s GLY 43 Ca 0.13 -1.91 -0.01 0.00 0.00 0.00 0.00 44.72 42.94 5gch s GLY 43 CO 0.00 -1.92 0.41 0.61 0.00 0.00 0.00 173.10 172.20 5gch n GLY 44 N -0.62 2.32 2.97 0.20 0.00 -1.05 -4.61 105.19 104.40 5gch n GLY 44 Ca -0.06 -1.62 -0.13 0.00 0.00 0.00 0.00 46.02 44.21 5gch n GLY 44 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 5gch s SER 45 N -2.93 -0.13 -0.15 1.61 0.01 0.24 -1.86 113.70 110.48 5gch s SER 45 Ca 0.27 0.30 -0.29 0.00 1.31 0.00 0.00 55.95 57.53 5gch s SER 45 Cb -0.01 0.24 -0.02 0.00 0.21 0.00 0.00 66.02 66.45 5gch s SER 45 CO 0.19 -0.10 1.24 -0.76 0.41 0.00 0.00 173.24 174.22 5gch s LEU 46 N 0.69 4.19 -0.00 2.44 1.43 0.72 -0.56 118.68 127.59 5gch s LEU 46 Ca -0.05 1.69 0.21 0.00 -1.03 0.00 0.00 54.13 54.95 5gch s LEU 46 Cb -0.07 -3.54 -0.22 0.00 0.03 0.00 0.00 46.19 42.39 5gch s LEU 46 CO -0.03 -0.73 0.90 2.30 0.23 0.00 0.00 176.35 179.02 5gch n ILE 47 N 5.26 0.00 0.00 -0.59 -5.35 -1.13 -0.10 119.36 117.44 5gch n ILE 47 Ca 0.13 -0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.61 5gch n ILE 47 Cb 0.45 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.33 5gch n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 5gch n ASN 48 N -1.51 0.00 -0.47 7.28 2.04 -1.26 -4.52 115.26 116.83 5gch n ASN 48 Ca 0.04 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.18 5gch n ASN 48 Cb 0.33 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 37.59 5gch n ASN 48 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 5gch n GLU 49 N -0.34 1.08 0.00 -3.83 0.00 -1.26 -3.56 120.64 112.74 5gch n GLU 49 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.09 5gch n GLU 49 Cb 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 31.44 29.98 5gch n GLU 49 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 5gch n ASN 50 N -0.04 0.35 -3.97 -1.84 3.02 -1.26 0.47 115.26 112.00 5gch n ASN 50 Ca 0.01 -0.11 -0.20 0.00 -0.03 0.00 0.00 54.58 54.24 5gch n ASN 50 Cb 0.24 0.30 -0.16 0.00 -0.61 0.00 0.00 39.78 39.55 5gch n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 5gch s TRP 51 N -0.37 0.90 0.24 3.10 0.52 -1.23 -0.99 118.94 121.12 5gch s TRP 51 Ca 0.00 -0.25 0.09 0.00 0.02 0.00 0.00 56.10 55.96 5gch s TRP 51 Cb 0.00 -0.69 -0.04 0.00 -1.15 0.00 0.00 33.47 31.59 5gch s TRP 51 CO 0.00 -0.14 0.04 0.08 0.02 0.00 0.00 176.95 176.95 5gch s VAL 52 N 0.44 3.73 -0.14 4.03 1.01 0.65 -2.84 120.40 127.29 5gch s VAL 52 Ca -0.07 -1.69 0.01 0.00 0.00 0.00 0.00 61.98 60.23 5gch s VAL 52 Cb -0.11 -2.98 0.02 0.00 0.00 0.00 0.00 36.38 33.31 5gch s VAL 52 CO 0.01 -0.31 -0.15 0.68 0.00 0.00 0.00 175.10 175.32 5gch s VAL 53 N -2.16 1.61 0.02 2.92 -7.23 0.28 -0.31 120.40 115.52 5gch s VAL 53 Ca 0.31 -0.68 0.00 0.00 -1.81 0.00 0.00 61.98 59.81 5gch s VAL 53 Cb -0.07 -1.49 -0.00 0.00 0.56 0.00 0.00 36.38 35.38 5gch s VAL 53 CO 0.21 0.46 0.02 1.07 -0.31 0.00 0.00 175.10 176.55 5gch n THR 54 N 4.53 0.00 -3.55 5.32 5.66 -1.17 0.82 114.28 125.89 5gch n THR 54 Ca -0.18 -0.11 -0.35 0.00 -3.05 0.00 0.00 64.05 60.36 5gch n THR 54 Cb 0.50 0.06 -0.05 0.00 -1.55 0.00 0.00 70.33 69.29 5gch n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 5gch s ALA 55 N -1.97 3.71 0.30 1.79 0.00 -1.26 -2.67 121.76 121.66 5gch s ALA 55 Ca 0.02 -0.35 0.04 0.00 0.00 0.00 0.00 51.96 51.66 5gch s ALA 55 Cb 0.00 -2.30 0.64 0.00 0.00 0.00 0.00 23.12 21.46 5gch s ALA 55 CO 0.01 0.55 1.83 0.00 0.00 0.00 0.00 175.76 178.16 5gch h ALA 56 N 3.70 1.61 0.00 0.00 0.00 -1.78 0.16 119.26 122.95 5gch h ALA 56 Ca -0.49 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 5gch h ALA 56 Cb 1.19 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 5gch h ALA 56 CO 0.66 0.12 -0.05 1.12 0.00 0.00 0.00 179.25 181.10 5gch h HIS 57 N 0.90 0.00 -1.00 0.00 2.07 -1.94 -2.89 115.15 112.30 5gch h HIS 57 Ca 0.51 0.00 0.15 0.00 -2.85 0.00 0.00 60.37 58.18 5gch h HIS 57 Cb 0.62 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 30.50 5gch h HIS 57 CO -0.00 0.05 0.61 0.00 -3.07 0.00 0.00 177.93 175.52 5gch n GLY 59 N -1.34 0.69 3.74 0.00 0.00 -1.09 -5.01 105.19 102.18 5gch n GLY 59 Ca 0.21 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 5gch n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 5gch s VAL 60 N -2.92 2.76 0.52 1.61 1.01 -1.26 -5.02 120.40 117.09 5gch s VAL 60 Ca 0.07 0.63 0.04 0.00 0.00 0.00 0.00 61.98 62.72 5gch s VAL 60 Cb -0.03 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.96 5gch s VAL 60 CO 0.09 0.09 0.23 0.42 0.00 0.00 0.00 175.10 175.94 5gch s THR 61 N 0.11 1.52 -2.65 3.92 -4.23 -1.26 -4.92 115.64 108.12 5gch s THR 61 Ca 0.60 -1.70 0.27 0.00 -1.18 0.00 0.00 61.69 59.67 5gch s THR 61 Cb -0.41 -2.22 0.44 0.00 1.34 0.00 0.00 72.50 71.65 5gch s THR 61 CO 0.41 0.00 1.59 0.35 -0.54 0.00 0.00 174.62 176.44 5gch n THR 62 N -1.53 0.01 1.40 3.99 -2.24 -1.26 -3.02 114.28 111.62 5gch n THR 62 Ca -0.08 -0.33 0.14 0.00 -2.27 0.00 0.00 64.05 61.50 5gch n THR 62 Cb 0.65 0.80 0.47 0.00 -2.10 0.00 0.00 70.33 70.16 5gch n THR 62 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 5gch n SER 63 N 0.54 1.30 -4.89 3.42 7.64 -1.26 -4.33 113.62 116.05 5gch n SER 63 Ca 0.17 -1.25 -0.30 0.00 1.01 0.00 0.00 58.87 58.51 5gch n SER 63 Cb 0.43 0.05 -0.03 0.00 -1.01 0.00 0.00 64.21 63.65 5gch n SER 63 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 5gch s ASP 64 N -2.20 6.49 -0.02 6.43 -0.00 -1.17 -4.08 116.67 122.12 5gch s ASP 64 Ca 0.33 0.94 0.07 0.00 -0.00 0.00 0.00 52.55 53.89 5gch s ASP 64 Cb 0.20 -2.24 -0.02 0.00 -0.00 0.00 0.00 42.92 40.87 5gch s ASP 64 CO 0.41 -0.30 -0.24 0.54 -0.00 0.00 0.00 175.17 175.58 5gch s VAL 65 N -2.23 1.87 0.18 -1.27 0.11 -0.74 -3.64 120.40 114.68 5gch s VAL 65 Ca 0.48 -1.01 -0.18 0.00 -2.93 0.00 0.00 61.98 58.34 5gch s VAL 65 Cb -0.10 -1.56 -0.08 0.00 -1.53 0.00 0.00 36.38 33.11 5gch s VAL 65 CO 0.30 0.53 0.66 -0.69 -3.33 0.00 0.00 175.10 172.57 5gch s VAL 66 N -0.50 4.66 -0.05 2.04 1.01 -0.09 -1.86 120.40 125.61 5gch s VAL 66 Ca 0.07 1.17 0.01 0.00 0.00 0.00 0.00 61.98 63.24 5gch s VAL 66 Cb -0.10 -3.84 0.02 0.00 0.00 0.00 0.00 36.38 32.46 5gch s VAL 66 CO -0.00 0.27 -0.07 -0.69 0.00 0.00 0.00 175.10 174.61 5gch s VAL 67 N -1.44 0.76 0.09 2.92 1.01 0.81 -1.00 120.40 123.55 5gch s VAL 67 Ca 0.40 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.19 5gch s VAL 67 Cb -0.17 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.43 5gch s VAL 67 CO 0.21 0.28 -0.15 0.00 0.00 0.00 0.00 175.10 175.43 5gch s ALA 68 N 0.88 1.37 0.00 5.51 0.00 -1.11 0.01 121.76 128.43 5gch s ALA 68 Ca -0.11 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.72 5gch s ALA 68 Cb -0.15 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.86 5gch s ALA 68 CO 0.01 0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.36 5gch n GLY 69 N 1.03 1.28 3.77 0.00 0.00 -1.26 -0.04 105.19 109.98 5gch n GLY 69 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 5gch n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 5gch s GLU 70 N -0.50 2.76 0.10 1.61 2.12 -1.26 -4.67 118.70 118.87 5gch s GLU 70 Ca 0.00 1.32 0.00 0.00 0.36 0.00 0.00 54.97 56.65 5gch s GLU 70 Cb 0.00 -1.95 0.00 0.00 0.26 0.00 0.00 34.13 32.44 5gch s GLU 70 CO 0.00 -1.27 0.00 0.34 -0.54 0.00 0.00 175.26 173.79 5gch n PHE 71 N -2.60 -0.92 -3.10 5.30 7.35 -1.26 -4.86 117.46 117.37 5gch n PHE 71 Ca 0.10 0.16 -0.44 0.00 -0.76 0.00 0.00 57.45 56.51 5gch n PHE 71 Cb 0.52 0.52 -0.05 0.00 0.35 0.00 0.00 39.48 40.82 5gch n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 5gch s ASP 72 N -4.39 6.21 0.36 -2.13 3.68 -1.26 -4.90 116.67 114.23 5gch s ASP 72 Ca 0.00 -1.11 0.20 0.00 2.13 0.00 0.00 52.55 53.77 5gch s ASP 72 Cb 0.00 -2.31 1.08 0.00 -1.45 0.00 0.00 42.92 40.24 5gch s ASP 72 CO 0.00 -1.04 1.56 1.56 0.13 0.00 0.00 175.17 177.38 5gch h GLN 73 N 9.13 0.00 -0.23 4.34 4.20 -2.02 -2.59 115.11 127.93 5gch h GLN 73 Ca -0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.43 5gch h GLN 73 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 5gch h GLN 73 CO 1.04 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 179.61 5gch n GLY 74 N -1.27 1.34 3.87 3.46 0.00 -1.26 -4.96 105.19 106.37 5gch n GLY 74 Ca -0.01 -0.67 -0.37 0.00 0.00 0.00 0.00 46.02 44.97 5gch n GLY 74 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 5gch s SER 75 N -1.58 6.51 -0.00 1.61 0.15 -0.98 -4.98 113.70 114.43 5gch s SER 75 Ca 0.32 0.61 0.20 0.00 0.70 0.00 0.00 55.95 57.78 5gch s SER 75 Cb 0.20 -2.12 -0.22 0.00 -1.71 0.00 0.00 66.02 62.17 5gch s SER 75 CO 0.29 0.38 0.83 -1.54 1.20 0.00 0.00 173.24 174.39 5gch n SER 76 N 1.87 0.90 -1.26 5.45 3.41 -1.26 -4.25 113.62 118.48 5gch n SER 76 Ca -0.18 -0.91 0.06 0.00 -0.26 0.00 0.00 58.87 57.58 5gch n SER 76 Cb 0.54 1.06 0.26 0.00 -0.26 0.00 0.00 64.21 65.81 5gch n SER 76 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 5gch n SER 77 N -1.52 3.68 -4.62 4.04 3.41 -1.26 -4.88 113.62 112.46 5gch n SER 77 Ca 0.03 -2.40 -0.38 0.00 -0.26 0.00 0.00 58.87 55.86 5gch n SER 77 Cb 0.33 -0.52 -0.10 0.00 -0.26 0.00 0.00 64.21 63.66 5gch n SER 77 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 5gch s GLU 78 N -1.88 4.02 -0.46 4.33 2.12 -1.26 -4.99 118.70 120.58 5gch s GLU 78 Ca 0.36 -0.20 -0.16 0.00 0.36 0.00 0.00 54.97 55.33 5gch s GLU 78 Cb 0.24 -3.61 -0.16 0.00 0.26 0.00 0.00 34.13 30.87 5gch s GLU 78 CO 0.15 -0.10 1.70 1.17 -0.54 0.00 0.00 175.26 177.64 5gch n LYS 79 N 4.79 0.97 -2.56 4.30 4.81 -1.26 -4.91 118.16 124.29 5gch n LYS 79 Ca -0.13 -1.28 -0.27 0.00 -0.87 0.00 0.00 58.31 55.76 5gch n LYS 79 Cb 0.52 -2.52 0.01 0.00 0.02 0.00 0.00 35.03 33.05 5gch n LYS 79 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 5gch s ILE 80 N 5.12 4.62 -0.29 3.15 -4.36 -1.26 -4.87 121.20 123.30 5gch s ILE 80 Ca 0.44 0.17 -0.00 0.00 -0.26 0.00 0.00 60.65 61.00 5gch s ILE 80 Cb 0.11 -3.77 0.06 0.00 1.25 0.00 0.00 42.46 40.10 5gch s ILE 80 CO 0.12 -0.77 -0.02 -1.10 0.24 0.00 0.00 174.94 173.40 5gch s GLN 81 N -4.81 2.30 -0.88 0.37 -0.21 0.94 -4.99 119.66 112.39 5gch s GLN 81 Ca 0.49 -1.35 -0.23 0.00 0.02 0.00 0.00 55.36 54.30 5gch s GLN 81 Cb -0.10 -3.11 0.07 0.00 1.00 0.00 0.00 33.01 30.87 5gch s GLN 81 CO 0.45 -0.64 1.24 0.15 -2.12 0.00 0.00 175.29 174.37 5gch s LYS 82 N 1.18 3.43 0.05 2.91 1.02 -1.26 -2.73 119.74 124.33 5gch s LYS 82 Ca -0.05 -1.07 -0.20 0.00 0.02 0.00 0.00 55.97 54.67 5gch s LYS 82 Cb -0.20 -4.81 -0.06 0.00 -0.52 0.00 0.00 37.83 32.24 5gch s LYS 82 CO -0.03 -2.01 0.59 -0.51 -0.92 0.00 0.00 175.35 172.47 5gch s LEU 83 N 4.35 4.49 0.17 3.17 1.43 -0.17 -4.94 118.68 127.18 5gch s LEU 83 Ca 0.36 1.25 -0.14 0.00 -1.03 0.00 0.00 54.13 54.57 5gch s LEU 83 Cb -0.06 -2.93 -0.07 0.00 0.03 0.00 0.00 46.19 43.16 5gch s LEU 83 CO -0.01 0.20 0.56 -0.54 0.23 0.00 0.00 176.35 176.79 5gch s LYS 84 N -0.76 3.97 -0.42 1.70 1.02 -1.26 -0.91 119.74 123.07 5gch s LYS 84 Ca 0.30 0.49 -0.25 0.00 0.02 0.00 0.00 55.97 56.53 5gch s LYS 84 Cb -0.19 -2.88 0.02 0.00 -0.52 0.00 0.00 37.83 34.26 5gch s LYS 84 CO 0.19 0.45 0.88 0.42 -0.92 0.00 0.00 175.35 176.36 5gch s ILE 85 N -1.53 4.57 0.00 2.17 1.01 -1.24 -1.30 121.20 124.89 5gch s ILE 85 Ca 0.40 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.85 5gch s ILE 85 Cb -0.14 -4.36 0.00 0.00 0.01 0.00 0.00 42.46 37.97 5gch s ILE 85 CO 0.19 -0.69 0.55 0.00 0.00 0.00 0.00 174.94 174.99 5gch n ALA 86 N 6.88 -0.20 -2.80 9.38 0.00 0.66 -4.67 120.51 129.76 5gch n ALA 86 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.34 5gch n ALA 86 Cb 0.48 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.81 5gch n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 5gch s LYS 87 N -1.68 0.54 -0.22 0.00 1.02 -1.08 -4.96 119.74 113.37 5gch s LYS 87 Ca 0.00 -0.56 -0.12 0.00 0.02 0.00 0.00 55.97 55.30 5gch s LYS 87 Cb 0.00 -0.41 -0.05 0.00 -0.52 0.00 0.00 37.83 36.85 5gch s LYS 87 CO 0.00 0.09 0.24 0.08 -0.92 0.00 0.00 175.35 174.85 5gch s VAL 88 N -0.88 5.31 -0.52 3.17 1.01 -1.26 -1.69 120.40 125.54 5gch s VAL 88 Ca -0.04 0.38 -0.07 0.00 0.00 0.00 0.00 61.98 62.24 5gch s VAL 88 Cb -0.07 -3.58 0.13 0.00 0.00 0.00 0.00 36.38 32.87 5gch s VAL 88 CO 0.00 0.33 0.37 -0.36 0.00 0.00 0.00 175.10 175.45 5gch s PHE 89 N 1.00 3.49 -0.38 5.22 0.40 0.67 -4.92 117.98 123.47 5gch s PHE 89 Ca 0.12 -2.16 -0.29 0.00 -0.60 0.00 0.00 56.93 54.00 5gch s PHE 89 Cb -0.14 -3.42 0.02 0.00 0.51 0.00 0.00 43.02 39.99 5gch s PHE 89 CO 0.05 -0.96 1.20 0.15 0.70 0.00 0.00 175.22 176.36 5gch s LYS 90 N 0.92 3.85 0.15 0.44 1.02 -1.26 0.21 119.74 125.07 5gch s LYS 90 Ca 0.10 0.95 -0.31 0.00 0.02 0.00 0.00 55.97 56.72 5gch s LYS 90 Cb -0.23 -3.87 -0.18 0.00 -0.52 0.00 0.00 37.83 33.04 5gch s LYS 90 CO -0.03 -1.20 0.67 -1.71 -0.92 0.00 0.00 175.35 172.16 5gch n ASN 91 N 7.64 -0.90 -0.05 2.83 2.85 0.53 -4.75 115.26 123.42 5gch n ASN 91 Ca 0.13 1.14 0.13 0.00 -0.11 0.00 0.00 54.58 55.88 5gch n ASN 91 Cb 0.48 -0.95 0.50 0.00 1.24 0.00 0.00 39.78 41.05 5gch n ASN 91 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 5gch n SER 92 N 1.87 0.34 -0.03 1.20 3.41 -1.26 -2.94 113.62 116.21 5gch n SER 92 Ca 0.18 -0.13 0.14 0.00 -0.26 0.00 0.00 58.87 58.80 5gch n SER 92 Cb 0.21 -0.11 0.53 0.00 -0.26 0.00 0.00 64.21 64.58 5gch n SER 92 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 5gch n LYS 93 N -1.29 0.19 -1.69 4.33 4.76 -1.26 -4.87 118.16 118.33 5gch n LYS 93 Ca 0.09 -0.06 -0.44 0.00 -2.87 0.00 0.00 58.31 55.04 5gch n LYS 93 Cb 0.32 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 5gch n LYS 93 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 5gch n TYR 94 N -1.35 2.52 -4.03 2.13 9.36 -1.15 -4.57 117.16 120.07 5gch n TYR 94 Ca 0.09 0.14 -0.31 0.00 3.32 0.00 0.00 57.90 61.14 5gch n TYR 94 Cb 0.32 -2.61 -0.15 0.00 -0.63 0.00 0.00 39.34 36.26 5gch n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 5gch s ASN 95 N 1.15 4.60 0.21 2.98 3.84 0.97 -4.96 114.94 123.73 5gch s ASN 95 Ca 0.77 -1.83 -0.10 0.00 0.21 0.00 0.00 52.86 51.92 5gch s ASN 95 Cb -0.59 -1.57 0.25 0.00 -0.55 0.00 0.00 41.25 38.80 5gch s ASN 95 CO 0.35 -0.31 1.78 -1.28 -2.79 0.00 0.00 177.10 174.86 5gch h SER 96 N 7.69 0.40 0.74 -4.21 0.87 -1.93 4.93 113.55 122.03 5gch h SER 96 Ca -0.10 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.46 5gch h SER 96 Cb 1.03 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.97 5gch h SER 96 CO 0.49 0.25 -0.21 -0.07 -0.53 0.00 0.00 176.83 176.76 5gch h LEU 97 N 0.54 0.00 0.00 2.23 4.07 -1.97 -3.22 115.31 116.96 5gch h LEU 97 Ca 0.30 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 58.07 5gch h LEU 97 Cb 0.28 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.98 5gch h LEU 97 CO -0.23 0.21 -1.77 0.35 -1.08 0.00 0.00 178.44 175.92 5gch n THR 98 N -3.48 0.69 -3.27 0.22 -2.24 -0.52 -4.99 114.28 100.69 5gch n THR 98 Ca -0.01 -0.46 -0.17 0.00 -2.27 0.00 0.00 64.05 61.14 5gch n THR 98 Cb 0.38 -0.57 0.06 0.00 -2.10 0.00 0.00 70.33 68.09 5gch n THR 98 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 5gch n ILE 99 N -2.36 -2.14 -3.79 2.28 5.41 1.60 -5.02 119.36 115.33 5gch n ILE 99 Ca -0.17 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.22 5gch n ILE 99 Cb 0.80 -3.29 -0.07 0.00 -0.71 0.00 0.00 39.64 36.38 5gch n ILE 99 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 5gch s ASN 100 N -3.21 6.39 -0.79 4.38 3.04 -0.98 -4.37 114.94 119.40 5gch s ASN 100 Ca 0.42 0.46 -0.03 0.00 0.04 0.00 0.00 52.86 53.74 5gch s ASN 100 Cb -0.18 -2.10 0.00 0.00 -1.54 0.00 0.00 41.25 37.43 5gch s ASN 100 CO 0.52 0.33 0.68 0.59 -3.04 0.00 0.00 177.10 176.18 5gch n ASN 101 N 2.42 -3.52 -4.30 -4.21 3.02 -1.26 -0.02 115.26 107.38 5gch n ASN 101 Ca -0.18 -0.35 -0.43 0.00 -0.03 0.00 0.00 54.58 53.58 5gch n ASN 101 Cb 0.54 -3.30 0.00 0.00 -0.61 0.00 0.00 39.78 36.41 5gch n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 5gch n ASP 102 N -1.72 5.04 -3.64 6.41 4.64 -1.26 -3.82 116.55 122.19 5gch n ASP 102 Ca -0.07 -2.99 -0.16 0.00 -1.38 0.00 0.00 54.79 50.19 5gch n ASP 102 Cb 0.57 -1.59 -0.15 0.00 -1.04 0.00 0.00 41.12 38.91 5gch n ASP 102 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 5gch s ILE 103 N 1.93 -0.31 0.18 5.18 2.07 -1.26 -3.50 121.20 125.49 5gch s ILE 103 Ca 0.45 0.27 0.10 0.00 -1.41 0.00 0.00 60.65 60.06 5gch s ILE 103 Cb 0.02 -0.39 -0.04 0.00 0.13 0.00 0.00 42.46 42.18 5gch s ILE 103 CO 0.01 0.09 -0.19 0.42 -1.91 0.00 0.00 174.94 173.37 5gch s THR 104 N 2.33 2.67 0.08 4.00 -4.23 -1.09 -0.34 115.64 119.06 5gch s THR 104 Ca 0.03 -1.86 0.06 0.00 -1.18 0.00 0.00 61.69 58.75 5gch s THR 104 Cb -0.12 -2.29 -0.04 0.00 1.34 0.00 0.00 72.50 71.39 5gch s THR 104 CO -0.07 -0.09 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.05 5gch s LEU 105 N -2.66 3.00 -0.17 4.79 1.43 0.55 -3.03 118.68 122.58 5gch s LEU 105 Ca 0.22 -0.35 0.00 0.00 -1.03 0.00 0.00 54.13 52.97 5gch s LEU 105 Cb -0.08 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.36 5gch s LEU 105 CO 0.12 0.21 -0.17 -0.76 0.23 0.00 0.00 176.35 175.97 5gch s LEU 106 N -1.95 2.32 -0.35 1.79 1.43 0.57 0.24 118.68 122.74 5gch s LEU 106 Ca 0.20 -0.56 -0.17 0.00 -1.03 0.00 0.00 54.13 52.57 5gch s LEU 106 Cb -0.11 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.57 5gch s LEU 106 CO 0.11 0.03 0.45 -0.75 0.23 0.00 0.00 176.35 176.43 5gch s LYS 107 N 1.10 3.60 -0.15 1.70 2.47 -0.68 0.24 119.74 128.02 5gch s LYS 107 Ca 0.00 -0.26 -0.23 0.00 -1.56 0.00 0.00 55.97 53.92 5gch s LYS 107 Cb -0.14 -3.80 -0.02 0.00 -1.46 0.00 0.00 37.83 32.40 5gch s LYS 107 CO -0.06 -0.59 0.72 -0.51 0.16 0.00 0.00 175.35 175.07 5gch s LEU 108 N 2.24 4.21 0.27 5.43 1.43 -0.16 -0.25 118.68 131.85 5gch s LEU 108 Ca 0.16 1.07 -0.04 0.00 -1.03 0.00 0.00 54.13 54.29 5gch s LEU 108 Cb -0.16 -3.07 0.34 0.00 0.03 0.00 0.00 46.19 43.32 5gch s LEU 108 CO 0.13 -0.27 1.91 0.77 0.23 0.00 0.00 176.35 179.11 5gch h SER 109 N 7.20 1.01 -3.52 2.29 4.64 -1.50 -3.38 113.55 120.29 5gch h SER 109 Ca -0.34 -0.07 -0.59 0.00 -0.47 0.00 0.00 61.79 60.33 5gch h SER 109 Cb 1.16 -0.26 -0.39 0.00 -0.31 0.00 0.00 62.40 62.60 5gch h SER 109 CO 0.79 0.79 -0.78 0.28 -0.87 0.00 0.00 176.83 177.05 5gch s THR 110 N -5.82 1.29 0.05 2.95 -1.32 -1.26 -4.97 115.64 106.56 5gch s THR 110 Ca -0.12 -1.14 -0.37 0.00 -1.21 0.00 0.00 61.69 58.85 5gch s THR 110 Cb 0.17 -1.66 -0.19 0.00 -1.51 0.00 0.00 72.50 69.32 5gch s THR 110 CO 0.81 -0.19 1.03 0.00 -2.21 0.00 0.00 174.62 174.06 5gch n ALA 111 N 4.75 -2.98 -1.44 11.08 0.00 -1.26 -4.65 120.51 126.01 5gch n ALA 111 Ca -0.10 0.56 -0.33 0.00 0.00 0.00 0.00 53.44 53.57 5gch n ALA 111 Cb 0.44 -1.80 0.06 0.00 0.00 0.00 0.00 19.45 18.16 5gch n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 5gch s ALA 112 N -0.10 2.37 -0.34 0.00 0.00 0.18 -5.00 121.76 118.88 5gch s ALA 112 Ca 0.85 0.54 -0.05 0.00 0.00 0.00 0.00 51.96 53.30 5gch s ALA 112 Cb -1.15 -3.33 0.05 0.00 0.00 0.00 0.00 23.12 18.69 5gch s ALA 112 CO 0.55 -1.45 0.09 0.45 0.00 0.00 0.00 175.76 175.40 5gch s SER 113 N -2.64 5.22 0.60 0.00 0.15 -1.26 -4.85 113.70 110.92 5gch s SER 113 Ca 0.67 -1.24 -0.17 0.00 0.70 0.00 0.00 55.95 55.91 5gch s SER 113 Cb -0.21 -1.83 -0.03 0.00 -1.71 0.00 0.00 66.02 62.24 5gch s SER 113 CO 0.44 -0.33 1.10 -0.36 1.20 0.00 0.00 173.24 175.29 5gch s PHE 114 N 1.35 2.75 0.00 3.44 0.08 -1.26 -4.78 117.98 119.56 5gch s PHE 114 Ca -0.02 1.54 0.00 0.00 0.12 0.00 0.00 56.93 58.57 5gch s PHE 114 Cb -0.20 -3.15 0.00 0.00 -0.57 0.00 0.00 43.02 39.10 5gch s PHE 114 CO 0.01 -1.45 0.00 -1.13 -0.10 0.00 0.00 175.22 172.55 5gch n SER 115 N -1.92 0.00 0.17 1.36 3.41 0.18 -4.89 113.62 111.93 5gch n SER 115 Ca 0.10 -0.29 0.13 0.00 -0.26 0.00 0.00 58.87 58.56 5gch n SER 115 Cb 0.52 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 65.00 5gch n SER 115 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 5gch h GLN 116 N 0.00 0.00 0.00 4.33 4.15 -1.97 -3.09 115.11 118.53 5gch h GLN 116 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 5gch h GLN 116 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 5gch h GLN 116 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 178.83 177.15 5gch n THR 117 N -2.50 0.27 -3.93 2.39 -2.24 -1.26 -4.89 114.28 102.12 5gch n THR 117 Ca 0.02 -0.57 -0.29 0.00 -2.27 0.00 0.00 64.05 60.94 5gch n THR 117 Cb 0.27 0.95 -0.16 0.00 -2.10 0.00 0.00 70.33 69.29 5gch n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 5gch s VAL 118 N -0.27 1.26 0.32 2.28 1.01 -1.17 -4.35 120.40 119.49 5gch s VAL 118 Ca 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 5gch s VAL 118 Cb 0.00 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 35.04 5gch s VAL 118 CO 0.00 0.22 0.48 -1.54 0.00 0.00 0.00 175.10 174.27 5gch n SER 119 N 4.84 -1.37 -4.89 3.32 3.41 0.14 -0.65 113.62 118.42 5gch n SER 119 Ca -0.13 -2.60 -0.33 0.00 -0.26 0.00 0.00 58.87 55.55 5gch n SER 119 Cb 0.48 2.47 -0.05 0.00 -0.26 0.00 0.00 64.21 66.85 5gch n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 5gch s ALA 120 N -2.47 3.77 0.23 7.33 0.00 -1.26 -3.69 121.76 125.66 5gch s ALA 120 Ca 0.23 -0.50 0.06 0.00 0.00 0.00 0.00 51.96 51.75 5gch s ALA 120 Cb -0.02 -2.17 -0.03 0.00 0.00 0.00 0.00 23.12 20.90 5gch s ALA 120 CO 0.16 0.63 0.24 0.54 0.00 0.00 0.00 175.76 177.34 5gch s VAL 121 N -1.56 4.73 -0.07 0.00 0.11 0.85 -4.89 120.40 119.56 5gch s VAL 121 Ca 0.38 -1.20 -0.21 0.00 -2.93 0.00 0.00 61.98 58.02 5gch s VAL 121 Cb -0.13 -3.53 -0.04 0.00 -1.53 0.00 0.00 36.38 31.15 5gch s VAL 121 CO 0.22 -0.29 0.61 0.00 -3.33 0.00 0.00 175.10 172.31 5gch s LEU 123 N 0.58 4.30 0.76 0.00 1.43 -1.26 -5.10 118.68 119.39 5gch s LEU 123 Ca 0.33 0.60 -0.08 0.00 -1.03 0.00 0.00 54.13 53.95 5gch s LEU 123 Cb -0.17 -3.13 0.09 0.00 0.03 0.00 0.00 46.19 43.01 5gch s LEU 123 CO 0.15 0.11 1.08 -2.16 0.23 0.00 0.00 176.35 175.77 5gch s PRO 124 N -2.37 1.89 0.45 1.29 0.04 -1.26 -5.09 135.00 129.96 5gch s PRO 124 Ca 0.37 -0.31 -0.21 0.00 0.04 0.00 0.00 61.00 60.89 5gch s PRO 124 Cb -0.13 -2.11 -0.10 0.00 0.04 0.00 0.00 34.50 32.21 5gch s PRO 124 CO 0.22 -1.48 0.99 -1.12 0.04 0.00 0.00 177.00 175.66 5gch s SER 125 N -4.60 6.68 0.56 6.66 0.01 -1.26 -4.87 113.70 116.88 5gch s SER 125 Ca 0.63 1.80 0.28 0.00 1.31 0.00 0.00 55.95 59.97 5gch s SER 125 Cb -0.09 -2.55 1.48 0.00 0.21 0.00 0.00 66.02 65.06 5gch s SER 125 CO 0.46 -0.54 1.95 0.00 0.41 0.00 0.00 173.24 175.52 5gch h ALA 126 N 1.77 2.34 -0.26 1.44 0.00 -2.07 0.39 119.26 122.88 5gch h ALA 126 Ca -0.49 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.28 5gch h ALA 126 Cb 1.20 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 5gch h ALA 126 CO 0.60 -0.70 -0.33 0.66 0.00 0.00 0.00 179.25 179.48 5gch h SER 127 N 0.00 0.57 -1.63 0.00 4.64 -2.04 -3.45 113.55 111.64 5gch h SER 127 Ca 0.24 -0.22 -0.64 0.00 -0.47 0.00 0.00 61.79 60.70 5gch h SER 127 Cb 1.12 -0.16 0.11 0.00 -0.31 0.00 0.00 62.40 63.17 5gch h SER 127 CO -0.00 0.86 -0.32 0.47 -0.87 0.00 0.00 176.83 176.97 5gch n ASP 128 N -4.07 -0.44 -4.44 4.97 10.43 0.14 -4.98 116.55 118.16 5gch n ASP 128 Ca -0.01 1.12 -0.32 0.00 2.57 0.00 0.00 54.79 58.14 5gch n ASP 128 Cb 0.47 -1.07 -0.14 0.00 1.84 0.00 0.00 41.12 42.22 5gch n ASP 128 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 5gch s ASP 129 N -0.85 3.84 -0.34 -2.24 2.15 -1.26 -4.90 116.67 113.08 5gch s ASP 129 Ca 0.62 -0.25 0.03 0.00 0.43 0.00 0.00 52.55 53.37 5gch s ASP 129 Cb -0.82 -0.79 0.16 0.00 -0.30 0.00 0.00 42.92 41.17 5gch s ASP 129 CO 0.58 0.33 0.40 -0.36 -0.17 0.00 0.00 175.17 175.95 5gch s PHE 130 N -0.66 -0.68 0.35 -5.34 0.40 -1.26 -5.15 117.98 105.63 5gch s PHE 130 Ca 0.10 -0.26 -0.26 0.00 -0.60 0.00 0.00 56.93 55.91 5gch s PHE 130 Cb -0.11 -0.27 -0.09 0.00 0.51 0.00 0.00 43.02 43.06 5gch s PHE 130 CO 0.00 -0.99 1.08 0.00 0.70 0.00 0.00 175.22 176.02 5gch s ALA 131 N 1.97 3.23 0.44 5.36 0.00 -1.26 -5.02 121.76 126.47 5gch s ALA 131 Ca 0.13 0.81 -0.23 0.00 0.00 0.00 0.00 51.96 52.68 5gch s ALA 131 Cb -0.13 -3.31 -0.11 0.00 0.00 0.00 0.00 23.12 19.57 5gch s ALA 131 CO -0.17 -0.22 0.72 0.00 0.00 0.00 0.00 175.76 176.09 5gch n ALA 132 N 0.49 -0.86 -0.77 0.00 0.00 -1.26 -2.32 120.51 115.79 5gch n ALA 132 Ca 0.02 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.63 5gch n ALA 132 Cb 0.47 -1.89 0.00 0.00 0.00 0.00 0.00 19.45 18.03 5gch n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5gch n GLY 133 N 1.57 1.27 3.72 0.00 0.00 -1.26 -5.02 105.19 105.46 5gch n GLY 133 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 5gch n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5gch s THR 134 N -3.70 4.24 -0.08 2.61 2.01 -0.98 -5.02 115.64 114.72 5gch s THR 134 Ca 0.00 1.65 -0.25 0.00 0.31 0.00 0.00 61.69 63.41 5gch s THR 134 Cb 0.00 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.42 5gch s THR 134 CO 0.00 0.16 0.78 -0.89 -0.69 0.00 0.00 174.62 173.97 5gch s THR 135 N 0.82 4.98 0.17 -0.82 2.01 -1.26 -5.04 115.64 116.49 5gch s THR 135 Ca 0.55 1.59 0.01 0.00 0.31 0.00 0.00 61.69 64.15 5gch s THR 135 Cb -0.27 -4.11 -0.00 0.00 0.01 0.00 0.00 72.50 68.13 5gch s THR 135 CO 0.30 0.18 0.05 0.00 -0.69 0.00 0.00 174.62 174.45 5gch s VAL 137 N -2.07 0.25 -0.04 0.00 1.01 -1.26 -5.17 120.40 113.12 5gch s VAL 137 Ca 0.07 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.50 5gch s VAL 137 Cb 0.00 -0.29 0.02 0.00 0.00 0.00 0.00 36.38 36.11 5gch s VAL 137 CO 0.05 -0.20 -0.05 0.28 0.00 0.00 0.00 175.10 175.18 5gch s THR 138 N -0.76 0.52 0.34 3.92 -1.32 -1.26 -5.15 115.64 111.93 5gch s THR 138 Ca -0.06 -0.15 0.06 0.00 -1.21 0.00 0.00 61.69 60.33 5gch s THR 138 Cb -0.06 -0.52 -0.07 0.00 -1.51 0.00 0.00 72.50 70.34 5gch s THR 138 CO -0.00 0.21 -0.01 0.42 -2.21 0.00 0.00 174.62 173.02 5gch s THR 139 N 0.70 1.72 -5.00 5.08 -4.23 -1.26 -5.09 115.64 107.56 5gch s THR 139 Ca -0.09 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.35 5gch s THR 139 Cb -0.12 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 70.98 5gch s THR 139 CO 0.00 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 5gch n GLY 140 N -0.76 -1.41 2.26 3.99 0.00 -1.26 -4.97 105.19 103.03 5gch n GLY 140 Ca -0.04 -1.55 -0.27 0.00 0.00 0.00 0.00 46.02 44.16 5gch n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 5gch n TRP 141 N -0.23 3.03 -1.83 1.61 8.01 -1.26 -4.88 117.44 121.89 5gch n TRP 141 Ca 0.00 -2.60 -0.29 0.00 -1.31 0.00 0.00 57.50 53.30 5gch n TRP 141 Cb 0.00 -0.41 0.13 0.00 -2.01 0.00 0.00 31.31 29.02 5gch n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 5gch s GLY 142 N -3.26 1.64 0.52 6.99 0.00 -1.26 -4.96 107.32 106.99 5gch s GLY 142 Ca 0.51 -0.79 -0.20 0.00 0.00 0.00 0.00 44.72 44.24 5gch s GLY 142 CO -0.07 -0.20 0.77 1.04 0.00 0.00 0.00 173.10 174.63 5gch n LEU 143 N -3.56 1.91 -0.05 0.66 4.77 -1.26 -3.79 117.00 115.67 5gch n LEU 143 Ca 0.10 0.85 0.06 0.00 -0.03 0.00 0.00 56.01 56.99 5gch n LEU 143 Cb 0.60 -1.27 -0.06 0.00 -2.33 0.00 0.00 43.42 40.37 5gch n LEU 143 CO 0.54 -2.32 0.02 0.35 -1.33 0.00 0.00 177.39 174.64 5gch n THR 144 N -1.30 0.00 -3.91 -5.08 -2.24 -1.26 -0.86 114.28 99.63 5gch n THR 144 Ca 0.12 -0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.56 5gch n THR 144 Cb 0.44 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.60 5gch n THR 144 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 5gch s ARG 145 N -2.07 0.42 0.00 -0.78 0.52 -1.26 -3.97 118.95 111.81 5gch s ARG 145 Ca 0.06 -0.45 0.19 0.00 -0.52 0.00 0.00 55.73 55.00 5gch s ARG 145 Cb 0.10 0.17 0.15 0.00 0.52 0.00 0.00 34.95 35.88 5gch s ARG 145 CO 0.48 -0.09 1.09 0.98 0.02 0.00 0.00 175.30 177.78