#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i2z s HIS 0 N 0.00 -0.03 0.22 0.66 4.02 -1.26 -5.03 115.29 113.87 3i2z s HIS 0 Ca 0.00 0.03 0.06 0.00 1.02 0.00 0.00 55.06 56.18 3i2z s HIS 0 Cb 0.00 -0.01 0.18 0.00 -1.02 0.00 0.00 32.58 31.72 3i2z s HIS 0 CO 0.00 -0.24 1.50 1.98 1.02 0.00 0.00 174.74 179.01 3i2z h MET 1 N 4.69 0.13 -3.13 1.40 1.85 -2.04 -3.48 114.93 114.36 3i2z h MET 1 Ca -0.29 -0.11 -0.04 0.00 -0.61 0.00 0.00 59.70 58.65 3i2z h MET 1 Cb 1.19 0.02 -0.01 0.00 0.43 0.00 0.00 31.60 33.24 3i2z h MET 1 CO 0.40 0.79 0.21 -1.54 -0.40 0.00 0.00 176.91 176.38 3i2z s SER 2 N -6.87 0.07 0.62 1.39 1.04 -1.26 -5.15 113.70 103.54 3i2z s SER 2 Ca -0.02 -1.12 -0.18 0.00 0.48 0.00 0.00 55.95 55.10 3i2z s SER 2 Cb 0.12 0.82 -0.02 0.00 0.10 0.00 0.00 66.02 67.03 3i2z s SER 2 CO 0.80 -1.61 1.23 -0.54 0.98 0.00 0.00 173.24 174.10 3i2z s LYS 3 N -2.58 2.80 0.40 4.02 1.02 -1.26 -4.94 119.74 119.20 3i2z s LYS 3 Ca 0.17 1.88 0.06 0.00 0.02 0.00 0.00 55.97 58.09 3i2z s LYS 3 Cb -0.05 -1.90 -0.07 0.00 -0.52 0.00 0.00 37.83 35.29 3i2z s LYS 3 CO 0.12 -1.35 0.02 0.96 -0.92 0.00 0.00 175.35 174.18 3i2z s ILE 4 N -1.58 1.72 0.31 2.17 -4.36 0.02 -4.89 121.20 114.58 3i2z s ILE 4 Ca 0.78 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 59.26 3i2z s ILE 4 Cb -0.32 -2.86 -0.04 0.00 1.25 0.00 0.00 42.46 40.49 3i2z s ILE 4 CO 0.36 0.00 0.15 -0.54 0.24 0.00 0.00 174.94 175.15 3i2z s LYS 5 N -3.76 2.53 0.08 0.37 1.02 -1.26 -0.51 119.74 118.20 3i2z s LYS 5 Ca 0.32 -1.37 -0.26 0.00 0.02 0.00 0.00 55.97 54.69 3i2z s LYS 5 Cb 0.09 -2.31 0.09 0.00 -0.52 0.00 0.00 37.83 35.18 3i2z s LYS 5 CO 0.16 0.22 1.16 0.20 -0.92 0.00 0.00 175.35 176.18 3i2z s GLY 6 N -3.84 -0.03 -0.05 -3.33 0.00 -0.29 -0.56 107.32 99.21 3i2z s GLY 6 Ca 0.36 -0.10 0.04 0.00 0.00 0.00 0.00 44.72 45.01 3i2z s GLY 6 CO 0.23 3.74 -0.15 -1.31 0.00 0.00 0.00 173.10 175.62 3i2z s ASN 7 N -3.56 4.00 0.03 1.64 0.01 -0.77 -1.16 114.94 115.13 3i2z s ASN 7 Ca 0.25 -0.21 -0.30 0.00 -0.71 0.00 0.00 52.86 51.89 3i2z s ASN 7 Cb -0.01 -0.87 -0.07 0.00 0.41 0.00 0.00 41.25 40.71 3i2z s ASN 7 CO 0.02 0.34 1.67 -0.69 -1.51 0.00 0.00 177.10 176.93 3i2z s VAL 8 N -0.68 3.21 -0.06 1.60 1.01 -0.03 -0.80 120.40 124.66 3i2z s VAL 8 Ca 0.10 0.52 -0.20 0.00 0.00 0.00 0.00 61.98 62.41 3i2z s VAL 8 Cb -0.11 -3.34 -0.15 0.00 0.00 0.00 0.00 36.38 32.78 3i2z s VAL 8 CO 0.01 -0.02 0.80 0.50 0.00 0.00 0.00 175.10 176.39 3i2z h LYS 9 N 8.86 -0.19 -3.20 2.72 1.63 -1.10 0.88 116.57 126.17 3i2z h LYS 9 Ca -0.42 0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 59.32 3i2z h LYS 9 Cb 1.20 0.04 -0.15 0.00 -0.60 0.00 0.00 32.23 32.72 3i2z h LYS 9 CO 0.94 0.24 -0.11 1.67 -3.45 0.00 0.00 179.45 178.73 3i2z s TRP 10 N -3.21 -0.22 -0.22 1.91 1.48 -1.16 -4.64 118.94 112.89 3i2z s TRP 10 Ca -0.12 0.07 -0.10 0.00 -1.06 0.00 0.00 56.10 54.89 3i2z s TRP 10 Cb 0.00 0.22 0.09 0.00 -1.16 0.00 0.00 33.47 32.61 3i2z s TRP 10 CO 0.45 -0.61 0.50 0.12 -4.06 0.00 0.00 176.95 173.35 3i2z s PHE 11 N -2.99 -0.88 -0.64 1.66 2.19 -1.26 -1.22 117.98 114.84 3i2z s PHE 11 Ca -0.02 1.69 -0.27 0.00 0.33 0.00 0.00 56.93 58.66 3i2z s PHE 11 Cb 0.00 0.43 0.03 0.00 -1.31 0.00 0.00 43.02 42.18 3i2z s PHE 11 CO -0.06 -0.48 1.21 1.21 1.83 0.00 0.00 175.22 178.93 3i2z s ASN 12 N 2.14 6.32 0.45 6.13 3.84 0.17 -4.77 114.94 129.23 3i2z s ASN 12 Ca -0.06 -0.16 0.25 0.00 0.21 0.00 0.00 52.86 53.10 3i2z s ASN 12 Cb -0.10 -2.55 0.89 0.00 -0.55 0.00 0.00 41.25 38.95 3i2z s ASN 12 CO -0.15 -1.61 1.81 -0.33 -2.79 0.00 0.00 177.10 174.03 3i2z h GLU 13 N 9.73 0.00 0.04 0.43 5.08 -1.85 0.26 114.58 128.26 3i2z h GLU 13 Ca -0.26 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.98 3i2z h GLU 13 Cb 1.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 3i2z h GLU 13 CO 1.22 0.18 -0.57 0.77 -1.00 0.00 0.00 179.01 179.61 3i2z h SER 14 N 0.00 0.12 1.57 1.42 0.02 -1.97 -3.37 113.55 111.35 3i2z h SER 14 Ca -0.00 -0.87 -0.06 0.00 -0.84 0.00 0.00 61.79 60.01 3i2z h SER 14 Cb 0.77 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 3i2z h SER 14 CO 0.02 1.24 -0.31 0.11 -1.14 0.00 0.00 176.83 176.76 3i2z h LYS 15 N -0.81 0.00 -1.69 3.45 1.79 -1.97 -3.48 116.57 113.85 3i2z h LYS 15 Ca -0.13 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.31 3i2z h LYS 15 Cb 1.26 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.92 3i2z h LYS 15 CO -0.01 0.31 -0.04 0.41 -1.08 0.00 0.00 179.45 179.03 3i2z n GLY 16 N 1.04 0.67 3.39 3.86 0.00 0.89 -4.93 105.19 110.12 3i2z n GLY 16 Ca 0.02 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 3i2z n GLY 16 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i2z s PHE 17 N -3.02 -0.09 -0.44 1.61 -0.71 -1.16 -0.56 117.98 113.62 3i2z s PHE 17 Ca 0.02 -0.25 0.00 0.00 -1.04 0.00 0.00 56.93 55.67 3i2z s PHE 17 Cb -0.01 0.26 0.00 0.00 -1.21 0.00 0.00 43.02 42.06 3i2z s PHE 17 CO 0.05 -0.78 0.00 0.41 -1.34 0.00 0.00 175.22 173.56 3i2z n GLY 18 N -0.26 -0.71 3.03 1.99 0.00 -0.14 -0.66 105.19 108.44 3i2z n GLY 18 Ca -0.13 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.36 3i2z n GLY 18 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i2z s PHE 19 N -3.66 0.55 -0.09 1.61 0.40 -0.36 -0.66 117.98 115.76 3i2z s PHE 19 Ca 0.00 -0.47 0.03 0.00 -0.60 0.00 0.00 56.93 55.89 3i2z s PHE 19 Cb 0.00 -0.34 -0.01 0.00 0.51 0.00 0.00 43.02 43.18 3i2z s PHE 19 CO 0.00 -0.10 -0.19 0.42 0.70 0.00 0.00 175.22 176.05 3i2z s ILE 20 N -1.30 2.56 -0.39 0.64 1.01 0.44 -0.47 121.20 123.69 3i2z s ILE 20 Ca -0.11 -0.86 -0.21 0.00 0.00 0.00 0.00 60.65 59.47 3i2z s ILE 20 Cb -0.09 -2.01 0.01 0.00 0.01 0.00 0.00 42.46 40.38 3i2z s ILE 20 CO 0.00 0.55 0.67 -0.89 0.00 0.00 0.00 174.94 175.27 3i2z s THR 21 N 0.09 4.83 0.64 2.92 2.01 0.02 -0.74 115.64 125.40 3i2z s THR 21 Ca -0.09 0.44 -0.16 0.00 0.31 0.00 0.00 61.69 62.19 3i2z s THR 21 Cb -0.15 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.19 3i2z s THR 21 CO 0.05 -0.46 1.12 -2.84 -0.69 0.00 0.00 174.62 171.80 3i2z s PRO 22 N 2.84 2.90 0.59 4.92 0.02 -1.26 -1.84 135.00 143.16 3i2z s PRO 22 Ca 0.25 1.46 0.31 0.00 0.02 0.00 0.00 61.00 63.04 3i2z s PRO 22 Cb -0.14 -1.96 1.85 0.00 0.02 0.00 0.00 34.50 34.28 3i2z s PRO 22 CO 0.17 -1.19 2.25 1.05 -0.33 0.00 0.00 177.00 178.96 3i2z h GLU 23 N 0.28 0.00 -0.27 5.54 4.11 -1.20 -3.25 114.58 119.81 3i2z h GLU 23 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3i2z h GLU 23 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3i2z h GLU 23 CO 0.54 0.01 0.00 -0.40 0.07 0.00 0.00 179.01 179.23 3i2z n ASP 24 N -3.76 2.15 0.00 3.06 5.68 -1.26 -4.91 116.55 117.51 3i2z n ASP 24 Ca -0.03 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.43 3i2z n ASP 24 Cb 0.09 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 3i2z n ASP 24 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3i2z n GLY 25 N 1.22 0.84 3.93 6.12 0.00 -1.23 -5.05 105.19 111.02 3i2z n GLY 25 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 3i2z n GLY 25 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i2z s SER 26 N -2.84 4.20 0.77 1.61 1.04 -1.26 -5.02 113.70 112.20 3i2z s SER 26 Ca 0.00 0.40 -0.14 0.00 0.48 0.00 0.00 55.95 56.69 3i2z s SER 26 Cb 0.00 -0.81 0.06 0.00 0.10 0.00 0.00 66.02 65.37 3i2z s SER 26 CO 0.00 -2.03 1.20 -1.59 0.98 0.00 0.00 173.24 171.80 3i2z s LYS 27 N -5.51 1.90 0.50 4.02 -2.85 -1.26 -4.43 119.74 112.12 3i2z s LYS 27 Ca 0.65 1.73 -0.23 0.00 -1.00 0.00 0.00 55.97 57.12 3i2z s LYS 27 Cb -0.08 -1.81 -0.07 0.00 -2.06 0.00 0.00 37.83 33.81 3i2z s LYS 27 CO 0.48 -2.01 1.30 -0.25 0.10 0.00 0.00 175.35 174.97 3i2z n ASP 28 N -3.04 2.53 -4.45 0.03 8.00 -1.26 -4.60 116.55 113.77 3i2z n ASP 28 Ca 0.13 1.02 -0.33 0.00 0.71 0.00 0.00 54.79 56.32 3i2z n ASP 28 Cb 0.50 -1.54 -0.13 0.00 -0.02 0.00 0.00 41.12 39.94 3i2z n ASP 28 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3i2z s VAL 29 N -1.27 3.54 0.31 2.53 1.01 0.08 -4.79 120.40 121.81 3i2z s VAL 29 Ca 0.67 -0.49 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 3i2z s VAL 29 Cb -0.45 -2.53 -0.10 0.00 0.00 0.00 0.00 36.38 33.30 3i2z s VAL 29 CO 0.53 0.51 1.23 0.12 0.00 0.00 0.00 175.10 177.49 3i2z s PHE 30 N 0.35 3.24 -0.05 5.22 2.19 -0.74 -0.42 117.98 127.77 3i2z s PHE 30 Ca -0.07 1.52 0.01 0.00 0.33 0.00 0.00 56.93 58.72 3i2z s PHE 30 Cb -0.15 -3.54 0.02 0.00 -1.31 0.00 0.00 43.02 38.04 3i2z s PHE 30 CO 0.04 -1.38 -0.06 0.54 1.83 0.00 0.00 175.22 176.19 3i2z s VAL 31 N -1.15 0.63 0.13 3.12 0.11 0.16 -0.35 120.40 123.05 3i2z s VAL 31 Ca 0.47 -0.18 0.04 0.00 -2.93 0.00 0.00 61.98 59.38 3i2z s VAL 31 Cb -0.37 -0.63 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 3i2z s VAL 31 CO 0.49 0.24 0.11 -2.28 -3.33 0.00 0.00 175.10 170.32 3i2z s HIS 32 N 0.82 3.14 0.50 1.54 2.46 -1.26 -0.97 115.29 121.53 3i2z s HIS 32 Ca -0.12 0.01 0.19 0.00 0.47 0.00 0.00 55.06 55.61 3i2z s HIS 32 Cb -0.14 -1.55 1.26 0.00 -0.13 0.00 0.00 32.58 32.02 3i2z s HIS 32 CO 0.01 0.52 2.06 0.27 -2.47 0.00 0.00 174.74 175.12 3i2z h PHE 33 N 2.77 0.10 0.00 3.88 -0.00 -1.18 -1.28 116.94 121.23 3i2z h PHE 33 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.50 3i2z h PHE 33 Cb 1.19 -0.03 0.00 0.00 -0.00 0.00 0.00 35.95 37.10 3i2z h PHE 33 CO 0.59 0.05 0.00 0.66 -0.00 0.00 0.00 178.31 179.61 3i2z h SER 34 N 0.10 0.00 1.59 -0.68 4.64 -1.95 -1.53 113.55 115.72 3i2z h SER 34 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3i2z h SER 34 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 3i2z h SER 34 CO -0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 176.83 175.93 3i2z h ALA 35 N 2.02 0.99 -2.42 5.18 0.00 -1.55 -3.46 119.26 120.02 3i2z h ALA 35 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 3i2z h ALA 35 Cb 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3i2z h ALA 35 CO 0.00 0.00 0.55 0.42 0.00 0.00 0.00 179.25 180.22 3i2z s ILE 36 N -3.13 4.31 -0.49 0.00 1.01 -0.58 -0.98 121.20 121.34 3i2z s ILE 36 Ca 0.10 1.65 0.24 0.00 0.00 0.00 0.00 60.65 62.63 3i2z s ILE 36 Cb 0.11 -4.06 0.05 0.00 0.01 0.00 0.00 42.46 38.56 3i2z s ILE 36 CO 0.62 0.09 1.24 1.56 0.00 0.00 0.00 174.94 178.45 3i2z h GLN 37 N 6.96 0.00 -6.82 2.79 1.08 -1.26 -3.47 115.11 114.40 3i2z h GLN 37 Ca -0.39 0.00 -0.56 0.00 -1.45 0.00 0.00 58.65 56.25 3i2z h GLN 37 Cb 1.20 0.00 0.11 0.00 -0.05 0.00 0.00 27.48 28.74 3i2z h GLN 37 CO 0.81 0.00 0.64 0.25 -0.95 0.00 0.00 178.83 179.58 3i2z n THR 38 N -2.35 1.91 -1.72 -0.54 -2.24 -1.26 -4.95 114.28 103.13 3i2z n THR 38 Ca 0.02 -0.48 -0.38 0.00 -2.27 0.00 0.00 64.05 60.94 3i2z n THR 38 Cb 0.48 -1.75 0.05 0.00 -2.10 0.00 0.00 70.33 67.01 3i2z n THR 38 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3i2z n ASN 39 N 0.77 2.18 0.00 3.42 3.02 -1.26 -4.77 115.26 118.62 3i2z n ASN 39 Ca 0.04 0.91 0.00 0.00 -0.03 0.00 0.00 54.58 55.50 3i2z n ASN 39 Cb 0.37 -1.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.00 3i2z n ASN 39 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i2z n GLY 40 N 0.90 -0.78 3.67 7.41 0.00 -1.26 -4.84 105.19 110.29 3i2z n GLY 40 Ca 0.12 -1.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 3i2z n GLY 40 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3i2z s PHE 41 N 0.00 2.92 -0.33 1.61 5.36 -1.26 -4.93 117.98 121.34 3i2z s PHE 41 Ca 0.00 1.01 -0.27 0.00 -0.96 0.00 0.00 56.93 56.71 3i2z s PHE 41 Cb 0.00 -3.52 0.01 0.00 -0.34 0.00 0.00 43.02 39.17 3i2z s PHE 41 CO 0.00 -1.79 0.97 0.15 -1.46 0.00 0.00 175.22 173.09 3i2z s LYS 42 N 2.94 3.98 0.25 10.12 1.02 -1.26 -4.99 119.74 131.79 3i2z s LYS 42 Ca 0.57 0.82 -0.17 0.00 0.02 0.00 0.00 55.97 57.21 3i2z s LYS 42 Cb -0.25 -3.76 0.01 0.00 -0.52 0.00 0.00 37.83 33.32 3i2z s LYS 42 CO 0.20 -0.87 0.58 -0.08 -0.92 0.00 0.00 175.35 174.26 3i2z s THR 43 N 3.45 0.00 0.03 2.17 -1.32 -1.26 -4.91 115.64 113.81 3i2z s THR 43 Ca 0.40 -1.12 -0.01 0.00 -1.21 0.00 0.00 61.69 59.75 3i2z s THR 43 Cb -0.12 -2.00 -0.03 0.00 -1.51 0.00 0.00 72.50 68.83 3i2z s THR 43 CO 0.16 -0.02 -0.02 -0.76 -2.21 0.00 0.00 174.62 171.76 3i2z s LEU 44 N -2.95 2.32 0.04 9.08 1.43 -1.26 -5.05 118.68 122.29 3i2z s LEU 44 Ca 0.15 -0.71 0.03 0.00 -1.03 0.00 0.00 54.13 52.57 3i2z s LEU 44 Cb -0.03 0.17 -0.04 0.00 0.03 0.00 0.00 46.19 46.33 3i2z s LEU 44 CO 0.06 -0.44 0.00 0.00 0.23 0.00 0.00 176.35 176.21 3i2z s ALA 45 N -2.56 3.30 0.22 4.21 0.00 -1.26 -4.74 121.76 120.94 3i2z s ALA 45 Ca -0.06 -1.02 -0.32 0.00 0.00 0.00 0.00 51.96 50.56 3i2z s ALA 45 Cb -0.02 -1.29 -0.13 0.00 0.00 0.00 0.00 23.12 21.68 3i2z s ALA 45 CO -0.05 0.68 1.47 -1.91 0.00 0.00 0.00 175.76 175.95 3i2z n GLU 46 N 1.01 2.13 -0.19 0.00 2.13 -1.26 -1.02 120.64 123.44 3i2z n GLU 46 Ca -0.13 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.45 3i2z n GLU 46 Cb 0.52 -2.46 0.00 0.00 0.27 0.00 0.00 31.44 29.77 3i2z n GLU 46 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3i2z n GLY 47 N 2.50 2.02 3.78 8.31 0.00 0.30 -4.97 105.19 117.13 3i2z n GLY 47 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 3i2z n GLY 47 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3i2z s GLN 48 N -0.21 4.21 0.02 1.61 0.74 -0.19 -4.45 119.66 121.40 3i2z s GLN 48 Ca 0.00 2.42 -0.27 0.00 0.05 0.00 0.00 55.36 57.56 3i2z s GLN 48 Cb 0.00 -3.01 -0.04 0.00 1.10 0.00 0.00 33.01 31.05 3i2z s GLN 48 CO 0.00 -0.39 0.85 1.03 -0.55 0.00 0.00 175.29 176.23 3i2z s ARG 49 N -1.97 4.54 0.10 1.67 0.52 -1.26 -0.85 118.95 121.71 3i2z s ARG 49 Ca 0.51 1.20 -0.02 0.00 -0.52 0.00 0.00 55.73 56.90 3i2z s ARG 49 Cb -0.44 -3.41 -0.04 0.00 0.52 0.00 0.00 34.95 31.59 3i2z s ARG 49 CO 0.59 0.13 0.05 0.14 0.02 0.00 0.00 175.30 176.22 3i2z s VAL 50 N 0.43 0.15 0.05 3.52 -7.23 -0.31 -0.83 120.40 116.19 3i2z s VAL 50 Ca 0.44 -1.79 0.08 0.00 -1.81 0.00 0.00 61.98 58.90 3i2z s VAL 50 Cb -0.21 -1.78 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 3i2z s VAL 50 CO 0.25 -0.68 -0.24 -0.70 -0.31 0.00 0.00 175.10 173.42 3i2z s GLU 51 N -3.98 1.59 0.10 4.82 2.12 -0.19 -1.14 118.70 122.02 3i2z s GLU 51 Ca 0.16 -1.05 -0.26 0.00 0.36 0.00 0.00 54.97 54.18 3i2z s GLU 51 Cb 0.07 -1.75 0.08 0.00 0.26 0.00 0.00 34.13 32.79 3i2z s GLU 51 CO -0.04 0.45 0.97 -0.59 -0.54 0.00 0.00 175.26 175.51 3i2z s PHE 52 N -0.82 -0.17 0.12 5.30 -0.71 0.33 -0.66 117.98 121.36 3i2z s PHE 52 Ca 0.10 -0.07 0.04 0.00 -1.04 0.00 0.00 56.93 55.95 3i2z s PHE 52 Cb -0.09 0.61 -0.04 0.00 -1.21 0.00 0.00 43.02 42.28 3i2z s PHE 52 CO 0.02 -0.71 0.10 -1.21 -1.34 0.00 0.00 175.22 172.08 3i2z s GLU 53 N -3.17 2.89 -0.07 1.99 2.02 0.01 -0.80 118.70 121.57 3i2z s GLU 53 Ca 0.11 -0.77 0.02 0.00 0.02 0.00 0.00 54.97 54.35 3i2z s GLU 53 Cb -0.01 -2.69 -0.03 0.00 0.10 0.00 0.00 34.13 31.50 3i2z s GLU 53 CO -0.01 0.53 -0.11 0.42 0.02 0.00 0.00 175.26 176.11 3i2z s ILE 54 N -1.54 3.34 0.19 -1.63 1.01 -1.26 -0.48 121.20 120.82 3i2z s ILE 54 Ca 0.30 -0.61 0.11 0.00 0.00 0.00 0.00 60.65 60.45 3i2z s ILE 54 Cb -0.11 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 3i2z s ILE 54 CO 0.23 0.58 -0.24 0.42 0.00 0.00 0.00 174.94 175.93 3i2z s THR 55 N -0.59 2.34 -1.40 2.92 -4.23 0.31 -4.85 115.64 110.15 3i2z s THR 55 Ca 0.09 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 58.57 3i2z s THR 55 Cb -0.11 -2.11 0.01 0.00 1.34 0.00 0.00 72.50 71.62 3i2z s THR 55 CO 0.01 -0.11 0.51 0.59 -0.54 0.00 0.00 174.62 175.09 3i2z n ASN 56 N 0.30 -0.73 -0.27 3.99 4.13 -1.26 -0.86 115.26 120.57 3i2z n ASN 56 Ca -0.13 -0.96 0.03 0.00 1.68 0.00 0.00 54.58 55.21 3i2z n ASN 56 Cb 0.56 -3.31 0.17 0.00 -1.54 0.00 0.00 39.78 35.66 3i2z n ASN 56 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 3i2z h GLY 57 N -1.84 1.21 1.88 7.41 0.00 -1.88 -2.44 103.07 107.41 3i2z h GLY 57 Ca -0.62 -0.25 -0.23 0.00 0.00 0.00 0.00 47.33 46.23 3i2z h GLY 57 CO 0.62 0.05 -1.08 0.00 0.00 0.00 0.00 176.54 176.13 3i2z h ALA 58 N 1.47 0.32 -3.03 3.60 0.00 -2.00 -3.39 119.26 116.23 3i2z h ALA 58 Ca 0.39 -0.93 -0.40 0.00 0.00 0.00 0.00 54.91 53.98 3i2z h ALA 58 Cb 0.45 -0.10 -0.39 0.00 0.00 0.00 0.00 17.79 17.75 3i2z h ALA 58 CO -0.29 1.21 -0.71 0.21 0.00 0.00 0.00 179.25 179.66 3i2z s LYS 59 N -2.69 0.05 -0.97 0.00 2.20 -1.05 -4.88 119.74 112.39 3i2z s LYS 59 Ca -0.00 0.14 -0.02 0.00 -0.36 0.00 0.00 55.97 55.73 3i2z s LYS 59 Cb 0.09 -1.25 -0.02 0.00 -1.51 0.00 0.00 37.83 35.14 3i2z s LYS 59 CO 0.83 -0.55 0.82 0.41 -0.36 0.00 0.00 175.35 176.51 3i2z n GLY 60 N 5.30 -0.45 3.77 5.54 0.00 -1.26 -4.87 105.19 113.21 3i2z n GLY 60 Ca -0.06 0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3i2z n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i2z s PRO 61 N -4.81 4.28 0.06 1.61 0.04 -0.95 -4.74 135.00 130.50 3i2z s PRO 61 Ca 0.14 2.21 0.05 0.00 0.04 0.00 0.00 61.00 63.44 3i2z s PRO 61 Cb -0.02 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.48 3i2z s PRO 61 CO 0.62 -0.25 -0.14 -1.12 0.04 0.00 0.00 177.00 176.15 3i2z s SER 62 N -0.53 1.65 0.24 6.66 0.01 -0.04 -1.80 113.70 119.90 3i2z s SER 62 Ca 0.50 -0.58 -0.16 0.00 1.31 0.00 0.00 55.95 57.02 3i2z s SER 62 Cb -0.40 -0.06 -0.08 0.00 0.21 0.00 0.00 66.02 65.70 3i2z s SER 62 CO 0.52 -0.06 0.69 0.00 0.41 0.00 0.00 173.24 174.80 3i2z s ALA 63 N -1.19 3.42 0.11 1.44 0.00 0.53 -0.53 121.76 125.54 3i2z s ALA 63 Ca -0.02 0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.03 3i2z s ALA 63 Cb -0.10 -2.72 -0.04 0.00 0.00 0.00 0.00 23.12 20.26 3i2z s ALA 63 CO 0.02 0.36 -0.11 0.00 0.00 0.00 0.00 175.76 176.04 3i2z s ALA 64 N -1.69 1.25 -0.94 0.00 0.00 0.37 -4.77 121.76 115.98 3i2z s ALA 64 Ca 0.46 -1.26 -0.10 0.00 0.00 0.00 0.00 51.96 51.05 3i2z s ALA 64 Cb -0.14 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.00 3i2z s ALA 64 CO 0.20 -0.02 0.65 -1.71 0.00 0.00 0.00 175.76 174.88 3i2z n ASN 65 N 0.42 -5.01 -4.66 0.00 2.85 -1.20 -0.81 115.26 106.85 3i2z n ASN 65 Ca -0.15 -0.97 -0.40 0.00 -0.11 0.00 0.00 54.58 52.96 3i2z n ASN 65 Cb 0.58 -2.17 -0.06 0.00 1.24 0.00 0.00 39.78 39.36 3i2z n ASN 65 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3i2z s VAL 66 N -3.16 5.07 0.04 3.44 1.01 -0.15 -4.12 120.40 122.52 3i2z s VAL 66 Ca 0.16 1.03 0.08 0.00 0.00 0.00 0.00 61.98 63.25 3i2z s VAL 66 Cb -0.08 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.40 3i2z s VAL 66 CO 0.90 0.14 -0.22 0.42 0.00 0.00 0.00 175.10 176.34 3i2z s THR 67 N 1.80 1.75 0.11 3.92 -4.23 0.16 -0.73 115.64 118.42 3i2z s THR 67 Ca 0.25 -1.21 -0.30 0.00 -1.18 0.00 0.00 61.69 59.25 3i2z s THR 67 Cb -0.16 -1.51 -0.06 0.00 1.34 0.00 0.00 72.50 72.11 3i2z s THR 67 CO 0.10 0.26 1.13 0.00 -0.54 0.00 0.00 174.62 175.57 3i2z s ALA 68 N -0.78 3.36 -2.18 3.99 0.00 -1.26 -1.02 121.76 123.87 3i2z s ALA 68 Ca 0.08 0.80 0.31 0.00 0.00 0.00 0.00 51.96 53.15 3i2z s ALA 68 Cb -0.09 -3.39 1.59 0.00 0.00 0.00 0.00 23.12 21.23 3i2z s ALA 68 CO 0.02 -0.32 2.05 1.28 0.00 0.00 0.00 175.76 178.79