#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxi n LEU 2 N 0.00 0.00 -4.18 0.00 -0.00 -1.26 -5.08 117.00 106.48 1gxi n LEU 2 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.90 1gxi n LEU 2 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.32 1gxi n LEU 2 CO 0.00 0.00 -0.25 0.20 -0.00 0.00 0.00 177.39 177.34 1gxi s ASN 3 N -0.64 0.19 -0.68 1.45 0.02 -1.26 -5.11 114.94 108.91 1gxi s ASN 3 Ca 0.00 -1.33 -0.18 0.00 -1.02 0.00 0.00 52.86 50.33 1gxi s ASN 3 Cb 0.00 0.36 0.13 0.00 0.02 0.00 0.00 41.25 41.76 1gxi s ASN 3 CO 0.00 -0.81 0.77 0.00 0.02 0.00 0.00 177.10 177.07 1gxi s ARG 4 N -4.13 3.22 0.00 -0.60 1.70 -1.13 -4.33 118.95 113.68 1gxi s ARG 4 Ca 0.35 -1.60 0.00 0.00 -0.47 0.00 0.00 55.73 54.00 1gxi s ARG 4 Cb 0.07 -4.39 0.00 0.00 -0.57 0.00 0.00 34.95 30.06 1gxi s ARG 4 CO 0.09 -1.53 0.00 0.41 -1.08 0.00 0.00 175.30 173.20 1gxi n GLY 5 N 5.09 1.58 3.84 3.88 0.00 -0.99 -4.73 105.19 113.86 1gxi n GLY 5 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1gxi n GLY 5 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gxi s ASP 6 N -1.74 6.86 -1.12 1.61 -1.08 -1.26 -4.67 116.67 115.28 1gxi s ASP 6 Ca 0.00 1.08 -0.13 0.00 -0.52 0.00 0.00 52.55 52.98 1gxi s ASP 6 Cb 0.00 -2.29 0.20 0.00 -1.46 0.00 0.00 42.92 39.37 1gxi s ASP 6 CO 0.00 0.18 1.27 -0.54 0.52 0.00 0.00 175.17 176.60 1gxi s LYS 7 N -1.62 4.02 -0.02 4.34 -0.14 -1.26 -1.97 119.74 123.09 1gxi s LYS 7 Ca 0.33 -2.62 -0.21 0.00 -1.36 0.00 0.00 55.97 52.11 1gxi s LYS 7 Cb -0.16 -4.88 -0.05 0.00 -1.68 0.00 0.00 37.83 31.06 1gxi s LYS 7 CO 0.18 -1.61 0.61 0.14 -0.76 0.00 0.00 175.35 173.92 1gxi s VAL 8 N 0.93 4.95 -0.43 3.17 -7.23 -0.83 -1.41 120.40 119.54 1gxi s VAL 8 Ca 0.37 1.28 -0.21 0.00 -1.81 0.00 0.00 61.98 61.61 1gxi s VAL 8 Cb -0.05 -3.95 0.02 0.00 0.56 0.00 0.00 36.38 32.96 1gxi s VAL 8 CO -0.04 0.38 0.64 -0.60 -0.31 0.00 0.00 175.10 175.17 1gxi s ARG 9 N 0.08 3.31 -0.39 4.82 3.52 0.18 -2.47 118.95 128.00 1gxi s ARG 9 Ca 0.32 -0.34 -0.32 0.00 -0.13 0.00 0.00 55.73 55.27 1gxi s ARG 9 Cb -0.18 -3.94 -0.10 0.00 -1.56 0.00 0.00 34.95 29.17 1gxi s ARG 9 CO 0.17 -0.99 2.27 -0.89 -0.81 0.00 0.00 175.30 175.05 1gxi n ILE 10 N 5.84 0.16 -2.44 4.11 2.08 -0.57 -2.72 119.36 125.82 1gxi n ILE 10 Ca -0.02 -0.37 -0.28 0.00 0.56 0.00 0.00 62.75 62.65 1gxi n ILE 10 Cb 0.48 -1.93 0.00 0.00 -0.75 0.00 0.00 39.64 37.44 1gxi n ILE 10 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1gxi n LYS 11 N 8.47 3.40 0.00 0.38 5.02 0.12 -3.06 118.16 132.49 1gxi n LYS 11 Ca 0.40 -4.45 0.00 0.00 -2.02 0.00 0.00 58.31 52.24 1gxi n LYS 11 Cb 0.31 -2.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.07 1gxi n LYS 11 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1gxi n ARG 12 N -0.49 0.00 0.00 1.97 0.63 -1.26 -4.77 116.66 112.74 1gxi n ARG 12 Ca 0.40 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.33 1gxi n ARG 12 Cb 0.65 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.56 1gxi n ARG 12 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1gxi n THR 13 N 0.00 0.00 -2.78 5.15 -1.04 -1.26 -5.06 114.28 109.30 1gxi n THR 13 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 1gxi n THR 13 Cb 0.00 -0.21 -0.03 0.00 -1.82 0.00 0.00 70.33 68.27 1gxi n THR 13 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1gxi s GLU 14 N -1.91 3.60 0.00 -2.82 2.02 -1.26 -4.94 118.70 113.39 1gxi s GLU 14 Ca 0.00 -1.50 0.00 0.00 0.02 0.00 0.00 54.97 53.49 1gxi s GLU 14 Cb 0.00 -5.10 0.00 0.00 0.10 0.00 0.00 34.13 29.13 1gxi s GLU 14 CO 0.00 -1.95 0.00 0.43 0.02 0.00 0.00 175.26 173.76 1gxi n SER 15 N 7.51 0.00 -0.12 -0.19 7.64 -1.26 -0.24 113.62 126.96 1gxi n SER 15 Ca 0.28 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.91 1gxi n SER 15 Cb 0.50 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.60 1gxi n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gxi n TYR 16 N 0.79 0.35 -1.68 1.43 4.19 -1.26 -4.55 117.16 116.43 1gxi n TYR 16 Ca 0.00 0.15 -0.15 0.00 3.31 0.00 0.00 57.90 61.22 1gxi n TYR 16 Cb 0.00 -0.98 0.12 0.00 0.49 0.00 0.00 39.34 38.97 1gxi n TYR 16 CO 0.00 0.00 0.00 0.91 0.91 0.00 0.00 176.86 178.68 1gxi n TRP 17 N -4.34 1.86 -3.85 2.98 8.01 0.67 -4.75 117.44 118.02 1gxi n TRP 17 Ca -0.43 -2.02 -0.14 0.00 -1.31 0.00 0.00 57.50 53.60 1gxi n TRP 17 Cb 0.77 -0.53 -0.15 0.00 -2.01 0.00 0.00 31.31 29.39 1gxi n TRP 17 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.69 176.21 1gxi s TYR 18 N -3.46 0.09 0.00 -5.99 5.04 -1.12 -4.71 117.35 107.20 1gxi s TYR 18 Ca 0.49 0.05 0.00 0.00 -2.44 0.00 0.00 57.07 55.17 1gxi s TYR 18 Cb 0.42 -0.19 0.00 0.00 0.35 0.00 0.00 41.96 42.54 1gxi s TYR 18 CO 0.00 -0.06 0.00 0.41 -1.34 0.00 0.00 175.55 174.56 1gxi n GLY 19 N 3.75 0.70 3.84 8.97 0.00 -1.17 -4.47 105.19 116.80 1gxi n GLY 19 Ca -0.22 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.78 1gxi n GLY 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gxi s ASP 20 N -1.25 -0.04 0.50 1.61 2.15 -1.25 -5.08 116.67 113.31 1gxi s ASP 20 Ca 0.00 -0.56 0.06 0.00 0.43 0.00 0.00 52.55 52.48 1gxi s ASP 20 Cb 0.00 0.46 0.02 0.00 -0.30 0.00 0.00 42.92 43.10 1gxi s ASP 20 CO 0.00 -0.90 0.38 0.54 -0.17 0.00 0.00 175.17 175.02 1gxi s VAL 21 N -2.44 1.93 -0.07 1.11 0.11 -1.26 -1.51 120.40 118.28 1gxi s VAL 21 Ca 0.19 -1.48 -0.32 0.00 -2.93 0.00 0.00 61.98 57.45 1gxi s VAL 21 Cb -0.02 -2.41 0.14 0.00 -1.53 0.00 0.00 36.38 32.56 1gxi s VAL 21 CO 0.04 0.00 1.37 -0.83 -3.33 0.00 0.00 175.10 172.34 1gxi s GLY 22 N -4.21 -0.45 -0.35 6.54 0.00 -1.03 -4.83 107.32 102.98 1gxi s GLY 22 Ca 0.38 0.89 -0.15 0.00 0.00 0.00 0.00 44.72 45.84 1gxi s GLY 22 CO 0.23 0.17 0.34 -1.59 0.00 0.00 0.00 173.10 172.26 1gxi s THR 23 N -2.21 5.19 -1.07 0.90 2.01 -1.25 -1.97 115.64 117.23 1gxi s THR 23 Ca 0.14 -0.05 -0.22 0.00 0.31 0.00 0.00 61.69 61.87 1gxi s THR 23 Cb 0.06 -3.82 0.01 0.00 0.01 0.00 0.00 72.50 68.76 1gxi s THR 23 CO -0.05 -0.11 1.68 0.54 -0.69 0.00 0.00 174.62 175.99 1gxi s VAL 24 N 1.96 3.80 -1.04 3.82 0.11 -0.83 -0.62 120.40 127.60 1gxi s VAL 24 Ca 0.11 -0.92 -0.03 0.00 -2.93 0.00 0.00 61.98 58.20 1gxi s VAL 24 Cb -0.17 -4.78 0.21 0.00 -1.53 0.00 0.00 36.38 30.11 1gxi s VAL 24 CO 0.12 -1.61 2.21 0.00 -3.33 0.00 0.00 175.10 172.49 1gxi n ALA 25 N 10.65 6.48 -1.00 1.54 0.00 0.21 -2.34 120.51 136.06 1gxi n ALA 25 Ca 0.39 -4.11 0.00 0.00 0.00 0.00 0.00 53.44 49.72 1gxi n ALA 25 Cb 0.48 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.54 1gxi n ALA 25 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1gxi n SER 26 N 0.73 0.00 -3.26 0.00 3.41 -1.25 -4.47 113.62 108.79 1gxi n SER 26 Ca 0.54 0.01 -0.37 0.00 -0.26 0.00 0.00 58.87 58.78 1gxi n SER 26 Cb 0.29 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 1gxi n SER 26 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1gxi n VAL 27 N -0.43 4.53 0.02 -3.33 3.14 -1.26 -0.76 118.33 120.24 1gxi n VAL 27 Ca 0.00 -3.12 0.00 0.00 -2.96 0.00 0.00 64.34 58.26 1gxi n VAL 27 Cb 0.00 -2.36 0.00 0.00 -1.06 0.00 0.00 33.84 30.42 1gxi n VAL 27 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 1gxi n GLU 28 N 2.80 0.00 -0.03 1.45 0.28 -1.26 -4.91 120.64 118.97 1gxi n GLU 28 Ca 0.70 0.00 0.04 0.00 -0.16 0.00 0.00 57.16 57.74 1gxi n GLU 28 Cb 0.29 0.00 -0.12 0.00 1.43 0.00 0.00 31.44 33.03 1gxi n GLU 28 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1gxi n LYS 29 N -2.59 0.81 -0.49 3.44 4.01 -1.09 -4.85 118.16 117.39 1gxi n LYS 29 Ca 0.00 -0.11 -0.12 0.00 -0.51 0.00 0.00 58.31 57.58 1gxi n LYS 29 Cb 0.00 -1.38 -0.04 0.00 -0.51 0.00 0.00 35.03 33.10 1gxi n LYS 29 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1gxi n SER 30 N -2.20 3.05 -2.02 4.39 7.64 0.06 -4.29 113.62 120.25 1gxi n SER 30 Ca -0.09 -2.10 -0.21 0.00 1.01 0.00 0.00 58.87 57.48 1gxi n SER 30 Cb 0.58 -0.80 0.12 0.00 -1.01 0.00 0.00 64.21 63.10 1gxi n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gxi n GLY 31 N 3.39 4.31 0.00 0.23 0.00 -1.26 -4.84 105.19 107.01 1gxi n GLY 31 Ca 0.27 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1gxi n GLY 31 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1gxi n ILE 32 N -0.68 0.00 -0.00 -0.61 5.41 -1.26 -5.11 119.36 117.10 1gxi n ILE 32 Ca 0.48 0.00 -0.00 0.00 1.00 0.00 0.00 62.75 64.23 1gxi n ILE 32 Cb 1.20 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 40.13 1gxi n ILE 32 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1gxi n LEU 33 N 0.00 0.10 -4.94 1.39 7.94 -1.26 -5.03 117.00 115.19 1gxi n LEU 33 Ca 0.00 0.26 -0.25 0.00 -1.11 0.00 0.00 56.01 54.91 1gxi n LEU 33 Cb 0.00 -0.52 -0.02 0.00 0.53 0.00 0.00 43.42 43.41 1gxi n LEU 33 CO 0.00 -0.50 0.05 -0.31 -1.11 0.00 0.00 177.39 175.52 1gxi s TYR 34 N -1.07 3.48 -0.16 1.96 1.51 -1.26 -5.08 117.35 116.73 1gxi s TYR 34 Ca -0.01 0.26 -0.23 0.00 -1.01 0.00 0.00 57.07 56.08 1gxi s TYR 34 Cb 0.00 -1.80 -0.21 0.00 -0.11 0.00 0.00 41.96 39.84 1gxi s TYR 34 CO 0.01 0.33 0.48 -1.00 -1.11 0.00 0.00 175.55 174.27 1gxi h PRO 35 N 1.53 0.00 -6.68 -1.71 0.13 -1.89 -3.46 132.00 119.92 1gxi h PRO 35 Ca -0.49 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.08 1gxi h PRO 35 Cb 1.21 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.27 1gxi h PRO 35 CO 0.65 0.88 0.94 0.08 -0.23 0.00 0.00 178.00 180.32 1gxi s VAL 36 N -2.22 4.18 -0.52 1.56 1.01 -1.03 -4.22 120.40 119.15 1gxi s VAL 36 Ca -0.21 1.21 -0.08 0.00 0.00 0.00 0.00 61.98 62.90 1gxi s VAL 36 Cb 0.00 -4.56 0.13 0.00 0.00 0.00 0.00 36.38 31.96 1gxi s VAL 36 CO 0.59 -0.97 0.38 -0.63 0.00 0.00 0.00 175.10 174.47 1gxi s ILE 37 N 4.53 4.16 -0.05 2.22 1.01 -1.26 -0.43 121.20 131.38 1gxi s ILE 37 Ca 0.49 -2.07 -0.00 0.00 0.00 0.00 0.00 60.65 59.07 1gxi s ILE 37 Cb -0.08 -3.73 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 1gxi s ILE 37 CO 0.31 -0.81 -0.00 -0.69 0.00 0.00 0.00 174.94 173.76 1gxi s VAL 38 N 1.00 4.23 0.42 2.92 1.01 -0.41 0.67 120.40 130.24 1gxi s VAL 38 Ca 0.09 -0.39 -0.24 0.00 0.00 0.00 0.00 61.98 61.43 1gxi s VAL 38 Cb -0.23 -2.82 -0.08 0.00 0.00 0.00 0.00 36.38 33.25 1gxi s VAL 38 CO -0.02 0.51 1.18 -0.60 0.00 0.00 0.00 175.10 176.17 1gxi s ARG 39 N -1.15 3.94 0.21 2.72 3.52 0.21 -1.88 118.95 126.52 1gxi s ARG 39 Ca 0.16 1.83 -0.15 0.00 -0.13 0.00 0.00 55.73 57.44 1gxi s ARG 39 Cb -0.11 -2.58 0.01 0.00 -1.56 0.00 0.00 34.95 30.70 1gxi s ARG 39 CO 0.05 -0.41 0.49 -0.06 -0.81 0.00 0.00 175.30 174.56 1gxi s PHE 40 N -1.45 0.11 -0.11 5.12 0.40 -1.23 -3.97 117.98 116.85 1gxi s PHE 40 Ca 0.59 -0.48 0.13 0.00 -0.60 0.00 0.00 56.93 56.57 1gxi s PHE 40 Cb -0.30 0.28 -0.18 0.00 0.51 0.00 0.00 43.02 43.33 1gxi s PHE 40 CO 0.38 -0.94 0.11 -3.47 0.70 0.00 0.00 175.22 171.99 1gxi n ASP 41 N -0.34 1.59 -1.86 1.36 2.03 -1.26 -4.75 116.55 113.32 1gxi n ASP 41 Ca -0.06 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.20 1gxi n ASP 41 Cb 0.62 1.02 -0.07 0.00 -0.72 0.00 0.00 41.12 41.97 1gxi n ASP 41 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1gxi n ARG 42 N -2.41 1.20 -2.58 -0.67 1.74 -1.26 -4.90 116.66 107.78 1gxi n ARG 42 Ca -0.18 -0.41 -0.23 0.00 -0.77 0.00 0.00 57.85 56.25 1gxi n ARG 42 Cb 0.83 -1.51 0.10 0.00 -1.02 0.00 0.00 32.46 30.86 1gxi n ARG 42 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1gxi s VAL 43 N 0.94 2.19 -1.42 1.55 -7.23 -1.26 -4.66 120.40 110.51 1gxi s VAL 43 Ca 0.27 -0.59 -0.10 0.00 -1.81 0.00 0.00 61.98 59.76 1gxi s VAL 43 Cb 0.13 -2.60 0.06 0.00 0.56 0.00 0.00 36.38 34.54 1gxi s VAL 43 CO 0.00 0.00 2.36 -3.20 -0.31 0.00 0.00 175.10 173.95 1gxi n ASN 44 N -2.79 6.47 -3.10 4.85 5.15 -1.25 -4.87 115.26 119.72 1gxi n ASN 44 Ca 0.14 -2.92 -0.11 0.00 -0.60 0.00 0.00 54.58 51.09 1gxi n ASN 44 Cb 0.60 -1.51 -0.01 0.00 -0.53 0.00 0.00 39.78 38.33 1gxi n ASN 44 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1gxi n TYR 45 N 3.76 0.52 -1.15 1.20 4.01 -1.26 -3.35 117.16 120.89 1gxi n TYR 45 Ca 0.58 -1.04 -0.12 0.00 -0.16 0.00 0.00 57.90 57.16 1gxi n TYR 45 Cb 0.31 -1.01 0.25 0.00 -0.31 0.00 0.00 39.34 38.58 1gxi n TYR 45 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1gxi n ASN 46 N 4.95 4.21 -4.71 7.72 5.03 -1.26 -4.95 115.26 126.25 1gxi n ASN 46 Ca 0.19 -3.41 -0.35 0.00 0.87 0.00 0.00 54.58 51.88 1gxi n ASN 46 Cb 0.07 -0.76 -0.08 0.00 -1.02 0.00 0.00 39.78 37.98 1gxi n ASN 46 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1gxi s GLY 47 N -1.31 2.02 0.00 7.41 0.00 -1.24 -4.81 107.32 109.39 1gxi s GLY 47 Ca 0.54 -0.75 0.20 0.00 0.00 0.00 0.00 44.72 44.71 1gxi s GLY 47 CO 0.11 0.21 1.44 0.33 0.00 0.00 0.00 173.10 175.19 1gxi n PHE 48 N 3.74 0.49 -0.07 1.90 7.35 -1.26 -3.33 117.46 126.28 1gxi n PHE 48 Ca -0.16 -0.24 -0.08 0.00 -0.76 0.00 0.00 57.45 56.21 1gxi n PHE 48 Cb 0.52 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.32 1gxi n PHE 48 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1gxi n SER 49 N 0.95 1.80 0.00 -2.13 3.41 -1.26 -5.10 113.62 111.28 1gxi n SER 49 Ca 0.18 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 1gxi n SER 49 Cb 0.45 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 1gxi n SER 49 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gxi n GLY 50 N 1.80 -1.26 3.29 5.00 0.00 -1.21 -5.08 105.19 107.73 1gxi n GLY 50 Ca -0.12 0.47 -0.45 0.00 0.00 0.00 0.00 46.02 45.92 1gxi n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gxi s SER 51 N -1.60 6.38 -0.18 1.61 0.01 -1.26 -3.66 113.70 115.00 1gxi s SER 51 Ca 0.00 -2.48 -0.16 0.00 1.31 0.00 0.00 55.95 54.62 1gxi s SER 51 Cb 0.00 -2.15 -0.06 0.00 0.21 0.00 0.00 66.02 64.02 1gxi s SER 51 CO 0.00 -0.61 -0.32 0.00 0.41 0.00 0.00 173.24 172.72 1gxi n ALA 52 N 4.23 0.84 -1.01 1.44 0.00 -1.26 -4.68 120.51 120.06 1gxi n ALA 52 Ca 0.06 -0.78 0.09 0.00 0.00 0.00 0.00 53.44 52.82 1gxi n ALA 52 Cb 0.44 0.03 0.15 0.00 0.00 0.00 0.00 19.45 20.07 1gxi n ALA 52 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1gxi n SER 53 N -4.47 2.56 -4.14 0.00 3.41 -1.25 -4.96 113.62 104.78 1gxi n SER 53 Ca -0.16 -3.03 -0.37 0.00 -0.26 0.00 0.00 58.87 55.04 1gxi n SER 53 Cb 0.51 -0.43 -0.10 0.00 -0.26 0.00 0.00 64.21 63.93 1gxi n SER 53 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1gxi s GLY 54 N -2.66 2.16 -0.40 5.00 0.00 -1.21 -3.85 107.32 106.35 1gxi s GLY 54 Ca 0.32 -2.75 -0.19 0.00 0.00 0.00 0.00 44.72 42.09 1gxi s GLY 54 CO 0.04 1.07 0.57 -1.34 0.00 0.00 0.00 173.10 173.44 1gxi s VAL 55 N 0.83 4.93 -0.29 1.40 -7.23 -1.26 -4.75 120.40 114.03 1gxi s VAL 55 Ca 0.10 0.13 0.02 0.00 -1.81 0.00 0.00 61.98 60.42 1gxi s VAL 55 Cb -0.22 -4.10 0.21 0.00 0.56 0.00 0.00 36.38 32.83 1gxi s VAL 55 CO -0.03 -0.44 1.18 0.59 -0.31 0.00 0.00 175.10 176.09 1gxi n ASN 56 N 5.98 3.03 -3.73 4.85 3.02 -1.26 -4.66 115.26 122.49 1gxi n ASN 56 Ca -0.03 -2.44 -0.14 0.00 -0.03 0.00 0.00 54.58 51.94 1gxi n ASN 56 Cb 0.48 -0.59 -0.08 0.00 -0.61 0.00 0.00 39.78 38.98 1gxi n ASN 56 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1gxi s THR 57 N -1.13 0.05 0.26 3.41 -4.23 -1.25 -3.49 115.64 109.26 1gxi s THR 57 Ca 0.17 -0.39 -0.21 0.00 -1.18 0.00 0.00 61.69 60.08 1gxi s THR 57 Cb 0.14 -0.65 0.03 0.00 1.34 0.00 0.00 72.50 73.35 1gxi s THR 57 CO 0.04 -0.21 0.68 0.54 -0.54 0.00 0.00 174.62 175.12 1gxi s ASN 58 N -1.21 -0.29 -0.37 3.99 2.20 -0.79 -4.89 114.94 113.58 1gxi s ASN 58 Ca -0.12 -0.54 -0.15 0.00 -0.94 0.00 0.00 52.86 51.10 1gxi s ASN 58 Cb -0.04 0.70 -0.00 0.00 -2.00 0.00 0.00 41.25 39.90 1gxi s ASN 58 CO 0.05 -1.27 0.36 0.21 -2.94 0.00 0.00 177.10 173.50 1gxi s ASN 59 N -2.90 6.16 0.41 3.54 3.04 -1.26 -1.28 114.94 122.65 1gxi s ASN 59 Ca 0.10 -0.45 0.07 0.00 0.04 0.00 0.00 52.86 52.62 1gxi s ASN 59 Cb -0.05 -2.19 -0.07 0.00 -1.54 0.00 0.00 41.25 37.40 1gxi s ASN 59 CO 0.04 -0.40 0.06 -0.36 -3.04 0.00 0.00 177.10 173.40 1gxi s PHE 60 N 1.97 2.53 -0.22 0.43 0.40 0.43 -5.01 117.98 118.50 1gxi s PHE 60 Ca 0.10 -0.65 0.02 0.00 -0.60 0.00 0.00 56.93 55.80 1gxi s PHE 60 Cb -0.17 -1.83 0.05 0.00 0.51 0.00 0.00 43.02 41.58 1gxi s PHE 60 CO 0.12 0.36 -0.11 0.00 0.70 0.00 0.00 175.22 176.29 1gxi s ALA 61 N -2.68 2.24 0.17 5.36 0.00 -1.26 -2.47 121.76 123.12 1gxi s ALA 61 Ca 0.36 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.90 1gxi s ALA 61 Cb 0.08 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.81 1gxi s ALA 61 CO 0.19 -0.93 0.30 0.39 0.00 0.00 0.00 175.76 175.71 1gxi n GLU 62 N 4.59 0.01 -0.00 0.00 1.02 -1.26 -1.65 120.64 123.33 1gxi n GLU 62 Ca -0.15 0.25 -0.11 0.00 -0.02 0.00 0.00 57.16 57.13 1gxi n GLU 62 Cb 0.45 -0.81 -0.05 0.00 -0.02 0.00 0.00 31.44 31.02 1gxi n GLU 62 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 1gxi h ASN 63 N 0.00 0.07 -0.51 1.62 -1.24 -2.01 -3.26 115.58 110.24 1gxi h ASN 63 Ca 0.00 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.02 1gxi h ASN 63 Cb 0.59 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.64 1gxi h ASN 63 CO 0.00 0.06 0.00 -1.84 -1.29 0.00 0.00 177.43 174.36 1gxi n GLU 64 N -5.05 2.66 -4.10 6.67 0.00 -0.66 -4.86 120.64 115.30 1gxi n GLU 64 Ca -0.05 -2.03 -0.32 0.00 0.00 0.00 0.00 57.16 54.76 1gxi n GLU 64 Cb 0.04 -1.58 -0.16 0.00 0.00 0.00 0.00 31.44 29.74 1gxi n GLU 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1gxi s LEU 65 N -1.26 2.15 -0.09 -1.84 2.01 -1.23 0.15 118.68 118.57 1gxi s LEU 65 Ca 0.37 -0.68 0.00 0.00 0.01 0.00 0.00 54.13 53.83 1gxi s LEU 65 Cb 0.22 -1.43 -0.03 0.00 0.01 0.00 0.00 46.19 44.97 1gxi s LEU 65 CO 0.21 -0.03 -0.08 -1.61 1.01 0.00 0.00 176.35 175.86 1gxi s GLU 66 N 1.31 3.01 0.37 1.70 0.41 -1.10 -4.87 118.70 119.54 1gxi s GLU 66 Ca 0.04 -0.58 -0.27 0.00 -0.41 0.00 0.00 54.97 53.75 1gxi s GLU 66 Cb -0.14 -2.64 -0.11 0.00 -1.78 0.00 0.00 34.13 29.46 1gxi s GLU 66 CO -0.12 0.51 1.37 -0.11 -0.49 0.00 0.00 175.26 176.42 1gxi n LEU 67 N 2.69 4.20 0.00 1.80 0.00 -1.26 0.51 117.00 124.94 1gxi n LEU 67 Ca -0.18 1.20 0.00 0.00 0.00 0.00 0.00 56.01 57.03 1gxi n LEU 67 Cb 0.53 -1.55 0.00 0.00 0.00 0.00 0.00 43.42 42.40 1gxi n LEU 67 CO 0.29 -0.23 -0.01 0.52 0.00 0.00 0.00 177.39 177.96 1gxi n VAL 68 N 0.27 0.00 -3.80 1.96 0.31 -0.50 -4.84 118.33 111.73 1gxi n VAL 68 Ca 0.04 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.00 1gxi n VAL 68 Cb 0.38 -0.01 -0.12 0.00 -0.91 0.00 0.00 33.84 33.18 1gxi n VAL 68 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1gxi s GLN 69 N -1.01 2.27 -0.62 5.55 0.74 -1.19 -4.87 119.66 120.54 1gxi s GLN 69 Ca 0.00 -1.53 -0.09 0.00 0.05 0.00 0.00 55.36 53.79 1gxi s GLN 69 Cb 0.00 -3.46 -0.08 0.00 1.10 0.00 0.00 33.01 30.57 1gxi s GLN 69 CO 0.00 -0.87 1.78 0.00 -0.55 0.00 0.00 175.29 175.65 1gxi n ALA 70 N 4.66 3.34 -1.89 1.58 0.00 -1.26 -4.01 120.51 122.93 1gxi n ALA 70 Ca -0.08 -1.82 -0.42 0.00 0.00 0.00 0.00 53.44 51.13 1gxi n ALA 70 Cb 0.43 -3.05 -0.00 0.00 0.00 0.00 0.00 19.45 16.82 1gxi n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gxi n ALA 71 N 5.31 5.90 -0.19 0.00 0.00 -1.26 -4.88 120.51 125.39 1gxi n ALA 71 Ca 0.35 -3.99 -0.02 0.00 0.00 0.00 0.00 53.44 49.78 1gxi n ALA 71 Cb 0.17 -3.26 -0.03 0.00 0.00 0.00 0.00 19.45 16.33 1gxi n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gxi n ALA 72 N 4.60 2.12 0.32 0.00 0.00 -1.26 -4.31 120.51 121.97 1gxi n ALA 72 Ca 0.53 -0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.71 1gxi n ALA 72 Cb 0.34 -2.15 0.03 0.00 0.00 0.00 0.00 19.45 17.67 1gxi n ALA 72 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67