#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q7i s LYS 2 N 0.00 0.09 -0.78 1.61 -2.85 -1.26 -5.08 119.74 111.47 1q7i s LYS 2 Ca 0.00 0.08 0.03 0.00 -1.00 0.00 0.00 55.97 55.08 1q7i s LYS 2 Cb 0.00 0.05 0.24 0.00 -2.06 0.00 0.00 37.83 36.05 1q7i s LYS 2 CO 0.00 -0.02 0.82 -0.85 0.10 0.00 0.00 175.35 175.40 1q7i n GLU 3 N 1.28 2.72 0.00 1.78 0.28 -1.26 -4.81 120.64 120.63 1q7i n GLU 3 Ca -0.07 -4.58 0.00 0.00 -0.16 0.00 0.00 57.16 52.34 1q7i n GLU 3 Cb 0.57 -2.34 0.00 0.00 1.43 0.00 0.00 31.44 31.11 1q7i n GLU 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1q7i n ASP 5 N 0.00 0.00 -4.76 0.00 -0.08 -1.20 -4.27 116.55 106.23 1q7i n ASP 5 Ca 0.00 0.81 -0.23 0.00 -1.51 0.00 0.00 54.79 53.86 1q7i n ASP 5 Cb 0.00 -0.40 -0.06 0.00 2.34 0.00 0.00 41.12 43.01 1q7i n ASP 5 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1q7i n SER 7 N -1.22 3.06 -3.98 0.00 3.41 -1.26 -4.92 113.62 108.70 1q7i n SER 7 Ca -0.02 -1.89 -0.15 0.00 -0.26 0.00 0.00 58.87 56.54 1q7i n SER 7 Cb 0.61 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 64.20 1q7i n SER 7 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1q7i s SER 8 N -1.15 0.70 0.00 4.04 0.01 -1.26 -5.01 113.70 111.02 1q7i s SER 8 Ca 0.30 -0.19 0.01 0.00 1.31 0.00 0.00 55.95 57.38 1q7i s SER 8 Cb 0.17 -0.05 0.06 0.00 0.21 0.00 0.00 66.02 66.41 1q7i s SER 8 CO 0.23 0.01 1.04 -0.81 0.41 0.00 0.00 173.24 174.13 1q7i n PRO 9 N 2.64 1.03 -0.06 12.44 -0.04 -1.26 -3.09 135.00 146.66 1q7i n PRO 9 Ca -0.15 -0.05 0.01 0.00 -0.04 0.00 0.00 63.50 63.27 1q7i n PRO 9 Cb 0.57 -1.02 0.02 0.00 -0.04 0.00 0.00 33.50 33.03 1q7i n PRO 9 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1q7i n GLU 10 N -0.47 1.47 -2.62 0.54 4.71 -1.26 -4.72 120.64 118.28 1q7i n GLU 10 Ca 0.01 -1.27 -0.42 0.00 -0.01 0.00 0.00 57.16 55.47 1q7i n GLU 10 Cb 0.01 -0.85 -0.03 0.00 -1.01 0.00 0.00 31.44 29.56 1q7i n GLU 10 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 1q7i s ASN 11 N -0.93 7.29 0.00 1.62 3.84 -1.18 -4.90 114.94 120.67 1q7i s ASN 11 Ca 0.04 1.77 0.07 0.00 0.21 0.00 0.00 52.86 54.96 1q7i s ASN 11 Cb 0.04 -2.57 0.43 0.00 -0.55 0.00 0.00 41.25 38.60 1q7i s ASN 11 CO 0.00 -0.32 1.25 -0.81 -2.79 0.00 0.00 177.10 174.44 1q7i n PRO 12 N 3.88 0.97 -0.01 0.43 -0.04 -1.26 -3.12 135.00 135.86 1q7i n PRO 12 Ca 0.07 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.62 1q7i n PRO 12 Cb 0.50 -1.12 -0.14 0.00 -0.04 0.00 0.00 33.50 32.70 1q7i n PRO 12 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1q7i n ASP 15 N 4.68 0.62 -0.45 0.00 2.03 0.51 -4.58 116.55 119.37 1q7i n ASP 15 Ca -0.15 1.16 0.09 0.00 0.52 0.00 0.00 54.79 56.40 1q7i n ASP 15 Cb 0.50 -0.88 0.35 0.00 -0.72 0.00 0.00 41.12 40.37 1q7i n ASP 15 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1q7i n ALA 16 N 2.76 2.52 0.67 -1.67 0.00 -1.26 -1.36 120.51 122.16 1q7i n ALA 16 Ca 0.25 -0.44 0.07 0.00 0.00 0.00 0.00 53.44 53.32 1q7i n ALA 16 Cb 0.01 -1.10 -0.09 0.00 0.00 0.00 0.00 19.45 18.27 1q7i n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q7i n ALA 17 N 0.12 3.89 -0.87 0.00 0.00 -1.26 -4.50 120.51 117.89 1q7i n ALA 17 Ca 0.14 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1q7i n ALA 17 Cb 0.26 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1q7i n ALA 17 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1q7i n THR 18 N -1.41 0.06 -3.19 0.00 -1.04 -1.22 -5.07 114.28 102.41 1q7i n THR 18 Ca 0.02 -0.09 -0.24 0.00 -2.04 0.00 0.00 64.05 61.71 1q7i n THR 18 Cb 0.25 1.46 0.02 0.00 -1.82 0.00 0.00 70.33 70.24 1q7i n THR 18 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1q7i s LYS 20 N -2.48 0.03 1.01 0.00 1.02 -1.15 -2.09 119.74 116.08 1q7i s LYS 20 Ca 0.31 -0.01 -0.15 0.00 0.02 0.00 0.00 55.97 56.14 1q7i s LYS 20 Cb -0.05 0.01 0.12 0.00 -0.52 0.00 0.00 37.83 37.39 1q7i s LYS 20 CO 0.81 -0.01 0.09 1.28 -0.92 0.00 0.00 175.35 176.60 1q7i n LEU 21 N 0.18 -1.72 -4.37 3.17 4.77 -1.26 0.19 117.00 117.95 1q7i n LEU 21 Ca 0.04 -0.29 -0.30 0.00 -0.03 0.00 0.00 56.01 55.43 1q7i n LEU 21 Cb 0.57 -0.77 -0.14 0.00 -2.33 0.00 0.00 43.42 40.75 1q7i n LEU 21 CO 0.08 -3.10 -0.56 -0.13 -1.33 0.00 0.00 177.39 172.35 1q7i s ARG 22 N -3.29 1.76 -0.59 3.23 0.52 -0.36 -3.21 118.95 117.02 1q7i s ARG 22 Ca 0.39 -1.14 -0.22 0.00 -0.52 0.00 0.00 55.73 54.24 1q7i s ARG 22 Cb -0.06 -2.00 -0.19 0.00 0.52 0.00 0.00 34.95 33.23 1q7i s ARG 22 CO 0.42 0.50 1.84 -0.35 0.02 0.00 0.00 175.30 177.73 1q7i n PRO 23 N 1.56 1.17 0.00 3.54 -0.04 -1.26 -3.12 135.00 136.85 1q7i n PRO 23 Ca -0.17 -1.58 0.00 0.00 -0.04 0.00 0.00 63.50 61.71 1q7i n PRO 23 Cb 0.52 -2.75 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 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 4.55 0.00 3.04 0.55 0.00 -1.26 -5.16 105.19 106.91 1q7i n GLY 24 Ca 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.46 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 0.00 -2.06 -0.57 4.61 0.00 -1.18 -4.95 120.51 116.35 1q7i n ALA 25 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1q7i n ALA 25 Cb 0.00 0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1q7i n ALA 25 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1q7i n GLN 26 N -0.56 1.39 0.00 0.00 -0.06 -0.96 -4.95 117.38 112.24 1q7i n GLN 26 Ca -0.02 -1.01 0.00 0.00 -2.00 0.00 0.00 57.00 53.97 1q7i n GLN 26 Cb 0.46 -0.75 0.00 0.00 -4.06 0.00 0.00 30.24 25.90 1q7i n GLN 26 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1q7i n GLY 28 N -0.01 -0.72 3.64 0.00 0.00 -1.26 -4.35 105.19 102.49 1q7i n GLY 28 Ca 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.41 0.23 -0.10 1.61 4.04 -1.26 -4.83 118.70 115.98 1q7i s GLU 29 Ca -0.13 0.29 -0.33 0.00 0.04 0.00 0.00 54.97 54.84 1q7i s GLU 29 Cb 0.06 0.10 0.15 0.00 0.02 0.00 0.00 34.13 34.46 1q7i s GLU 29 CO 0.65 -0.03 1.44 0.20 -1.84 0.00 0.00 175.26 175.68 1q7i s GLY 30 N 0.29 -0.50 0.40 -3.83 0.00 -1.26 -4.94 107.32 97.48 1q7i s GLY 30 Ca 0.03 0.99 0.28 0.00 0.00 0.00 0.00 44.72 46.02 1q7i s GLY 30 CO -0.12 0.19 1.85 1.41 0.00 0.00 0.00 173.10 176.43 1q7i h LEU 31 N 2.00 0.00 -5.45 0.66 -0.00 -1.63 -2.87 115.31 108.02 1q7i h LEU 31 Ca -0.33 0.00 -0.51 0.00 -0.00 0.00 0.00 57.88 57.04 1q7i h LEU 31 Cb 1.19 0.00 -0.41 0.00 -0.00 0.00 0.00 40.66 41.44 1q7i h LEU 31 CO 0.30 0.00 -0.96 0.00 -0.00 0.00 0.00 178.44 177.78 1q7i n GLU 34 N 3.43 2.08 -1.55 0.00 0.28 0.11 -4.45 120.64 120.55 1q7i n GLU 34 Ca 0.17 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 57.03 1q7i n GLU 34 Cb 0.39 0.00 -0.09 0.00 1.43 0.00 0.00 31.44 33.17 1q7i n GLU 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1q7i n GLN 35 N 0.00 0.47 -4.16 3.44 10.64 -1.26 -3.00 117.38 123.51 1q7i n GLN 35 Ca 0.00 -0.80 -0.33 0.00 -1.83 0.00 0.00 57.00 54.04 1q7i n GLN 35 Cb 0.00 -3.41 -0.03 0.00 -0.86 0.00 0.00 30.24 25.94 1q7i n GLN 35 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1q7i s LYS 37 N -6.86 0.74 -0.15 0.00 1.02 -1.16 -2.26 119.74 111.07 1q7i s LYS 37 Ca 0.44 1.09 -0.39 0.00 0.02 0.00 0.00 55.97 57.14 1q7i s LYS 37 Cb -0.24 0.25 -0.16 0.00 -0.52 0.00 0.00 37.83 37.17 1q7i s LYS 37 CO 0.93 -0.12 1.64 1.19 -0.92 0.00 0.00 175.35 178.06 1q7i n PHE 38 N 3.53 1.93 -0.04 3.18 3.72 -1.26 0.07 117.46 128.59 1q7i n PHE 38 Ca -0.17 0.51 0.00 0.00 -0.05 0.00 0.00 57.45 57.74 1q7i n PHE 38 Cb 0.57 -2.44 0.00 0.00 -0.94 0.00 0.00 39.48 36.67 1q7i n PHE 38 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1q7i n SER 39 N 4.64 -1.80 -4.69 4.37 7.64 -0.81 -4.68 113.62 118.29 1q7i n SER 39 Ca 0.24 -0.04 -0.37 0.00 1.01 0.00 0.00 58.87 59.70 1q7i n SER 39 Cb 0.16 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.28 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 -2.84 4.17 1.02 1.43 0.52 -1.26 -4.77 118.95 117.23 1q7i s ARG 40 Ca 0.00 -0.01 -0.25 0.00 -0.52 0.00 0.00 55.73 54.95 1q7i s ARG 40 Cb 0.00 -3.49 -0.13 0.00 0.52 0.00 0.00 34.95 31.85 1q7i s ARG 40 CO 0.00 0.11 -1.15 0.00 0.02 0.00 0.00 175.30 174.28 1q7i n ALA 41 N 4.04 -5.42 -1.29 2.13 0.00 -0.63 -3.15 120.51 116.19 1q7i n ALA 41 Ca -0.12 -1.29 -0.08 0.00 0.00 0.00 0.00 53.44 51.94 1q7i n ALA 41 Cb 0.52 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.95 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 3.17 0.95 3.79 0.00 0.00 0.49 -4.91 105.19 108.67 1q7i n GLY 42 Ca -0.01 -0.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 1q7i n GLY 42 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q7i s LYS 43 N -2.79 3.40 -0.41 1.61 -2.85 -1.19 -4.89 119.74 112.62 1q7i s LYS 43 Ca 0.00 -0.24 -0.29 0.00 -1.00 0.00 0.00 55.97 54.44 1q7i s LYS 43 Cb 0.00 -3.09 0.01 0.00 -2.06 0.00 0.00 37.83 32.70 1q7i s LYS 43 CO 0.00 0.68 1.32 -1.50 0.10 0.00 0.00 175.35 175.95 1q7i s ILE 44 N -0.77 4.02 -0.12 3.79 1.10 -1.26 -0.53 121.20 127.43 1q7i s ILE 44 Ca 0.13 1.06 0.17 0.00 -0.51 0.00 0.00 60.65 61.50 1q7i s ILE 44 Cb -0.12 -4.31 -0.14 0.00 0.15 0.00 0.00 42.46 38.05 1q7i s ILE 44 CO 0.03 -0.79 0.80 0.00 -2.11 0.00 0.00 174.94 172.88 1q7i n ARG 46 N -2.87 0.00 -3.93 0.00 3.00 -1.25 -5.04 116.66 106.57 1q7i n ARG 46 Ca -0.10 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.66 1q7i n ARG 46 Cb 0.84 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 33.23 1q7i n ARG 46 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 1q7i s ILE 47 N -1.07 0.09 0.47 5.15 2.07 -1.26 -4.57 121.20 122.08 1q7i s ILE 47 Ca 0.00 -1.32 0.02 0.00 -1.41 0.00 0.00 60.65 57.95 1q7i s ILE 47 Cb 0.00 -1.69 -0.02 0.00 0.13 0.00 0.00 42.46 40.88 1q7i s ILE 47 CO 0.00 -0.39 0.05 0.00 -1.91 0.00 0.00 174.94 172.68 1q7i s ALA 48 N -3.94 3.68 0.00 1.50 0.00 -1.26 -4.89 121.76 116.85 1q7i s ALA 48 Ca 0.14 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.36 1q7i s ALA 48 Cb 0.04 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.44 1q7i s ALA 48 CO -0.03 -0.13 0.04 0.54 0.00 0.00 0.00 175.76 176.18 1q7i n ARG 49 N -1.13 0.00 -3.37 0.00 5.12 -1.26 -4.90 116.66 111.11 1q7i n ARG 49 Ca -0.14 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.71 1q7i n ARG 49 Cb 0.66 -0.54 -0.07 0.00 -1.16 0.00 0.00 32.46 31.35 1q7i n ARG 49 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1q7i s GLY 50 N 0.00 -0.50 0.00 -0.13 0.00 -1.26 -5.06 107.32 100.37 1q7i s GLY 50 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 44.72 45.90 1q7i s GLY 50 CO 0.00 2.74 0.00 1.34 0.00 0.00 0.00 173.10 177.18 1q7i n ASP 51 N 5.38 -1.91 0.00 1.64 -0.08 -1.26 -5.12 116.55 115.21 1q7i n ASP 51 Ca -0.04 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.24 1q7i n ASP 51 Cb 0.50 -0.95 0.00 0.00 2.34 0.00 0.00 41.12 43.01 1q7i n ASP 51 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 1q7i n TRP 52 N 0.08 0.00 -3.40 -0.67 -0.00 -1.26 -5.08 117.44 107.12 1q7i n TRP 52 Ca 0.00 0.00 -0.44 0.00 -0.00 0.00 0.00 57.50 57.06 1q7i n TRP 52 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 31.31 31.25 1q7i n TRP 52 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 1q7i s ASN 53 N -4.00 6.03 1.28 -0.67 -0.87 -1.26 -5.07 114.94 110.38 1q7i s ASN 53 Ca 0.00 -1.77 -0.17 0.00 -1.57 0.00 0.00 52.86 49.35 1q7i s ASN 53 Cb 0.00 -2.14 0.32 0.00 -0.02 0.00 0.00 41.25 39.41 1q7i s ASN 53 CO 0.00 -0.78 0.98 -1.81 -2.57 0.00 0.00 177.10 172.92 1q7i s ASP 54 N 3.20 0.06 -0.11 -1.22 1.01 -1.26 -4.65 116.67 113.69 1q7i s ASP 54 Ca 0.04 1.26 -0.13 0.00 0.71 0.00 0.00 52.55 54.43 1q7i s ASP 54 Cb -0.28 -1.91 -0.05 0.00 1.01 0.00 0.00 42.92 41.69 1q7i s ASP 54 CO 0.02 -4.73 0.29 -1.81 0.21 0.00 0.00 175.17 169.15 1q7i s ASP 55 N -2.70 6.52 -0.18 0.27 1.01 -1.26 -4.96 116.67 115.36 1q7i s ASP 55 Ca 0.69 0.61 -0.01 0.00 0.71 0.00 0.00 52.55 54.54 1q7i s ASP 55 Cb -0.21 -2.18 0.05 0.00 1.01 0.00 0.00 42.92 41.59 1q7i s ASP 55 CO 0.63 0.22 -0.02 -0.13 0.21 0.00 0.00 175.17 176.07 1q7i s ARG 56 N -0.20 1.19 0.60 8.23 0.52 -1.25 -2.24 118.95 125.79 1q7i s ARG 56 Ca 0.18 -0.53 -0.18 0.00 -0.52 0.00 0.00 55.73 54.68 1q7i s ARG 56 Cb -0.14 -2.07 -0.07 0.00 0.52 0.00 0.00 34.95 33.19 1q7i s ARG 56 CO 0.06 -0.51 0.59 0.00 0.02 0.00 0.00 175.30 175.46 1q7i n THR 58 N -1.82 0.00 -0.21 0.00 -2.24 -1.26 -0.38 114.28 108.36 1q7i n THR 58 Ca 0.12 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.97 1q7i n THR 58 Cb 0.48 -0.56 0.20 0.00 -2.10 0.00 0.00 70.33 68.34 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 5.00 2.65 0.00 3.38 0.00 -1.26 -1.61 105.19 113.35 1q7i n GLY 59 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 0.82 0.01 -4.47 1.61 6.02 -1.26 -4.87 117.38 115.24 1q7i n GLN 60 Ca 0.15 -0.20 -0.33 0.00 -0.01 0.00 0.00 57.00 56.61 1q7i n GLN 60 Cb 0.48 -0.51 -0.14 0.00 1.02 0.00 0.00 30.24 31.09 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 -0.00 4.00 0.00 1.08 0.15 -1.26 -4.97 113.70 112.69 1q7i s SER 61 Ca 0.00 -0.38 0.27 0.00 0.70 0.00 0.00 55.95 56.54 1q7i s SER 61 Cb 0.00 -1.63 0.82 0.00 -1.71 0.00 0.00 66.02 63.50 1q7i s SER 61 CO 0.00 0.10 1.60 0.00 1.20 0.00 0.00 173.24 176.14 1q7i n ALA 62 N 4.00 3.03 -2.60 5.45 0.00 -1.26 -4.50 120.51 124.63 1q7i n ALA 62 Ca -0.18 -0.39 -0.30 0.00 0.00 0.00 0.00 53.44 52.57 1q7i n ALA 62 Cb 0.52 -1.16 -0.04 0.00 0.00 0.00 0.00 19.45 18.77 1q7i n ALA 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1q7i s ASP 63 N -2.49 4.38 -0.07 0.00 1.01 -1.26 -1.53 116.67 116.70 1q7i s ASP 63 Ca 0.25 -1.49 0.01 0.00 0.71 0.00 0.00 52.55 52.03 1q7i s ASP 63 Cb 0.19 0.57 0.02 0.00 1.01 0.00 0.00 42.92 44.71 1q7i s ASP 63 CO 0.51 -1.02 -0.09 0.00 0.21 0.00 0.00 175.17 174.78 1q7i n PRO 65 N 4.21 1.52 -4.13 0.00 -0.04 -1.26 -5.08 135.00 130.22 1q7i n PRO 65 Ca -0.20 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.10 1q7i n PRO 65 Cb 0.51 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.85 1q7i n PRO 65 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1q7i s ARG 66 N 0.00 0.71 -0.35 0.54 0.52 -1.26 -4.98 118.95 114.13 1q7i s ARG 66 Ca 0.00 -0.91 0.07 0.00 -0.52 0.00 0.00 55.73 54.37 1q7i s ARG 66 Cb 0.00 -0.58 0.28 0.00 0.52 0.00 0.00 34.95 35.17 1q7i s ARG 66 CO 0.00 0.12 1.25 0.98 0.02 0.00 0.00 175.30 177.67 1q7i n TYR 67 N 1.24 -1.71 -0.60 -0.53 9.36 -1.26 -5.08 117.16 118.58 1q7i n TYR 67 Ca -0.21 -1.46 0.00 0.00 3.32 0.00 0.00 57.90 59.55 1q7i n TYR 67 Cb 0.55 1.43 0.00 0.00 -0.63 0.00 0.00 39.34 40.69 1q7i n TYR 67 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69