#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bi7 n PRO 11 N 0.00 0.00 0.00 5.31 -0.04 -1.26 -4.94 135.00 134.07 1bi7 n PRO 11 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1bi7 n PRO 11 Cb 0.00 -0.15 0.00 0.00 -0.04 0.00 0.00 33.50 33.31 1bi7 n PRO 11 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1bi7 n SER 12 N -0.61 0.00 -4.06 3.54 2.88 -1.26 -4.70 113.62 109.42 1bi7 n SER 12 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1bi7 n SER 12 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1bi7 n SER 12 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bi7 n ALA 13 N 0.00 4.81 0.00 -1.46 0.00 -1.26 -0.88 120.51 121.72 1bi7 n ALA 13 Ca 0.00 -3.97 0.00 0.00 0.00 0.00 0.00 53.44 49.47 1bi7 n ALA 13 Cb 0.00 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.02 1bi7 n ALA 13 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1bi7 n ASP 14 N 6.36 0.00 -0.30 0.00 -0.08 -1.26 -4.38 116.55 116.88 1bi7 n ASP 14 Ca 0.48 0.00 -0.04 0.00 -1.51 0.00 0.00 54.79 53.72 1bi7 n ASP 14 Cb 0.41 0.05 0.07 0.00 2.34 0.00 0.00 41.12 43.99 1bi7 n ASP 14 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 1bi7 h TRP 15 N 0.00 1.06 -0.71 -0.67 4.06 -1.40 0.09 115.95 118.39 1bi7 h TRP 15 Ca 0.00 -0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.91 1bi7 h TRP 15 Cb 0.00 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 27.78 1bi7 h TRP 15 CO 0.00 0.71 0.29 1.25 -3.56 0.00 0.00 178.44 177.12 1bi7 h LEU 16 N 1.11 0.95 0.74 -4.49 7.12 -1.84 -0.87 115.31 118.03 1bi7 h LEU 16 Ca 0.29 -0.13 -0.04 0.00 0.13 0.00 0.00 57.88 58.13 1bi7 h LEU 16 Cb -0.05 -0.25 0.01 0.00 -0.53 0.00 0.00 40.66 39.84 1bi7 h LEU 16 CO -0.06 0.84 -0.36 0.00 -0.13 0.00 0.00 178.44 178.74 1bi7 h ALA 17 N 1.29 -0.99 -0.62 1.25 0.00 -1.30 0.12 119.26 119.01 1bi7 h ALA 17 Ca 0.24 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 55.02 1bi7 h ALA 17 Cb 0.19 0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1bi7 h ALA 17 CO -0.02 -1.01 0.42 1.79 0.00 0.00 0.00 179.25 180.43 1bi7 h THR 18 N -1.10 0.91 0.22 0.00 1.35 -1.30 1.16 112.91 114.15 1bi7 h THR 18 Ca -0.10 -0.16 -0.01 0.00 -0.55 0.00 0.00 66.41 65.59 1bi7 h THR 18 Cb 0.78 0.41 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 1bi7 h THR 18 CO 0.17 0.08 -0.12 0.00 -0.25 0.00 0.00 175.52 175.40 1bi7 h ALA 19 N 1.68 -1.03 -0.86 6.62 0.00 -0.66 1.81 119.26 126.84 1bi7 h ALA 19 Ca 0.29 -0.07 0.19 0.00 0.00 0.00 0.00 54.91 55.32 1bi7 h ALA 19 Cb 0.52 0.19 -0.11 0.00 0.00 0.00 0.00 17.79 18.39 1bi7 h ALA 19 CO -0.08 -1.01 0.37 0.00 0.00 0.00 0.00 179.25 178.52 1bi7 h ALA 20 N -1.77 1.31 -0.69 0.00 0.00 0.22 0.38 119.26 118.72 1bi7 h ALA 20 Ca -0.03 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1bi7 h ALA 20 Cb 0.25 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1bi7 h ALA 20 CO 0.04 -0.28 0.24 0.00 0.00 0.00 0.00 179.25 179.24 1bi7 h ALA 21 N 1.66 0.90 -0.01 0.00 0.00 0.18 0.22 119.26 122.21 1bi7 h ALA 21 Ca 0.51 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1bi7 h ALA 21 Cb 0.91 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1bi7 h ALA 21 CO -0.49 0.55 0.00 0.54 0.00 0.00 0.00 179.25 179.85 1bi7 n ARG 22 N -4.34 1.16 -3.55 0.00 1.74 0.61 -3.74 116.66 108.54 1bi7 n ARG 22 Ca 0.05 -0.23 -0.21 0.00 -0.77 0.00 0.00 57.85 56.68 1bi7 n ARG 22 Cb 0.20 -1.49 0.08 0.00 -1.02 0.00 0.00 32.46 30.23 1bi7 n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bi7 n GLY 23 N 1.03 -0.46 2.87 -0.13 0.00 0.93 -4.92 105.19 104.52 1bi7 n GLY 23 Ca 0.22 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 46.01 1bi7 n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bi7 n ARG 24 N -4.62 3.88 -0.21 1.61 3.00 -0.56 -4.87 116.66 114.89 1bi7 n ARG 24 Ca -0.12 -3.76 -0.06 0.00 -0.01 0.00 0.00 57.85 53.90 1bi7 n ARG 24 Cb 0.61 -2.82 -0.05 0.00 0.00 0.00 0.00 32.46 30.20 1bi7 n ARG 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1bi7 n VAL 25 N 2.77 -0.34 -0.12 1.55 0.31 -1.26 0.67 118.33 121.91 1bi7 n VAL 25 Ca 0.38 1.47 -0.07 0.00 -0.01 0.00 0.00 64.34 66.11 1bi7 n VAL 25 Cb 0.35 -1.84 0.02 0.00 -0.91 0.00 0.00 33.84 31.46 1bi7 n VAL 25 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1bi7 h GLU 26 N 0.00 0.38 -0.46 5.55 4.39 -1.99 0.19 114.58 122.64 1bi7 h GLU 26 Ca 0.08 -0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.64 1bi7 h GLU 26 Cb 0.21 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 1bi7 h GLU 26 CO -0.47 0.25 -0.17 0.93 -1.16 0.00 0.00 179.01 178.39 1bi7 h GLU 27 N 0.39 0.89 0.03 2.33 5.08 -0.94 0.27 114.58 122.63 1bi7 h GLU 27 Ca 0.16 -0.35 0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1bi7 h GLU 27 Cb 0.08 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1bi7 h GLU 27 CO -0.12 0.99 -0.12 0.28 -1.00 0.00 0.00 179.01 179.04 1bi7 h VAL 28 N 0.79 0.70 0.00 3.13 2.07 0.12 1.36 116.25 124.41 1bi7 h VAL 28 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1bi7 h VAL 28 Cb 0.71 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1bi7 h VAL 28 CO 0.05 0.00 0.00 -1.14 0.02 0.00 0.00 177.57 176.50 1bi7 n ARG 29 N -5.25 0.00 -0.27 1.57 0.63 0.59 -0.35 116.66 113.58 1bi7 n ARG 29 Ca -0.06 0.58 -0.07 0.00 -0.92 0.00 0.00 57.85 57.38 1bi7 n ARG 29 Cb 0.17 -1.44 -0.06 0.00 0.45 0.00 0.00 32.46 31.58 1bi7 n ARG 29 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1bi7 n ALA 30 N -2.08 -0.41 -0.30 5.13 0.00 0.91 0.13 120.51 123.88 1bi7 n ALA 30 Ca 0.00 0.55 0.03 0.00 0.00 0.00 0.00 53.44 54.02 1bi7 n ALA 30 Cb 0.00 0.06 0.11 0.00 0.00 0.00 0.00 19.45 19.62 1bi7 n ALA 30 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1bi7 h LEU 31 N 0.00 -0.81 0.44 0.00 5.85 0.18 0.40 115.31 121.37 1bi7 h LEU 31 Ca 0.10 0.26 -0.02 0.00 0.84 0.00 0.00 57.88 59.06 1bi7 h LEU 31 Cb 0.26 0.53 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1bi7 h LEU 31 CO -0.60 -0.28 -0.21 -0.07 -0.34 0.00 0.00 178.44 176.93 1bi7 h LEU 32 N -0.00 -0.50 -1.85 2.25 3.38 0.40 -2.88 115.31 116.11 1bi7 h LEU 32 Ca 0.41 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.40 1bi7 h LEU 32 Cb 0.63 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1bi7 h LEU 32 CO -0.89 -0.31 0.00 -0.62 0.09 0.00 0.00 178.44 176.72 1bi7 n GLU 33 N -3.86 0.55 -0.19 1.13 1.02 0.21 0.37 120.64 119.87 1bi7 n GLU 33 Ca -0.07 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.09 1bi7 n GLU 33 Cb 0.23 -1.23 0.03 0.00 -0.02 0.00 0.00 31.44 30.45 1bi7 n GLU 33 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bi7 n ALA 34 N 0.65 1.74 -1.86 0.62 0.00 0.13 -4.91 120.51 116.87 1bi7 n ALA 34 Ca 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 53.44 52.30 1bi7 n ALA 34 Cb 0.26 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1bi7 n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bi7 n GLY 35 N -0.34 -0.61 3.00 0.00 0.00 0.16 -4.99 105.19 102.42 1bi7 n GLY 35 Ca 0.03 0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 1bi7 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bi7 s ALA 36 N -2.57 0.70 -0.32 4.61 0.00 -1.00 -4.95 121.76 118.23 1bi7 s ALA 36 Ca 0.02 -0.33 -0.29 0.00 0.00 0.00 0.00 51.96 51.36 1bi7 s ALA 36 Cb -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 23.12 22.91 1bi7 s ALA 36 CO 0.18 0.15 1.39 1.21 0.00 0.00 0.00 175.76 178.69 1bi7 s ASN 37 N -0.07 6.52 0.00 0.00 3.84 -1.26 -4.70 114.94 119.27 1bi7 s ASN 37 Ca 0.01 1.17 -0.00 0.00 0.21 0.00 0.00 52.86 54.25 1bi7 s ASN 37 Cb -0.05 -2.54 -0.02 0.00 -0.55 0.00 0.00 41.25 38.10 1bi7 s ASN 37 CO -0.00 -1.22 1.92 -0.81 -2.79 0.00 0.00 177.10 174.20 1bi7 n PRO 38 N 7.60 0.97 0.00 0.43 -0.04 -1.26 -3.18 135.00 139.52 1bi7 n PRO 38 Ca 0.16 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1bi7 n PRO 38 Cb 0.47 -1.10 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 1bi7 n PRO 38 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1bi7 n ASN 39 N 1.61 0.00 -4.78 3.54 0.23 -1.26 -4.30 115.26 110.29 1bi7 n ASN 39 Ca 0.03 -0.55 -0.35 0.00 -0.53 0.00 0.00 54.58 53.18 1bi7 n ASN 39 Cb 0.48 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.17 1bi7 n ASN 39 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1bi7 s ALA 40 N 0.00 2.76 0.44 -2.53 0.00 -1.19 -4.82 121.76 116.42 1bi7 s ALA 40 Ca 0.00 0.73 -0.23 0.00 0.00 0.00 0.00 51.96 52.46 1bi7 s ALA 40 Cb 0.00 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.72 1bi7 s ALA 40 CO 0.00 -0.60 1.11 -2.14 0.00 0.00 0.00 175.76 174.13 1bi7 s PRO 41 N -3.28 3.91 -0.37 0.00 0.02 -1.26 -3.88 135.00 130.14 1bi7 s PRO 41 Ca 0.70 1.63 0.02 0.00 0.02 0.00 0.00 61.00 63.37 1bi7 s PRO 41 Cb -0.21 -2.42 0.47 0.00 0.02 0.00 0.00 34.50 32.36 1bi7 s PRO 41 CO 0.24 -0.39 1.75 0.27 -0.33 0.00 0.00 177.00 178.55 1bi7 n ASN 42 N -0.39 4.26 0.00 2.53 6.94 -0.80 -4.76 115.26 123.03 1bi7 n ASN 42 Ca 0.07 -3.25 0.00 0.00 -0.02 0.00 0.00 54.58 51.38 1bi7 n ASN 42 Cb 0.49 -0.81 0.00 0.00 -2.36 0.00 0.00 39.78 37.11 1bi7 n ASN 42 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1bi7 n SER 43 N -0.64 0.00 -0.17 0.53 3.41 -1.26 -4.43 113.62 111.06 1bi7 n SER 43 Ca 0.45 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 59.08 1bi7 n SER 43 Cb 1.23 -0.23 0.04 0.00 -0.26 0.00 0.00 64.21 64.99 1bi7 n SER 43 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1bi7 n TYR 44 N -1.88 0.10 -2.96 7.33 4.02 -1.26 -5.05 117.16 117.46 1bi7 n TYR 44 Ca 0.00 -0.36 -0.02 0.00 -0.01 0.00 0.00 57.90 57.51 1bi7 n TYR 44 Cb 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.29 1bi7 n TYR 44 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1bi7 n GLY 45 N -0.10 -2.18 0.00 2.72 0.00 -1.26 -5.03 105.19 99.34 1bi7 n GLY 45 Ca 0.03 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1bi7 n GLY 45 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1bi7 n ARG 46 N 0.90 0.00 -2.04 1.61 3.00 -1.26 -4.74 116.66 114.14 1bi7 n ARG 46 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.56 1bi7 n ARG 46 Cb 0.26 0.00 0.04 0.00 0.00 0.00 0.00 32.46 32.76 1bi7 n ARG 46 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 1bi7 s ARG 47 N 0.00 2.96 1.40 -0.14 1.70 -1.25 -1.91 118.95 121.70 1bi7 s ARG 47 Ca 0.00 0.36 -0.23 0.00 -0.47 0.00 0.00 55.73 55.39 1bi7 s ARG 47 Cb 0.00 -2.10 0.36 0.00 -0.57 0.00 0.00 34.95 32.64 1bi7 s ARG 47 CO 0.00 -0.88 0.98 -1.25 -1.08 0.00 0.00 175.30 173.07 1bi7 s PRO 48 N -5.23 -2.73 -1.64 3.89 0.04 -1.26 -2.43 135.00 125.63 1bi7 s PRO 48 Ca 0.56 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.57 1bi7 s PRO 48 Cb -0.11 -1.42 0.00 0.00 0.04 0.00 0.00 34.50 33.02 1bi7 s PRO 48 CO 0.50 -4.71 0.00 1.51 0.04 0.00 0.00 177.00 174.34 1bi7 n ILE 49 N -5.48 0.00 0.00 0.56 0.00 -1.26 -4.26 119.36 108.92 1bi7 n ILE 49 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.89 1bi7 n ILE 49 Cb 0.61 -1.65 0.00 0.00 0.00 0.00 0.00 39.64 38.59 1bi7 n ILE 49 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1bi7 n GLN 50 N -2.06 0.00 0.00 9.51 7.27 -1.12 -4.61 117.38 126.36 1bi7 n GLN 50 Ca -0.15 0.00 0.06 0.00 0.07 0.00 0.00 57.00 56.98 1bi7 n GLN 50 Cb 0.57 -0.32 0.04 0.00 2.41 0.00 0.00 30.24 32.94 1bi7 n GLN 50 CO 0.00 0.00 0.00 1.55 0.07 0.00 0.00 177.06 178.68 1bi7 n VAL 51 N -1.13 0.00 -0.71 1.69 3.14 -1.02 -4.85 118.33 115.44 1bi7 n VAL 51 Ca 0.00 -0.47 -0.29 0.00 -2.96 0.00 0.00 64.34 60.61 1bi7 n VAL 51 Cb 0.00 1.24 0.21 0.00 -1.06 0.00 0.00 33.84 34.23 1bi7 n VAL 51 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1bi7 s MET 52 N -1.16 -0.05 -0.91 1.45 0.23 -1.26 -3.43 119.30 114.17 1bi7 s MET 52 Ca 0.14 1.00 -0.24 0.00 -1.03 0.00 0.00 55.69 55.56 1bi7 s MET 52 Cb 0.10 -1.64 0.05 0.00 -1.53 0.00 0.00 34.83 31.81 1bi7 s MET 52 CO 0.19 -3.19 1.35 1.41 -2.03 0.00 0.00 175.02 172.75 1bi7 s MET 53 N -4.60 3.45 0.57 3.16 -2.45 0.55 -4.72 119.30 115.26 1bi7 s MET 53 Ca 0.67 -0.90 -0.18 0.00 -1.25 0.00 0.00 55.69 54.03 1bi7 s MET 53 Cb -0.23 -4.92 -0.09 0.00 1.25 0.00 0.00 34.83 30.84 1bi7 s MET 53 CO 0.61 -2.14 0.50 -1.33 1.05 0.00 0.00 175.02 173.72 1bi7 n MET 54 N 8.77 0.48 0.00 4.11 0.00 -1.26 0.61 117.12 129.83 1bi7 n MET 54 Ca 0.22 0.19 0.00 0.00 0.00 0.00 0.00 57.70 58.11 1bi7 n MET 54 Cb 0.50 -1.68 0.00 0.00 0.00 0.00 0.00 33.22 32.04 1bi7 n MET 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1bi7 n GLY 55 N 1.81 1.44 2.78 3.03 0.00 -1.26 -4.86 105.19 108.13 1bi7 n GLY 55 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1bi7 n GLY 55 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bi7 n SER 56 N 0.00 5.56 -0.31 1.61 2.88 0.20 -4.87 113.62 118.68 1bi7 n SER 56 Ca 0.00 -3.63 0.06 0.00 -1.33 0.00 0.00 58.87 53.97 1bi7 n SER 56 Cb 0.00 -0.85 0.15 0.00 -0.75 0.00 0.00 64.21 62.76 1bi7 n SER 56 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bi7 h ALA 57 N 3.79 0.69 -1.00 -1.46 0.00 -1.89 1.66 119.26 121.05 1bi7 h ALA 57 Ca 0.28 0.33 0.22 0.00 0.00 0.00 0.00 54.91 55.75 1bi7 h ALA 57 Cb 0.47 0.63 -0.11 0.00 0.00 0.00 0.00 17.79 18.79 1bi7 h ALA 57 CO 0.99 -0.42 0.61 0.00 0.00 0.00 0.00 179.25 180.44 1bi7 h ARG 58 N 0.01 0.61 -0.06 0.00 3.08 -1.96 0.42 114.38 116.48 1bi7 h ARG 58 Ca 0.45 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 60.29 1bi7 h ARG 58 Cb 0.74 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.67 1bi7 h ARG 58 CO -0.89 0.40 -0.63 0.28 -1.07 0.00 0.00 179.97 178.06 1bi7 h VAL 59 N 0.63 1.37 0.16 2.04 2.07 0.20 0.16 116.25 122.88 1bi7 h VAL 59 Ca 0.60 -1.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.13 1bi7 h VAL 59 Cb 1.12 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 33.23 1bi7 h VAL 59 CO -0.39 0.59 -0.10 0.00 0.02 0.00 0.00 177.57 177.69 1bi7 h ALA 60 N 0.41 -0.24 -1.00 1.67 0.00 -0.12 -1.19 119.26 118.78 1bi7 h ALA 60 Ca -0.06 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 54.92 1bi7 h ALA 60 Cb 1.30 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 19.14 1bi7 h ALA 60 CO 0.13 -0.64 0.63 1.49 0.00 0.00 0.00 179.25 180.86 1bi7 h GLU 61 N -0.26 0.99 0.60 0.00 4.81 -0.21 0.12 114.58 120.63 1bi7 h GLU 61 Ca -0.01 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1bi7 h GLU 61 Cb 0.22 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 29.38 1bi7 h GLU 61 CO 0.01 0.65 -0.29 1.25 -0.73 0.00 0.00 179.01 179.90 1bi7 h LEU 62 N 1.02 -0.69 0.48 1.64 7.12 0.02 -2.37 115.31 122.53 1bi7 h LEU 62 Ca 0.49 -0.01 -0.02 0.00 0.13 0.00 0.00 57.88 58.47 1bi7 h LEU 62 Cb 0.45 0.18 0.00 0.00 -0.53 0.00 0.00 40.66 40.76 1bi7 h LEU 62 CO -0.26 -0.43 -0.23 -0.07 -0.13 0.00 0.00 178.44 177.33 1bi7 h LEU 63 N -0.90 -0.54 -0.46 2.25 3.38 -0.92 -3.29 115.31 114.83 1bi7 h LEU 63 Ca -0.08 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 57.89 1bi7 h LEU 63 Cb 0.65 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 1bi7 h LEU 63 CO 0.14 -0.29 -0.32 -0.07 0.09 0.00 0.00 178.44 177.99 1bi7 h LEU 64 N -0.77 -1.15 -4.31 1.67 3.38 -0.77 0.64 115.31 113.99 1bi7 h LEU 64 Ca -0.07 0.17 -0.34 0.00 0.09 0.00 0.00 57.88 57.74 1bi7 h LEU 64 Cb 0.55 0.50 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 1bi7 h LEU 64 CO 0.11 -0.15 0.84 0.18 0.09 0.00 0.00 178.44 179.50 1bi7 n LEU 65 N -4.22 6.29 -0.39 1.67 4.32 -0.89 -2.33 117.00 121.44 1bi7 n LEU 65 Ca 0.00 -3.56 0.00 0.00 -0.02 0.00 0.00 56.01 52.44 1bi7 n LEU 65 Cb 0.15 -1.45 0.00 0.00 -1.62 0.00 0.00 43.42 40.50 1bi7 n LEU 65 CO -0.06 1.81 0.19 1.57 -1.22 0.00 0.00 177.39 179.68 1bi7 n HIS 66 N 2.73 0.00 -0.98 -1.77 -0.00 0.21 -4.93 115.22 110.48 1bi7 n HIS 66 Ca 0.53 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.71 1bi7 n HIS 66 Cb 0.71 0.23 0.00 0.00 -0.12 0.00 0.00 29.99 30.81 1bi7 n HIS 66 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1bi7 n GLY 67 N 0.00 0.63 2.74 1.57 0.00 -1.09 -4.84 105.19 104.19 1bi7 n GLY 67 Ca 0.00 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 1bi7 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bi7 s ALA 68 N -2.24 1.74 -0.40 4.61 0.00 -0.98 -4.56 121.76 119.93 1bi7 s ALA 68 Ca 0.00 -1.94 -0.36 0.00 0.00 0.00 0.00 51.96 49.66 1bi7 s ALA 68 Cb 0.00 -1.70 -0.13 0.00 0.00 0.00 0.00 23.12 21.29 1bi7 s ALA 68 CO 0.00 -1.77 2.21 -0.85 0.00 0.00 0.00 175.76 175.35 1bi7 n GLU 69 N 4.50 0.88 0.00 0.00 0.00 -1.26 -4.56 120.64 120.20 1bi7 n GLU 69 Ca 0.01 0.23 0.13 0.00 0.00 0.00 0.00 57.16 57.53 1bi7 n GLU 69 Cb 0.40 -2.32 0.59 0.00 0.00 0.00 0.00 31.44 30.11 1bi7 n GLU 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1bi7 n PRO 70 N 8.14 0.05 -3.44 3.44 -0.04 -1.26 -4.67 135.00 137.21 1bi7 n PRO 70 Ca 0.44 0.04 -0.43 0.00 -0.04 0.00 0.00 63.50 63.50 1bi7 n PRO 70 Cb 0.19 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.06 1bi7 n PRO 70 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1bi7 s ASN 71 N -2.95 6.08 -0.17 3.54 0.02 -1.26 -4.63 114.94 115.56 1bi7 s ASN 71 Ca 0.15 -1.13 -0.08 0.00 -1.02 0.00 0.00 52.86 50.78 1bi7 s ASN 71 Cb 0.18 -2.15 0.07 0.00 0.02 0.00 0.00 41.25 39.36 1bi7 s ASN 71 CO 0.48 -0.54 0.40 0.00 0.02 0.00 0.00 177.10 177.46 1bi7 s ALA 73 N 1.84 3.35 -0.86 0.00 0.00 -1.26 -4.37 121.76 120.46 1bi7 s ALA 73 Ca -0.06 0.31 -0.25 0.00 0.00 0.00 0.00 51.96 51.95 1bi7 s ALA 73 Cb -0.10 -3.03 0.02 0.00 0.00 0.00 0.00 23.12 20.02 1bi7 s ALA 73 CO -0.12 0.04 1.49 0.34 0.00 0.00 0.00 175.76 177.50 1bi7 s ASP 74 N 0.05 6.09 0.00 0.00 2.15 -0.47 -4.83 116.67 119.65 1bi7 s ASP 74 Ca 0.40 -0.80 0.00 0.00 0.43 0.00 0.00 52.55 52.58 1bi7 s ASP 74 Cb -0.21 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 1bi7 s ASP 74 CO 0.23 -1.87 0.00 -2.65 -0.17 0.00 0.00 175.17 170.72 1bi7 n PRO 75 N 9.10 0.00 0.00 4.34 -0.02 -1.26 0.93 135.00 148.10 1bi7 n PRO 75 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1bi7 n PRO 75 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 1bi7 n PRO 75 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bi7 n ALA 76 N 0.00 -0.07 -0.31 3.55 0.00 -1.26 -3.52 120.51 118.91 1bi7 n ALA 76 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 53.44 53.69 1bi7 n ALA 76 Cb 0.00 0.04 0.47 0.00 0.00 0.00 0.00 19.45 19.96 1bi7 n ALA 76 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bi7 n THR 77 N -0.80 -0.39 -0.11 0.00 -2.24 -0.17 -4.79 114.28 105.78 1bi7 n THR 77 Ca 0.00 1.94 0.00 0.00 -2.27 0.00 0.00 64.05 63.72 1bi7 n THR 77 Cb 0.00 -3.05 0.00 0.00 -2.10 0.00 0.00 70.33 65.18 1bi7 n THR 77 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1bi7 n LEU 78 N -5.19 0.02 -4.69 3.22 7.94 0.27 -2.18 117.00 116.38 1bi7 n LEU 78 Ca 0.31 0.00 -0.34 0.00 -1.11 0.00 0.00 56.01 54.87 1bi7 n LEU 78 Cb 1.06 -0.09 0.12 0.00 0.53 0.00 0.00 43.42 45.03 1bi7 n LEU 78 CO -0.01 -0.01 0.78 0.35 -1.11 0.00 0.00 177.39 177.38 1bi7 n THR 79 N -2.00 2.44 -4.45 1.96 -2.24 -1.26 -3.68 114.28 105.05 1bi7 n THR 79 Ca 0.00 -0.25 -0.23 0.00 -2.27 0.00 0.00 64.05 61.30 1bi7 n THR 79 Cb 0.00 -1.23 -0.10 0.00 -2.10 0.00 0.00 70.33 66.89 1bi7 n THR 79 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1bi7 s ARG 80 N -4.00 1.61 0.04 -0.78 0.52 -1.26 -1.37 118.95 113.71 1bi7 s ARG 80 Ca 0.75 -1.75 -0.13 0.00 -0.52 0.00 0.00 55.73 54.07 1bi7 s ARG 80 Cb -0.30 -1.56 -0.05 0.00 0.52 0.00 0.00 34.95 33.56 1bi7 s ARG 80 CO 0.49 0.24 1.22 -1.00 0.02 0.00 0.00 175.30 176.27 1bi7 h PRO 81 N 2.30 -0.23 -1.84 3.54 0.13 -1.82 0.10 132.00 134.19 1bi7 h PRO 81 Ca -0.40 0.02 0.53 0.00 -0.87 0.00 0.00 66.00 65.28 1bi7 h PRO 81 Cb 1.25 0.05 -0.07 0.00 0.13 0.00 0.00 31.00 32.36 1bi7 h PRO 81 CO 0.63 -0.15 1.40 1.33 -0.23 0.00 0.00 178.00 180.98 1bi7 n VAL 82 N -3.68 0.00 0.22 1.56 0.24 -1.26 0.11 118.33 115.53 1bi7 n VAL 82 Ca -0.03 1.46 -0.09 0.00 -2.04 0.00 0.00 64.34 63.64 1bi7 n VAL 82 Cb 0.15 -2.46 -0.04 0.00 -1.47 0.00 0.00 33.84 30.02 1bi7 n VAL 82 CO 0.00 0.00 0.00 0.45 -2.14 0.00 0.00 176.83 175.14 1bi7 h HIS 83 N 0.00 -0.54 -0.55 6.34 3.86 -1.19 -1.65 115.15 121.42 1bi7 h HIS 83 Ca 0.87 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 60.18 1bi7 h HIS 83 Cb 3.67 0.18 -0.10 0.00 1.06 0.00 0.00 27.41 32.22 1bi7 h HIS 83 CO 0.00 -0.34 -0.09 -0.44 0.86 0.00 0.00 177.93 177.92 1bi7 h ASP 84 N -0.77 -0.42 -0.67 2.45 3.32 0.13 0.63 116.42 121.09 1bi7 h ASP 84 Ca -0.06 0.16 0.11 0.00 0.02 0.00 0.00 57.03 57.26 1bi7 h ASP 84 Cb 0.45 0.31 -0.08 0.00 0.22 0.00 0.00 39.33 40.22 1bi7 h ASP 84 CO 0.10 -0.15 0.24 0.00 -1.72 0.00 0.00 179.24 177.71 1bi7 h ALA 85 N 1.54 0.88 -0.62 3.45 0.00 -1.08 -0.04 119.26 123.38 1bi7 h ALA 85 Ca 0.27 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.23 1bi7 h ALA 85 Cb 0.42 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1bi7 h ALA 85 CO -0.54 -0.21 0.17 0.00 0.00 0.00 0.00 179.25 178.68 1bi7 h ALA 86 N 1.48 0.82 0.00 0.00 0.00 0.11 -1.72 119.26 119.94 1bi7 h ALA 86 Ca 0.35 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1bi7 h ALA 86 Cb 0.48 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1bi7 h ALA 86 CO -0.36 0.51 -0.44 0.07 0.00 0.00 0.00 179.25 179.04 1bi7 h ARG 87 N 0.91 0.00 -0.01 0.00 0.11 0.80 -3.00 114.38 113.19 1bi7 h ARG 87 Ca 0.20 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.28 1bi7 h ARG 87 Cb 0.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.41 1bi7 h ARG 87 CO -0.00 0.44 -0.35 -1.91 0.10 0.00 0.00 179.97 178.24 1bi7 n GLU 88 N -3.61 0.87 -0.92 0.08 4.07 -0.16 -4.91 120.64 116.06 1bi7 n GLU 88 Ca -0.00 -0.59 0.00 0.00 -0.06 0.00 0.00 57.16 56.50 1bi7 n GLU 88 Cb 0.54 -1.49 0.00 0.00 -0.06 0.00 0.00 31.44 30.43 1bi7 n GLU 88 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1bi7 n GLY 89 N 1.38 0.59 3.53 8.31 0.00 -0.73 -4.98 105.19 113.29 1bi7 n GLY 89 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 1bi7 n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bi7 s PHE 90 N -2.23 3.00 0.28 1.61 0.08 -0.73 -4.74 117.98 115.25 1bi7 s PHE 90 Ca 0.00 -1.64 0.03 0.00 0.12 0.00 0.00 56.93 55.44 1bi7 s PHE 90 Cb 0.00 -4.57 0.66 0.00 -0.57 0.00 0.00 43.02 38.55 1bi7 s PHE 90 CO 0.00 -1.67 1.74 1.25 -0.10 0.00 0.00 175.22 176.44 1bi7 h LEU 91 N 11.51 0.50 0.00 -0.37 5.85 -1.94 -1.46 115.31 129.40 1bi7 h LEU 91 Ca 0.34 0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.18 1bi7 h LEU 91 Cb 0.91 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.99 1bi7 h LEU 91 CO 1.35 0.13 0.00 0.47 -0.34 0.00 0.00 178.44 180.06 1bi7 n ASP 92 N -4.92 0.00 -0.36 1.25 9.92 -1.26 0.52 116.55 121.70 1bi7 n ASP 92 Ca 0.21 1.00 0.03 0.00 -0.53 0.00 0.00 54.79 55.49 1bi7 n ASP 92 Cb 0.56 -0.50 0.18 0.00 -0.64 0.00 0.00 41.12 40.73 1bi7 n ASP 92 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 1bi7 h THR 93 N 0.00 1.10 0.38 -3.53 1.35 -1.74 -1.41 112.91 109.07 1bi7 h THR 93 Ca 0.00 -0.40 -0.01 0.00 -0.55 0.00 0.00 66.41 65.45 1bi7 h THR 93 Cb 0.00 -0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 66.23 1bi7 h THR 93 CO 0.00 0.21 -0.34 0.25 -0.25 0.00 0.00 175.52 175.39 1bi7 h LEU 94 N 1.17 -0.93 -0.48 3.87 5.85 0.30 0.37 115.31 125.47 1bi7 h LEU 94 Ca 0.42 0.07 0.10 0.00 0.84 0.00 0.00 57.88 59.31 1bi7 h LEU 94 Cb 0.15 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 41.39 1bi7 h LEU 94 CO -0.16 -0.47 -0.10 0.58 -0.34 0.00 0.00 178.44 177.95 1bi7 h VAL 95 N -0.71 0.54 -0.91 1.05 2.07 0.40 0.86 116.25 119.55 1bi7 h VAL 95 Ca -0.05 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.53 1bi7 h VAL 95 Cb 0.61 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 30.83 1bi7 h VAL 95 CO -0.02 0.00 0.57 0.58 0.02 0.00 0.00 177.57 178.73 1bi7 h VAL 96 N 0.02 1.04 -0.54 2.57 2.07 -0.91 0.26 116.25 120.76 1bi7 h VAL 96 Ca 0.23 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1bi7 h VAL 96 Cb 0.36 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 1bi7 h VAL 96 CO -0.48 0.19 0.26 -0.07 0.02 0.00 0.00 177.57 177.49 1bi7 h LEU 97 N 1.03 0.72 0.42 2.57 4.07 0.19 -2.25 115.31 122.05 1bi7 h LEU 97 Ca 0.40 -0.13 -0.02 0.00 0.08 0.00 0.00 57.88 58.21 1bi7 h LEU 97 Cb 0.19 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.75 1bi7 h LEU 97 CO -0.18 0.65 -0.20 -0.74 -1.08 0.00 0.00 178.44 176.88 1bi7 h HIS 98 N 0.73 -0.53 -1.10 1.13 2.76 0.38 -2.09 115.15 116.43 1bi7 h HIS 98 Ca 0.19 -0.01 0.30 0.00 -2.20 0.00 0.00 60.37 58.65 1bi7 h HIS 98 Cb 0.12 0.17 -0.07 0.00 1.55 0.00 0.00 27.41 29.19 1bi7 h HIS 98 CO -0.00 -0.33 0.75 0.00 -1.30 0.00 0.00 177.93 177.05 1bi7 h ARG 99 N -0.56 0.19 -0.48 5.26 3.08 -0.74 0.10 114.38 121.23 1bi7 h ARG 99 Ca -0.06 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 1bi7 h ARG 99 Cb 0.43 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1bi7 h ARG 99 CO 0.09 0.13 0.06 0.00 -1.07 0.00 0.00 179.97 179.18 1bi7 h ALA 100 N 1.53 1.22 0.00 0.04 0.00 -0.95 -3.47 119.26 117.62 1bi7 h ALA 100 Ca 0.58 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1bi7 h ALA 100 Cb 1.87 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1bi7 h ALA 100 CO -0.16 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.03 1bi7 n GLY 101 N -0.80 2.16 3.64 0.00 0.00 0.35 -4.92 105.19 105.62 1bi7 n GLY 101 Ca 0.03 -0.23 -0.51 0.00 0.00 0.00 0.00 46.02 45.31 1bi7 n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bi7 n ALA 102 N 0.00 -0.14 -2.64 4.61 0.00 -1.13 -4.87 120.51 116.35 1bi7 n ALA 102 Ca 0.00 0.46 -0.43 0.00 0.00 0.00 0.00 53.44 53.47 1bi7 n ALA 102 Cb 0.00 -2.20 -0.02 0.00 0.00 0.00 0.00 19.45 17.23 1bi7 n ALA 102 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1bi7 s ARG 103 N 1.38 4.06 0.00 0.00 1.70 -1.26 -4.48 118.95 120.35 1bi7 s ARG 103 Ca 0.86 1.02 0.00 0.00 -0.47 0.00 0.00 55.73 57.14 1bi7 s ARG 103 Cb -0.89 -3.73 0.00 0.00 -0.57 0.00 0.00 34.95 29.76 1bi7 s ARG 103 CO 0.48 -0.88 0.18 1.47 -1.08 0.00 0.00 175.30 175.47 1bi7 n LEU 104 N 6.79 0.46 -2.98 -1.89 -0.00 -1.26 -3.65 117.00 114.46 1bi7 n LEU 104 Ca 0.11 -0.23 -0.15 0.00 -0.00 0.00 0.00 56.01 55.74 1bi7 n LEU 104 Cb 0.47 -0.13 -0.02 0.00 -0.00 0.00 0.00 43.42 43.75 1bi7 n LEU 104 CO 0.58 0.09 -0.04 0.47 -0.00 0.00 0.00 177.39 178.49 1bi7 n ASP 105 N 0.58 -1.71 -4.30 1.45 9.92 -1.26 -4.62 116.55 116.61 1bi7 n ASP 105 Ca 0.00 -2.91 -0.18 0.00 -0.53 0.00 0.00 54.79 51.17 1bi7 n ASP 105 Cb 0.09 0.71 -0.10 0.00 -0.64 0.00 0.00 41.12 41.18 1bi7 n ASP 105 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1bi7 s VAL 106 N 0.06 1.54 0.20 2.53 1.01 -1.24 -5.07 120.40 119.43 1bi7 s VAL 106 Ca 0.33 -2.04 0.11 0.00 0.00 0.00 0.00 61.98 60.38 1bi7 s VAL 106 Cb 0.14 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1bi7 s VAL 106 CO -0.16 -0.55 -0.23 -0.13 0.00 0.00 0.00 175.10 174.02 1bi7 s ARG 107 N -3.34 1.51 0.50 2.72 0.52 -1.26 -3.78 118.95 115.82 1bi7 s ARG 107 Ca 0.17 -1.53 0.07 0.00 -0.52 0.00 0.00 55.73 53.92 1bi7 s ARG 107 Cb -0.02 -1.80 0.07 0.00 0.52 0.00 0.00 34.95 33.72 1bi7 s ARG 107 CO 0.05 0.38 0.55 -0.40 0.02 0.00 0.00 175.30 175.90 1bi7 n ASP 108 N 0.21 2.17 -0.23 0.23 5.68 -1.18 -4.79 116.55 118.63 1bi7 n ASP 108 Ca -0.12 -2.49 0.23 0.00 -0.50 0.00 0.00 54.79 51.90 1bi7 n ASP 108 Cb 0.56 -0.22 0.58 0.00 -1.14 0.00 0.00 41.12 40.91 1bi7 n ASP 108 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1bi7 h ALA 109 N 0.40 2.42 -0.43 2.12 0.00 -1.70 1.34 119.26 123.40 1bi7 h ALA 109 Ca -0.27 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1bi7 h ALA 109 Cb 1.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1bi7 h ALA 109 CO 0.40 -0.71 0.00 0.91 0.00 0.00 0.00 179.25 179.85 1bi7 n TRP 110 N -4.44 0.88 -3.17 0.00 8.01 -1.26 -4.94 117.44 112.52 1bi7 n TRP 110 Ca 0.20 -0.37 -0.07 0.00 -1.31 0.00 0.00 57.50 55.95 1bi7 n TRP 110 Cb 0.81 -0.13 0.00 0.00 -2.01 0.00 0.00 31.31 29.98 1bi7 n TRP 110 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1bi7 n GLY 111 N 0.95 -1.21 2.89 6.99 0.00 0.46 -5.04 105.19 110.23 1bi7 n GLY 111 Ca 0.16 0.65 -0.17 0.00 0.00 0.00 0.00 46.02 46.66 1bi7 n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bi7 s ARG 112 N -3.24 0.49 0.34 1.61 0.52 -1.25 -4.79 118.95 112.63 1bi7 s ARG 112 Ca 0.05 -0.06 -0.26 0.00 -0.52 0.00 0.00 55.73 54.94 1bi7 s ARG 112 Cb -0.01 -0.55 -0.10 0.00 0.52 0.00 0.00 34.95 34.81 1bi7 s ARG 112 CO 0.78 -0.03 0.98 -0.51 0.02 0.00 0.00 175.30 176.54 1bi7 s LEU 113 N 0.59 4.29 0.37 2.53 1.02 -1.25 -3.12 118.68 123.11 1bi7 s LEU 113 Ca -0.07 1.90 0.13 0.00 0.02 0.00 0.00 54.13 56.11 1bi7 s LEU 113 Cb -0.10 -4.05 0.94 0.00 0.02 0.00 0.00 46.19 43.00 1bi7 s LEU 113 CO -0.01 -0.18 1.81 -0.65 0.02 0.00 0.00 176.35 177.35 1bi7 h PRO 114 N 3.02 0.55 -0.33 1.29 0.11 -1.82 0.65 132.00 135.47 1bi7 h PRO 114 Ca -0.47 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.67 1bi7 h PRO 114 Cb 1.20 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 32.10 1bi7 h PRO 114 CO 0.64 0.36 -0.37 0.28 -0.21 0.00 0.00 178.00 178.70 1bi7 h VAL 115 N 0.56 0.18 -0.64 3.15 2.07 -1.91 0.25 116.25 119.92 1bi7 h VAL 115 Ca 0.53 0.00 0.09 0.00 0.82 0.00 0.00 66.70 68.14 1bi7 h VAL 115 Cb 1.09 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.97 1bi7 h VAL 115 CO -0.27 0.00 0.27 0.44 0.02 0.00 0.00 177.57 178.03 1bi7 h ASP 116 N -0.33 0.32 0.69 0.57 3.32 -0.06 1.00 116.42 121.92 1bi7 h ASP 116 Ca 0.14 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 1bi7 h ASP 116 Cb 0.57 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.14 1bi7 h ASP 116 CO -0.51 0.19 -0.42 -0.07 -1.72 0.00 0.00 179.24 176.71 1bi7 h LEU 117 N 0.48 -1.05 -0.81 1.55 3.38 -0.30 0.60 115.31 119.17 1bi7 h LEU 117 Ca 0.32 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.46 1bi7 h LEU 117 Cb 0.36 0.30 -0.08 0.00 0.09 0.00 0.00 40.66 41.33 1bi7 h LEU 117 CO -0.28 -0.65 0.43 0.00 0.09 0.00 0.00 178.44 178.03 1bi7 h ALA 118 N -1.31 1.17 -0.56 1.53 0.00 -0.07 0.16 119.26 120.18 1bi7 h ALA 118 Ca -0.09 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1bi7 h ALA 118 Cb 0.83 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1bi7 h ALA 118 CO 0.10 -0.00 0.16 0.93 0.00 0.00 0.00 179.25 180.44 1bi7 h GLU 119 N 0.69 0.87 1.00 0.00 5.08 0.14 0.21 114.58 122.56 1bi7 h GLU 119 Ca 0.41 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.53 1bi7 h GLU 119 Cb 0.48 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.61 1bi7 h GLU 119 CO -0.30 0.80 -0.48 1.49 -1.00 0.00 0.00 179.01 179.53 1bi7 h GLU 120 N 0.78 -1.29 0.00 2.33 4.81 0.16 -2.81 114.58 118.56 1bi7 h GLU 120 Ca 0.18 0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1bi7 h GLU 120 Cb 0.30 0.29 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1bi7 h GLU 120 CO -0.00 -0.86 0.00 1.28 -0.73 0.00 0.00 179.01 178.70 1bi7 n LEU 121 N -5.64 0.09 0.00 1.64 7.99 -0.10 -4.82 117.00 116.16 1bi7 n LEU 121 Ca -0.17 0.53 0.00 0.00 -0.01 0.00 0.00 56.01 56.37 1bi7 n LEU 121 Cb 0.53 -0.54 0.00 0.00 -0.11 0.00 0.00 43.42 43.30 1bi7 n LEU 121 CO 0.40 -0.48 0.00 0.61 -1.51 0.00 0.00 177.39 176.41 1bi7 n GLY 122 N -1.00 0.95 2.89 -0.72 0.00 -1.03 -4.99 105.19 101.29 1bi7 n GLY 122 Ca 0.01 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 1bi7 n GLY 122 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1bi7 n HIS 123 N -2.62 3.35 -0.24 1.61 8.25 0.03 -4.83 115.22 120.77 1bi7 n HIS 123 Ca 0.00 -2.89 -0.06 0.00 -0.26 0.00 0.00 57.72 54.50 1bi7 n HIS 123 Cb 0.18 -2.21 -0.06 0.00 1.12 0.00 0.00 29.99 29.03 1bi7 n HIS 123 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1bi7 n ARG 124 N 4.96 -0.26 -0.09 -0.41 0.00 -1.26 0.23 116.66 119.82 1bi7 n ARG 124 Ca 0.44 1.08 -0.04 0.00 -0.00 0.00 0.00 57.85 59.33 1bi7 n ARG 124 Cb 0.38 -1.59 -0.03 0.00 0.00 0.00 0.00 32.46 31.21 1bi7 n ARG 124 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.63 178.01 1bi7 h ASP 125 N 0.00 -0.68 -0.87 6.15 2.03 -1.97 0.46 116.42 121.54 1bi7 h ASP 125 Ca 0.09 0.10 0.07 0.00 -0.73 0.00 0.00 57.03 56.56 1bi7 h ASP 125 Cb 0.24 0.29 -0.06 0.00 -0.83 0.00 0.00 39.33 38.97 1bi7 h ASP 125 CO -0.55 -0.11 0.57 0.58 -1.03 0.00 0.00 179.24 178.70 1bi7 h VAL 126 N -0.07 1.04 -0.88 4.15 2.07 -1.61 0.87 116.25 121.82 1bi7 h VAL 126 Ca 0.04 -0.33 0.13 0.00 0.82 0.00 0.00 66.70 67.36 1bi7 h VAL 126 Cb 0.17 0.01 -0.09 0.00 -1.52 0.00 0.00 31.29 29.86 1bi7 h VAL 126 CO -0.26 0.17 0.49 0.00 0.02 0.00 0.00 177.57 178.00 1bi7 h ALA 127 N 1.53 1.32 0.12 1.67 0.00 0.17 -0.16 119.26 123.91 1bi7 h ALA 127 Ca 0.38 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.34 1bi7 h ALA 127 Cb 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1bi7 h ALA 127 CO -0.14 0.02 -0.06 0.00 0.00 0.00 0.00 179.25 179.07 1bi7 h ARG 128 N 0.75 -0.16 0.00 0.00 3.08 0.52 0.34 114.38 118.92 1bi7 h ARG 128 Ca 0.46 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.52 1bi7 h ARG 128 Cb 0.56 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1bi7 h ARG 128 CO -0.31 0.30 0.09 -0.92 -1.07 0.00 0.00 179.97 178.05 1bi7 h TYR 129 N -0.69 0.00 0.00 3.04 3.20 -0.31 -1.39 116.97 120.82 1bi7 h TYR 129 Ca -0.02 0.00 -0.20 0.00 3.14 0.00 0.00 58.73 61.66 1bi7 h TYR 129 Cb 0.52 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.76 1bi7 h TYR 129 CO 0.08 0.00 -1.85 1.28 -1.64 0.00 0.00 178.16 176.04 1bi7 n LEU 130 N -2.30 0.00 -1.91 2.82 4.77 -0.14 -4.40 117.00 115.84 1bi7 n LEU 130 Ca -0.01 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.83 1bi7 n LEU 130 Cb 0.13 0.26 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 1bi7 n LEU 130 CO 0.10 0.26 1.27 -1.14 -1.33 0.00 0.00 177.39 176.55 1bi7 n ARG 131 N -2.39 1.72 0.00 3.23 0.63 0.12 -4.24 116.66 115.73 1bi7 n ARG 131 Ca -0.18 -1.23 0.00 0.00 -0.92 0.00 0.00 57.85 55.53 1bi7 n ARG 131 Cb 0.82 -1.59 0.00 0.00 0.45 0.00 0.00 32.46 32.14 1bi7 n ARG 131 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1bi7 n ALA 132 N 0.99 0.00 -1.28 5.13 0.00 -1.19 -4.92 120.51 119.25 1bi7 n ALA 132 Ca 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.62 1bi7 n ALA 132 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.00 1bi7 n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bi7 n ALA 133 N -0.06 -0.15 -0.95 0.00 0.00 -1.26 -4.84 120.51 113.25 1bi7 n ALA 133 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1bi7 n ALA 133 Cb 0.00 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1bi7 n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50