#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q7i n LYS 2 N 0.00 -5.45 -2.08 1.61 4.81 -1.26 -4.93 118.16 110.87 1q7i n LYS 2 Ca 0.00 0.85 -0.26 0.00 -0.87 0.00 0.00 58.31 58.03 1q7i n LYS 2 Cb 0.00 -5.86 0.02 0.00 0.02 0.00 0.00 35.03 29.22 1q7i n LYS 2 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1q7i n GLU 3 N -3.89 3.47 -3.30 1.64 0.28 -1.26 -4.85 120.64 112.72 1q7i n GLU 3 Ca -0.23 -4.16 -0.23 0.00 -0.16 0.00 0.00 57.16 52.37 1q7i n GLU 3 Cb 0.66 -2.27 -0.08 0.00 1.43 0.00 0.00 31.44 31.17 1q7i n GLU 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1q7i h ASP 5 N 5.69 0.00 -3.60 0.00 3.32 -0.81 -3.41 116.42 117.62 1q7i h ASP 5 Ca 0.22 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.02 1q7i h ASP 5 Cb 0.95 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.45 1q7i h ASP 5 CO 0.30 0.00 -0.20 0.00 -1.72 0.00 0.00 179.24 177.63 1q7i n SER 7 N -1.61 0.43 -4.42 0.00 3.41 -1.26 -4.86 113.62 105.31 1q7i n SER 7 Ca -0.04 -0.95 -0.32 0.00 -0.26 0.00 0.00 58.87 57.29 1q7i n SER 7 Cb 0.26 0.03 -0.14 0.00 -0.26 0.00 0.00 64.21 64.10 1q7i n SER 7 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1q7i s SER 8 N -0.03 3.82 0.26 4.04 0.15 -1.26 -5.01 113.70 115.68 1q7i s SER 8 Ca 0.00 -0.28 0.14 0.00 0.70 0.00 0.00 55.95 56.51 1q7i s SER 8 Cb 0.00 -0.93 0.04 0.00 -1.71 0.00 0.00 66.02 63.42 1q7i s SER 8 CO 0.00 0.30 1.43 1.55 1.20 0.00 0.00 173.24 177.72 1q7i h PRO 9 N 5.68 0.00 0.00 5.44 0.13 -1.96 -3.18 132.00 138.11 1q7i h PRO 9 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1q7i h PRO 9 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1q7i h PRO 9 CO 0.51 0.57 -0.14 0.39 -0.23 0.00 0.00 178.00 179.09 1q7i n GLU 10 N -3.25 0.15 -2.16 0.86 1.02 -1.26 -4.60 120.64 111.40 1q7i n GLU 10 Ca 0.02 0.10 -0.42 0.00 -0.02 0.00 0.00 57.16 56.84 1q7i n GLU 10 Cb 0.76 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 30.50 1q7i n GLU 10 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1q7i s ASN 11 N -3.81 6.81 0.12 1.62 3.84 -1.20 -4.90 114.94 117.41 1q7i s ASN 11 Ca 0.11 2.29 0.01 0.00 0.21 0.00 0.00 52.86 55.48 1q7i s ASN 11 Cb 0.15 -2.58 -0.17 0.00 -0.55 0.00 0.00 41.25 38.10 1q7i s ASN 11 CO 0.60 -0.68 1.26 1.55 -2.79 0.00 0.00 177.10 177.03 1q7i h PRO 12 N 7.13 0.18 0.00 0.43 0.13 -1.90 -3.17 132.00 134.79 1q7i h PRO 12 Ca -0.41 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 1q7i h PRO 12 Cb 1.20 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1q7i h PRO 12 CO 0.88 1.08 0.03 0.00 -0.23 0.00 0.00 178.00 179.75 1q7i n ASP 15 N 5.18 2.47 0.03 0.00 -0.08 0.64 -4.56 116.55 120.23 1q7i n ASP 15 Ca -0.07 1.08 0.10 0.00 -1.51 0.00 0.00 54.79 54.39 1q7i n ASP 15 Cb 0.49 -1.27 0.43 0.00 2.34 0.00 0.00 41.12 43.11 1q7i n ASP 15 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1q7i n ALA 16 N 4.03 1.88 0.32 -1.67 0.00 -1.26 -0.87 120.51 122.93 1q7i n ALA 16 Ca 0.20 -0.04 0.16 0.00 0.00 0.00 0.00 53.44 53.76 1q7i n ALA 16 Cb 0.22 -1.34 0.61 0.00 0.00 0.00 0.00 19.45 18.94 1q7i n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q7i h ALA 17 N 2.58 1.00 -0.00 0.00 0.00 -1.93 -3.30 119.26 117.60 1q7i h ALA 17 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1q7i h ALA 17 Cb 0.37 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 17.95 1q7i h ALA 17 CO 0.00 0.00 -0.54 -2.37 0.00 0.00 0.00 179.25 176.34 1q7i n THR 18 N -2.83 0.01 -1.90 0.00 5.66 -1.03 -4.98 114.28 109.21 1q7i n THR 18 Ca 0.01 -0.36 0.00 0.00 -3.05 0.00 0.00 64.05 60.65 1q7i n THR 18 Cb 0.29 0.68 0.00 0.00 -1.55 0.00 0.00 70.33 69.75 1q7i n THR 18 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1q7i n LYS 20 N -1.82 0.73 -1.88 0.00 5.02 -1.04 -0.14 118.16 119.02 1q7i n LYS 20 Ca 0.00 -3.56 -0.42 0.00 -2.02 0.00 0.00 58.31 52.31 1q7i n LYS 20 Cb 0.34 0.67 -0.03 0.00 -0.02 0.00 0.00 35.03 35.99 1q7i n LYS 20 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1q7i s LEU 21 N 0.00 4.37 -0.14 -0.35 1.43 -1.26 0.24 118.68 122.97 1q7i s LEU 21 Ca 0.16 2.59 -0.12 0.00 -1.03 0.00 0.00 54.13 55.73 1q7i s LEU 21 Cb -0.01 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.54 1q7i s LEU 21 CO 0.10 -0.89 0.13 -0.09 0.23 0.00 0.00 176.35 175.83 1q7i h ARG 22 N 7.84 0.00 0.00 1.70 2.43 -1.56 -3.37 114.38 121.42 1q7i h ARG 22 Ca -0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1q7i h ARG 22 Cb 1.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1q7i h ARG 22 CO 0.93 0.36 0.00 -0.35 -1.51 0.00 0.00 179.97 179.40 1q7i n PRO 23 N -4.64 -0.07 -0.41 0.20 -0.04 -1.26 -4.83 135.00 123.94 1q7i n PRO 23 Ca -0.09 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.41 1q7i n PRO 23 Cb 0.28 0.00 0.20 0.00 -0.04 0.00 0.00 33.50 33.94 1q7i n PRO 23 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1q7i n GLY 24 N 4.59 2.03 3.27 0.55 0.00 -1.26 -4.93 105.19 109.44 1q7i n GLY 24 Ca 0.00 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 1q7i n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q7i n ALA 25 N 0.35 -4.74 0.11 4.61 0.00 -1.26 -4.95 120.51 114.62 1q7i n ALA 25 Ca 0.14 -1.80 0.04 0.00 0.00 0.00 0.00 53.44 51.81 1q7i n ALA 25 Cb 0.66 -1.68 0.06 0.00 0.00 0.00 0.00 19.45 18.49 1q7i n ALA 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1q7i n GLN 26 N -5.63 1.35 0.00 0.00 6.02 -1.18 -4.95 117.38 112.99 1q7i n GLN 26 Ca 0.11 -1.35 0.00 0.00 -0.01 0.00 0.00 57.00 55.75 1q7i n GLN 26 Cb 0.59 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.70 1q7i n GLN 26 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1q7i n GLY 28 N -0.02 0.51 3.65 0.00 0.00 -1.26 -3.63 105.19 104.43 1q7i n GLY 28 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1q7i n GLY 28 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1q7i s GLU 29 N -1.36 0.14 0.00 1.61 -1.05 -1.26 -4.85 118.70 111.93 1q7i s GLU 29 Ca 0.00 0.23 0.00 0.00 -0.15 0.00 0.00 54.97 55.05 1q7i s GLU 29 Cb 0.00 0.04 0.00 0.00 -0.44 0.00 0.00 34.13 33.73 1q7i s GLU 29 CO 0.00 -0.03 0.00 0.41 0.95 0.00 0.00 175.26 176.59 1q7i n GLY 30 N 2.87 -1.16 0.25 -3.83 0.00 -1.26 -4.89 105.19 97.17 1q7i n GLY 30 Ca -0.16 -0.93 0.17 0.00 0.00 0.00 0.00 46.02 45.10 1q7i n GLY 30 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1q7i h LEU 31 N 0.00 0.00 -5.51 0.99 -0.00 -0.84 -3.29 115.31 106.66 1q7i h LEU 31 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.88 57.50 1q7i h LEU 31 Cb 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 40.66 40.35 1q7i h LEU 31 CO 0.00 0.00 -0.91 0.00 -0.00 0.00 0.00 178.44 177.53 1q7i n GLU 34 N 4.59 -1.85 -1.56 0.00 2.13 0.51 -4.67 120.64 119.80 1q7i n GLU 34 Ca -0.04 -0.22 -0.13 0.00 0.66 0.00 0.00 57.16 57.42 1q7i n GLU 34 Cb 0.42 -0.25 -0.08 0.00 0.27 0.00 0.00 31.44 31.80 1q7i n GLU 34 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1q7i n GLN 35 N -2.25 0.49 -3.55 5.31 7.27 -1.26 -2.69 117.38 120.71 1q7i n GLN 35 Ca 0.02 -0.91 -0.21 0.00 0.07 0.00 0.00 57.00 55.97 1q7i n GLN 35 Cb 0.08 -3.63 0.08 0.00 2.41 0.00 0.00 30.24 29.19 1q7i n GLN 35 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1q7i s LYS 37 N -5.91 0.89 0.12 0.00 3.01 -1.10 -3.08 119.74 113.67 1q7i s LYS 37 Ca 0.32 0.79 -0.31 0.00 -1.01 0.00 0.00 55.97 55.75 1q7i s LYS 37 Cb -0.14 0.43 -0.09 0.00 -1.01 0.00 0.00 37.83 37.01 1q7i s LYS 37 CO 0.74 -0.16 1.61 -0.06 0.51 0.00 0.00 175.35 177.99 1q7i s PHE 38 N -0.06 2.76 0.59 3.18 0.08 -1.26 -0.36 117.98 122.91 1q7i s PHE 38 Ca -0.03 0.48 -0.18 0.00 0.12 0.00 0.00 56.93 57.31 1q7i s PHE 38 Cb -0.04 -3.95 -0.06 0.00 -0.57 0.00 0.00 43.02 38.41 1q7i s PHE 38 CO 0.03 -3.65 0.86 0.43 -0.10 0.00 0.00 175.22 172.79 1q7i n SER 39 N 4.72 0.36 -4.74 1.36 7.64 -0.15 -4.74 113.62 118.06 1q7i n SER 39 Ca 0.15 0.79 -0.41 0.00 1.01 0.00 0.00 58.87 60.42 1q7i n SER 39 Cb 0.39 -1.34 -0.05 0.00 -1.01 0.00 0.00 64.21 62.21 1q7i n SER 39 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1q7i s ARG 40 N -2.58 4.68 0.49 1.43 1.81 -1.26 -4.43 118.95 119.09 1q7i s ARG 40 Ca 0.74 1.62 -0.19 0.00 -1.72 0.00 0.00 55.73 56.17 1q7i s ARG 40 Cb -0.43 -3.29 -0.13 0.00 -0.45 0.00 0.00 34.95 30.65 1q7i s ARG 40 CO 0.49 0.23 0.14 0.00 -0.68 0.00 0.00 175.30 175.48 1q7i n ALA 41 N 2.11 -2.41 -0.02 2.13 0.00 -0.34 -3.34 120.51 118.65 1q7i n ALA 41 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1q7i n ALA 41 Cb 0.47 -1.56 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1q7i n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q7i n GLY 42 N 2.22 0.99 3.65 0.00 0.00 -0.64 -4.91 105.19 106.51 1q7i n GLY 42 Ca 0.10 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1q7i n GLY 42 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1q7i s LYS 43 N -0.19 4.04 -0.69 1.61 2.47 -1.21 -4.89 119.74 120.87 1q7i s LYS 43 Ca 0.00 -0.30 -0.25 0.00 -1.56 0.00 0.00 55.97 53.86 1q7i s LYS 43 Cb 0.00 -3.39 0.05 0.00 -1.46 0.00 0.00 37.83 33.02 1q7i s LYS 43 CO 0.00 0.16 1.14 -1.50 0.16 0.00 0.00 175.35 175.31 1q7i s ILE 44 N 0.72 4.00 -1.15 5.43 1.10 -1.26 0.10 121.20 130.14 1q7i s ILE 44 Ca 0.06 0.12 0.28 0.00 -0.51 0.00 0.00 60.65 60.61 1q7i s ILE 44 Cb -0.13 -4.80 0.33 0.00 0.15 0.00 0.00 42.46 38.01 1q7i s ILE 44 CO 0.02 -1.65 1.94 0.00 -2.11 0.00 0.00 174.94 173.14 1q7i n ARG 46 N -1.42 0.97 -4.40 0.00 1.74 -1.26 -5.02 116.66 107.26 1q7i n ARG 46 Ca 0.09 -1.94 -0.22 0.00 -0.77 0.00 0.00 57.85 55.01 1q7i n ARG 46 Cb 0.30 2.46 -0.10 0.00 -1.02 0.00 0.00 32.46 34.09 1q7i n ARG 46 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1q7i s ILE 47 N -2.13 2.11 -0.17 0.55 1.10 -1.26 -4.52 121.20 116.88 1q7i s ILE 47 Ca 0.17 -2.24 0.00 0.00 -0.51 0.00 0.00 60.65 58.07 1q7i s ILE 47 Cb -0.04 -2.13 0.01 0.00 0.15 0.00 0.00 42.46 40.45 1q7i s ILE 47 CO 0.10 -0.44 -0.17 0.00 -2.11 0.00 0.00 174.94 172.32 1q7i s ALA 48 N -2.55 2.43 0.00 1.50 0.00 -1.26 -4.91 121.76 116.98 1q7i s ALA 48 Ca 0.24 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1q7i s ALA 48 Cb -0.04 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.86 1q7i s ALA 48 CO 0.10 -0.16 0.00 2.89 0.00 0.00 0.00 175.76 178.59 1q7i n ARG 49 N 4.30 3.74 0.00 0.00 0.00 -1.26 -4.94 116.66 118.50 1q7i n ARG 49 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.65 1q7i n ARG 49 Cb 0.51 -0.51 0.00 0.00 -0.00 0.00 0.00 32.46 32.46 1q7i n ARG 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1q7i n GLY 50 N 1.01 0.34 3.38 2.89 0.00 -1.26 -5.02 105.19 106.53 1q7i n GLY 50 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1q7i n GLY 50 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1q7i n ASP 51 N 0.00 -3.24 -3.35 1.61 9.92 -1.26 -5.00 116.55 115.24 1q7i n ASP 51 Ca 0.00 -1.03 -0.19 0.00 -0.53 0.00 0.00 54.79 53.05 1q7i n ASP 51 Cb 0.00 -1.01 -0.08 0.00 -0.64 0.00 0.00 41.12 39.39 1q7i n ASP 51 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1q7i s TRP 52 N -2.54 -0.09 -0.39 1.24 0.51 -1.26 -4.80 118.94 111.60 1q7i s TRP 52 Ca 0.70 -1.08 0.05 0.00 -2.12 0.00 0.00 56.10 53.65 1q7i s TRP 52 Cb -0.10 -0.48 0.17 0.00 -0.81 0.00 0.00 33.47 32.25 1q7i s TRP 52 CO 0.56 -0.96 0.50 1.21 -0.51 0.00 0.00 176.95 177.75 1q7i s ASN 53 N 1.20 -0.07 0.26 2.95 3.84 -1.26 -5.11 114.94 116.75 1q7i s ASN 53 Ca 0.19 -1.28 -0.31 0.00 0.21 0.00 0.00 52.86 51.67 1q7i s ASN 53 Cb -0.14 1.18 -0.13 0.00 -0.55 0.00 0.00 41.25 41.62 1q7i s ASN 53 CO -0.04 -0.21 1.49 -0.90 -2.79 0.00 0.00 177.10 174.65 1q7i n ASP 54 N 4.24 3.23 -4.52 -4.21 5.68 -1.26 -4.78 116.55 114.94 1q7i n ASP 54 Ca 0.12 1.14 -0.42 0.00 -0.50 0.00 0.00 54.79 55.13 1q7i n ASP 54 Cb 0.50 -1.50 -0.03 0.00 -1.14 0.00 0.00 41.12 38.95 1q7i n ASP 54 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1q7i s ASP 55 N 0.37 6.22 -0.96 -1.12 1.11 -1.26 -4.95 116.67 116.08 1q7i s ASP 55 Ca 0.66 -0.54 -0.16 0.00 0.18 0.00 0.00 52.55 52.69 1q7i s ASP 55 Cb -0.58 -2.50 0.17 0.00 1.07 0.00 0.00 42.92 41.08 1q7i s ASP 55 CO 0.49 -1.59 1.08 -0.60 1.18 0.00 0.00 175.17 175.73 1q7i s ARG 56 N 4.88 3.72 0.02 8.23 6.06 -1.25 -1.58 118.95 139.02 1q7i s ARG 56 Ca 0.31 -2.16 -0.05 0.00 -2.50 0.00 0.00 55.73 51.33 1q7i s ARG 56 Cb -0.11 -4.79 -0.03 0.00 0.06 0.00 0.00 34.95 30.08 1q7i s ARG 56 CO 0.15 -1.61 0.11 0.00 -2.50 0.00 0.00 175.30 171.44 1q7i n THR 58 N 0.08 0.00 0.90 0.00 -2.24 -1.26 -1.62 114.28 110.14 1q7i n THR 58 Ca 0.03 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.93 1q7i n THR 58 Cb 0.03 -1.25 0.23 0.00 -2.10 0.00 0.00 70.33 67.24 1q7i n THR 58 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1q7i n GLY 59 N 3.75 0.98 0.65 3.38 0.00 -1.26 -1.20 105.19 111.49 1q7i n GLY 59 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1q7i n GLY 59 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1q7i n GLN 60 N 1.09 0.00 -4.62 1.61 6.02 -1.26 -4.69 117.38 115.53 1q7i n GLN 60 Ca 0.17 -0.88 -0.33 0.00 -0.01 0.00 0.00 57.00 55.95 1q7i n GLN 60 Cb 0.53 -0.26 -0.14 0.00 1.02 0.00 0.00 30.24 31.40 1q7i n GLN 60 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1q7i s SER 61 N -0.88 4.20 -0.08 1.08 0.15 -1.26 -4.97 113.70 111.94 1q7i s SER 61 Ca 0.04 -0.29 0.21 0.00 0.70 0.00 0.00 55.95 56.61 1q7i s SER 61 Cb 0.05 -1.66 -0.31 0.00 -1.71 0.00 0.00 66.02 62.39 1q7i s SER 61 CO -0.02 0.15 0.36 0.00 1.20 0.00 0.00 173.24 174.93 1q7i n ALA 62 N 3.63 2.43 -2.67 5.45 0.00 -1.26 -4.43 120.51 123.66 1q7i n ALA 62 Ca -0.18 -0.76 -0.10 0.00 0.00 0.00 0.00 53.44 52.41 1q7i n ALA 62 Cb 0.52 -0.58 0.04 0.00 0.00 0.00 0.00 19.45 19.43 1q7i n ALA 62 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1q7i n ASP 63 N -2.40 0.69 -3.71 0.00 9.92 -1.26 -0.18 116.55 119.61 1q7i n ASP 63 Ca -0.12 -1.54 -0.13 0.00 -0.53 0.00 0.00 54.79 52.47 1q7i n ASP 63 Cb 0.74 -0.22 -0.13 0.00 -0.64 0.00 0.00 41.12 40.86 1q7i n ASP 63 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1q7i s PRO 65 N 1.55 4.73 0.33 0.00 0.04 -1.26 -5.04 135.00 135.34 1q7i s PRO 65 Ca -0.06 1.43 -0.22 0.00 0.04 0.00 0.00 61.00 62.18 1q7i s PRO 65 Cb -0.11 -3.34 -0.10 0.00 0.04 0.00 0.00 34.50 30.99 1q7i s PRO 65 CO -0.08 0.33 0.88 1.03 0.04 0.00 0.00 177.00 179.19 1q7i s ARG 66 N -0.41 4.37 0.00 4.56 0.52 -1.26 -4.82 118.95 121.91 1q7i s ARG 66 Ca 0.44 1.11 0.00 0.00 -0.52 0.00 0.00 55.73 56.76 1q7i s ARG 66 Cb -0.24 -2.63 0.00 0.00 0.52 0.00 0.00 34.95 32.60 1q7i s ARG 66 CO 0.30 0.22 0.28 0.98 0.02 0.00 0.00 175.30 177.10 1q7i n TYR 67 N 0.21 0.00 -1.63 -0.53 9.36 -1.26 -5.13 117.16 118.18 1q7i n TYR 67 Ca 0.02 -0.04 0.00 0.00 3.32 0.00 0.00 57.90 61.21 1q7i n TYR 67 Cb 0.52 -0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.22 1q7i n TYR 67 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69