#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i1z n ILE 20 N 0.00 0.00 -3.55 6.31 -6.64 -1.26 -4.83 119.36 109.39 3i1z n ILE 20 Ca 0.00 -0.10 -0.09 0.00 -1.77 0.00 0.00 62.75 60.79 3i1z n ILE 20 Cb 0.00 0.56 -0.04 0.00 -1.44 0.00 0.00 39.64 38.72 3i1z n ILE 20 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 3i1z s ASP 21 N -0.75 -0.34 0.00 7.28 -1.08 -1.26 -5.03 116.67 115.49 3i1z s ASP 21 Ca 0.00 0.22 0.26 0.00 -0.52 0.00 0.00 52.55 52.50 3i1z s ASP 21 Cb 0.00 0.31 1.36 0.00 -1.46 0.00 0.00 42.92 43.14 3i1z s ASP 21 CO 0.00 -0.42 1.87 0.00 0.52 0.00 0.00 175.17 177.14 3i1z n TYR 22 N 0.30 0.00 0.01 -5.34 0.18 -1.26 -4.06 117.16 106.99 3i1z n TYR 22 Ca -0.08 0.00 -0.18 0.00 1.88 0.00 0.00 57.90 59.52 3i1z n TYR 22 Cb 0.59 -0.20 -0.13 0.00 -0.38 0.00 0.00 39.34 39.23 3i1z n TYR 22 CO 0.00 0.00 0.00 0.87 -2.08 0.00 0.00 176.86 175.65 3i1z h LYS 23 N 0.00 0.30 -4.77 -3.48 1.57 -1.96 -3.39 116.57 104.85 3i1z h LYS 23 Ca 0.00 -0.40 -0.59 0.00 -1.87 0.00 0.00 60.65 57.79 3i1z h LYS 23 Cb 0.16 0.13 0.09 0.00 0.08 0.00 0.00 32.23 32.70 3i1z h LYS 23 CO 0.00 1.12 1.76 -0.25 -0.57 0.00 0.00 179.45 181.51 3i1z n ASP 24 N -4.25 1.80 0.29 0.86 9.92 -1.26 -4.63 116.55 119.27 3i1z n ASP 24 Ca -0.12 -2.59 0.17 0.00 -0.53 0.00 0.00 54.79 51.73 3i1z n ASP 24 Cb 0.69 -0.87 0.83 0.00 -0.64 0.00 0.00 41.12 41.14 3i1z n ASP 24 CO 0.00 0.00 0.00 0.16 0.13 0.00 0.00 177.20 177.49 3i1z h ILE 25 N 4.84 0.18 0.00 0.53 3.07 -1.92 0.89 117.51 125.10 3i1z h ILE 25 Ca 0.33 -0.41 0.00 0.00 1.55 0.00 0.00 64.86 66.33 3i1z h ILE 25 Cb 0.70 1.34 0.00 0.00 -0.27 0.00 0.00 36.82 38.59 3i1z h ILE 25 CO 1.95 0.04 0.00 0.00 -1.05 0.00 0.00 178.15 179.10 3i1z h ALA 26 N 1.96 1.00 0.17 0.16 0.00 -1.96 -2.09 119.26 118.49 3i1z h ALA 26 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 3i1z h ALA 26 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3i1z h ALA 26 CO 0.01 0.00 -1.75 1.15 0.00 0.00 0.00 179.25 178.65 3i1z h THR 27 N 0.00 0.92 0.00 0.00 2.02 0.40 -3.38 112.91 112.87 3i1z h THR 27 Ca 0.00 -2.54 -0.17 0.00 0.77 0.00 0.00 66.41 64.48 3i1z h THR 27 Cb 0.62 2.72 -0.02 0.00 -1.74 0.00 0.00 68.15 69.73 3i1z h THR 27 CO 0.00 0.85 -0.80 -0.07 0.37 0.00 0.00 175.52 175.87 3i1z h LEU 28 N 0.10 0.00 -2.37 2.58 4.07 -1.21 -3.20 115.31 115.28 3i1z h LEU 28 Ca -0.34 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.62 3i1z h LEU 28 Cb 2.08 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 43.82 3i1z h LEU 28 CO 0.16 0.80 0.00 0.07 -1.08 0.00 0.00 178.44 178.39 3i1z h LYS 29 N 0.00 0.00 -0.86 1.13 2.10 -1.55 -1.44 116.57 115.95 3i1z h LYS 29 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3i1z h LYS 29 Cb 1.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.84 3i1z h LYS 29 CO 0.10 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.64 3i1z n ASN 30 N -4.00 2.30 0.00 7.07 5.03 -1.21 -3.05 115.26 121.40 3i1z n ASN 30 Ca -0.03 -2.25 0.00 0.00 0.87 0.00 0.00 54.58 53.17 3i1z n ASN 30 Cb 0.08 -0.54 0.00 0.00 -1.02 0.00 0.00 39.78 38.30 3i1z n ASN 30 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3i1z n TYR 31 N 0.17 0.00 -4.37 3.10 4.02 -0.54 -5.07 117.16 114.47 3i1z n TYR 31 Ca 0.08 -0.04 -0.21 0.00 -0.01 0.00 0.00 57.90 57.72 3i1z n TYR 31 Cb 0.51 -0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.69 3i1z n TYR 31 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 3i1z s ILE 32 N -0.08 1.25 1.00 -0.72 -4.36 -1.17 -0.91 121.20 116.21 3i1z s ILE 32 Ca 0.00 -1.12 -0.12 0.00 -0.26 0.00 0.00 60.65 59.16 3i1z s ILE 32 Cb 0.00 -1.13 0.19 0.00 1.25 0.00 0.00 42.46 42.77 3i1z s ILE 32 CO 0.00 -0.00 1.08 0.28 0.24 0.00 0.00 174.94 176.54 3i1z s THR 33 N -0.93 2.26 0.47 8.37 -1.32 -0.88 -4.84 115.64 118.78 3i1z s THR 33 Ca 0.02 0.09 0.18 0.00 -1.21 0.00 0.00 61.69 60.77 3i1z s THR 33 Cb -0.08 -2.31 0.35 0.00 -1.51 0.00 0.00 72.50 68.94 3i1z s THR 33 CO 0.02 -0.11 2.00 -0.33 -2.21 0.00 0.00 174.62 173.98 3i1z h GLU 34 N -2.04 0.23 -0.40 7.08 5.08 -1.94 -0.69 114.58 121.91 3i1z h GLU 34 Ca -0.53 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 3i1z h GLU 34 Cb 1.30 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3i1z h GLU 34 CO 0.50 0.15 0.00 -1.13 -1.00 0.00 0.00 179.01 177.54 3i1z n SER 35 N -4.45 1.93 0.00 1.42 3.41 -1.26 -4.93 113.62 109.74 3i1z n SER 35 Ca 0.09 -2.06 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 3i1z n SER 35 Cb 0.43 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 3i1z n SER 35 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i1z n GLY 36 N 0.91 2.66 3.55 5.00 0.00 -0.27 -4.31 105.19 112.72 3i1z n GLY 36 Ca 0.11 -0.62 -0.62 0.00 0.00 0.00 0.00 46.02 44.90 3i1z n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3i1z n LYS 37 N 0.00 0.00 -1.68 1.61 5.02 -1.26 -4.17 118.16 117.67 3i1z n LYS 37 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 3i1z n LYS 37 Cb 0.00 -1.48 0.07 0.00 -0.02 0.00 0.00 35.03 33.60 3i1z n LYS 37 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3i1z n ILE 38 N 2.49 4.58 -4.08 -0.18 5.41 -1.26 -2.08 119.36 124.24 3i1z n ILE 38 Ca 0.24 -0.50 -0.34 0.00 1.00 0.00 0.00 62.75 63.15 3i1z n ILE 38 Cb 0.02 -1.38 -0.10 0.00 -0.71 0.00 0.00 39.64 37.47 3i1z n ILE 38 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3i1z s VAL 39 N -1.44 4.65 1.01 1.39 1.01 -0.09 -4.83 120.40 122.11 3i1z s VAL 39 Ca 0.81 -0.09 -0.11 0.00 0.00 0.00 0.00 61.98 62.59 3i1z s VAL 39 Cb -0.39 -3.08 0.20 0.00 0.00 0.00 0.00 36.38 33.11 3i1z s VAL 39 CO 0.42 0.48 1.09 -2.16 0.00 0.00 0.00 175.10 174.93 3i1z s PRO 40 N 0.21 0.30 0.00 2.72 0.04 -1.26 -4.66 135.00 132.35 3i1z s PRO 40 Ca 0.03 1.12 0.19 0.00 0.04 0.00 0.00 61.00 62.38 3i1z s PRO 40 Cb -0.12 -1.68 0.92 0.00 0.04 0.00 0.00 34.50 33.66 3i1z s PRO 40 CO 0.01 -2.98 1.60 0.43 0.04 0.00 0.00 177.00 176.10 3i1z n SER 41 N -4.43 0.00 0.11 6.66 7.64 -1.26 -0.62 113.62 121.71 3i1z n SER 41 Ca 0.07 0.19 -0.02 0.00 1.01 0.00 0.00 58.87 60.12 3i1z n SER 41 Cb 0.54 -0.37 0.06 0.00 -1.01 0.00 0.00 64.21 63.43 3i1z n SER 41 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 3i1z h ARG 42 N 0.00 0.00 0.00 1.43 0.11 -1.90 -0.28 114.38 113.73 3i1z h ARG 42 Ca 0.00 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.91 3i1z h ARG 42 Cb 0.24 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.28 3i1z h ARG 42 CO 0.00 0.73 -1.65 -0.89 0.10 0.00 0.00 179.97 178.27 3i1z n ILE 43 N -3.54 0.65 0.92 0.08 2.08 -1.00 -4.34 119.36 114.20 3i1z n ILE 43 Ca -0.00 -0.35 0.13 0.00 0.56 0.00 0.00 62.75 63.08 3i1z n ILE 43 Cb 0.74 -0.80 0.41 0.00 -0.75 0.00 0.00 39.64 39.24 3i1z n ILE 43 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 3i1z n THR 44 N -2.50 0.09 -0.28 1.39 -2.24 0.20 -4.91 114.28 106.04 3i1z n THR 44 Ca -0.17 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3i1z n THR 44 Cb 0.78 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 3i1z n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i1z n GLY 45 N 1.47 0.13 3.41 3.38 0.00 -0.12 -4.91 105.19 108.55 3i1z n GLY 45 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3i1z n GLY 45 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3i1z n THR 46 N -2.00 0.00 0.00 2.61 5.66 -1.24 -4.93 114.28 114.37 3i1z n THR 46 Ca 0.00 -0.32 0.00 0.00 -3.05 0.00 0.00 64.05 60.68 3i1z n THR 46 Cb 0.00 -0.81 0.00 0.00 -1.55 0.00 0.00 70.33 67.97 3i1z n THR 46 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3i1z n ARG 47 N -3.48 0.76 0.07 1.09 5.12 -1.26 -4.73 116.66 114.23 3i1z n ARG 47 Ca 0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.95 3i1z n ARG 47 Cb 0.57 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.87 3i1z n ARG 47 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3i1z n ALA 48 N -3.00 3.00 0.11 7.54 0.00 -1.26 -4.55 120.51 122.35 3i1z n ALA 48 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 3i1z n ALA 48 Cb 0.00 0.07 0.50 0.00 0.00 0.00 0.00 19.45 20.02 3i1z n ALA 48 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3i1z h LYS 49 N 0.00 0.32 0.29 0.00 3.64 -2.00 -1.63 116.57 117.20 3i1z h LYS 49 Ca 0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 3i1z h LYS 49 Cb 0.00 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 3i1z h LYS 49 CO 0.00 0.23 -0.14 1.88 -2.27 0.00 0.00 179.45 179.15 3i1z h TYR 50 N 0.32 -0.37 -1.03 1.91 0.99 -1.98 -2.90 116.97 113.92 3i1z h TYR 50 Ca 0.09 -0.01 0.30 0.00 2.00 0.00 0.00 58.73 61.11 3i1z h TYR 50 Cb 0.00 0.12 -0.04 0.00 1.00 0.00 0.00 36.73 37.81 3i1z h TYR 50 CO 0.00 -0.10 0.76 0.37 -0.00 0.00 0.00 178.16 179.19 3i1z h GLN 51 N -0.60 0.00 0.00 4.88 5.75 -1.56 0.48 115.11 124.06 3i1z h GLN 51 Ca -0.04 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.42 3i1z h GLN 51 Cb 0.43 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.98 3i1z h GLN 51 CO 0.07 0.00 -0.20 0.00 -2.65 0.00 0.00 178.83 176.04 3i1z h ARG 52 N 0.00 0.00 0.00 1.69 3.08 -1.21 -3.04 114.38 114.90 3i1z h ARG 52 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.54 3i1z h ARG 52 Cb 2.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.05 3i1z h ARG 52 CO -0.01 0.20 -1.17 1.04 -1.07 0.00 0.00 179.97 178.96 3i1z n GLN 53 N -3.19 0.44 0.00 0.04 6.02 0.15 -3.55 117.38 117.30 3i1z n GLN 53 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 3i1z n GLN 53 Cb 0.56 -1.65 0.00 0.00 1.02 0.00 0.00 30.24 30.17 3i1z n GLN 53 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3i1z n LEU 54 N -2.23 0.05 -0.44 1.08 7.99 -0.27 -1.54 117.00 121.65 3i1z n LEU 54 Ca 0.00 0.32 0.38 0.00 -0.01 0.00 0.00 56.01 56.71 3i1z n LEU 54 Cb 0.49 0.00 0.66 0.00 -0.11 0.00 0.00 43.42 44.46 3i1z n LEU 54 CO 0.41 0.00 1.19 0.00 -1.51 0.00 0.00 177.39 177.48 3i1z n ALA 55 N -1.35 1.29 -0.03 -1.18 0.00 -1.20 -0.14 120.51 117.89 3i1z n ALA 55 Ca 0.00 0.91 0.00 0.00 0.00 0.00 0.00 53.44 54.35 3i1z n ALA 55 Cb 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3i1z n ALA 55 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3i1z n ARG 56 N -4.87 0.00 -0.01 0.00 0.63 -1.22 -0.12 116.66 111.07 3i1z n ARG 56 Ca 0.40 0.53 0.15 0.00 -0.92 0.00 0.00 57.85 58.00 3i1z n ARG 56 Cb 1.51 -1.48 0.59 0.00 0.45 0.00 0.00 32.46 33.53 3i1z n ARG 56 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3i1z h ALA 57 N -1.92 2.21 0.20 5.13 0.00 -0.34 0.68 119.26 125.23 3i1z h ALA 57 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3i1z h ALA 57 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3i1z h ALA 57 CO 0.00 -0.34 -0.10 0.82 0.00 0.00 0.00 179.25 179.63 3i1z h ILE 58 N 0.19 0.00 -0.97 0.00 2.04 -0.31 0.27 117.51 118.73 3i1z h ILE 58 Ca 0.24 -0.01 0.14 0.00 1.00 0.00 0.00 64.86 66.23 3i1z h ILE 58 Cb 0.68 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.60 3i1z h ILE 58 CO -0.04 0.00 -0.41 0.11 0.00 0.00 0.00 178.15 177.81 3i1z h LYS 59 N -0.28 -0.01 -1.09 2.37 1.57 -0.29 0.56 116.57 119.40 3i1z h LYS 59 Ca -0.03 0.00 0.30 0.00 -1.87 0.00 0.00 60.65 59.05 3i1z h LYS 59 Cb 0.21 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.43 3i1z h LYS 59 CO 0.05 -0.01 0.71 -0.09 -0.57 0.00 0.00 179.45 179.54 3i1z h ARG 60 N -0.01 0.30 0.07 3.15 2.43 -0.51 0.46 114.38 120.28 3i1z h ARG 60 Ca 0.31 -0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 59.19 3i1z h ARG 60 Cb 0.57 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 3i1z h ARG 60 CO -0.96 0.20 -1.37 0.00 -1.51 0.00 0.00 179.97 176.32 3i1z h ALA 61 N 1.60 0.33 -0.33 2.80 0.00 0.36 -3.36 119.26 120.66 3i1z h ALA 61 Ca 0.62 -1.07 0.03 0.00 0.00 0.00 0.00 54.91 54.49 3i1z h ALA 61 Cb 1.72 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.63 3i1z h ALA 61 CO -0.28 1.20 0.15 0.00 0.00 0.00 0.00 179.25 180.32 3i1z h ARG 62 N 0.04 0.30 -0.98 0.00 3.08 0.29 -2.09 114.38 115.03 3i1z h ARG 62 Ca -0.17 -0.02 0.12 0.00 0.07 0.00 0.00 59.98 59.98 3i1z h ARG 62 Cb 1.95 -0.07 -0.08 0.00 0.08 0.00 0.00 29.97 31.85 3i1z h ARG 62 CO 0.15 0.20 0.62 1.88 -1.07 0.00 0.00 179.97 181.75 3i1z h TYR 63 N 0.31 1.09 0.00 3.04 0.05 -1.57 0.17 116.97 120.06 3i1z h TYR 63 Ca 0.14 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.95 3i1z h TYR 63 Cb 0.07 -0.34 0.00 0.00 1.01 0.00 0.00 36.73 37.47 3i1z h TYR 63 CO -0.11 0.43 0.00 1.28 -1.05 0.00 0.00 178.16 178.71 3i1z n LEU 64 N -4.61 0.40 -1.57 3.88 4.77 -0.95 -4.79 117.00 114.14 3i1z n LEU 64 Ca 0.19 -0.20 -0.19 0.00 -0.03 0.00 0.00 56.01 55.77 3i1z n LEU 64 Cb 0.37 -0.20 -0.07 0.00 -2.33 0.00 0.00 43.42 41.19 3i1z n LEU 64 CO 0.28 0.10 -0.19 -0.24 -1.33 0.00 0.00 177.39 176.01 3i1z n SER 65 N -0.21 -5.34 -0.06 -1.43 2.88 0.05 -4.88 113.62 104.62 3i1z n SER 65 Ca 0.00 0.41 -0.14 0.00 -1.33 0.00 0.00 58.87 57.81 3i1z n SER 65 Cb 0.10 -4.52 -0.13 0.00 -0.75 0.00 0.00 64.21 58.92 3i1z n SER 65 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3i1z h LEU 66 N 0.00 0.01 -8.40 2.46 3.38 -1.50 -3.46 115.31 107.80 3i1z h LEU 66 Ca -0.40 -0.93 -0.50 0.00 0.09 0.00 0.00 57.88 56.14 3i1z h LEU 66 Cb 1.26 -0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.75 3i1z h LEU 66 CO 0.57 0.94 -0.82 -0.76 0.09 0.00 0.00 178.44 178.46 3i1z s LEU 67 N -8.36 2.15 0.05 1.67 1.43 -1.23 -4.97 118.68 109.42 3i1z s LEU 67 Ca -0.18 -0.45 -0.28 0.00 -1.03 0.00 0.00 54.13 52.19 3i1z s LEU 67 Cb -0.02 -0.77 -0.05 0.00 0.03 0.00 0.00 46.19 45.38 3i1z s LEU 67 CO 0.69 0.11 0.87 -2.16 0.23 0.00 0.00 176.35 176.09 3i1z s PRO 68 N -1.03 4.58 -0.00 1.29 0.04 -1.26 -4.02 135.00 134.60 3i1z s PRO 68 Ca 0.04 1.26 -0.24 0.00 0.04 0.00 0.00 61.00 62.10 3i1z s PRO 68 Cb -0.08 -3.39 -0.17 0.00 0.04 0.00 0.00 34.50 30.90 3i1z s PRO 68 CO 0.01 0.17 1.19 1.88 0.04 0.00 0.00 177.00 180.30 3i1z h TYR 69 N 5.95 -0.27 -3.77 0.56 -1.99 -1.96 -3.45 116.97 112.03 3i1z h TYR 69 Ca -0.43 -0.01 -0.49 0.00 2.00 0.00 0.00 58.73 59.81 3i1z h TYR 69 Cb 1.21 0.09 0.05 0.00 2.00 0.00 0.00 36.73 40.08 3i1z h TYR 69 CO 0.65 0.09 0.20 -0.08 -0.00 0.00 0.00 178.16 179.02 3i1z s THR 70 N -4.42 4.41 -1.26 -2.88 -1.32 -1.26 -4.62 115.64 104.29 3i1z s THR 70 Ca -0.14 0.26 0.17 0.00 -1.21 0.00 0.00 61.69 60.77 3i1z s THR 70 Cb 0.02 -3.72 0.53 0.00 -1.51 0.00 0.00 72.50 67.82 3i1z s THR 70 CO 0.56 -0.77 1.45 -0.90 -2.21 0.00 0.00 174.62 172.75 3i1z n ASP 71 N -2.48 3.76 0.00 8.08 5.68 -1.26 -4.64 116.55 125.69 3i1z n ASP 71 Ca 0.03 -2.18 0.00 0.00 -0.50 0.00 0.00 54.79 52.14 3i1z n ASP 71 Cb 0.56 -0.42 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 3i1z n ASP 71 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3i1z n ARG 72 N 0.95 0.00 0.00 0.11 5.12 -1.26 -5.04 116.66 116.53 3i1z n ARG 72 Ca 0.20 0.22 0.00 0.00 -1.93 0.00 0.00 57.85 56.34 3i1z n ARG 72 Cb 0.63 -0.70 0.00 0.00 -1.16 0.00 0.00 32.46 31.23 3i1z n ARG 72 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42