#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gpq s PRO 2 N 0.00 4.27 0.32 0.00 0.04 -1.26 -5.02 135.00 133.36 3gpq s PRO 2 Ca 0.00 2.34 0.08 0.00 0.04 0.00 0.00 61.00 63.46 3gpq s PRO 2 Cb 0.00 -3.04 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 3gpq s PRO 2 CO 0.00 -0.31 0.11 -1.54 0.04 0.00 0.00 177.00 175.30 3gpq s SER 3 N -0.33 4.65 -0.10 6.66 1.04 -1.26 -4.94 113.70 119.42 3gpq s SER 3 Ca 0.51 -0.75 -0.02 0.00 0.48 0.00 0.00 55.95 56.17 3gpq s SER 3 Cb -0.42 -0.76 -0.03 0.00 0.10 0.00 0.00 66.02 64.91 3gpq s SER 3 CO 0.56 -0.23 -0.00 -0.31 0.98 0.00 0.00 173.24 174.23 3gpq s TYR 4 N -2.40 3.13 0.11 5.02 1.51 -1.26 -0.82 117.35 122.64 3gpq s TYR 4 Ca 0.36 0.12 -0.00 0.00 -1.01 0.00 0.00 57.07 56.54 3gpq s TYR 4 Cb -0.03 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 3gpq s TYR 4 CO 0.22 0.38 0.01 1.03 -1.11 0.00 0.00 175.55 176.08 3gpq s ARG 5 N -0.66 0.85 -0.01 -0.62 0.52 -0.39 -4.98 118.95 113.65 3gpq s ARG 5 Ca 0.11 -1.38 0.04 0.00 -0.52 0.00 0.00 55.73 53.98 3gpq s ARG 5 Cb -0.12 0.10 -0.01 0.00 0.52 0.00 0.00 34.95 35.44 3gpq s ARG 5 CO 0.02 -0.17 -0.14 0.54 0.02 0.00 0.00 175.30 175.58 3gpq s VAL 6 N -3.90 1.11 -0.03 3.52 0.11 -1.26 -0.42 120.40 119.54 3gpq s VAL 6 Ca 0.17 -0.59 0.03 0.00 -2.93 0.00 0.00 61.98 58.66 3gpq s VAL 6 Cb 0.07 -0.93 0.00 0.00 -1.53 0.00 0.00 36.38 33.99 3gpq s VAL 6 CO -0.02 0.32 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.41 3gpq s LYS 7 N -0.28 1.18 -0.83 1.54 1.02 -0.55 -4.92 119.74 116.90 3gpq s LYS 7 Ca 0.04 -0.40 -0.13 0.00 0.02 0.00 0.00 55.97 55.50 3gpq s LYS 7 Cb -0.06 -1.08 0.22 0.00 -0.52 0.00 0.00 37.83 36.39 3gpq s LYS 7 CO -0.00 0.17 0.76 0.50 -0.92 0.00 0.00 175.35 175.85 3gpq s ARG 8 N 0.10 3.57 0.14 1.68 3.52 -1.26 -2.13 118.95 124.57 3gpq s ARG 8 Ca -0.02 -2.49 -0.24 0.00 -0.13 0.00 0.00 55.73 52.84 3gpq s ARG 8 Cb -0.09 -4.40 0.08 0.00 -1.56 0.00 0.00 34.95 28.98 3gpq s ARG 8 CO 0.01 -1.28 1.08 0.00 -0.81 0.00 0.00 175.30 174.30 3gpq s MET 9 N 0.10 1.10 -0.04 5.12 0.23 -0.62 -4.92 119.30 120.27 3gpq s MET 9 Ca 0.18 -0.69 -0.30 0.00 -1.03 0.00 0.00 55.69 53.86 3gpq s MET 9 Cb -0.10 0.32 -0.07 0.00 -1.53 0.00 0.00 34.83 33.45 3gpq s MET 9 CO -0.09 -0.51 1.80 0.34 -2.03 0.00 0.00 175.02 174.53 3gpq s ASP 10 N -3.36 6.50 0.60 -1.18 -1.08 -1.26 -4.47 116.67 112.42 3gpq s ASP 10 Ca 0.21 2.34 0.35 0.00 -0.52 0.00 0.00 52.55 54.93 3gpq s ASP 10 Cb -0.02 -2.53 1.92 0.00 -1.46 0.00 0.00 42.92 40.84 3gpq s ASP 10 CO 0.03 -1.05 2.23 -0.29 0.52 0.00 0.00 175.17 176.61 3gpq h ILE 11 N 5.72 0.29 0.00 4.11 2.10 -1.96 -0.98 117.51 126.78 3gpq h ILE 11 Ca -0.43 -0.18 -0.00 0.00 1.08 0.00 0.00 64.86 65.33 3gpq h ILE 11 Cb 1.20 1.13 -0.00 0.00 -1.09 0.00 0.00 36.82 38.06 3gpq h ILE 11 CO 0.95 0.03 -0.00 0.00 -1.08 0.00 0.00 178.15 178.05 3gpq h ALA 12 N 1.97 1.03 -0.47 0.18 0.00 -1.90 -1.75 119.26 118.33 3gpq h ALA 12 Ca -0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3gpq h ALA 12 Cb 0.13 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3gpq h ALA 12 CO 0.00 0.00 0.05 1.63 0.00 0.00 0.00 179.25 180.93 3gpq n LYS 13 N -3.12 3.68 -1.26 0.00 5.02 -0.37 -5.02 118.16 117.09 3gpq n LYS 13 Ca -0.03 -3.03 -0.34 0.00 -2.02 0.00 0.00 58.31 52.89 3gpq n LYS 13 Cb 0.08 -2.06 0.11 0.00 -0.02 0.00 0.00 35.03 33.14 3gpq n LYS 13 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3gpq s ASN 14 N -1.42 3.84 -0.27 4.39 2.20 -0.66 -4.94 114.94 118.08 3gpq s ASN 14 Ca 0.49 2.41 0.09 0.00 -0.94 0.00 0.00 52.86 54.91 3gpq s ASN 14 Cb 0.39 -2.59 0.46 0.00 -2.00 0.00 0.00 41.25 37.51 3gpq s ASN 14 CO 0.12 -2.50 1.35 -0.67 -2.94 0.00 0.00 177.10 172.45 3gpq n ASP 15 N -2.99 2.73 -4.94 3.54 2.03 -1.26 -5.03 116.55 110.63 3gpq n ASP 15 Ca 0.14 -3.84 -0.20 0.00 0.52 0.00 0.00 54.79 51.41 3gpq n ASP 15 Cb 0.50 -0.56 0.05 0.00 -0.72 0.00 0.00 41.12 40.39 3gpq n ASP 15 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3gpq s GLU 16 N -3.33 2.35 0.18 -0.67 8.01 -1.26 -5.02 118.70 118.97 3gpq s GLU 16 Ca 0.44 -1.25 0.25 0.00 0.01 0.00 0.00 54.97 54.42 3gpq s GLU 16 Cb 0.40 -2.57 0.90 0.00 -4.31 0.00 0.00 34.13 28.54 3gpq s GLU 16 CO -0.02 -0.81 1.76 0.39 0.01 0.00 0.00 175.26 176.59 3gpq n GLU 17 N -2.29 0.20 -3.77 1.61 1.02 -1.18 -4.87 120.64 111.35 3gpq n GLU 17 Ca 0.12 0.24 -0.06 0.00 -0.02 0.00 0.00 57.16 57.44 3gpq n GLU 17 Cb 0.60 -1.77 -0.02 0.00 -0.02 0.00 0.00 31.44 30.24 3gpq n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3gpq s VAL 19 N -3.65 1.03 -0.25 0.00 0.11 -0.96 -1.38 120.40 115.30 3gpq s VAL 19 Ca 0.10 -0.99 -0.10 0.00 -2.93 0.00 0.00 61.98 58.06 3gpq s VAL 19 Cb -0.04 -0.95 -0.05 0.00 -1.53 0.00 0.00 36.38 33.82 3gpq s VAL 19 CO 0.03 -0.04 0.16 -0.69 -3.33 0.00 0.00 175.10 171.23 3gpq s VAL 20 N -0.89 5.22 0.04 2.04 1.01 0.04 -0.50 120.40 127.36 3gpq s VAL 20 Ca 0.00 0.14 -0.23 0.00 0.00 0.00 0.00 61.98 61.89 3gpq s VAL 20 Cb -0.08 -3.45 -0.06 0.00 0.00 0.00 0.00 36.38 32.79 3gpq s VAL 20 CO 0.01 0.32 0.68 0.21 0.00 0.00 0.00 175.10 176.32 3gpq s ASN 21 N 1.31 7.12 -1.24 3.32 2.47 0.99 -4.48 114.94 124.43 3gpq s ASN 21 Ca 0.07 1.33 -0.19 0.00 0.42 0.00 0.00 52.86 54.49 3gpq s ASN 21 Cb -0.14 -2.42 0.05 0.00 -1.45 0.00 0.00 41.25 37.29 3gpq s ASN 21 CO 0.06 0.10 1.72 0.00 -3.72 0.00 0.00 177.10 175.26 3gpq s ALA 22 N -0.33 3.07 0.66 1.71 0.00 -1.26 -0.81 121.76 124.81 3gpq s ALA 22 Ca 0.34 -2.74 -0.02 0.00 0.00 0.00 0.00 51.96 49.55 3gpq s ALA 22 Cb -0.20 -4.63 0.08 0.00 0.00 0.00 0.00 23.12 18.37 3gpq s ALA 22 CO 0.20 -3.54 0.93 0.00 0.00 0.00 0.00 175.76 173.35 3gpq s ALA 23 N 5.03 3.63 0.32 0.00 0.00 0.34 -4.28 121.76 126.80 3gpq s ALA 23 Ca 0.54 -1.43 0.08 0.00 0.00 0.00 0.00 51.96 51.16 3gpq s ALA 23 Cb 0.03 -2.16 -0.04 0.00 0.00 0.00 0.00 23.12 20.95 3gpq s ALA 23 CO 0.06 -1.21 0.15 0.54 0.00 0.00 0.00 175.76 175.30 3gpq s ASN 24 N -4.59 4.87 0.00 0.00 2.20 -1.26 -4.32 114.94 111.83 3gpq s ASN 24 Ca 0.62 -0.64 0.18 0.00 -0.94 0.00 0.00 52.86 52.08 3gpq s ASN 24 Cb -0.08 -0.87 0.94 0.00 -2.00 0.00 0.00 41.25 39.24 3gpq s ASN 24 CO 0.43 -0.23 1.54 -0.81 -2.94 0.00 0.00 177.10 175.09 3gpq n PRO 25 N -1.15 0.30 -0.07 3.55 -0.04 -1.26 -2.69 135.00 133.64 3gpq n PRO 25 Ca -0.04 0.10 0.12 0.00 -0.04 0.00 0.00 63.50 63.64 3gpq n PRO 25 Cb 0.60 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.70 3gpq n PRO 25 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3gpq n ARG 26 N -1.25 2.31 -2.38 0.54 5.12 -1.26 -3.65 116.66 116.09 3gpq n ARG 26 Ca 0.09 -2.02 -0.20 0.00 -1.93 0.00 0.00 57.85 53.79 3gpq n ARG 26 Cb 0.13 -1.46 -0.01 0.00 -1.16 0.00 0.00 32.46 29.96 3gpq n ARG 26 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3gpq n GLY 27 N 1.36 -0.44 3.92 -0.13 0.00 -1.10 -4.68 105.19 104.12 3gpq n GLY 27 Ca 0.15 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 3gpq n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gpq s LEU 28 N -5.79 4.20 0.56 0.99 1.43 -1.26 -4.69 118.68 114.11 3gpq s LEU 28 Ca 0.00 0.02 -0.21 0.00 -1.03 0.00 0.00 54.13 52.92 3gpq s LEU 28 Cb 0.00 -2.75 -0.04 0.00 0.03 0.00 0.00 46.19 43.43 3gpq s LEU 28 CO 0.00 -0.02 1.32 -2.84 0.23 0.00 0.00 176.35 175.04 3gpq s PRO 29 N -3.70 3.05 0.00 1.29 0.02 -1.26 -4.71 135.00 129.70 3gpq s PRO 29 Ca 0.34 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.50 3gpq s PRO 29 Cb -0.09 -2.16 0.00 0.00 0.02 0.00 0.00 34.50 32.27 3gpq s PRO 29 CO 0.28 -1.23 0.00 0.41 -0.33 0.00 0.00 177.00 176.13 3gpq n GLY 30 N 0.72 4.04 3.98 0.52 0.00 -1.26 -5.01 105.19 108.19 3gpq n GLY 30 Ca 0.11 -1.04 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 3gpq n GLY 30 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gpq s ASP 31 N 1.54 6.06 1.34 1.61 -0.00 -1.26 -2.76 116.67 123.20 3gpq s ASP 31 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 52.55 52.48 3gpq s ASP 31 Cb 0.00 -1.43 0.00 0.00 -0.00 0.00 0.00 42.92 41.49 3gpq s ASP 31 CO 0.00 -0.36 0.00 0.61 -0.00 0.00 0.00 175.17 175.42 3gpq n GLY 32 N -1.63 2.00 0.23 0.21 0.00 -1.26 -3.25 105.19 101.50 3gpq n GLY 32 Ca -0.02 -0.43 -0.00 0.00 0.00 0.00 0.00 46.02 45.57 3gpq n GLY 32 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3gpq h VAL 33 N 0.00 0.71 -0.73 1.61 2.07 -1.93 -2.28 116.25 115.69 3gpq h VAL 33 Ca 0.00 -0.11 0.09 0.00 0.82 0.00 0.00 66.70 67.50 3gpq h VAL 33 Cb 0.00 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.08 3gpq h VAL 33 CO 0.00 0.06 0.48 0.00 0.02 0.00 0.00 177.57 178.13 3gpq h LYS 35 N 0.65 -0.26 -0.60 0.00 3.64 -1.22 0.22 116.57 119.01 3gpq h LYS 35 Ca 0.33 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 3gpq h LYS 35 Cb 0.43 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.28 3gpq h LYS 35 CO -0.12 -0.17 0.38 0.00 -2.27 0.00 0.00 179.45 177.28 3gpq h ALA 36 N 0.56 0.76 -0.29 5.00 0.00 -1.20 -1.93 119.26 122.15 3gpq h ALA 36 Ca -0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3gpq h ALA 36 Cb 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3gpq h ALA 36 CO 0.02 0.21 0.07 0.28 0.00 0.00 0.00 179.25 179.83 3gpq h VAL 37 N 0.81 1.21 -0.87 0.00 2.07 -0.79 -2.26 116.25 116.41 3gpq h VAL 37 Ca 0.22 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3gpq h VAL 37 Cb -0.07 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 3gpq h VAL 37 CO -0.05 0.23 0.55 0.22 0.02 0.00 0.00 177.57 178.54 3gpq h TYR 38 N 0.30 1.13 -0.62 1.57 3.20 -0.78 0.22 116.97 121.99 3gpq h TYR 38 Ca 0.09 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 3gpq h TYR 38 Cb 0.28 -0.38 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 3gpq h TYR 38 CO 0.01 0.74 0.23 0.87 -1.64 0.00 0.00 178.16 178.37 3gpq h LYS 39 N 1.20 0.94 0.13 1.82 1.57 -1.08 -2.69 116.57 118.46 3gpq h LYS 39 Ca 0.32 -0.18 -0.31 0.00 -1.87 0.00 0.00 60.65 58.61 3gpq h LYS 39 Cb -0.09 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.08 3gpq h LYS 39 CO -0.06 0.80 -1.50 -0.22 -0.57 0.00 0.00 179.45 177.90 3gpq h LYS 40 N 0.87 0.28 -2.02 3.15 1.63 -1.11 -3.41 116.57 115.96 3gpq h LYS 40 Ca 0.21 -0.48 -0.51 0.00 -0.85 0.00 0.00 60.65 59.02 3gpq h LYS 40 Cb 0.23 0.18 -0.41 0.00 -0.60 0.00 0.00 32.23 31.63 3gpq h LYS 40 CO -0.01 1.16 -1.01 0.91 -3.45 0.00 0.00 179.45 177.04 3gpq n TRP 41 N -3.49 1.52 -0.32 1.91 8.01 0.75 -4.96 117.44 120.86 3gpq n TRP 41 Ca -0.16 -3.80 0.02 0.00 -1.31 0.00 0.00 57.50 52.25 3gpq n TRP 41 Cb 1.05 -0.43 0.16 0.00 -2.01 0.00 0.00 31.31 30.07 3gpq n TRP 41 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 3gpq h PRO 42 N 2.98 0.95 0.00 -0.99 0.13 -1.65 -0.25 132.00 133.17 3gpq h PRO 42 Ca 0.10 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 3gpq h PRO 42 Cb 0.83 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 31.75 3gpq h PRO 42 CO 0.61 0.63 0.07 0.93 -0.23 0.00 0.00 178.00 180.00 3gpq h GLU 43 N 0.97 0.00 0.00 0.86 3.07 -1.93 -0.97 114.58 116.59 3gpq h GLU 43 Ca 0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 3gpq h GLU 43 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 3gpq h GLU 43 CO -0.19 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.29 3gpq n SER 44 N -2.34 0.00 -1.13 1.42 3.41 -0.11 -3.23 113.62 111.65 3gpq n SER 44 Ca -0.02 -0.22 0.09 0.00 -0.26 0.00 0.00 58.87 58.46 3gpq n SER 44 Cb 0.11 -0.23 0.26 0.00 -0.26 0.00 0.00 64.21 64.08 3gpq n SER 44 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3gpq n PHE 45 N -1.23 0.89 -2.25 7.33 3.72 -0.37 -4.59 117.46 120.95 3gpq n PHE 45 Ca 0.14 -0.41 -0.43 0.00 -0.05 0.00 0.00 57.45 56.70 3gpq n PHE 45 Cb 0.19 -0.06 -0.02 0.00 -0.94 0.00 0.00 39.48 38.64 3gpq n PHE 45 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3gpq s LYS 46 N -1.40 3.75 -1.42 -1.08 2.47 -1.20 -3.59 119.74 117.27 3gpq s LYS 46 Ca 0.39 1.36 -0.07 0.00 -1.56 0.00 0.00 55.97 56.08 3gpq s LYS 46 Cb 0.22 -4.00 0.01 0.00 -1.46 0.00 0.00 37.83 32.60 3gpq s LYS 46 CO 0.24 -1.34 0.31 0.09 0.16 0.00 0.00 175.35 174.80 3gpq n ASN 47 N 8.42 -0.74 -0.42 1.43 3.02 -1.26 -4.86 115.26 120.84 3gpq n ASN 47 Ca 0.17 -1.17 0.13 0.00 -0.03 0.00 0.00 54.58 53.68 3gpq n ASN 47 Cb 0.46 -2.24 0.31 0.00 -0.61 0.00 0.00 39.78 37.71 3gpq n ASN 47 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3gpq n SER 48 N -2.79 1.53 -4.75 6.41 3.41 -1.24 -4.95 113.62 111.24 3gpq n SER 48 Ca -0.27 -1.27 -0.41 0.00 -0.26 0.00 0.00 58.87 56.66 3gpq n SER 48 Cb 0.67 0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 64.75 3gpq n SER 48 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gpq s ALA 49 N -2.33 3.69 -0.08 7.33 0.00 -1.26 -4.64 121.76 124.46 3gpq s ALA 49 Ca 0.27 1.46 -0.25 0.00 0.00 0.00 0.00 51.96 53.44 3gpq s ALA 49 Cb 0.19 -3.60 0.06 0.00 0.00 0.00 0.00 23.12 19.77 3gpq s ALA 49 CO 0.46 -0.87 0.57 -0.08 0.00 0.00 0.00 175.76 175.84 3gpq s THR 50 N -0.04 0.01 0.72 0.00 -1.32 -1.24 -4.91 115.64 108.86 3gpq s THR 50 Ca 0.61 -0.12 -0.13 0.00 -1.21 0.00 0.00 61.69 60.84 3gpq s THR 50 Cb -0.45 -0.86 0.03 0.00 -1.51 0.00 0.00 72.50 69.71 3gpq s THR 50 CO 0.46 -0.06 1.11 -2.84 -2.21 0.00 0.00 174.62 171.08 3gpq s PRO 51 N -0.86 2.48 0.24 7.08 0.02 -1.26 -4.15 135.00 138.54 3gpq s PRO 51 Ca -0.09 1.33 -0.29 0.00 0.02 0.00 0.00 61.00 61.96 3gpq s PRO 51 Cb -0.02 -1.91 -0.15 0.00 0.02 0.00 0.00 34.50 32.43 3gpq s PRO 51 CO 0.06 -1.49 0.89 0.28 -0.33 0.00 0.00 177.00 176.41 3gpq n VAL 52 N -2.95 1.77 -1.01 3.83 0.31 -1.26 -2.13 118.33 116.89 3gpq n VAL 52 Ca 0.10 -0.44 -0.00 0.00 -0.01 0.00 0.00 64.34 63.98 3gpq n VAL 52 Cb 0.52 -0.64 -0.00 0.00 -0.91 0.00 0.00 33.84 32.81 3gpq n VAL 52 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gpq n GLY 53 N 1.59 0.47 3.37 2.92 0.00 0.31 -5.00 105.19 108.85 3gpq n GLY 53 Ca 0.13 -0.44 -0.19 0.00 0.00 0.00 0.00 46.02 45.52 3gpq n GLY 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gpq s THR 54 N -1.99 0.69 0.01 2.61 -4.23 -0.90 -3.36 115.64 108.46 3gpq s THR 54 Ca 0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 3gpq s THR 54 Cb 0.00 -2.63 -0.01 0.00 1.34 0.00 0.00 72.50 71.20 3gpq s THR 54 CO 0.00 0.00 -0.03 0.00 -0.54 0.00 0.00 174.62 174.05 3gpq s ALA 55 N -3.56 0.20 -0.03 3.99 0.00 -1.26 -1.77 121.76 119.34 3gpq s ALA 55 Ca 0.36 -0.36 -0.00 0.00 0.00 0.00 0.00 51.96 51.95 3gpq s ALA 55 Cb 0.07 0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.26 3gpq s ALA 55 CO 0.15 -0.04 0.02 0.21 0.00 0.00 0.00 175.76 176.10 3gpq s LYS 56 N -0.77 0.10 -0.11 0.00 2.20 0.22 -4.94 119.74 116.45 3gpq s LYS 56 Ca -0.07 0.18 -0.17 0.00 -0.36 0.00 0.00 55.97 55.56 3gpq s LYS 56 Cb -0.05 -0.42 -0.05 0.00 -1.51 0.00 0.00 37.83 35.81 3gpq s LYS 56 CO -0.00 -0.20 0.42 0.99 -0.36 0.00 0.00 175.35 176.20 3gpq s THR 57 N 1.31 5.18 -0.10 3.43 2.01 -1.26 -0.31 115.64 125.91 3gpq s THR 57 Ca -0.06 0.84 0.02 0.00 0.31 0.00 0.00 61.69 62.80 3gpq s THR 57 Cb -0.13 -3.76 0.01 0.00 0.01 0.00 0.00 72.50 68.64 3gpq s THR 57 CO -0.03 0.39 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.46 3gpq s VAL 58 N 0.27 1.40 0.14 3.82 1.01 -0.30 -4.97 120.40 121.77 3gpq s VAL 58 Ca 0.23 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 3gpq s VAL 58 Cb -0.15 -1.28 -0.07 0.00 0.00 0.00 0.00 36.38 34.88 3gpq s VAL 58 CO 0.09 0.42 1.16 -0.04 0.00 0.00 0.00 175.10 176.73 3gpq s MET 59 N 0.89 4.51 -0.46 2.72 -1.94 -1.26 -1.48 119.30 122.29 3gpq s MET 59 Ca -0.09 1.77 -0.08 0.00 -1.71 0.00 0.00 55.69 55.58 3gpq s MET 59 Cb -0.15 -3.29 0.12 0.00 2.01 0.00 0.00 34.83 33.51 3gpq s MET 59 CO 0.00 -0.08 0.32 0.00 -0.01 0.00 0.00 175.02 175.25 3gpq n GLY 61 N 4.84 3.03 0.81 0.00 0.00 -1.26 -0.54 105.19 112.06 3gpq n GLY 61 Ca -0.07 -0.09 0.09 0.00 0.00 0.00 0.00 46.02 45.96 3gpq n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gpq n THR 62 N 0.00 0.36 -2.97 2.61 -2.24 -1.26 -4.97 114.28 105.81 3gpq n THR 62 Ca 0.00 -0.68 -0.42 0.00 -2.27 0.00 0.00 64.05 60.68 3gpq n THR 62 Cb 0.00 1.05 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 3gpq n THR 62 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3gpq s TYR 63 N -1.29 3.24 0.05 4.78 5.04 0.29 -5.03 117.35 124.44 3gpq s TYR 63 Ca 0.26 0.88 -0.26 0.00 -2.44 0.00 0.00 57.07 55.51 3gpq s TYR 63 Cb 0.16 -3.11 -0.05 0.00 0.35 0.00 0.00 41.96 39.31 3gpq s TYR 63 CO 0.23 -0.48 0.81 -2.14 -1.34 0.00 0.00 175.55 172.62 3gpq s PRO 64 N 2.84 4.53 -0.27 4.97 0.02 -1.26 0.56 135.00 146.39 3gpq s PRO 64 Ca 0.32 1.14 -0.03 0.00 0.02 0.00 0.00 61.00 62.45 3gpq s PRO 64 Cb -0.15 -3.37 0.03 0.00 0.02 0.00 0.00 34.50 31.03 3gpq s PRO 64 CO 0.11 0.25 -0.02 0.08 -0.33 0.00 0.00 177.00 177.09 3gpq s VAL 65 N 0.02 3.13 -0.49 3.83 1.01 -0.55 -2.26 120.40 125.09 3gpq s VAL 65 Ca 0.40 -1.00 -0.19 0.00 0.00 0.00 0.00 61.98 61.19 3gpq s VAL 65 Cb -0.21 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.60 3gpq s VAL 65 CO 0.24 0.13 0.59 -0.63 0.00 0.00 0.00 175.10 175.43 3gpq s ILE 66 N 1.35 4.92 -0.50 2.22 1.01 0.35 -1.15 121.20 129.40 3gpq s ILE 66 Ca -0.00 -0.47 -0.24 0.00 0.00 0.00 0.00 60.65 59.93 3gpq s ILE 66 Cb -0.17 -4.25 0.03 0.00 0.01 0.00 0.00 42.46 38.08 3gpq s ILE 66 CO -0.02 -0.73 0.90 -1.00 0.00 0.00 0.00 174.94 174.09 3gpq s HIS 67 N 2.51 2.88 -0.20 3.97 3.76 0.57 -0.00 115.29 128.78 3gpq s HIS 67 Ca 0.14 0.15 -0.05 0.00 -0.15 0.00 0.00 55.06 55.16 3gpq s HIS 67 Cb -0.19 -3.96 -0.02 0.00 1.11 0.00 0.00 32.58 29.52 3gpq s HIS 67 CO 0.12 -1.19 -0.01 0.00 -0.85 0.00 0.00 174.74 172.81 3gpq s ALA 68 N 3.74 2.98 -0.58 -1.40 0.00 0.01 -0.61 121.76 125.91 3gpq s ALA 68 Ca 0.32 -1.02 -0.12 0.00 0.00 0.00 0.00 51.96 51.14 3gpq s ALA 68 Cb -0.12 -1.75 0.15 0.00 0.00 0.00 0.00 23.12 21.40 3gpq s ALA 68 CO 0.22 -0.20 0.49 0.08 0.00 0.00 0.00 175.76 176.36 3gpq s VAL 69 N 1.08 4.79 0.57 0.00 1.01 -0.73 -0.50 120.40 126.64 3gpq s VAL 69 Ca 0.02 -1.94 -0.12 0.00 0.00 0.00 0.00 61.98 59.94 3gpq s VAL 69 Cb -0.14 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 3gpq s VAL 69 CO 0.01 -0.87 0.99 -0.83 0.00 0.00 0.00 175.10 174.40 3gpq s GLY 70 N 2.70 1.75 0.51 4.51 0.00 -1.26 -0.53 107.32 115.01 3gpq s GLY 70 Ca 0.08 -0.07 -0.21 0.00 0.00 0.00 0.00 44.72 44.52 3gpq s GLY 70 CO -0.01 0.19 1.17 2.56 0.00 0.00 0.00 173.10 177.00 3gpq s PRO 71 N -4.83 3.46 -0.44 2.90 0.04 -1.26 -4.77 135.00 130.10 3gpq s PRO 71 Ca 0.55 1.75 -0.24 0.00 0.04 0.00 0.00 61.00 63.09 3gpq s PRO 71 Cb -0.11 -2.18 0.02 0.00 0.04 0.00 0.00 34.50 32.28 3gpq s PRO 71 CO 0.47 -0.79 0.86 1.21 0.04 0.00 0.00 177.00 178.79 3gpq s ASN 72 N -1.53 6.49 0.06 6.66 3.84 -1.26 -4.61 114.94 124.59 3gpq s ASN 72 Ca 0.69 0.11 0.09 0.00 0.21 0.00 0.00 52.86 53.97 3gpq s ASN 72 Cb -0.28 -2.42 0.42 0.00 -0.55 0.00 0.00 41.25 38.42 3gpq s ASN 72 CO 0.32 -0.94 1.29 0.49 -2.79 0.00 0.00 177.10 175.46 3gpq n PHE 73 N 6.87 0.16 0.24 0.43 3.72 -0.18 0.01 117.46 128.72 3gpq n PHE 73 Ca 0.04 0.07 0.09 0.00 -0.05 0.00 0.00 57.45 57.61 3gpq n PHE 73 Cb 0.48 -0.62 0.62 0.00 -0.94 0.00 0.00 39.48 39.03 3gpq n PHE 73 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3gpq h SER 74 N 0.00 0.00 0.63 4.37 0.02 -1.87 -3.19 113.55 113.51 3gpq h SER 74 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3gpq h SER 74 Cb 0.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.65 3gpq h SER 74 CO 0.00 0.15 -0.87 0.59 -1.14 0.00 0.00 176.83 175.57 3gpq n ASN 75 N -3.98 0.65 -4.36 3.07 3.02 0.10 -4.99 115.26 108.78 3gpq n ASN 75 Ca -0.02 -0.04 -0.29 0.00 -0.03 0.00 0.00 54.58 54.20 3gpq n ASN 75 Cb 0.24 0.53 -0.14 0.00 -0.61 0.00 0.00 39.78 39.80 3gpq n ASN 75 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3gpq s TYR 76 N -3.20 2.26 1.06 3.10 2.02 -1.20 -5.07 117.35 116.33 3gpq s TYR 76 Ca 0.04 -0.40 -0.12 0.00 -0.37 0.00 0.00 57.07 56.23 3gpq s TYR 76 Cb 0.14 -1.28 0.23 0.00 -0.40 0.00 0.00 41.96 40.64 3gpq s TYR 76 CO 0.77 0.23 1.08 -1.54 -1.57 0.00 0.00 175.55 174.51 3gpq s SER 77 N -1.66 1.73 0.10 2.29 1.04 -1.26 -4.76 113.70 111.17 3gpq s SER 77 Ca 0.12 1.82 -0.21 0.00 0.48 0.00 0.00 55.95 58.17 3gpq s SER 77 Cb -0.10 -2.43 -0.10 0.00 0.10 0.00 0.00 66.02 63.49 3gpq s SER 77 CO 0.04 -3.78 1.69 -0.33 0.98 0.00 0.00 173.24 171.83 3gpq h GLU 78 N -2.34 0.21 -0.01 4.02 4.39 -1.98 0.21 114.58 119.07 3gpq h GLU 78 Ca -0.54 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.14 3gpq h GLU 78 Cb 1.31 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.91 3gpq h GLU 78 CO 0.46 0.23 0.01 0.66 -1.16 0.00 0.00 179.01 179.21 3gpq h SER 79 N 0.14 0.02 -0.51 1.42 4.64 -2.00 -1.44 113.55 115.81 3gpq h SER 79 Ca 0.05 -0.07 -0.10 0.00 -0.47 0.00 0.00 61.79 61.21 3gpq h SER 79 Cb 0.08 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 3gpq h SER 79 CO -0.01 0.08 -0.04 -0.33 -0.87 0.00 0.00 176.83 175.67 3gpq h GLU 80 N -0.05 0.97 -0.53 4.77 4.39 -1.92 -2.63 114.58 119.57 3gpq h GLU 80 Ca 0.01 -0.31 -0.04 0.00 0.34 0.00 0.00 59.36 59.36 3gpq h GLU 80 Cb 0.07 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3gpq h GLU 80 CO -0.00 0.98 0.19 0.78 -1.16 0.00 0.00 179.01 179.80 3gpq h GLY 81 N 0.98 0.87 1.34 -3.84 0.00 -0.87 -1.80 103.07 99.75 3gpq h GLY 81 Ca 0.15 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 3gpq h GLY 81 CO 0.03 0.46 0.19 -1.80 0.00 0.00 0.00 176.54 175.43 3gpq h ASP 82 N 0.73 0.77 -0.48 0.19 3.58 -1.17 -0.10 116.42 119.93 3gpq h ASP 82 Ca 0.18 -0.11 -0.10 0.00 0.42 0.00 0.00 57.03 57.42 3gpq h ASP 82 Cb 0.23 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 3gpq h ASP 82 CO -0.01 0.72 -0.05 -0.09 -2.88 0.00 0.00 179.24 176.93 3gpq h ARG 83 N 0.82 0.93 -0.05 0.28 2.43 -1.08 -1.61 114.38 116.11 3gpq h ARG 83 Ca 0.19 -0.30 -0.15 0.00 -0.81 0.00 0.00 59.98 58.91 3gpq h ARG 83 Cb 0.21 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3gpq h ARG 83 CO -0.01 0.96 -0.63 0.93 -1.51 0.00 0.00 179.97 179.70 3gpq h GLU 84 N 0.85 0.18 -0.16 0.20 4.39 -0.77 -1.61 114.58 117.65 3gpq h GLU 84 Ca 0.15 -0.13 -0.08 0.00 0.34 0.00 0.00 59.36 59.64 3gpq h GLU 84 Cb 0.58 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 3gpq h GLU 84 CO 0.03 0.75 -0.21 1.25 -1.16 0.00 0.00 179.01 179.68 3gpq h LEU 85 N 0.13 0.47 -0.40 1.33 5.85 -0.71 -1.00 115.31 120.99 3gpq h LEU 85 Ca -0.01 -0.50 0.05 0.00 0.84 0.00 0.00 57.88 58.26 3gpq h LEU 85 Cb 1.14 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.99 3gpq h LEU 85 CO 0.09 0.88 0.13 0.00 -0.34 0.00 0.00 178.44 179.20 3gpq h ALA 86 N 0.60 0.46 -0.89 1.25 0.00 -1.24 -2.12 119.26 117.32 3gpq h ALA 86 Ca 0.02 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.03 3gpq h ALA 86 Cb 0.76 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 3gpq h ALA 86 CO 0.05 -0.26 0.57 0.00 0.00 0.00 0.00 179.25 179.60 3gpq h ALA 87 N 1.26 1.21 -0.43 0.00 0.00 -1.15 -0.89 119.26 119.25 3gpq h ALA 87 Ca 0.18 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3gpq h ALA 87 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3gpq h ALA 87 CO -0.20 0.36 -0.08 0.00 0.00 0.00 0.00 179.25 179.34 3gpq h ALA 88 N 1.40 0.60 -0.46 0.00 0.00 -0.67 -1.82 119.26 118.30 3gpq h ALA 88 Ca 0.38 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3gpq h ALA 88 Cb 0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3gpq h ALA 88 CO -0.15 0.46 -0.02 1.88 0.00 0.00 0.00 179.25 181.42 3gpq h TYR 89 N 0.65 0.83 -0.56 0.00 0.99 -0.99 -1.27 116.97 116.63 3gpq h TYR 89 Ca 0.11 -0.12 0.05 0.00 2.00 0.00 0.00 58.73 60.78 3gpq h TYR 89 Cb 0.61 -0.23 -0.05 0.00 1.00 0.00 0.00 36.73 38.06 3gpq h TYR 89 CO 0.05 0.78 0.28 -0.09 -0.00 0.00 0.00 178.16 179.18 3gpq h ARG 90 N 0.72 0.52 -0.45 4.88 2.43 -0.82 -0.95 114.38 120.71 3gpq h ARG 90 Ca 0.14 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 3gpq h ARG 90 Cb 0.47 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 3gpq h ARG 90 CO 0.02 0.34 -0.00 0.93 -1.51 0.00 0.00 179.97 179.75 3gpq h GLU 91 N 0.53 0.74 -0.36 0.20 5.08 -1.00 -1.10 114.58 118.67 3gpq h GLU 91 Ca 0.25 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3gpq h GLU 91 Cb 0.17 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3gpq h GLU 91 CO -0.18 0.75 0.23 0.28 -1.00 0.00 0.00 179.01 179.09 3gpq h VAL 92 N 0.69 1.08 -0.77 3.13 2.07 -0.37 -0.53 116.25 121.55 3gpq h VAL 92 Ca 0.14 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 67.53 3gpq h VAL 92 Cb 0.43 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 3gpq h VAL 92 CO 0.02 0.09 0.48 0.00 0.02 0.00 0.00 177.57 178.18 3gpq h ALA 93 N 1.14 1.02 0.14 1.67 0.00 -0.82 0.14 119.26 122.56 3gpq h ALA 93 Ca 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3gpq h ALA 93 Cb -0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 3gpq h ALA 93 CO -0.04 0.26 -0.10 -0.22 0.00 0.00 0.00 179.25 179.16 3gpq h LYS 94 N 0.93 -0.23 -0.81 0.00 3.64 -0.80 0.29 116.57 119.59 3gpq h LYS 94 Ca 0.32 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.71 3gpq h LYS 94 Cb 0.06 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 3gpq h LYS 94 CO -0.13 -0.15 0.49 0.93 -2.27 0.00 0.00 179.45 178.32 3gpq h GLU 95 N -0.24 1.10 -0.81 1.90 4.39 -0.72 0.01 114.58 120.20 3gpq h GLU 95 Ca -0.01 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 3gpq h GLU 95 Cb 0.20 -0.23 -0.04 0.00 -0.10 0.00 0.00 28.75 28.58 3gpq h GLU 95 CO 0.01 0.77 0.48 0.28 -1.16 0.00 0.00 179.01 179.39 3gpq h VAL 96 N 1.11 1.22 -0.03 3.13 2.07 -0.42 -1.55 116.25 121.79 3gpq h VAL 96 Ca 0.29 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 3gpq h VAL 96 Cb -0.05 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 29.81 3gpq h VAL 96 CO -0.06 0.24 -0.01 0.74 0.02 0.00 0.00 177.57 178.50 3gpq h THR 97 N 1.11 1.31 -0.91 2.57 2.02 -0.20 -2.97 112.91 115.85 3gpq h THR 97 Ca 0.29 -0.96 0.05 0.00 0.77 0.00 0.00 66.41 66.56 3gpq h THR 97 Cb -0.04 1.90 -0.06 0.00 -1.74 0.00 0.00 68.15 68.20 3gpq h THR 97 CO -0.05 0.26 0.59 -0.09 0.37 0.00 0.00 175.52 176.59 3gpq h ARG 98 N -0.31 1.04 0.00 6.66 2.43 -0.68 -1.38 114.38 122.13 3gpq h ARG 98 Ca 0.01 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 3gpq h ARG 98 Cb 0.42 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3gpq h ARG 98 CO 0.00 0.69 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.03 3gpq h LEU 99 N 1.07 0.00 0.33 3.80 3.38 -1.32 -3.47 115.31 119.10 3gpq h LEU 99 Ca 0.38 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.21 3gpq h LEU 99 Cb 0.13 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 3gpq h LEU 99 CO -0.13 0.05 -0.13 0.61 0.09 0.00 0.00 178.44 178.93 3gpq n GLY 100 N 0.48 0.89 3.76 0.83 0.00 -0.52 -4.98 105.19 105.65 3gpq n GLY 100 Ca 0.02 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 3gpq n GLY 100 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gpq s VAL 101 N -2.13 3.04 -0.73 1.61 -7.23 -1.24 -4.95 120.40 108.77 3gpq s VAL 101 Ca 0.00 0.52 0.25 0.00 -1.81 0.00 0.00 61.98 60.94 3gpq s VAL 101 Cb 0.00 -3.07 0.13 0.00 0.56 0.00 0.00 36.38 34.00 3gpq s VAL 101 CO 0.00 -0.26 1.51 0.59 -0.31 0.00 0.00 175.10 176.63 3gpq n ASN 102 N -2.24 0.66 -3.54 4.85 3.02 -1.26 -4.61 115.26 112.15 3gpq n ASN 102 Ca 0.11 0.25 -0.13 0.00 -0.03 0.00 0.00 54.58 54.78 3gpq n ASN 102 Cb 0.51 -0.16 -0.04 0.00 -0.61 0.00 0.00 39.78 39.48 3gpq n ASN 102 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3gpq s SER 103 N -4.10 -0.45 -0.13 6.41 1.04 -1.26 -1.34 113.70 113.86 3gpq s SER 103 Ca 0.09 0.07 -0.10 0.00 0.48 0.00 0.00 55.95 56.48 3gpq s SER 103 Cb 0.14 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.82 3gpq s SER 103 CO 0.67 -0.81 0.34 0.54 0.98 0.00 0.00 173.24 174.95 3gpq s VAL 104 N -3.01 -0.01 -0.17 5.02 0.11 -0.60 -3.13 120.40 118.62 3gpq s VAL 104 Ca -0.02 0.05 -0.14 0.00 -2.93 0.00 0.00 61.98 58.94 3gpq s VAL 104 Cb -0.00 -0.48 -0.05 0.00 -1.53 0.00 0.00 36.38 34.32 3gpq s VAL 104 CO -0.06 0.02 0.28 0.00 -3.33 0.00 0.00 175.10 172.01 3gpq s ALA 105 N 0.64 3.60 -0.02 1.54 0.00 -0.48 -1.15 121.76 125.88 3gpq s ALA 105 Ca -0.04 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 3gpq s ALA 105 Cb -0.05 -2.39 0.02 0.00 0.00 0.00 0.00 23.12 20.71 3gpq s ALA 105 CO -0.04 0.06 0.04 -1.50 0.00 0.00 0.00 175.76 174.32 3gpq s ILE 106 N 0.54 -0.04 0.44 0.00 2.07 0.19 -0.78 121.20 123.61 3gpq s ILE 106 Ca 0.16 0.15 0.01 0.00 -1.41 0.00 0.00 60.65 59.56 3gpq s ILE 106 Cb -0.13 -0.09 -0.00 0.00 0.13 0.00 0.00 42.46 42.36 3gpq s ILE 106 CO 0.04 0.06 0.65 -2.16 -1.91 0.00 0.00 174.94 171.62 3gpq s PRO 107 N 0.79 3.07 -0.44 3.50 0.04 -1.26 -0.31 135.00 140.40 3gpq s PRO 107 Ca -0.06 -0.53 -0.29 0.00 0.04 0.00 0.00 61.00 60.16 3gpq s PRO 107 Cb -0.09 -2.58 0.02 0.00 0.04 0.00 0.00 34.50 31.89 3gpq s PRO 107 CO -0.03 -0.24 1.17 -0.51 0.04 0.00 0.00 177.00 177.43 3gpq s LEU 108 N -4.52 3.68 0.53 -3.56 1.43 -1.26 -4.91 118.68 110.07 3gpq s LEU 108 Ca 0.48 0.62 -0.21 0.00 -1.03 0.00 0.00 54.13 54.00 3gpq s LEU 108 Cb -0.10 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.52 3gpq s LEU 108 CO 0.37 -1.21 1.18 -0.76 0.23 0.00 0.00 176.35 176.16 3gpq s LEU 109 N 4.45 3.82 -1.47 1.79 1.43 -1.26 -3.34 118.68 124.10 3gpq s LEU 109 Ca 0.49 2.32 0.00 0.00 -1.03 0.00 0.00 54.13 55.92 3gpq s LEU 109 Cb -0.09 -4.45 0.00 0.00 0.03 0.00 0.00 46.19 41.68 3gpq s LEU 109 CO 0.29 -1.24 0.00 -1.20 0.23 0.00 0.00 176.35 174.43 3gpq n SER 110 N -1.08 -4.75 -4.91 2.29 7.64 -1.26 -4.76 113.62 106.78 3gpq n SER 110 Ca 0.11 0.17 -0.20 0.00 1.01 0.00 0.00 58.87 59.96 3gpq n SER 110 Cb 0.49 -3.76 0.06 0.00 -1.01 0.00 0.00 64.21 59.99 3gpq n SER 110 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3gpq n THR 111 N -3.35 0.00 0.00 0.44 -2.24 -1.21 -3.47 114.28 104.45 3gpq n THR 111 Ca -0.17 -1.94 0.00 0.00 -2.27 0.00 0.00 64.05 59.67 3gpq n THR 111 Cb 0.58 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 3gpq n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gpq n GLY 112 N -1.99 3.62 0.24 3.38 0.00 -1.26 -2.01 105.19 107.16 3gpq n GLY 112 Ca 0.15 0.03 0.16 0.00 0.00 0.00 0.00 46.02 46.35 3gpq n GLY 112 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3gpq h VAL 113 N 0.00 0.00 -0.31 1.61 -1.51 -1.97 -1.02 116.25 113.05 3gpq h VAL 113 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 3gpq h VAL 113 Cb 0.00 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 29.84 3gpq h VAL 113 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.12 3gpq n TYR 114 N -2.61 0.39 0.87 5.19 4.02 -0.85 -4.52 117.16 119.65 3gpq n TYR 114 Ca -0.02 -0.21 0.14 0.00 -0.01 0.00 0.00 57.90 57.80 3gpq n TYR 114 Cb 0.09 -0.00 0.54 0.00 -0.02 0.00 0.00 39.34 39.94 3gpq n TYR 114 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3gpq n SER 115 N 1.39 0.29 -2.87 7.72 3.41 -0.39 -1.01 113.62 122.17 3gpq n SER 115 Ca 0.17 0.50 -0.22 0.00 -0.26 0.00 0.00 58.87 59.07 3gpq n SER 115 Cb 0.58 -0.57 0.03 0.00 -0.26 0.00 0.00 64.21 63.99 3gpq n SER 115 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gpq n GLY 116 N 1.43 -0.51 2.92 5.00 0.00 -1.26 -2.58 105.19 110.20 3gpq n GLY 116 Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3gpq n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gpq n GLY 117 N -1.42 2.58 3.95 -0.02 0.00 -1.26 -4.84 105.19 104.19 3gpq n GLY 117 Ca -0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 3gpq n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gpq s LYS 118 N -0.03 3.44 -0.33 1.61 1.02 -1.06 -5.05 119.74 119.34 3gpq s LYS 118 Ca 0.00 -0.63 -0.29 0.00 0.02 0.00 0.00 55.97 55.07 3gpq s LYS 118 Cb 0.00 -2.93 0.00 0.00 -0.52 0.00 0.00 37.83 34.38 3gpq s LYS 118 CO 0.00 0.48 1.35 0.34 -0.92 0.00 0.00 175.35 176.60 3gpq s ASP 119 N -3.48 6.56 -0.18 2.83 -1.08 -1.26 -4.80 116.67 115.27 3gpq s ASP 119 Ca 0.35 1.12 0.16 0.00 -0.52 0.00 0.00 52.55 53.66 3gpq s ASP 119 Cb -0.10 -2.54 0.54 0.00 -1.46 0.00 0.00 42.92 39.36 3gpq s ASP 119 CO 0.29 -1.19 1.44 0.54 0.52 0.00 0.00 175.17 176.77 3gpq n ARG 120 N 7.55 3.04 0.17 4.34 1.74 -1.26 -4.76 116.66 127.47 3gpq n ARG 120 Ca 0.15 -2.84 -0.16 0.00 -0.77 0.00 0.00 57.85 54.23 3gpq n ARG 120 Cb 0.47 -1.85 -0.10 0.00 -1.02 0.00 0.00 32.46 29.96 3gpq n ARG 120 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3gpq h LEU 121 N 1.94 -1.47 -0.48 0.55 6.46 -1.96 0.11 115.31 120.47 3gpq h LEU 121 Ca 0.00 0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.85 3gpq h LEU 121 Cb 1.45 0.52 -0.02 0.00 -0.73 0.00 0.00 40.66 41.89 3gpq h LEU 121 CO 0.23 -0.57 0.08 0.74 -0.62 0.00 0.00 178.44 178.30 3gpq h THR 122 N -0.81 1.25 -0.00 1.05 2.02 -1.99 -0.16 112.91 114.27 3gpq h THR 122 Ca -0.02 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 66.25 3gpq h THR 122 Cb 0.77 0.91 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 3gpq h THR 122 CO -0.20 0.32 0.00 -0.61 0.37 0.00 0.00 175.52 175.40 3gpq h GLN 123 N 0.67 0.00 -0.05 6.66 4.15 -1.85 -0.39 115.11 124.30 3gpq h GLN 123 Ca 0.15 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.57 3gpq h GLN 123 Cb 0.38 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.07 3gpq h GLN 123 CO 0.01 0.10 0.03 1.03 -1.93 0.00 0.00 178.83 178.07 3gpq h SER 124 N -0.10 0.06 -0.78 -0.69 0.87 -0.62 -2.82 113.55 109.47 3gpq h SER 124 Ca 0.00 -0.09 0.04 0.00 -1.23 0.00 0.00 61.79 60.51 3gpq h SER 124 Cb 0.10 -0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.00 3gpq h SER 124 CO -0.00 0.13 0.49 0.25 -0.53 0.00 0.00 176.83 177.18 3gpq h LEU 125 N -0.02 0.80 -1.06 2.23 5.85 -0.93 -0.30 115.31 121.88 3gpq h LEU 125 Ca 0.02 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 3gpq h LEU 125 Cb 0.09 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 3gpq h LEU 125 CO -0.00 0.54 -0.01 0.78 -0.34 0.00 0.00 178.44 179.41 3gpq h ASN 126 N 0.95 0.62 0.47 1.25 2.35 -1.01 1.00 115.58 121.20 3gpq h ASN 126 Ca 0.32 -0.14 -0.16 0.00 -0.55 0.00 0.00 56.30 55.78 3gpq h ASN 126 Cb 0.05 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 3gpq h ASN 126 CO -0.13 0.70 -0.68 0.45 -1.65 0.00 0.00 177.43 176.12 3gpq h HIS 127 N 0.61 0.25 0.07 1.19 3.86 -1.17 -2.11 115.15 117.84 3gpq h HIS 127 Ca 0.12 -0.11 -0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3gpq h HIS 127 Cb 0.41 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.84 3gpq h HIS 127 CO 0.02 0.80 -0.03 1.25 0.86 0.00 0.00 177.93 180.83 3gpq h LEU 128 N 0.13 -0.08 0.13 2.43 6.46 -0.39 -2.52 115.31 121.47 3gpq h LEU 128 Ca -0.01 -0.05 0.01 0.00 -0.12 0.00 0.00 57.88 57.70 3gpq h LEU 128 Cb 1.21 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.14 3gpq h LEU 128 CO 0.10 0.00 -0.19 -0.26 -0.62 0.00 0.00 178.44 177.47 3gpq h PHE 129 N -0.15 -0.51 -0.62 1.25 0.04 -0.77 -0.58 116.94 115.60 3gpq h PHE 129 Ca -0.01 0.01 0.13 0.00 2.80 0.00 0.00 57.97 60.90 3gpq h PHE 129 Cb 0.13 0.21 -0.11 0.00 2.20 0.00 0.00 35.95 38.38 3gpq h PHE 129 CO -0.05 -0.29 -0.04 1.15 -0.60 0.00 0.00 178.31 178.48 3gpq h THR 130 N -0.38 0.45 0.05 -1.55 2.02 -1.40 -0.61 112.91 111.49 3gpq h THR 130 Ca 0.02 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 3gpq h THR 130 Cb 0.39 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 3gpq h THR 130 CO -0.09 0.01 -0.03 0.00 0.37 0.00 0.00 175.52 175.78 3gpq h ALA 131 N 1.58 -0.07 0.00 6.16 0.00 -1.30 -3.32 119.26 122.32 3gpq h ALA 131 Ca 0.32 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3gpq h ALA 131 Cb 0.51 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3gpq h ALA 131 CO -0.57 -0.24 0.00 -1.33 0.00 0.00 0.00 179.25 177.12 3gpq n MET 132 N -4.84 0.09 0.22 0.00 2.00 -0.24 -2.92 117.12 111.42 3gpq n MET 132 Ca -0.09 0.21 0.15 0.00 0.00 0.00 0.00 57.70 57.97 3gpq n MET 132 Cb 0.29 -1.64 0.69 0.00 0.00 0.00 0.00 33.22 32.56 3gpq n MET 132 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 3gpq h ASP 133 N 0.00 0.00 -0.61 7.83 3.32 -1.21 -0.81 116.42 124.94 3gpq h ASP 133 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gpq h ASP 133 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3gpq h ASP 133 CO 0.00 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.98 3gpq n SER 134 N -2.64 4.46 -4.63 6.45 3.41 -1.15 -4.93 113.62 114.59 3gpq n SER 134 Ca 0.00 -2.40 -0.23 0.00 -0.26 0.00 0.00 58.87 55.98 3gpq n SER 134 Cb 0.19 -0.56 -0.08 0.00 -0.26 0.00 0.00 64.21 63.51 3gpq n SER 134 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3gpq s THR 135 N -1.80 3.36 -2.35 6.66 -4.23 -0.31 -5.03 115.64 111.94 3gpq s THR 135 Ca 0.48 -1.91 0.26 0.00 -1.18 0.00 0.00 61.69 59.34 3gpq s THR 135 Cb 0.31 -2.78 0.37 0.00 1.34 0.00 0.00 72.50 71.73 3gpq s THR 135 CO 0.24 -0.35 1.56 -0.67 -0.54 0.00 0.00 174.62 174.86 3gpq n ASP 136 N -0.77 1.68 -4.76 3.99 2.03 -1.26 -4.96 116.55 112.50 3gpq n ASP 136 Ca -0.07 -1.43 -0.40 0.00 0.52 0.00 0.00 54.79 53.41 3gpq n ASP 136 Cb 0.59 0.08 -0.05 0.00 -0.72 0.00 0.00 41.12 41.02 3gpq n ASP 136 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gpq s ALA 137 N -2.17 3.39 0.25 -1.67 0.00 -1.26 -4.58 121.76 115.72 3gpq s ALA 137 Ca 0.31 0.84 -0.30 0.00 0.00 0.00 0.00 51.96 52.81 3gpq s ALA 137 Cb 0.20 -3.30 -0.10 0.00 0.00 0.00 0.00 23.12 19.92 3gpq s ALA 137 CO 0.40 -0.08 1.50 -0.51 0.00 0.00 0.00 175.76 177.07 3gpq s ASP 138 N -0.95 6.56 -0.16 0.00 1.01 -0.45 -4.58 116.67 118.09 3gpq s ASP 138 Ca 0.44 2.74 -0.03 0.00 0.71 0.00 0.00 52.55 56.42 3gpq s ASP 138 Cb -0.31 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 40.98 3gpq s ASP 138 CO 0.39 -0.78 -0.07 -0.69 0.21 0.00 0.00 175.17 174.23 3gpq s VAL 139 N 0.14 3.51 -0.24 -1.27 1.01 0.00 -1.55 120.40 122.00 3gpq s VAL 139 Ca 0.62 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.12 3gpq s VAL 139 Cb -0.44 -2.53 0.04 0.00 0.00 0.00 0.00 36.38 33.44 3gpq s VAL 139 CO 0.43 0.49 -0.10 -0.69 0.00 0.00 0.00 175.10 175.23 3gpq s VAL 140 N 0.61 2.52 -0.05 2.92 1.01 -0.30 -1.26 120.40 125.84 3gpq s VAL 140 Ca -0.04 -1.20 -0.18 0.00 0.00 0.00 0.00 61.98 60.55 3gpq s VAL 140 Cb -0.15 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.88 3gpq s VAL 140 CO 0.03 0.19 0.51 -0.63 0.00 0.00 0.00 175.10 175.20 3gpq s ILE 141 N 1.25 5.04 0.01 2.22 1.01 0.44 -0.64 121.20 130.53 3gpq s ILE 141 Ca -0.02 1.05 0.04 0.00 0.00 0.00 0.00 60.65 61.72 3gpq s ILE 141 Cb -0.17 -3.84 -0.03 0.00 0.01 0.00 0.00 42.46 38.42 3gpq s ILE 141 CO -0.06 0.41 -0.08 -0.31 0.00 0.00 0.00 174.94 174.90 3gpq s TYR 142 N -0.03 2.84 0.31 3.97 2.02 0.58 -1.49 117.35 125.55 3gpq s TYR 142 Ca 0.28 -0.07 -0.04 0.00 -0.37 0.00 0.00 57.07 56.87 3gpq s TYR 142 Cb -0.17 -1.59 -0.01 0.00 -0.40 0.00 0.00 41.96 39.80 3gpq s TYR 142 CO 0.14 0.35 0.43 0.00 -1.57 0.00 0.00 175.55 174.89 3gpq n ARG 144 N -0.50 0.73 -3.20 0.00 5.12 -1.26 -1.59 116.66 115.95 3gpq n ARG 144 Ca 0.01 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.54 3gpq n ARG 144 Cb 0.62 -0.97 -0.06 0.00 -1.16 0.00 0.00 32.46 30.89 3gpq n ARG 144 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3gpq s ASP 145 N -2.00 7.13 0.06 0.55 2.15 -1.26 -4.89 116.67 118.42 3gpq s ASP 145 Ca 0.00 1.35 -0.20 0.00 0.43 0.00 0.00 52.55 54.14 3gpq s ASP 145 Cb 0.00 -2.39 -0.12 0.00 -0.30 0.00 0.00 42.92 40.11 3gpq s ASP 145 CO 0.00 0.24 1.42 0.11 -0.17 0.00 0.00 175.17 176.77 3gpq h LYS 146 N 4.40 0.38 -0.84 4.34 1.57 -2.00 -1.58 116.57 122.84 3gpq h LYS 146 Ca -0.49 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.13 3gpq h LYS 146 Cb 1.21 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.47 3gpq h LYS 146 CO 0.64 0.68 0.53 0.93 -0.57 0.00 0.00 179.45 181.66 3gpq h GLU 147 N 0.07 1.13 -0.65 3.15 4.39 -1.99 -2.41 114.58 118.26 3gpq h GLU 147 Ca 0.04 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.58 3gpq h GLU 147 Cb 0.56 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 28.94 3gpq h GLU 147 CO 0.03 0.77 0.09 -1.49 -1.16 0.00 0.00 179.01 177.25 3gpq h TRP 148 N 1.15 1.16 -0.41 4.33 4.06 -1.96 -0.68 115.95 123.60 3gpq h TRP 148 Ca 0.31 -0.17 0.06 0.00 2.06 0.00 0.00 58.89 61.15 3gpq h TRP 148 Cb -0.09 -0.32 -0.05 0.00 -1.00 0.00 0.00 29.16 27.71 3gpq h TRP 148 CO -0.01 0.98 0.12 1.49 -3.56 0.00 0.00 178.44 177.46 3gpq h GLU 149 N 1.00 0.26 -0.00 0.49 4.81 -1.07 0.15 114.58 120.21 3gpq h GLU 149 Ca 0.20 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 3gpq h GLU 149 Cb 0.45 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 3gpq h GLU 149 CO 0.01 0.17 0.00 0.87 -0.73 0.00 0.00 179.01 179.34 3gpq h LYS 150 N 0.26 0.00 -0.58 1.92 1.57 -1.21 0.32 116.57 118.86 3gpq h LYS 150 Ca 0.19 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 3gpq h LYS 150 Cb 0.21 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 3gpq h LYS 150 CO -0.22 0.01 0.34 0.87 -0.57 0.00 0.00 179.45 179.88 3gpq h LYS 151 N -0.01 0.80 -0.34 3.15 1.57 -0.90 -1.80 116.57 119.05 3gpq h LYS 151 Ca 0.00 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3gpq h LYS 151 Cb 0.01 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 3gpq h LYS 151 CO -0.00 0.59 0.08 0.82 -0.57 0.00 0.00 179.45 180.36 3gpq h ILE 152 N 0.79 1.22 -0.60 1.86 2.04 -0.53 -2.02 117.51 120.27 3gpq h ILE 152 Ca 0.21 -0.76 0.09 0.00 1.00 0.00 0.00 64.86 65.40 3gpq h ILE 152 Cb 0.00 1.08 -0.07 0.00 -0.74 0.00 0.00 36.82 37.09 3gpq h ILE 152 CO -0.04 0.26 0.23 -1.28 0.00 0.00 0.00 178.15 177.32 3gpq h SER 153 N 0.39 0.24 -0.50 1.72 0.87 -0.79 -0.59 113.55 114.88 3gpq h SER 153 Ca 0.10 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 3gpq h SER 153 Cb 0.31 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 3gpq h SER 153 CO 0.00 0.14 0.23 -0.33 -0.53 0.00 0.00 176.83 176.34 3gpq h GLU 154 N 0.42 0.73 -0.61 2.24 5.08 -1.19 -1.16 114.58 120.09 3gpq h GLU 154 Ca 0.30 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 3gpq h GLU 154 Cb 0.36 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 3gpq h GLU 154 CO -0.30 0.62 0.17 0.00 -1.00 0.00 0.00 179.01 178.51 3gpq h ALA 155 N 1.07 1.15 -0.11 3.43 0.00 -0.75 0.75 119.26 124.80 3gpq h ALA 155 Ca 0.17 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3gpq h ALA 155 Cb 0.15 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3gpq h ALA 155 CO -0.02 0.58 0.04 0.82 0.00 0.00 0.00 179.25 180.67 3gpq h ILE 156 N 0.90 1.16 -0.70 0.00 2.04 -0.88 -3.01 117.51 117.02 3gpq h ILE 156 Ca 0.20 -0.48 0.03 0.00 1.00 0.00 0.00 64.86 65.60 3gpq h ILE 156 Cb 0.29 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 3gpq h ILE 156 CO -0.00 0.14 0.44 1.56 0.00 0.00 0.00 178.15 180.29 3gpq h GLN 157 N 0.00 0.83 -0.77 2.37 7.50 -0.74 -2.86 115.11 121.44 3gpq h GLN 157 Ca 0.04 -0.05 0.09 0.00 0.50 0.00 0.00 58.65 59.22 3gpq h GLN 157 Cb 0.19 -0.19 -0.07 0.00 0.05 0.00 0.00 27.48 27.47 3gpq h GLN 157 CO -0.00 0.55 0.43 0.52 -1.50 0.00 0.00 178.83 178.82 3gpq h MET 158 N 0.85 0.71 0.00 1.46 2.86 -0.78 -1.95 114.93 118.09 3gpq h MET 158 Ca 0.28 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.82 3gpq h MET 158 Cb 0.02 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 3gpq h MET 158 CO -0.11 0.47 -0.26 0.00 1.06 0.00 0.00 176.91 178.07 3gpq h ARG 159 N 0.73 0.00 0.00 1.72 3.08 -1.38 -3.51 114.38 115.02 3gpq h ARG 159 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 3gpq h ARG 159 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3gpq h ARG 159 CO -0.24 0.26 0.00 -2.37 -1.07 0.00 0.00 179.97 176.55