#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4gch s VAL 17 N 0.00 4.94 -0.10 1.39 1.01 -1.26 -4.12 120.40 122.26 4gch s VAL 17 Ca 0.00 1.12 0.00 0.00 0.00 0.00 0.00 61.98 63.10 4gch s VAL 17 Cb 0.00 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.40 4gch s VAL 17 CO 0.00 -0.04 0.00 -3.20 0.00 0.00 0.00 175.10 171.86 4gch n ASN 18 N 5.82 -1.65 -4.31 3.32 2.85 -1.26 -5.07 115.26 114.96 4gch n ASN 18 Ca 0.00 0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.28 4gch n ASN 18 Cb 0.49 -0.74 0.09 0.00 1.24 0.00 0.00 39.78 40.86 4gch n ASN 18 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 4gch n GLY 19 N -1.38 0.96 3.40 8.20 0.00 -1.26 -5.12 105.19 110.00 4gch n GLY 19 Ca -0.01 -2.07 -0.20 0.00 0.00 0.00 0.00 46.02 43.74 4gch n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4gch s GLU 20 N -4.66 1.49 0.33 1.61 2.02 -1.26 -5.12 118.70 113.11 4gch s GLU 20 Ca 0.57 -1.74 -0.29 0.00 0.02 0.00 0.00 54.97 53.53 4gch s GLU 20 Cb -0.04 -1.10 -0.11 0.00 0.10 0.00 0.00 34.13 32.99 4gch s GLU 20 CO 0.37 0.05 1.44 -2.00 0.02 0.00 0.00 175.26 175.15 4gch s GLU 21 N -3.72 4.21 0.57 1.61 2.12 -1.26 -5.04 118.70 117.18 4gch s GLU 21 Ca 0.28 2.43 -0.13 0.00 0.36 0.00 0.00 54.97 57.90 4gch s GLU 21 Cb 0.03 -3.03 -0.06 0.00 0.26 0.00 0.00 34.13 31.33 4gch s GLU 21 CO 0.11 -0.43 1.00 0.00 -0.54 0.00 0.00 175.26 175.40 4gch s ALA 22 N -0.78 3.10 0.16 6.30 0.00 -1.26 -5.06 121.76 124.22 4gch s ALA 22 Ca 0.54 0.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 4gch s ALA 22 Cb -0.44 -3.08 -0.08 0.00 0.00 0.00 0.00 23.12 19.52 4gch s ALA 22 CO 0.55 -0.48 1.19 0.08 0.00 0.00 0.00 175.76 177.10 4gch s VAL 23 N -2.92 3.68 0.04 0.00 1.01 -1.26 -4.95 120.40 116.00 4gch s VAL 23 Ca 0.56 1.37 -0.31 0.00 0.00 0.00 0.00 61.98 63.61 4gch s VAL 23 Cb -0.10 -3.88 -0.07 0.00 0.00 0.00 0.00 36.38 32.33 4gch s VAL 23 CO 0.44 0.20 1.44 -2.16 0.00 0.00 0.00 175.10 175.01 4gch s PRO 24 N -0.01 4.28 0.00 2.72 0.04 -1.26 -2.50 135.00 138.27 4gch s PRO 24 Ca 0.54 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.63 4gch s PRO 24 Cb -0.32 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.74 4gch s PRO 24 CO 0.35 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 177.24 4gch n GLY 25 N 3.66 0.65 0.02 0.56 0.00 -1.26 -4.94 105.19 103.87 4gch n GLY 25 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 4gch n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 4gch n SER 26 N 0.00 0.12 -3.37 1.61 3.41 -1.04 -3.80 113.62 110.54 4gch n SER 26 Ca 0.00 0.52 -0.26 0.00 -0.26 0.00 0.00 58.87 58.87 4gch n SER 26 Cb 0.00 -0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 63.32 4gch n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 4gch n TRP 27 N -1.62 1.22 0.58 7.33 7.02 -1.26 -5.01 117.44 125.70 4gch n TRP 27 Ca 0.05 -3.79 0.07 0.00 -1.02 0.00 0.00 57.50 52.80 4gch n TRP 27 Cb 0.25 -0.35 0.34 0.00 -2.42 0.00 0.00 31.31 29.12 4gch n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 4gch n PRO 28 N 1.51 0.08 0.00 -0.99 -0.04 -1.25 -2.69 135.00 131.62 4gch n PRO 28 Ca 0.25 0.21 0.09 0.00 -0.04 0.00 0.00 63.50 64.01 4gch n PRO 28 Cb 0.46 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.37 4gch n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 4gch n TRP 29 N -1.42 0.00 -2.25 0.54 2.14 -1.22 -1.52 117.44 113.70 4gch n TRP 29 Ca 0.05 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.20 4gch n TRP 29 Cb 0.15 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.62 4gch n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 4gch s GLN 30 N -2.41 4.36 0.23 -2.67 2.00 -1.10 -0.46 119.66 119.61 4gch s GLN 30 Ca 0.11 1.98 0.05 0.00 -2.00 0.00 0.00 55.36 55.50 4gch s GLN 30 Cb 0.14 -3.27 -0.05 0.00 0.80 0.00 0.00 33.01 30.63 4gch s GLN 30 CO 0.60 -0.37 -0.03 0.14 -0.50 0.00 0.00 175.29 175.13 4gch s VAL 31 N 1.01 1.23 -0.07 1.34 -7.23 -0.98 -4.37 120.40 111.33 4gch s VAL 31 Ca 0.62 -2.07 0.03 0.00 -1.81 0.00 0.00 61.98 58.76 4gch s VAL 31 Cb -0.35 -2.29 0.01 0.00 0.56 0.00 0.00 36.38 34.31 4gch s VAL 31 CO 0.30 -0.38 -0.15 -0.55 -0.31 0.00 0.00 175.10 174.01 4gch s SER 32 N -3.32 2.10 -0.13 4.85 0.15 0.18 -2.65 113.70 114.87 4gch s SER 32 Ca 0.27 -0.36 -0.25 0.00 0.70 0.00 0.00 55.95 56.31 4gch s SER 32 Cb 0.05 -0.88 -0.02 0.00 -1.71 0.00 0.00 66.02 63.45 4gch s SER 32 CO 0.08 0.08 0.80 -0.76 1.20 0.00 0.00 173.24 174.65 4gch s LEU 33 N 0.46 4.23 0.04 3.45 1.43 -0.80 -0.63 118.68 126.85 4gch s LEU 33 Ca -0.13 1.21 0.06 0.00 -1.03 0.00 0.00 54.13 54.23 4gch s LEU 33 Cb -0.15 -3.21 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 4gch s LEU 33 CO 0.04 -0.31 -0.16 -1.10 0.23 0.00 0.00 176.35 175.06 4gch s GLN 34 N 1.69 1.03 0.00 1.70 -0.21 -0.95 -1.91 119.66 121.02 4gch s GLN 34 Ca 0.39 -0.82 -0.00 0.00 0.02 0.00 0.00 55.36 54.94 4gch s GLN 34 Cb -0.17 -1.07 0.00 0.00 1.00 0.00 0.00 33.01 32.77 4gch s GLN 34 CO 0.15 0.27 0.01 -0.40 -2.12 0.00 0.00 175.29 173.19 4gch n ASP 35 N 1.82 0.00 0.00 5.90 3.85 -0.89 -2.00 116.55 125.23 4gch n ASP 35 Ca -0.18 -1.00 0.14 0.00 -0.71 0.00 0.00 54.79 53.03 4gch n ASP 35 Cb 0.54 -0.00 0.61 0.00 -1.35 0.00 0.00 41.12 40.92 4gch n ASP 35 CO 0.00 0.00 0.00 2.29 -1.01 0.00 0.00 177.20 178.48 4gch n LYS 36 N -1.01 0.00 0.10 0.11 2.85 -1.26 -2.50 118.16 116.46 4gch n LYS 36 Ca 0.00 0.01 -0.03 0.00 -1.05 0.00 0.00 58.31 57.24 4gch n LYS 36 Cb 0.00 -1.50 0.02 0.00 -0.65 0.00 0.00 35.03 32.90 4gch n LYS 36 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 4gch h THR 37 N 0.00 1.46 0.00 0.58 2.02 -1.93 -3.48 112.91 111.56 4gch h THR 37 Ca 0.00 -2.75 0.00 0.00 0.77 0.00 0.00 66.41 64.43 4gch h THR 37 Cb 0.49 2.52 0.00 0.00 -1.74 0.00 0.00 68.15 69.42 4gch h THR 37 CO 0.00 0.76 0.00 0.61 0.37 0.00 0.00 175.52 177.26 4gch n GLY 38 N 0.94 0.79 3.61 2.16 0.00 -1.04 -5.07 105.19 106.57 4gch n GLY 38 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 4gch n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 4gch s PHE 39 N -2.00 1.91 0.07 1.61 5.36 -1.26 -4.73 117.98 118.95 4gch s PHE 39 Ca 0.00 0.59 -0.31 0.00 -0.96 0.00 0.00 56.93 56.25 4gch s PHE 39 Cb 0.00 -4.11 -0.08 0.00 -0.34 0.00 0.00 43.02 38.49 4gch s PHE 39 CO 0.00 -2.93 1.57 -1.58 -1.46 0.00 0.00 175.22 170.81 4gch s HIS 40 N 6.31 2.66 0.00 10.12 5.65 -1.26 -2.10 115.29 136.67 4gch s HIS 40 Ca 0.77 0.52 0.00 0.00 0.25 0.00 0.00 55.06 56.59 4gch s HIS 40 Cb -0.23 -3.87 0.00 0.00 -1.18 0.00 0.00 32.58 27.30 4gch s HIS 40 CO 0.33 -3.39 0.00 1.97 -0.65 0.00 0.00 174.74 173.00 4gch n PHE 41 N 5.20 0.00 -3.76 3.88 1.16 -0.80 -4.98 117.46 118.16 4gch n PHE 41 Ca 0.15 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.63 4gch n PHE 41 Cb 0.41 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.25 4gch n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 4gch n GLY 43 N -0.37 2.85 3.61 0.00 0.00 -1.26 -1.90 105.19 108.12 4gch n GLY 43 Ca -0.09 -2.09 -0.03 0.00 0.00 0.00 0.00 46.02 43.81 4gch n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4gch s GLY 44 N -1.25 -0.26 -0.04 -0.02 0.00 -1.09 -4.41 107.32 100.25 4gch s GLY 44 Ca 0.00 1.71 0.02 0.00 0.00 0.00 0.00 44.72 46.45 4gch s GLY 44 CO 0.00 0.57 -0.08 -0.56 0.00 0.00 0.00 173.10 173.03 4gch s SER 45 N -2.13 1.23 0.00 1.64 0.01 0.14 -2.31 113.70 112.29 4gch s SER 45 Ca 0.10 -0.19 -0.30 0.00 1.31 0.00 0.00 55.95 56.87 4gch s SER 45 Cb -0.01 -0.51 -0.07 0.00 0.21 0.00 0.00 66.02 65.64 4gch s SER 45 CO -0.04 0.01 1.60 -0.76 0.41 0.00 0.00 173.24 174.46 4gch s LEU 46 N 0.62 4.34 -0.01 2.44 1.43 0.39 0.29 118.68 128.19 4gch s LEU 46 Ca -0.10 2.30 0.17 0.00 -1.03 0.00 0.00 54.13 55.47 4gch s LEU 46 Cb -0.13 -3.55 -0.20 0.00 0.03 0.00 0.00 46.19 42.34 4gch s LEU 46 CO 0.01 -0.87 0.63 2.30 0.23 0.00 0.00 176.35 178.65 4gch n ILE 47 N 5.01 0.00 -3.22 -0.59 -5.35 0.28 -1.60 119.36 113.89 4gch n ILE 47 Ca 0.16 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 4gch n ILE 47 Cb 0.42 0.79 0.00 0.00 -1.74 0.00 0.00 39.64 39.11 4gch n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 4gch n ASN 48 N -1.56 0.00 -0.01 7.28 2.04 -1.23 -4.63 115.26 117.16 4gch n ASN 48 Ca 0.02 0.00 0.14 0.00 -0.44 0.00 0.00 54.58 54.30 4gch n ASN 48 Cb 0.30 0.00 0.67 0.00 -2.53 0.00 0.00 39.78 38.22 4gch n ASN 48 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 4gch n GLU 49 N 0.00 0.26 0.00 -3.83 0.00 -1.26 -3.28 120.64 112.53 4gch n GLU 49 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.14 4gch n GLU 49 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 29.94 4gch n GLU 49 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 4gch n ASN 50 N -1.35 1.54 -3.69 -1.84 3.02 -1.26 -1.27 115.26 110.42 4gch n ASN 50 Ca 0.11 -1.58 -0.17 0.00 -0.03 0.00 0.00 54.58 52.91 4gch n ASN 50 Cb 0.29 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.30 4gch n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 4gch s TRP 51 N -0.58 -0.13 -0.12 3.10 0.52 -1.20 -1.52 118.94 119.01 4gch s TRP 51 Ca 0.00 0.51 -0.04 0.00 0.02 0.00 0.00 56.10 56.59 4gch s TRP 51 Cb 0.00 -0.26 -0.04 0.00 -1.15 0.00 0.00 33.47 32.02 4gch s TRP 51 CO 0.00 -0.23 0.04 0.08 0.02 0.00 0.00 176.95 176.86 4gch s VAL 52 N 2.02 4.64 -0.13 4.03 1.01 0.34 -0.56 120.40 131.75 4gch s VAL 52 Ca 0.01 -0.11 -0.05 0.00 0.00 0.00 0.00 61.98 61.83 4gch s VAL 52 Cb -0.12 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 4gch s VAL 52 CO -0.05 0.57 0.05 -0.69 0.00 0.00 0.00 175.10 174.98 4gch s VAL 53 N -0.57 4.71 0.00 2.92 1.01 0.15 -0.80 120.40 127.81 4gch s VAL 53 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.00 4gch s VAL 53 Cb -0.12 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.21 4gch s VAL 53 CO 0.02 0.56 0.00 1.07 0.00 0.00 0.00 175.10 176.75 4gch n THR 54 N 2.64 0.00 -3.36 3.92 5.66 -0.52 0.27 114.28 122.89 4gch n THR 54 Ca -0.18 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.48 4gch n THR 54 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.26 4gch n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 4gch s ALA 55 N -1.97 3.55 0.22 1.79 0.00 -1.26 -1.77 121.76 122.32 4gch s ALA 55 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 51.96 51.78 4gch s ALA 55 Cb 0.00 -2.51 0.22 0.00 0.00 0.00 0.00 23.12 20.82 4gch s ALA 55 CO 0.00 0.46 1.58 0.00 0.00 0.00 0.00 175.76 177.81 4gch h ALA 56 N 3.05 0.84 0.00 0.00 0.00 -1.70 -2.53 119.26 118.92 4gch h ALA 56 Ca -0.48 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 53.98 4gch h ALA 56 Cb 1.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.87 4gch h ALA 56 CO 0.67 0.65 0.00 1.12 0.00 0.00 0.00 179.25 181.69 4gch h HIS 57 N 0.42 0.00 -0.08 0.00 2.07 -1.92 -2.52 115.15 113.12 4gch h HIS 57 Ca 0.03 0.00 0.02 0.00 -2.85 0.00 0.00 60.37 57.57 4gch h HIS 57 Cb 0.94 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.92 4gch h HIS 57 CO 0.04 0.00 0.12 0.00 -3.07 0.00 0.00 177.93 175.02 4gch n GLY 59 N -1.30 -0.45 3.73 0.00 0.00 -0.95 -4.99 105.19 101.24 4gch n GLY 59 Ca -0.01 0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 4gch n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4gch s VAL 60 N -3.39 2.80 0.07 1.61 1.01 -1.26 -5.04 120.40 116.19 4gch s VAL 60 Ca 0.37 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.98 4gch s VAL 60 Cb -0.17 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.81 4gch s VAL 60 CO 0.77 0.08 0.01 0.35 0.00 0.00 0.00 175.10 176.31 4gch n THR 61 N 3.04 0.00 -0.29 3.92 -2.24 -1.26 -4.94 114.28 112.51 4gch n THR 61 Ca 0.09 -0.32 0.11 0.00 -2.27 0.00 0.00 64.05 61.66 4gch n THR 61 Cb 0.40 -0.06 0.32 0.00 -2.10 0.00 0.00 70.33 68.89 4gch n THR 61 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 4gch n THR 62 N -0.30 1.07 1.49 4.28 -2.24 -1.26 -3.59 114.28 113.72 4gch n THR 62 Ca -0.02 -0.97 0.13 0.00 -2.27 0.00 0.00 64.05 60.91 4gch n THR 62 Cb 0.09 0.42 0.53 0.00 -2.10 0.00 0.00 70.33 69.27 4gch n THR 62 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 4gch n SER 63 N 1.51 1.36 -4.94 3.42 7.64 -1.26 -4.62 113.62 116.72 4gch n SER 63 Ca 0.24 -1.50 -0.24 0.00 1.01 0.00 0.00 58.87 58.37 4gch n SER 63 Cb 0.64 -0.03 0.02 0.00 -1.01 0.00 0.00 64.21 63.83 4gch n SER 63 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 4gch s ASP 64 N -1.88 5.67 0.01 6.43 -0.00 -1.24 -4.04 116.67 121.63 4gch s ASP 64 Ca 0.37 0.43 -0.01 0.00 -0.00 0.00 0.00 52.55 53.34 4gch s ASP 64 Cb 0.20 -1.53 -0.01 0.00 -0.00 0.00 0.00 42.92 41.57 4gch s ASP 64 CO 0.32 -0.90 0.00 0.68 -0.00 0.00 0.00 175.17 175.27 4gch s VAL 65 N -2.76 0.09 -0.31 -1.27 -7.23 -0.85 -4.00 120.40 104.08 4gch s VAL 65 Ca 0.51 -0.78 -0.18 0.00 -1.81 0.00 0.00 61.98 59.73 4gch s VAL 65 Cb -0.10 -0.26 -0.01 0.00 0.56 0.00 0.00 36.38 36.56 4gch s VAL 65 CO 0.41 -0.43 0.53 -0.69 -0.31 0.00 0.00 175.10 174.61 4gch s VAL 66 N -1.28 5.02 -0.14 1.32 1.01 0.18 -2.23 120.40 124.28 4gch s VAL 66 Ca -0.14 0.61 -0.02 0.00 0.00 0.00 0.00 61.98 62.43 4gch s VAL 66 Cb -0.09 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 4gch s VAL 66 CO -0.01 -0.10 -0.08 -0.69 0.00 0.00 0.00 175.10 174.22 4gch s VAL 67 N 2.40 3.48 0.05 2.92 1.01 0.19 0.43 120.40 130.90 4gch s VAL 67 Ca 0.21 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.71 4gch s VAL 67 Cb -0.15 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 4gch s VAL 67 CO 0.12 0.52 -0.10 0.00 0.00 0.00 0.00 175.10 175.63 4gch s ALA 68 N 0.27 0.81 0.00 5.51 0.00 -1.01 -0.65 121.76 126.68 4gch s ALA 68 Ca -0.06 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.03 4gch s ALA 68 Cb -0.15 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.96 4gch s ALA 68 CO 0.04 0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.26 4gch n GLY 69 N 1.37 0.44 3.85 0.00 0.00 -1.26 -0.64 105.19 108.95 4gch n GLY 69 Ca -0.22 -0.99 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 4gch n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 4gch s GLU 70 N -1.90 3.87 0.00 1.61 2.12 -1.26 -4.43 118.70 118.70 4gch s GLU 70 Ca 0.00 0.34 0.00 0.00 0.36 0.00 0.00 54.97 55.67 4gch s GLU 70 Cb 0.00 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.32 4gch s GLU 70 CO 0.00 0.59 0.00 0.34 -0.54 0.00 0.00 175.26 175.65 4gch n PHE 71 N 1.21 0.00 -3.10 5.30 7.35 -1.26 -4.85 117.46 122.11 4gch n PHE 71 Ca -0.09 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.16 4gch n PHE 71 Cb 0.52 0.02 -0.06 0.00 0.35 0.00 0.00 39.48 40.31 4gch n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 4gch s ASP 72 N -2.58 6.26 0.54 -2.13 3.68 -1.26 -4.91 116.67 116.28 4gch s ASP 72 Ca 0.00 -0.72 0.30 0.00 2.13 0.00 0.00 52.55 54.26 4gch s ASP 72 Cb 0.00 -2.32 1.47 0.00 -1.45 0.00 0.00 42.92 40.62 4gch s ASP 72 CO 0.00 -0.92 1.90 1.56 0.13 0.00 0.00 175.17 177.84 4gch h GLN 73 N 9.02 0.00 -0.00 4.34 4.20 -2.03 -2.31 115.11 128.32 4gch h GLN 73 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 4gch h GLN 73 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 4gch h GLN 73 CO 0.97 0.00 -0.57 0.41 -0.67 0.00 0.00 178.83 178.97 4gch n GLY 74 N -1.67 -0.81 3.75 3.46 0.00 -1.26 -4.93 105.19 103.74 4gch n GLY 74 Ca 0.16 -0.48 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 4gch n GLY 74 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 4gch s SER 75 N -2.79 7.23 0.06 1.61 0.15 -0.87 -4.98 113.70 114.11 4gch s SER 75 Ca 0.15 1.46 0.23 0.00 0.70 0.00 0.00 55.95 58.49 4gch s SER 75 Cb 0.18 -2.47 -0.03 0.00 -1.71 0.00 0.00 66.02 61.99 4gch s SER 75 CO 0.68 0.06 0.93 -0.24 1.20 0.00 0.00 173.24 175.87 4gch n SER 76 N 2.57 0.56 -1.35 5.45 2.88 -1.26 -4.45 113.62 118.02 4gch n SER 76 Ca -0.03 -0.11 0.06 0.00 -1.33 0.00 0.00 58.87 57.46 4gch n SER 76 Cb 0.50 0.95 0.28 0.00 -0.75 0.00 0.00 64.21 65.18 4gch n SER 76 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 4gch n SER 77 N -2.12 3.96 -4.70 -3.46 3.41 -1.26 -4.93 113.62 104.52 4gch n SER 77 Ca 0.01 -2.47 -0.39 0.00 -0.26 0.00 0.00 58.87 55.76 4gch n SER 77 Cb 0.47 -0.55 -0.06 0.00 -0.26 0.00 0.00 64.21 63.81 4gch n SER 77 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 4gch s GLU 78 N -1.98 4.31 -0.91 4.33 2.02 -1.26 -4.98 118.70 120.23 4gch s GLU 78 Ca 0.38 0.50 -0.21 0.00 0.02 0.00 0.00 54.97 55.67 4gch s GLU 78 Cb 0.27 -3.48 -0.12 0.00 0.10 0.00 0.00 34.13 30.90 4gch s GLU 78 CO 0.15 0.05 1.97 1.17 0.02 0.00 0.00 175.26 178.62 4gch n LYS 79 N 4.04 1.75 -2.93 1.61 4.81 -1.26 -4.93 118.16 121.25 4gch n LYS 79 Ca -0.05 -2.03 -0.23 0.00 -0.87 0.00 0.00 58.31 55.13 4gch n LYS 79 Cb 0.51 -3.04 0.01 0.00 0.02 0.00 0.00 35.03 32.54 4gch n LYS 79 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 4gch s ILE 80 N 5.07 3.81 -0.28 3.15 -4.36 -1.26 -4.90 121.20 122.42 4gch s ILE 80 Ca 0.56 -0.51 -0.01 0.00 -0.26 0.00 0.00 60.65 60.43 4gch s ILE 80 Cb 0.13 -3.41 0.04 0.00 1.25 0.00 0.00 42.46 40.47 4gch s ILE 80 CO 0.09 -0.29 -0.03 -1.10 0.24 0.00 0.00 174.94 173.85 4gch s GLN 81 N -4.59 2.55 -0.45 0.37 -0.21 0.18 -4.97 119.66 112.54 4gch s GLN 81 Ca 0.50 -1.18 -0.24 0.00 0.02 0.00 0.00 55.36 54.46 4gch s GLN 81 Cb -0.10 -3.10 0.03 0.00 1.00 0.00 0.00 33.01 30.83 4gch s GLN 81 CO 0.38 -0.55 0.83 0.15 -2.12 0.00 0.00 175.29 173.99 4gch s LYS 82 N 1.27 3.45 -0.16 2.91 1.02 -1.26 -2.42 119.74 124.55 4gch s LYS 82 Ca -0.04 -0.01 -0.05 0.00 0.02 0.00 0.00 55.97 55.90 4gch s LYS 82 Cb -0.19 -3.93 -0.03 0.00 -0.52 0.00 0.00 37.83 33.16 4gch s LYS 82 CO -0.02 -1.15 -0.00 -0.51 -0.92 0.00 0.00 175.35 172.74 4gch s LEU 83 N 3.45 3.45 0.05 3.17 1.43 0.17 -4.96 118.68 125.43 4gch s LEU 83 Ca 0.32 -0.04 -0.26 0.00 -1.03 0.00 0.00 54.13 53.12 4gch s LEU 83 Cb -0.11 -1.84 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 4gch s LEU 83 CO 0.24 0.19 0.80 -0.54 0.23 0.00 0.00 176.35 177.27 4gch s LYS 84 N 0.26 4.53 -0.05 1.70 1.02 -1.26 0.49 119.74 126.42 4gch s LYS 84 Ca -0.01 1.13 -0.25 0.00 0.02 0.00 0.00 55.97 56.86 4gch s LYS 84 Cb -0.13 -3.37 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 4gch s LYS 84 CO 0.02 0.25 0.76 0.42 -0.92 0.00 0.00 175.35 175.88 4gch s ILE 85 N 0.05 5.01 -0.18 2.17 1.01 -1.26 -1.52 121.20 126.48 4gch s ILE 85 Ca 0.40 1.58 -0.19 0.00 0.00 0.00 0.00 60.65 62.44 4gch s ILE 85 Cb -0.21 -4.10 -0.16 0.00 0.01 0.00 0.00 42.46 38.00 4gch s ILE 85 CO 0.24 0.23 0.24 0.00 0.00 0.00 0.00 174.94 175.65 4gch h ALA 86 N 6.75 0.15 -2.96 9.38 0.00 -0.91 -3.44 119.26 128.25 4gch h ALA 86 Ca -0.41 -0.88 -0.15 0.00 0.00 0.00 0.00 54.91 53.47 4gch h ALA 86 Cb 1.20 0.51 -0.24 0.00 0.00 0.00 0.00 17.79 19.27 4gch h ALA 86 CO 0.75 0.49 -0.41 0.15 0.00 0.00 0.00 179.25 180.23 4gch s LYS 87 N -2.26 0.39 -0.10 0.00 1.02 -1.17 -4.99 119.74 112.62 4gch s LYS 87 Ca -0.23 0.13 -0.00 0.00 0.02 0.00 0.00 55.97 55.89 4gch s LYS 87 Cb 0.03 0.18 -0.03 0.00 -0.52 0.00 0.00 37.83 37.49 4gch s LYS 87 CO 0.51 -0.07 -0.08 0.08 -0.92 0.00 0.00 175.35 174.87 4gch s VAL 88 N -0.38 3.58 -0.43 3.17 1.01 -1.26 -2.38 120.40 123.71 4gch s VAL 88 Ca -0.05 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.47 4gch s VAL 88 Cb -0.03 -2.49 0.12 0.00 0.00 0.00 0.00 36.38 33.97 4gch s VAL 88 CO 0.01 0.56 0.16 -0.36 0.00 0.00 0.00 175.10 175.47 4gch s PHE 89 N -0.30 3.45 0.04 5.22 0.40 -0.07 -5.01 117.98 121.71 4gch s PHE 89 Ca 0.04 -3.08 -0.30 0.00 -0.60 0.00 0.00 56.93 52.99 4gch s PHE 89 Cb -0.13 -2.86 -0.04 0.00 0.51 0.00 0.00 43.02 40.51 4gch s PHE 89 CO 0.02 -0.84 0.98 0.15 0.70 0.00 0.00 175.22 176.23 4gch s LYS 90 N 0.31 4.60 0.23 0.44 1.02 -1.26 0.26 119.74 125.34 4gch s LYS 90 Ca 0.14 1.45 -0.31 0.00 0.02 0.00 0.00 55.97 57.27 4gch s LYS 90 Cb -0.22 -3.42 -0.11 0.00 -0.52 0.00 0.00 37.83 33.55 4gch s LYS 90 CO -0.04 0.03 1.62 1.21 -0.92 0.00 0.00 175.35 177.25 4gch s ASN 91 N 0.65 6.44 0.00 2.83 3.84 -1.05 -4.90 114.94 122.75 4gch s ASN 91 Ca 0.50 2.83 0.15 0.00 0.21 0.00 0.00 52.86 56.55 4gch s ASN 91 Cb -0.22 -2.61 0.72 0.00 -0.55 0.00 0.00 41.25 38.59 4gch s ASN 91 CO 0.29 -0.90 1.43 -1.54 -2.79 0.00 0.00 177.10 173.59 4gch n SER 92 N 3.18 0.00 0.01 -4.21 3.41 -1.26 -2.39 113.62 112.36 4gch n SER 92 Ca 0.12 0.18 0.12 0.00 -0.26 0.00 0.00 58.87 59.03 4gch n SER 92 Cb 0.37 -0.34 0.21 0.00 -0.26 0.00 0.00 64.21 64.19 4gch n SER 92 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 4gch n LYS 93 N -1.34 0.03 -1.56 4.33 4.76 -1.26 -4.90 118.16 118.21 4gch n LYS 93 Ca 0.06 0.01 -0.50 0.00 -2.87 0.00 0.00 58.31 55.00 4gch n LYS 93 Cb 0.13 -1.52 -0.05 0.00 -1.84 0.00 0.00 35.03 31.76 4gch n LYS 93 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 4gch n TYR 94 N -1.56 1.19 -3.79 2.13 9.36 -1.01 -4.66 117.16 118.81 4gch n TYR 94 Ca 0.05 0.72 -0.29 0.00 3.32 0.00 0.00 57.90 61.70 4gch n TYR 94 Cb 0.35 -2.25 -0.16 0.00 -0.63 0.00 0.00 39.34 36.65 4gch n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 4gch s ASN 95 N 0.05 3.60 0.51 2.98 3.84 0.20 -4.98 114.94 121.13 4gch s ASN 95 Ca 0.77 -1.25 0.27 0.00 0.21 0.00 0.00 52.86 52.86 4gch s ASN 95 Cb -0.92 -0.86 1.34 0.00 -0.55 0.00 0.00 41.25 40.25 4gch s ASN 95 CO 0.52 -0.33 2.01 -1.28 -2.79 0.00 0.00 177.10 175.23 4gch h SER 96 N 8.10 0.00 0.95 -4.21 0.87 -1.93 4.75 113.55 122.08 4gch h SER 96 Ca -0.15 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.19 4gch h SER 96 Cb 1.07 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.99 4gch h SER 96 CO 0.41 0.14 -1.08 -0.07 -0.53 0.00 0.00 176.83 175.70 4gch h LEU 97 N 0.00 0.00 0.00 2.23 4.07 -1.96 -3.33 115.31 116.32 4gch h LEU 97 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 4gch h LEU 97 Cb 0.44 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.18 4gch h LEU 97 CO 0.02 0.95 -0.71 0.35 -1.08 0.00 0.00 178.44 177.98 4gch n THR 98 N -3.28 0.00 -3.34 0.22 -2.24 -0.88 -4.96 114.28 99.80 4gch n THR 98 Ca -0.03 -0.27 -0.24 0.00 -2.27 0.00 0.00 64.05 61.25 4gch n THR 98 Cb 0.94 0.73 0.05 0.00 -2.10 0.00 0.00 70.33 69.95 4gch n THR 98 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 4gch n ILE 99 N -1.38 -2.23 -3.36 2.28 5.41 1.54 -4.99 119.36 116.63 4gch n ILE 99 Ca 0.00 0.00 -0.38 0.00 1.00 0.00 0.00 62.75 63.38 4gch n ILE 99 Cb 0.13 -3.42 -0.06 0.00 -0.71 0.00 0.00 39.64 35.58 4gch n ILE 99 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 4gch s ASN 100 N -2.97 6.66 -0.70 4.38 3.04 -0.49 -4.46 114.94 120.41 4gch s ASN 100 Ca 0.45 0.79 -0.00 0.00 0.04 0.00 0.00 52.86 54.13 4gch s ASN 100 Cb -0.20 -2.27 -0.00 0.00 -1.54 0.00 0.00 41.25 37.24 4gch s ASN 100 CO 0.55 0.05 0.58 0.59 -3.04 0.00 0.00 177.10 175.83 4gch n ASN 101 N 3.47 -2.14 -4.11 -4.21 3.02 -1.26 -0.63 115.26 109.39 4gch n ASN 101 Ca -0.08 -0.36 -0.43 0.00 -0.03 0.00 0.00 54.58 53.67 4gch n ASN 101 Cb 0.52 -3.20 0.00 0.00 -0.61 0.00 0.00 39.78 36.49 4gch n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 4gch n ASP 102 N -2.25 5.02 -3.69 6.41 4.64 -1.26 -3.66 116.55 121.75 4gch n ASP 102 Ca -0.16 -3.03 -0.12 0.00 -1.38 0.00 0.00 54.79 50.09 4gch n ASP 102 Cb 0.60 -1.54 -0.13 0.00 -1.04 0.00 0.00 41.12 39.01 4gch n ASP 102 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 4gch s ILE 103 N 1.29 -0.22 -0.04 5.18 -1.16 -1.26 -3.38 121.20 121.61 4gch s ILE 103 Ca 0.42 0.20 0.00 0.00 -0.51 0.00 0.00 60.65 60.76 4gch s ILE 103 Cb 0.05 -0.44 0.03 0.00 0.61 0.00 0.00 42.46 42.71 4gch s ILE 103 CO 0.00 0.08 -0.01 -0.89 -2.81 0.00 0.00 174.94 171.32 4gch s THR 104 N 1.82 0.28 0.30 4.00 2.01 -0.73 -2.54 115.64 120.79 4gch s THR 104 Ca -0.05 0.07 -0.09 0.00 0.31 0.00 0.00 61.69 61.93 4gch s THR 104 Cb -0.11 -0.38 -0.07 0.00 0.01 0.00 0.00 72.50 71.95 4gch s THR 104 CO -0.09 0.19 0.63 -0.76 -0.69 0.00 0.00 174.62 173.90 4gch s LEU 105 N 1.25 4.04 -0.11 4.42 1.43 0.14 -1.44 118.68 128.41 4gch s LEU 105 Ca -0.06 0.96 -0.00 0.00 -1.03 0.00 0.00 54.13 53.99 4gch s LEU 105 Cb -0.13 -3.77 0.02 0.00 0.03 0.00 0.00 46.19 42.34 4gch s LEU 105 CO -0.02 -0.21 -0.09 -0.76 0.23 0.00 0.00 176.35 175.50 4gch s LEU 106 N -3.31 1.32 -0.21 1.79 1.43 0.02 -0.90 118.68 118.82 4gch s LEU 106 Ca 0.48 -0.34 -0.17 0.00 -1.03 0.00 0.00 54.13 53.08 4gch s LEU 106 Cb -0.11 -0.90 -0.03 0.00 0.03 0.00 0.00 46.19 45.18 4gch s LEU 106 CO 0.26 -0.09 0.46 -0.75 0.23 0.00 0.00 176.35 176.45 4gch s LYS 107 N 1.56 4.16 -0.11 1.70 2.47 -1.00 -0.50 119.74 128.02 4gch s LYS 107 Ca 0.03 0.29 -0.16 0.00 -1.56 0.00 0.00 55.97 54.57 4gch s LYS 107 Cb -0.13 -3.57 -0.05 0.00 -1.46 0.00 0.00 37.83 32.63 4gch s LYS 107 CO -0.07 -0.13 0.40 -0.51 0.16 0.00 0.00 175.35 175.20 4gch s LEU 108 N 1.58 4.30 0.24 5.43 1.43 -0.57 -0.24 118.68 130.86 4gch s LEU 108 Ca 0.21 0.74 0.10 0.00 -1.03 0.00 0.00 54.13 54.15 4gch s LEU 108 Cb -0.15 -2.56 0.23 0.00 0.03 0.00 0.00 46.19 43.74 4gch s LEU 108 CO 0.09 0.10 1.54 0.77 0.23 0.00 0.00 176.35 179.08 4gch h SER 109 N 6.30 0.00 -3.66 2.29 4.64 -1.55 -3.41 113.55 118.15 4gch h SER 109 Ca -0.43 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.20 4gch h SER 109 Cb 1.18 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.97 4gch h SER 109 CO 0.73 0.70 -0.68 -0.89 -0.87 0.00 0.00 176.83 175.82 4gch s THR 110 N -3.40 3.30 0.39 2.95 2.01 -1.26 -5.02 115.64 114.61 4gch s THR 110 Ca -0.01 -1.13 -0.26 0.00 0.31 0.00 0.00 61.69 60.60 4gch s THR 110 Cb 0.12 -2.81 -0.11 0.00 0.01 0.00 0.00 72.50 69.71 4gch s THR 110 CO 0.77 -0.02 1.20 0.00 -0.69 0.00 0.00 174.62 175.88 4gch n ALA 111 N 4.72 0.92 -1.82 7.40 0.00 -1.26 -4.79 120.51 125.68 4gch n ALA 111 Ca -0.14 0.29 -0.40 0.00 0.00 0.00 0.00 53.44 53.20 4gch n ALA 111 Cb 0.45 -2.20 -0.06 0.00 0.00 0.00 0.00 19.45 17.64 4gch n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 4gch s ALA 112 N -1.17 3.36 -0.51 0.00 0.00 -0.39 -4.99 121.76 118.06 4gch s ALA 112 Ca 0.60 0.54 -0.20 0.00 0.00 0.00 0.00 51.96 52.90 4gch s ALA 112 Cb -0.55 -3.14 0.05 0.00 0.00 0.00 0.00 23.12 19.48 4gch s ALA 112 CO 0.59 0.23 0.67 0.45 0.00 0.00 0.00 175.76 177.70 4gch s SER 113 N -1.21 6.25 0.65 0.00 0.15 -1.26 -4.87 113.70 113.40 4gch s SER 113 Ca 0.40 -0.78 -0.13 0.00 0.70 0.00 0.00 55.95 56.14 4gch s SER 113 Cb -0.25 -2.31 -0.01 0.00 -1.71 0.00 0.00 66.02 61.74 4gch s SER 113 CO 0.30 -0.92 1.06 -0.36 1.20 0.00 0.00 173.24 174.52 4gch s PHE 114 N 2.82 3.00 0.00 3.44 0.08 -1.26 -4.73 117.98 121.33 4gch s PHE 114 Ca 0.18 1.48 0.00 0.00 0.12 0.00 0.00 56.93 58.71 4gch s PHE 114 Cb -0.18 -2.97 0.00 0.00 -0.57 0.00 0.00 43.02 39.31 4gch s PHE 114 CO 0.14 -1.22 0.00 -1.13 -0.10 0.00 0.00 175.22 172.91 4gch n SER 115 N -2.56 0.00 0.21 1.36 3.41 -0.15 -4.90 113.62 111.00 4gch n SER 115 Ca 0.08 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.77 4gch n SER 115 Cb 0.53 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 64.94 4gch n SER 115 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 4gch h GLN 116 N 0.00 0.00 -0.01 4.33 5.75 -1.99 -3.22 115.11 119.98 4gch h GLN 116 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 4gch h GLN 116 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 4gch h GLN 116 CO 0.00 0.28 -0.05 0.25 -2.65 0.00 0.00 178.83 176.65 4gch n THR 117 N -3.57 0.00 -3.89 2.39 -2.24 -1.26 -4.94 114.28 100.77 4gch n THR 117 Ca -0.01 -0.47 -0.27 0.00 -2.27 0.00 0.00 64.05 61.03 4gch n THR 117 Cb 0.42 1.12 -0.17 0.00 -2.10 0.00 0.00 70.33 69.60 4gch n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 4gch s VAL 118 N -0.76 1.00 0.37 2.28 1.01 -1.22 -4.42 120.40 118.67 4gch s VAL 118 Ca 0.07 -0.33 -0.16 0.00 0.00 0.00 0.00 61.98 61.56 4gch s VAL 118 Cb 0.06 -1.06 0.06 0.00 0.00 0.00 0.00 36.38 35.43 4gch s VAL 118 CO 0.12 0.31 0.82 -0.94 0.00 0.00 0.00 175.10 175.40 4gch s SER 119 N 1.71 0.01 -0.03 3.32 1.04 -0.58 -0.97 113.70 118.20 4gch s SER 119 Ca 0.04 -1.12 -0.03 0.00 0.48 0.00 0.00 55.95 55.32 4gch s SER 119 Cb -0.13 0.82 -0.04 0.00 0.10 0.00 0.00 66.02 66.77 4gch s SER 119 CO -0.08 -1.64 0.13 0.00 0.98 0.00 0.00 173.24 172.64 4gch s ALA 120 N -2.24 3.80 0.55 5.32 0.00 -1.26 -3.46 121.76 124.47 4gch s ALA 120 Ca 0.16 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.36 4gch s ALA 120 Cb -0.05 -1.79 0.03 0.00 0.00 0.00 0.00 23.12 21.31 4gch s ALA 120 CO 0.11 0.70 0.78 0.54 0.00 0.00 0.00 175.76 177.88 4gch s VAL 121 N -1.20 2.69 -0.06 0.00 0.11 -0.63 -4.91 120.40 116.40 4gch s VAL 121 Ca 0.23 -0.65 -0.07 0.00 -2.93 0.00 0.00 61.98 58.56 4gch s VAL 121 Cb -0.12 -3.01 -0.04 0.00 -1.53 0.00 0.00 36.38 31.67 4gch s VAL 121 CO 0.13 -0.01 0.20 0.00 -3.33 0.00 0.00 175.10 172.10 4gch s LEU 123 N -1.41 4.44 0.77 0.00 1.43 -1.26 -5.10 118.68 117.54 4gch s LEU 123 Ca 0.21 1.25 -0.12 0.00 -1.03 0.00 0.00 54.13 54.45 4gch s LEU 123 Cb -0.13 -3.15 0.06 0.00 0.03 0.00 0.00 46.19 43.00 4gch s LEU 123 CO 0.11 0.18 1.14 -2.16 0.23 0.00 0.00 176.35 175.85 4gch s PRO 124 N -1.53 2.29 0.55 1.29 0.04 -1.26 -5.08 135.00 131.30 4gch s PRO 124 Ca 0.34 0.22 -0.15 0.00 0.04 0.00 0.00 61.00 61.46 4gch s PRO 124 Cb -0.18 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.31 4gch s PRO 124 CO 0.20 -1.38 1.00 -1.12 0.04 0.00 0.00 177.00 175.74 4gch s SER 125 N -4.50 6.48 0.55 6.66 0.01 -1.26 -4.89 113.70 116.75 4gch s SER 125 Ca 0.60 1.52 0.22 0.00 1.31 0.00 0.00 55.95 59.60 4gch s SER 125 Cb -0.11 -2.50 1.50 0.00 0.21 0.00 0.00 66.02 65.13 4gch s SER 125 CO 0.50 -0.69 2.18 0.00 0.41 0.00 0.00 173.24 175.64 4gch h ALA 126 N 0.48 1.75 -0.16 1.44 0.00 -2.05 0.13 119.26 120.84 4gch h ALA 126 Ca -0.46 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 4gch h ALA 126 Cb 1.19 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 4gch h ALA 126 CO 0.62 0.02 -0.20 0.66 0.00 0.00 0.00 179.25 180.35 4gch h SER 127 N 0.00 0.26 -1.48 0.00 4.64 -2.04 -3.46 113.55 111.47 4gch h SER 127 Ca -0.00 -0.07 -0.71 0.00 -0.47 0.00 0.00 61.79 60.54 4gch h SER 127 Cb 0.03 -0.07 0.06 0.00 -0.31 0.00 0.00 62.40 62.11 4gch h SER 127 CO 0.00 0.48 0.25 0.47 -0.87 0.00 0.00 176.83 177.17 4gch n ASP 128 N -4.20 0.94 -4.89 4.97 10.43 0.45 -4.98 116.55 119.25 4gch n ASP 128 Ca -0.01 1.14 -0.34 0.00 2.57 0.00 0.00 54.79 58.15 4gch n ASP 128 Cb 0.33 -1.10 -0.05 0.00 1.84 0.00 0.00 41.12 42.14 4gch n ASP 128 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 4gch s ASP 129 N 0.18 6.44 -0.39 -2.24 2.15 -1.26 -4.97 116.67 116.58 4gch s ASP 129 Ca 0.84 0.47 0.05 0.00 0.43 0.00 0.00 52.55 54.33 4gch s ASP 129 Cb -1.04 -2.05 0.18 0.00 -0.30 0.00 0.00 42.92 39.71 4gch s ASP 129 CO 0.51 0.25 0.70 -0.36 -0.17 0.00 0.00 175.17 176.10 4gch s PHE 130 N -1.33 -1.50 0.34 -5.34 0.40 -1.26 -5.12 117.98 104.17 4gch s PHE 130 Ca 0.28 0.25 -0.29 0.00 -0.60 0.00 0.00 56.93 56.57 4gch s PHE 130 Cb -0.13 0.28 -0.11 0.00 0.51 0.00 0.00 43.02 43.56 4gch s PHE 130 CO 0.18 -1.01 1.52 0.00 0.70 0.00 0.00 175.22 176.60 4gch n ALA 131 N 4.33 2.39 -1.92 5.36 0.00 -1.26 -5.01 120.51 124.39 4gch n ALA 131 Ca 0.10 0.35 -0.42 0.00 0.00 0.00 0.00 53.44 53.47 4gch n ALA 131 Cb 0.58 -2.43 -0.03 0.00 0.00 0.00 0.00 19.45 17.57 4gch n ALA 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 4gch s ALA 132 N -0.68 3.78 0.00 0.00 0.00 -1.26 -1.91 121.76 121.69 4gch s ALA 132 Ca 0.57 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.91 4gch s ALA 132 Cb -0.49 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.01 4gch s ALA 132 CO 0.58 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.96 4gch n GLY 133 N 3.69 1.92 3.70 0.00 0.00 -1.26 -5.07 105.19 108.17 4gch n GLY 133 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 4gch n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4gch s THR 134 N -1.99 2.48 -0.13 2.61 2.01 -0.80 -4.96 115.64 114.86 4gch s THR 134 Ca 0.00 0.11 -0.24 0.00 0.31 0.00 0.00 61.69 61.87 4gch s THR 134 Cb 0.00 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.41 4gch s THR 134 CO 0.00 0.00 0.74 -0.89 -0.69 0.00 0.00 174.62 173.78 4gch s THR 135 N 2.30 4.97 0.23 -0.82 2.01 -1.26 -5.03 115.64 118.03 4gch s THR 135 Ca 0.78 1.47 0.02 0.00 0.31 0.00 0.00 61.69 64.27 4gch s THR 135 Cb -0.46 -4.06 -0.01 0.00 0.01 0.00 0.00 72.50 67.98 4gch s THR 135 CO 0.35 0.13 0.06 0.00 -0.69 0.00 0.00 174.62 174.47 4gch s VAL 137 N -2.28 -0.03 0.04 0.00 1.01 -1.26 -5.16 120.40 112.73 4gch s VAL 137 Ca 0.09 0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.23 4gch s VAL 137 Cb 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 36.38 36.17 4gch s VAL 137 CO 0.06 0.04 -0.21 0.28 0.00 0.00 0.00 175.10 175.28 4gch s THR 138 N 0.61 1.65 0.28 3.92 -1.32 -1.26 -5.15 115.64 114.38 4gch s THR 138 Ca -0.05 -1.17 0.02 0.00 -1.21 0.00 0.00 61.69 59.29 4gch s THR 138 Cb -0.06 -1.43 -0.05 0.00 -1.51 0.00 0.00 72.50 69.44 4gch s THR 138 CO -0.03 0.22 0.09 0.42 -2.21 0.00 0.00 174.62 173.11 4gch s THR 139 N -0.77 0.73 -5.00 5.08 -4.23 -1.26 -5.10 115.64 105.09 4gch s THR 139 Ca 0.07 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 4gch s THR 139 Cb -0.09 -2.68 0.00 0.00 1.34 0.00 0.00 72.50 71.07 4gch s THR 139 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 4gch n GLY 140 N -0.54 0.74 1.45 3.99 0.00 -1.26 -4.97 105.19 104.60 4gch n GLY 140 Ca -0.01 -1.89 -0.03 0.00 0.00 0.00 0.00 46.02 44.09 4gch n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 4gch n TRP 141 N -0.13 1.67 -1.35 1.61 8.01 -1.26 -4.85 117.44 121.14 4gch n TRP 141 Ca 0.00 -1.30 -0.30 0.00 -1.31 0.00 0.00 57.50 54.59 4gch n TRP 141 Cb 0.00 -0.55 0.11 0.00 -2.01 0.00 0.00 31.31 28.86 4gch n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 4gch s GLY 142 N -1.79 1.63 -0.06 6.99 0.00 -1.26 -4.95 107.32 107.88 4gch s GLY 142 Ca 0.48 -0.07 -0.40 0.00 0.00 0.00 0.00 44.72 44.74 4gch s GLY 142 CO 0.08 0.37 1.27 1.04 0.00 0.00 0.00 173.10 175.86 4gch n LEU 143 N -3.64 0.84 -0.32 0.66 4.77 -1.26 -3.73 117.00 114.32 4gch n LEU 143 Ca 0.07 1.14 0.11 0.00 -0.03 0.00 0.00 56.01 57.31 4gch n LEU 143 Cb 0.55 -1.02 0.07 0.00 -2.33 0.00 0.00 43.42 40.70 4gch n LEU 143 CO 0.56 -1.40 0.32 0.35 -1.33 0.00 0.00 177.39 175.89 4gch n THR 144 N 2.36 0.00 -3.64 -5.08 -2.24 -1.26 -1.07 114.28 103.34 4gch n THR 144 Ca 0.21 -0.17 -0.10 0.00 -2.27 0.00 0.00 64.05 61.72 4gch n THR 144 Cb 0.10 0.96 -0.07 0.00 -2.10 0.00 0.00 70.33 69.22 4gch n THR 144 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 4gch s ARG 145 N -2.62 0.73 0.00 -0.78 3.52 -1.26 -4.09 118.95 114.46 4gch s ARG 145 Ca 0.17 1.08 0.24 0.00 -0.13 0.00 0.00 55.73 57.10 4gch s ARG 145 Cb 0.18 0.24 0.27 0.00 -1.56 0.00 0.00 34.95 34.08 4gch s ARG 145 CO 0.63 -0.13 1.30 0.98 -0.81 0.00 0.00 175.30 177.27