#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 0.00 0.00 -0.00 -1.26 -5.14 117.00 110.60 1gxi n LEU 2 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.91 1gxi n LEU 2 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.38 1gxi n LEU 2 CO 0.00 0.00 -0.01 0.59 -0.00 0.00 0.00 177.39 177.97 1gxi n ASN 3 N 0.00 -0.52 -3.48 1.45 5.03 -1.26 -5.07 115.26 111.41 1gxi n ASN 3 Ca 0.00 -2.21 -0.40 0.00 0.87 0.00 0.00 54.58 52.84 1gxi n ASN 3 Cb 0.00 1.10 -0.01 0.00 -1.02 0.00 0.00 39.78 39.86 1gxi n ASN 3 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32 1gxi n ARG 4 N -0.35 4.49 0.00 3.52 0.00 -1.26 -3.71 116.66 119.35 1gxi n ARG 4 Ca 0.03 -3.37 0.00 0.00 -0.00 0.00 0.00 57.85 54.52 1gxi n ARG 4 Cb 0.34 -2.66 0.00 0.00 -0.00 0.00 0.00 32.46 30.15 1gxi n ARG 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1gxi n GLY 5 N 1.91 0.00 3.74 2.89 0.00 -1.17 -4.86 105.19 107.69 1gxi n GLY 5 Ca 0.63 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.24 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 0.00 7.35 -1.28 1.61 -1.08 -1.24 -4.80 116.67 117.22 1gxi s ASP 6 Ca 0.00 2.03 -0.18 0.00 -0.52 0.00 0.00 52.55 53.88 1gxi s ASP 6 Cb 0.00 -2.60 0.08 0.00 -1.46 0.00 0.00 42.92 38.93 1gxi s ASP 6 CO 0.00 -0.15 1.70 -0.54 0.52 0.00 0.00 175.17 176.70 1gxi s LYS 7 N -0.45 3.98 -0.01 4.34 1.02 -1.25 -1.82 119.74 125.54 1gxi s LYS 7 Ca 0.48 -2.00 -0.19 0.00 0.02 0.00 0.00 55.97 54.27 1gxi s LYS 7 Cb -0.28 -5.49 -0.05 0.00 -0.52 0.00 0.00 37.83 31.48 1gxi s LYS 7 CO 0.34 -2.22 0.55 0.14 -0.92 0.00 0.00 175.35 173.24 1gxi s VAL 8 N 4.05 4.94 -0.42 3.17 -7.23 -0.91 -3.15 120.40 120.85 1gxi s VAL 8 Ca 0.53 1.14 -0.18 0.00 -1.81 0.00 0.00 61.98 61.66 1gxi s VAL 8 Cb 0.03 -3.88 0.02 0.00 0.56 0.00 0.00 36.38 33.11 1gxi s VAL 8 CO 0.06 0.45 0.48 -0.60 -0.31 0.00 0.00 175.10 175.18 1gxi s ARG 9 N -0.32 3.17 -0.37 4.82 3.52 0.18 -2.45 118.95 127.51 1gxi s ARG 9 Ca 0.29 -0.64 -0.34 0.00 -0.13 0.00 0.00 55.73 54.91 1gxi s ARG 9 Cb -0.18 -3.95 -0.11 0.00 -1.56 0.00 0.00 34.95 29.15 1gxi s ARG 9 CO 0.16 -0.87 2.23 -0.89 -0.81 0.00 0.00 175.30 175.12 1gxi n ILE 10 N 5.52 0.18 -2.37 4.11 2.08 -0.29 -2.40 119.36 126.19 1gxi n ILE 10 Ca -0.06 -0.31 -0.28 0.00 0.56 0.00 0.00 62.75 62.66 1gxi n ILE 10 Cb 0.48 -1.78 0.01 0.00 -0.75 0.00 0.00 39.64 37.59 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 8.34 3.38 -3.83 0.38 4.76 0.12 -1.58 118.16 129.73 1gxi n LYS 11 Ca 0.41 -4.37 -0.35 0.00 -2.87 0.00 0.00 58.31 51.13 1gxi n LYS 11 Cb 0.27 -2.26 -0.09 0.00 -1.84 0.00 0.00 35.03 31.11 1gxi n LYS 11 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1gxi s ARG 12 N -3.60 4.07 -0.06 1.97 3.52 -1.26 -4.80 118.95 118.80 1gxi s ARG 12 Ca 0.49 -0.28 -0.12 0.00 -0.13 0.00 0.00 55.73 55.68 1gxi s ARG 12 Cb 0.41 -3.35 -0.08 0.00 -1.56 0.00 0.00 34.95 30.36 1gxi s ARG 12 CO -0.18 0.24 0.50 1.79 -0.81 0.00 0.00 175.30 176.83 1gxi h THR 13 N 4.82 0.21 0.00 4.11 1.35 -1.98 -3.32 112.91 118.11 1gxi h THR 13 Ca -0.39 -0.87 -0.05 0.00 -0.55 0.00 0.00 66.41 64.55 1gxi h THR 13 Cb 1.16 0.37 -0.02 0.00 -1.73 0.00 0.00 68.15 67.93 1gxi h THR 13 CO 0.72 0.06 0.20 -0.62 -0.25 0.00 0.00 175.52 175.63 1gxi n GLU 14 N -4.98 0.57 -3.66 4.72 -0.58 -1.26 -4.71 120.64 110.73 1gxi n GLU 14 Ca -0.05 -0.27 -0.05 0.00 -0.42 0.00 0.00 57.16 56.38 1gxi n GLU 14 Cb 0.17 -1.61 -0.02 0.00 -0.57 0.00 0.00 31.44 29.41 1gxi n GLU 14 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1gxi s SER 15 N 2.61 -0.23 -0.09 1.62 0.01 -1.26 -5.05 113.70 111.31 1gxi s SER 15 Ca 0.18 -0.25 0.12 0.00 1.31 0.00 0.00 55.95 57.31 1gxi s SER 15 Cb 0.09 0.43 0.49 0.00 0.21 0.00 0.00 66.02 67.23 1gxi s SER 15 CO 0.00 -0.76 1.33 0.00 0.41 0.00 0.00 173.24 174.22 1gxi n TYR 16 N -0.39 1.05 -0.37 2.43 4.11 -1.26 -4.10 117.16 118.63 1gxi n TYR 16 Ca -0.07 -0.41 0.04 0.00 -0.00 0.00 0.00 57.90 57.47 1gxi n TYR 16 Cb 0.61 -0.21 0.10 0.00 -0.00 0.00 0.00 39.34 39.84 1gxi n TYR 16 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.86 177.77 1gxi n TRP 17 N 0.63 0.24 -1.67 -3.48 8.01 -1.26 -5.03 117.44 114.88 1gxi n TRP 17 Ca 0.17 -0.64 -0.40 0.00 -1.31 0.00 0.00 57.50 55.32 1gxi n TRP 17 Cb 0.67 -0.10 -0.03 0.00 -2.01 0.00 0.00 31.31 29.84 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 -1.58 1.25 0.00 -5.99 5.04 -1.25 -2.43 117.35 112.39 1gxi s TYR 18 Ca 0.17 0.92 0.00 0.00 -2.44 0.00 0.00 57.07 55.72 1gxi s TYR 18 Cb 0.13 -3.85 0.00 0.00 0.35 0.00 0.00 41.96 38.59 1gxi s TYR 18 CO 0.06 -3.29 0.00 0.41 -1.34 0.00 0.00 175.55 171.38 1gxi n GLY 19 N 5.80 0.99 3.89 8.97 0.00 -0.61 -5.02 105.19 119.21 1gxi n GLY 19 Ca 0.31 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.08 4.83 0.55 1.61 2.15 -1.02 -4.99 116.67 117.72 1gxi s ASP 20 Ca 0.00 -1.00 0.06 0.00 0.43 0.00 0.00 52.55 52.04 1gxi s ASP 20 Cb 0.00 -0.05 0.05 0.00 -0.30 0.00 0.00 42.92 42.62 1gxi s ASP 20 CO 0.00 -0.91 0.45 0.54 -0.17 0.00 0.00 175.17 175.08 1gxi s VAL 21 N -2.63 1.69 -0.02 1.11 0.11 -1.26 -1.14 120.40 118.26 1gxi s VAL 21 Ca 0.43 -1.43 -0.30 0.00 -2.93 0.00 0.00 61.98 57.75 1gxi s VAL 21 Cb -0.02 -2.13 0.11 0.00 -1.53 0.00 0.00 36.38 32.81 1gxi s VAL 21 CO 0.26 0.00 1.30 -0.83 -3.33 0.00 0.00 175.10 172.49 1gxi s GLY 22 N -4.33 -0.28 -0.30 6.54 0.00 -1.03 -4.75 107.32 103.17 1gxi s GLY 22 Ca 0.37 0.39 -0.08 0.00 0.00 0.00 0.00 44.72 45.40 1gxi s GLY 22 CO 0.23 2.69 0.11 -1.59 0.00 0.00 0.00 173.10 174.55 1gxi s THR 23 N -2.20 4.23 -1.03 0.90 2.01 -1.24 -2.15 115.64 116.17 1gxi s THR 23 Ca 0.21 -0.59 -0.24 0.00 0.31 0.00 0.00 61.69 61.39 1gxi s THR 23 Cb 0.03 -3.17 -0.08 0.00 0.01 0.00 0.00 72.50 69.28 1gxi s THR 23 CO -0.02 0.07 1.97 0.54 -0.69 0.00 0.00 174.62 176.49 1gxi s VAL 24 N 1.55 3.45 -0.38 3.82 0.11 -0.76 -0.03 120.40 128.16 1gxi s VAL 24 Ca 0.03 -0.57 -0.04 0.00 -2.93 0.00 0.00 61.98 58.47 1gxi s VAL 24 Cb -0.17 -4.20 0.01 0.00 -1.53 0.00 0.00 36.38 30.49 1gxi s VAL 24 CO 0.04 -0.87 2.91 0.00 -3.33 0.00 0.00 175.10 173.85 1gxi n ALA 25 N 14.70 6.45 -0.18 1.54 0.00 0.02 -3.06 120.51 139.98 1gxi n ALA 25 Ca 0.43 -2.85 0.00 0.00 0.00 0.00 0.00 53.44 51.01 1gxi n ALA 25 Cb 0.47 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.74 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 1.14 0.00 -2.93 0.00 3.41 -1.21 -4.73 113.62 109.30 1gxi n SER 26 Ca 0.48 0.11 -0.31 0.00 -0.26 0.00 0.00 58.87 58.89 1gxi n SER 26 Cb 0.61 -0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 64.08 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 -2.16 3.99 0.00 -3.33 3.14 -1.26 0.57 118.33 119.28 1gxi n VAL 27 Ca 0.00 -2.42 0.00 0.00 -2.96 0.00 0.00 64.34 58.96 1gxi n VAL 27 Cb 0.00 -2.37 0.00 0.00 -1.06 0.00 0.00 33.84 30.41 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 3.04 0.00 -0.07 1.45 0.28 -1.26 -4.64 120.64 119.44 1gxi n GLU 28 Ca 0.67 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 57.57 1gxi n GLU 28 Cb 0.44 -0.20 -0.07 0.00 1.43 0.00 0.00 31.44 33.04 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 -2.06 0.50 -0.54 3.44 4.76 0.13 -4.88 118.16 119.50 1gxi n LYS 29 Ca 0.00 0.07 -0.10 0.00 -2.87 0.00 0.00 58.31 55.41 1gxi n LYS 29 Cb 0.00 -1.28 -0.06 0.00 -1.84 0.00 0.00 35.03 31.85 1gxi n LYS 29 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1gxi n SER 30 N -2.87 3.17 -2.23 4.39 7.64 0.19 -4.42 113.62 119.49 1gxi n SER 30 Ca -0.24 -2.08 -0.21 0.00 1.01 0.00 0.00 58.87 57.34 1gxi n SER 30 Cb 0.77 -0.81 -0.05 0.00 -1.01 0.00 0.00 64.21 63.11 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 3.10 4.04 0.00 0.23 0.00 -1.26 -4.70 105.19 106.60 1gxi n GLY 31 Ca 0.27 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 0.97 0.00 -0.15 -0.61 5.41 -1.26 -5.10 119.36 118.63 1gxi n ILE 32 Ca 0.42 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 64.07 1gxi n ILE 32 Cb 0.61 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.53 1gxi n ILE 32 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1gxi h LEU 33 N 0.00 0.72 -8.80 1.39 5.85 -1.99 -3.43 115.31 109.05 1gxi h LEU 33 Ca 0.00 -0.29 -0.64 0.00 0.84 0.00 0.00 57.88 57.79 1gxi h LEU 33 Cb 0.00 -0.19 -0.22 0.00 0.37 0.00 0.00 40.66 40.62 1gxi h LEU 33 CO 0.00 0.83 -0.66 -0.31 -0.34 0.00 0.00 178.44 177.96 1gxi s TYR 34 N -5.08 3.03 0.09 1.25 2.02 -1.26 -5.02 117.35 112.38 1gxi s TYR 34 Ca -0.13 -0.34 0.10 0.00 -0.37 0.00 0.00 57.07 56.33 1gxi s TYR 34 Cb 0.11 -2.00 0.01 0.00 -0.40 0.00 0.00 41.96 39.67 1gxi s TYR 34 CO 0.80 -0.09 1.40 -1.00 -1.57 0.00 0.00 175.55 175.09 1gxi h PRO 35 N 6.94 0.00 -6.02 -1.71 0.13 -1.84 -3.45 132.00 126.05 1gxi h PRO 35 Ca -0.33 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.12 1gxi h PRO 35 Cb 1.19 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.12 1gxi h PRO 35 CO 0.63 0.78 -0.70 0.08 -0.23 0.00 0.00 178.00 178.56 1gxi s VAL 36 N -2.98 3.65 -0.05 1.56 1.01 -1.15 -4.30 120.40 118.15 1gxi s VAL 36 Ca 0.01 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 1gxi s VAL 36 Cb 0.10 -2.50 0.03 0.00 0.00 0.00 0.00 36.38 34.01 1gxi s VAL 36 CO 0.78 0.58 0.03 -0.63 0.00 0.00 0.00 175.10 175.87 1gxi s ILE 37 N -0.61 0.08 0.20 2.22 1.01 -1.26 0.34 121.20 123.18 1gxi s ILE 37 Ca 0.09 0.27 0.09 0.00 0.00 0.00 0.00 60.65 61.11 1gxi s ILE 37 Cb -0.12 -0.28 -0.04 0.00 0.01 0.00 0.00 42.46 42.03 1gxi s ILE 37 CO 0.02 0.20 -0.18 -0.69 0.00 0.00 0.00 174.94 174.29 1gxi s VAL 38 N 1.89 1.95 0.25 2.92 1.01 0.32 -0.80 120.40 127.93 1gxi s VAL 38 Ca 0.02 -2.11 -0.22 0.00 0.00 0.00 0.00 61.98 59.67 1gxi s VAL 38 Cb -0.12 -2.01 -0.09 0.00 0.00 0.00 0.00 36.38 34.16 1gxi s VAL 38 CO -0.03 -0.40 0.80 -0.60 0.00 0.00 0.00 175.10 174.86 1gxi s ARG 39 N -3.18 4.39 -0.07 2.72 3.00 0.96 -2.83 118.95 123.94 1gxi s ARG 39 Ca 0.21 1.05 0.02 0.00 -1.00 0.00 0.00 55.73 56.01 1gxi s ARG 39 Cb -0.04 -2.89 0.02 0.00 0.00 0.00 0.00 34.95 32.03 1gxi s ARG 39 CO 0.08 0.37 -0.10 -0.06 0.00 0.00 0.00 175.30 175.60 1gxi s PHE 40 N -1.52 1.34 -0.49 5.12 0.08 -0.76 -3.65 117.98 118.11 1gxi s PHE 40 Ca 0.45 -0.51 0.22 0.00 0.12 0.00 0.00 56.93 57.21 1gxi s PHE 40 Cb -0.18 -1.02 -0.20 0.00 -0.57 0.00 0.00 43.02 41.04 1gxi s PHE 40 CO 0.22 -0.29 0.76 -0.40 -0.10 0.00 0.00 175.22 175.41 1gxi n ASP 41 N 4.01 0.49 -3.13 1.36 5.75 -1.26 -4.53 116.55 119.24 1gxi n ASP 41 Ca -0.22 -0.37 -0.30 0.00 -0.01 0.00 0.00 54.79 53.89 1gxi n ASP 41 Cb 0.51 1.35 -0.03 0.00 -1.03 0.00 0.00 41.12 41.92 1gxi n ASP 41 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gxi n ARG 42 N -1.95 3.72 -2.41 0.11 5.12 -1.26 -5.07 116.66 114.92 1gxi n ARG 42 Ca 0.00 -4.81 -0.25 0.00 -1.93 0.00 0.00 57.85 50.86 1gxi n ARG 42 Cb 0.46 -2.29 0.11 0.00 -1.16 0.00 0.00 32.46 29.57 1gxi n ARG 42 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1gxi s VAL 43 N -4.34 2.19 -1.35 1.55 0.11 -1.26 -4.94 120.40 112.35 1gxi s VAL 43 Ca 0.46 -0.44 -0.11 0.00 -2.93 0.00 0.00 61.98 58.96 1gxi s VAL 43 Cb 0.25 -2.74 0.11 0.00 -1.53 0.00 0.00 36.38 32.47 1gxi s VAL 43 CO -0.13 0.00 2.04 -3.20 -3.33 0.00 0.00 175.10 170.48 1gxi n ASN 44 N -2.97 4.75 0.00 3.54 5.15 -1.26 -4.85 115.26 119.63 1gxi n ASN 44 Ca 0.13 -3.00 0.00 0.00 -0.60 0.00 0.00 54.58 51.11 1gxi n ASN 44 Cb 0.60 -1.54 0.00 0.00 -0.53 0.00 0.00 39.78 38.31 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 4.63 0.00 -3.55 1.20 4.01 -1.26 -4.51 117.16 117.68 1gxi n TYR 45 Ca 0.45 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.82 1gxi n TYR 45 Cb 0.37 -0.22 -0.09 0.00 -0.31 0.00 0.00 39.34 39.09 1gxi n TYR 45 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1gxi s ASN 46 N -2.35 6.25 -0.53 7.72 4.22 -1.26 -4.74 114.94 124.25 1gxi s ASN 46 Ca 0.00 0.28 -0.28 0.00 -2.14 0.00 0.00 52.86 50.72 1gxi s ASN 46 Cb 0.00 -2.16 0.00 0.00 1.28 0.00 0.00 41.25 40.37 1gxi s ASN 46 CO 0.00 0.01 1.55 -0.83 -2.04 0.00 0.00 177.10 175.78 1gxi s GLY 47 N 1.04 0.77 0.00 0.45 0.00 -1.26 -4.64 107.32 103.69 1gxi s GLY 47 Ca 0.12 -0.50 0.00 0.00 0.00 0.00 0.00 44.72 44.34 1gxi s GLY 47 CO 0.06 2.97 0.00 0.33 0.00 0.00 0.00 173.10 176.46 1gxi n PHE 48 N 10.17 -0.88 -0.34 1.90 7.35 0.09 -4.82 117.46 130.94 1gxi n PHE 48 Ca 0.15 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.97 1gxi n PHE 48 Cb 0.49 0.00 0.33 0.00 0.35 0.00 0.00 39.48 40.66 1gxi n PHE 48 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 1gxi h SER 49 N 0.00 0.76 -0.81 -2.13 0.02 -2.01 0.06 113.55 109.44 1gxi h SER 49 Ca 0.00 0.08 -0.43 0.00 -0.84 0.00 0.00 61.79 60.60 1gxi h SER 49 Cb 0.00 -0.06 -0.25 0.00 0.14 0.00 0.00 62.40 62.23 1gxi h SER 49 CO 0.00 0.29 0.43 0.61 -1.14 0.00 0.00 176.83 177.03 1gxi n GLY 50 N -1.36 4.75 7.00 -3.77 0.00 -1.26 -5.08 105.19 105.47 1gxi n GLY 50 Ca 0.22 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1gxi n GLY 50 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gxi n SER 51 N -1.12 -0.36 0.00 1.61 3.41 0.01 -4.80 113.62 112.36 1gxi n SER 51 Ca 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 1gxi n SER 51 Cb 1.41 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1gxi n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gxi n ALA 52 N 3.00 0.00 -0.29 7.33 0.00 -1.26 -0.73 120.51 128.55 1gxi n ALA 52 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1gxi n ALA 52 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1gxi n ALA 52 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1gxi n SER 53 N 0.00 2.26 0.02 0.00 7.64 -1.26 -4.51 113.62 117.76 1gxi n SER 53 Ca 0.00 -1.72 -0.09 0.00 1.01 0.00 0.00 58.87 58.07 1gxi n SER 53 Cb 0.00 -0.53 -0.07 0.00 -1.01 0.00 0.00 64.21 62.60 1gxi n SER 53 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1gxi h GLY 54 N 4.32 -0.16 -7.15 0.23 0.00 -1.88 -3.41 103.07 95.02 1gxi h GLY 54 Ca 0.03 0.06 -0.72 0.00 0.00 0.00 0.00 47.33 46.70 1gxi h GLY 54 CO 0.14 -0.06 2.16 1.55 0.00 0.00 0.00 176.54 180.33 1gxi n VAL 55 N -4.85 3.99 -0.04 4.60 3.14 -1.26 -4.59 118.33 119.32 1gxi n VAL 55 Ca -0.07 -4.08 -0.07 0.00 -2.96 0.00 0.00 64.34 57.16 1gxi n VAL 55 Cb 0.25 -2.44 -0.14 0.00 -1.06 0.00 0.00 33.84 30.45 1gxi n VAL 55 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 1gxi n ASN 56 N 6.33 0.49 -3.94 6.55 0.23 -1.26 -4.82 115.26 118.84 1gxi n ASN 56 Ca 0.45 0.23 -0.22 0.00 -0.53 0.00 0.00 54.58 54.51 1gxi n ASN 56 Cb 0.42 0.49 -0.16 0.00 -2.08 0.00 0.00 39.78 38.44 1gxi n ASN 56 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1gxi s THR 57 N -2.66 0.77 -0.02 5.53 -4.23 -1.25 -1.82 115.64 111.95 1gxi s THR 57 Ca -0.07 -0.25 -0.22 0.00 -1.18 0.00 0.00 61.69 59.97 1gxi s THR 57 Cb 0.08 -0.75 0.04 0.00 1.34 0.00 0.00 72.50 73.21 1gxi s THR 57 CO 0.83 0.28 0.48 0.21 -0.54 0.00 0.00 174.62 175.88 1gxi s ASN 58 N 0.86 -0.40 -0.09 3.99 3.84 -1.13 -4.92 114.94 117.09 1gxi s ASN 58 Ca -0.12 0.36 -0.30 0.00 0.21 0.00 0.00 52.86 53.01 1gxi s ASN 58 Cb -0.15 0.42 -0.02 0.00 -0.55 0.00 0.00 41.25 40.95 1gxi s ASN 58 CO 0.01 -0.54 1.07 0.20 -2.79 0.00 0.00 177.10 175.06 1gxi s ASN 59 N -1.32 7.18 0.13 -4.21 -0.87 -1.26 -0.52 114.94 114.06 1gxi s ASN 59 Ca -0.12 1.62 0.06 0.00 -1.57 0.00 0.00 52.86 52.85 1gxi s ASN 59 Cb -0.03 -2.56 -0.04 0.00 -0.02 0.00 0.00 41.25 38.61 1gxi s ASN 59 CO 0.06 -0.50 -0.14 -0.36 -2.57 0.00 0.00 177.10 173.59 1gxi s PHE 60 N 2.11 1.45 -0.42 2.20 0.40 0.15 -4.94 117.98 118.94 1gxi s PHE 60 Ca 0.51 -0.55 -0.06 0.00 -0.60 0.00 0.00 56.93 56.23 1gxi s PHE 60 Cb -0.20 -0.75 0.10 0.00 0.51 0.00 0.00 43.02 42.68 1gxi s PHE 60 CO 0.19 0.17 0.23 0.00 0.70 0.00 0.00 175.22 176.51 1gxi s ALA 61 N -2.17 3.21 0.21 5.36 0.00 -1.26 -2.95 121.76 124.16 1gxi s ALA 61 Ca 0.10 -2.39 0.13 0.00 0.00 0.00 0.00 51.96 49.80 1gxi s ALA 61 Cb -0.05 -2.52 0.44 0.00 0.00 0.00 0.00 23.12 21.00 1gxi s ALA 61 CO 0.03 -1.75 0.51 -1.91 0.00 0.00 0.00 175.76 172.64 1gxi n GLU 62 N 4.74 0.00 -0.23 0.00 2.13 -1.26 -1.54 120.64 124.48 1gxi n GLU 62 Ca -0.06 0.38 0.01 0.00 0.66 0.00 0.00 57.16 58.14 1gxi n GLU 62 Cb 0.42 -0.92 0.08 0.00 0.27 0.00 0.00 31.44 31.29 1gxi n GLU 62 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 1gxi h ASN 63 N 0.00 -0.56 -0.57 4.31 -1.24 -2.02 -2.79 115.58 112.71 1gxi h ASN 63 Ca 0.24 0.20 0.00 0.00 0.71 0.00 0.00 56.30 57.45 1gxi h ASN 63 Cb 1.19 0.39 0.00 0.00 0.73 0.00 0.00 38.32 40.63 1gxi h ASN 63 CO -0.00 -0.21 0.00 -1.84 -1.29 0.00 0.00 177.43 174.09 1gxi n GLU 64 N -5.43 2.31 -4.05 6.67 0.00 -0.59 -4.87 120.64 114.68 1gxi n GLU 64 Ca 0.09 -2.03 -0.34 0.00 0.00 0.00 0.00 57.16 54.88 1gxi n GLU 64 Cb 0.36 -1.44 -0.15 0.00 0.00 0.00 0.00 31.44 30.21 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 -1.00 2.57 -0.34 -1.84 2.01 -1.05 0.13 118.68 119.15 1gxi s LEU 65 Ca 0.38 -0.49 -0.13 0.00 0.01 0.00 0.00 54.13 53.90 1gxi s LEU 65 Cb 0.20 -1.63 -0.02 0.00 0.01 0.00 0.00 46.19 44.75 1gxi s LEU 65 CO 0.26 -0.00 0.24 -1.61 1.01 0.00 0.00 176.35 176.25 1gxi s GLU 66 N 1.33 3.47 0.17 1.70 0.41 -1.01 -4.85 118.70 119.92 1gxi s GLU 66 Ca 0.04 -0.66 -0.31 0.00 -0.41 0.00 0.00 54.97 53.63 1gxi s GLU 66 Cb -0.14 -3.81 -0.09 0.00 -1.78 0.00 0.00 34.13 28.32 1gxi s GLU 66 CO -0.06 -0.46 1.41 -1.17 -0.49 0.00 0.00 175.26 174.49 1gxi s LEU 67 N 1.72 4.38 0.00 1.80 0.20 -1.26 0.50 118.68 126.02 1gxi s LEU 67 Ca 0.06 2.47 0.00 0.00 0.69 0.00 0.00 54.13 57.35 1gxi s LEU 67 Cb -0.17 -3.60 0.00 0.00 -0.43 0.00 0.00 46.19 41.99 1gxi s LEU 67 CO 0.10 -0.67 0.00 0.52 -0.29 0.00 0.00 176.35 176.02 1gxi n VAL 68 N 3.33 0.00 -3.80 1.68 0.31 -1.19 -4.94 118.33 113.71 1gxi n VAL 68 Ca 0.10 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.06 1gxi n VAL 68 Cb 0.41 -0.33 -0.12 0.00 -0.91 0.00 0.00 33.84 32.89 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 -1.62 2.38 -0.73 5.55 0.74 -1.25 -4.98 119.66 119.75 1gxi s GLN 69 Ca 0.00 -1.41 -0.12 0.00 0.05 0.00 0.00 55.36 53.88 1gxi s GLN 69 Cb 0.00 -3.41 -0.10 0.00 1.10 0.00 0.00 33.01 30.60 1gxi s GLN 69 CO 0.00 -0.78 1.90 0.00 -0.55 0.00 0.00 175.29 175.86 1gxi n ALA 70 N 4.69 3.66 -0.74 1.58 0.00 -1.26 -4.36 120.51 124.08 1gxi n ALA 70 Ca -0.10 -2.25 -0.15 0.00 0.00 0.00 0.00 53.44 50.94 1gxi n ALA 70 Cb 0.43 -3.19 -0.08 0.00 0.00 0.00 0.00 19.45 16.61 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 5.62 4.89 -2.57 0.00 0.00 -1.26 -4.91 120.51 122.28 1gxi n ALA 71 Ca 0.42 -1.64 -0.25 0.00 0.00 0.00 0.00 53.44 51.97 1gxi n ALA 71 Cb 0.22 -2.59 -0.01 0.00 0.00 0.00 0.00 19.45 17.07 1gxi n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gxi s ALA 72 N 2.20 3.63 -2.14 0.00 0.00 -1.26 -4.40 121.76 119.79 1gxi s ALA 72 Ca 0.45 -0.82 0.17 0.00 0.00 0.00 0.00 51.96 51.77 1gxi s ALA 72 Cb 0.18 -2.22 0.14 0.00 0.00 0.00 0.00 23.12 21.22 1gxi s ALA 72 CO -0.01 -0.10 1.04 1.63 0.00 0.00 0.00 175.76 178.32