#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g7r h LEU 30 N 0.00 -0.25 0.00 -4.42 4.07 -1.45 0.50 115.31 113.76 2g7r h LEU 30 Ca 0.00 0.20 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2g7r h LEU 30 Cb 0.00 0.32 0.00 0.00 1.08 0.00 0.00 40.66 42.06 2g7r h LEU 30 CO 0.00 -0.17 0.00 -0.46 -1.08 0.00 0.00 178.44 176.73 2g7r n ASN 31 N -5.31 0.00 -0.57 -0.43 6.94 -1.26 -3.30 115.26 111.32 2g7r n ASN 31 Ca 0.16 -0.63 0.06 0.00 -0.02 0.00 0.00 54.58 54.15 2g7r n ASN 31 Cb 0.53 -0.09 0.11 0.00 -2.36 0.00 0.00 39.78 37.98 2g7r n ASN 31 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2g7r n ARG 32 N -1.09 2.03 -1.91 -3.83 5.12 0.16 -4.99 116.66 112.14 2g7r n ARG 32 Ca 0.18 -1.73 -0.31 0.00 -1.93 0.00 0.00 57.85 54.07 2g7r n ARG 32 Cb 0.13 -1.25 0.02 0.00 -1.16 0.00 0.00 32.46 30.20 2g7r n ARG 32 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2g7r s LEU 33 N -0.97 3.15 0.57 0.55 1.43 -1.19 -4.92 118.68 117.29 2g7r s LEU 33 Ca 0.20 1.31 -0.18 0.00 -1.03 0.00 0.00 54.13 54.42 2g7r s LEU 33 Cb 0.11 -4.28 -0.05 0.00 0.03 0.00 0.00 46.19 42.01 2g7r s LEU 33 CO 0.15 -0.99 1.09 -0.13 0.23 0.00 0.00 176.35 176.69 2g7r s ARG 34 N -5.21 3.32 0.24 1.70 0.52 -1.26 -4.72 118.95 113.55 2g7r s ARG 34 Ca 0.56 1.41 -0.05 0.00 -0.52 0.00 0.00 55.73 57.13 2g7r s ARG 34 Cb -0.11 -2.02 0.47 0.00 0.52 0.00 0.00 34.95 33.81 2g7r s ARG 34 CO 0.53 -0.83 1.69 0.93 0.02 0.00 0.00 175.30 177.63 2g7r h GLU 35 N 0.84 0.27 -0.98 3.54 3.07 -1.98 0.22 114.58 119.55 2g7r h GLU 35 Ca -0.48 -0.02 0.19 0.00 -0.50 0.00 0.00 59.36 58.55 2g7r h GLU 35 Cb 1.24 -0.06 -0.09 0.00 -0.84 0.00 0.00 28.75 29.00 2g7r h GLU 35 CO 0.57 0.18 0.61 -1.35 -1.40 0.00 0.00 179.01 177.62 2g7r h PRO 36 N 0.27 0.66 0.14 2.33 0.11 -1.97 0.32 132.00 133.86 2g7r h PRO 36 Ca 0.42 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.48 2g7r h PRO 36 Cb 0.71 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.67 2g7r h PRO 36 CO -0.51 0.44 -0.07 1.25 -0.21 0.00 0.00 178.00 178.90 2g7r h LEU 37 N 0.68 -0.16 0.19 2.35 5.85 -0.92 -0.46 115.31 122.84 2g7r h LEU 37 Ca 0.54 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.91 2g7r h LEU 37 Cb 0.95 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 2g7r h LEU 37 CO -0.31 0.42 -0.21 0.25 -0.34 0.00 0.00 178.44 178.25 2g7r h LEU 38 N -0.91 -0.57 -0.72 2.25 7.12 -1.37 0.28 115.31 121.39 2g7r h LEU 38 Ca -0.02 0.06 0.16 0.00 0.13 0.00 0.00 57.88 58.20 2g7r h LEU 38 Cb 0.51 0.20 -0.11 0.00 -0.53 0.00 0.00 40.66 40.73 2g7r h LEU 38 CO 0.03 -0.31 0.15 -0.09 -0.13 0.00 0.00 178.44 178.09 2g7r h ARG 39 N -0.45 0.24 -0.14 1.25 9.65 -0.47 0.84 114.38 125.29 2g7r h ARG 39 Ca 0.00 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.85 2g7r h ARG 39 Cb 0.43 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 2g7r h ARG 39 CO -0.06 0.16 0.01 -0.09 2.80 0.00 0.00 179.97 182.78 2g7r h ARG 40 N 0.25 0.24 -0.62 0.20 9.65 -0.28 -2.84 114.38 120.98 2g7r h ARG 40 Ca 0.40 -0.07 0.02 0.00 -1.10 0.00 0.00 59.98 59.22 2g7r h ARG 40 Cb 0.68 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.21 2g7r h ARG 40 CO -0.51 0.46 0.41 -0.07 2.80 0.00 0.00 179.97 183.06 2g7r h LEU 41 N -0.01 0.69 -0.11 3.80 4.07 0.07 -3.00 115.31 120.82 2g7r h LEU 41 Ca 0.04 -0.01 -0.09 0.00 0.08 0.00 0.00 57.88 57.90 2g7r h LEU 41 Cb 0.35 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.92 2g7r h LEU 41 CO 0.01 0.49 -0.27 0.77 -1.08 0.00 0.00 178.44 178.35 2g7r h SER 42 N 0.81 0.44 0.50 -0.43 4.64 -0.64 -2.59 113.55 116.28 2g7r h SER 42 Ca 0.24 -0.58 -0.10 0.00 -0.47 0.00 0.00 61.79 60.88 2g7r h SER 42 Cb -0.04 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2g7r h SER 42 CO -0.06 0.93 -0.45 1.05 -0.87 0.00 0.00 176.83 177.44 2g7r h GLU 43 N -0.04 0.00 -0.53 4.77 4.11 -1.52 0.20 114.58 121.57 2g7r h GLU 43 Ca -0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.36 2g7r h GLU 43 Cb 0.88 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 2g7r h GLU 43 CO 0.06 0.45 0.06 -0.07 0.07 0.00 0.00 179.01 179.58 2g7r h LEU 44 N 0.00 0.86 -1.02 3.06 3.38 -1.54 -2.78 115.31 117.28 2g7r h LEU 44 Ca -0.00 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 2g7r h LEU 44 Cb 0.83 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2g7r h LEU 44 CO 0.06 0.92 -0.17 0.25 0.09 0.00 0.00 178.44 179.59 2g7r h LEU 45 N 0.77 0.49 -0.60 1.67 6.46 -0.98 -2.79 115.31 120.33 2g7r h LEU 45 Ca 0.16 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 2g7r h LEU 45 Cb 0.45 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 2g7r h LEU 45 CO 0.02 0.68 0.00 -0.67 -0.62 0.00 0.00 178.44 177.85 2g7r n ASP 46 N -4.17 0.04 -3.43 1.25 4.64 0.65 -4.23 116.55 111.31 2g7r n ASP 46 Ca 0.00 -0.14 -0.09 0.00 -1.38 0.00 0.00 54.79 53.18 2g7r n ASP 46 Cb 0.36 -0.02 -0.08 0.00 -1.04 0.00 0.00 41.12 40.33 2g7r n ASP 46 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2g7r s GLN 47 N -1.40 0.33 0.00 -0.67 -2.07 -1.06 -5.03 119.66 109.77 2g7r s GLN 47 Ca 0.00 0.65 0.00 0.00 -1.82 0.00 0.00 55.36 54.19 2g7r s GLN 47 Cb 0.00 -0.29 0.00 0.00 -1.09 0.00 0.00 33.01 31.63 2g7r s GLN 47 CO 0.00 -0.54 0.00 0.00 -1.32 0.00 0.00 175.29 173.43 2g7r n ALA 48 N 5.37 0.00 0.00 2.60 0.00 -1.26 -4.96 120.51 122.26 2g7r n ALA 48 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2g7r n ALA 48 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2g7r n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g7r n GLY 53 N 0.00 -0.24 0.22 0.00 0.00 -1.26 -5.20 105.19 98.71 2g7r n GLY 53 Ca 0.00 -0.95 0.11 0.00 0.00 0.00 0.00 46.02 45.18 2g7r n GLY 53 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2g7r h TRP 54 N 0.00 0.00 0.04 1.61 5.08 -1.99 -1.17 115.95 119.52 2g7r h TRP 54 Ca 0.00 0.00 -0.24 0.00 1.08 0.00 0.00 58.89 59.73 2g7r h TRP 54 Cb 0.00 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.16 2g7r h TRP 54 CO 0.00 0.16 -1.02 0.00 -1.28 0.00 0.00 178.44 176.30 2g7r h ARG 55 N 0.00 0.37 -0.19 0.12 3.08 -1.98 -1.08 114.38 114.70 2g7r h ARG 55 Ca -0.00 -0.44 -0.05 0.00 0.07 0.00 0.00 59.98 59.56 2g7r h ARG 55 Cb 0.92 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 31.10 2g7r h ARG 55 CO 0.02 1.13 -0.08 -0.09 -1.07 0.00 0.00 179.97 179.88 2g7r h ARG 56 N 0.18 0.38 0.41 0.04 9.65 -1.95 0.16 114.38 123.26 2g7r h ARG 56 Ca -0.09 -0.16 -0.01 0.00 -1.10 0.00 0.00 59.98 58.62 2g7r h ARG 56 Cb 1.67 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 30.21 2g7r h ARG 56 CO 0.17 0.68 -0.49 1.25 2.80 0.00 0.00 179.97 184.38 2g7r h LEU 57 N 0.08 -1.38 -1.04 3.80 5.85 -1.26 0.25 115.31 121.61 2g7r h LEU 57 Ca 0.04 0.12 0.22 0.00 0.84 0.00 0.00 57.88 59.10 2g7r h LEU 57 Cb 0.56 0.47 -0.11 0.00 0.37 0.00 0.00 40.66 41.94 2g7r h LEU 57 CO 0.03 -0.63 0.61 0.00 -0.34 0.00 0.00 178.44 178.10 2g7r h ALA 58 N -0.73 1.78 -0.29 1.25 0.00 -1.14 0.03 119.26 120.16 2g7r h ALA 58 Ca -0.05 0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2g7r h ALA 58 Cb 0.83 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2g7r h ALA 58 CO -0.11 -0.20 -0.46 1.49 0.00 0.00 0.00 179.25 179.97 2g7r h GLU 59 N 0.64 0.77 -0.39 0.00 4.81 0.49 -3.23 114.58 117.68 2g7r h GLU 59 Ca 0.61 -0.44 -0.13 0.00 -0.13 0.00 0.00 59.36 59.27 2g7r h GLU 59 Cb 1.10 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 2g7r h GLU 59 CO -0.42 1.07 -0.28 1.25 -0.73 0.00 0.00 179.01 179.90 2g7r h LEU 60 N 0.61 0.85 -8.42 1.64 7.12 0.13 -3.38 115.31 113.87 2g7r h LEU 60 Ca 0.04 -0.33 -0.67 0.00 0.13 0.00 0.00 57.88 57.05 2g7r h LEU 60 Cb 1.03 -0.23 -0.17 0.00 -0.53 0.00 0.00 40.66 40.76 2g7r h LEU 60 CO 0.10 1.07 0.17 0.00 -0.13 0.00 0.00 178.44 179.66 2g7r s ALA 61 N -4.53 3.33 0.00 1.25 0.00 -0.63 -5.10 121.76 116.09 2g7r s ALA 61 Ca -0.10 -1.61 0.00 0.00 0.00 0.00 0.00 51.96 50.26 2g7r s ALA 61 Cb 0.12 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2g7r s ALA 61 CO 0.85 -2.09 0.00 0.41 0.00 0.00 0.00 175.76 174.93 2g7r n GLY 62 N 5.15 0.01 1.68 0.00 0.00 -1.26 -4.82 105.19 105.96 2g7r n GLY 62 Ca -0.04 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.72 2g7r n GLY 62 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2g7r n LEU 69 N 0.00 -5.68 -4.30 0.99 7.94 -1.26 -5.12 117.00 109.58 2g7r n LEU 69 Ca 0.00 2.79 -0.16 0.00 -1.11 0.00 0.00 56.01 57.53 2g7r n LEU 69 Cb 0.00 -2.65 -0.10 0.00 0.53 0.00 0.00 43.42 41.20 2g7r n LEU 69 CO 0.00 -0.91 -0.31 -0.94 -1.11 0.00 0.00 177.39 174.12 2g7r s SER 70 N -1.32 1.47 0.10 1.96 1.04 -1.26 -5.02 113.70 110.67 2g7r s SER 70 Ca 0.00 -1.25 -0.19 0.00 0.48 0.00 0.00 55.95 54.99 2g7r s SER 70 Cb 0.00 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 2g7r s SER 70 CO 0.00 -0.59 1.09 0.00 0.98 0.00 0.00 173.24 174.72 2g7r h LEU 72 N 0.00 0.54 -0.47 0.00 -0.00 -2.00 -0.63 115.31 112.75 2g7r h LEU 72 Ca 0.10 -0.07 0.03 0.00 -0.00 0.00 0.00 57.88 57.94 2g7r h LEU 72 Cb 0.25 -0.14 -0.03 0.00 -0.00 0.00 0.00 40.66 40.74 2g7r h LEU 72 CO -0.58 0.52 0.27 0.44 -0.00 0.00 0.00 178.44 179.09 2g7r h ASP 73 N 0.59 0.42 0.45 0.17 3.45 -1.52 -2.49 116.42 117.48 2g7r h ASP 73 Ca 0.14 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.59 2g7r h ASP 73 Cb 0.18 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 38.87 2g7r h ASP 73 CO -0.01 0.30 -0.09 -0.07 -1.57 0.00 0.00 179.24 177.80 2g7r h LEU 74 N 0.53 0.00 -0.32 1.55 3.38 0.68 -3.10 115.31 118.03 2g7r h LEU 74 Ca 0.19 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 2g7r h LEU 74 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2g7r h LEU 74 CO -0.10 0.09 -0.15 -0.33 0.09 0.00 0.00 178.44 178.04 2g7r h GLU 75 N 0.00 0.66 -1.40 1.13 5.08 -0.73 -1.07 114.58 118.25 2g7r h GLU 75 Ca -0.00 -0.29 0.44 0.00 -1.00 0.00 0.00 59.36 58.51 2g7r h GLU 75 Cb 0.34 -0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.45 2g7r h GLU 75 CO 0.01 0.88 0.93 1.96 -1.00 0.00 0.00 179.01 181.79 2g7r h GLN 76 N 0.42 0.08 0.18 2.33 1.08 -1.58 0.12 115.11 117.74 2g7r h GLN 76 Ca 0.07 -0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 56.93 2g7r h GLN 76 Cb 0.68 -0.02 0.01 0.00 -0.05 0.00 0.00 27.48 28.10 2g7r h GLN 76 CO 0.05 0.05 -1.67 0.00 -0.95 0.00 0.00 178.83 176.31 2g7r h SER 78 N 0.10 0.82 0.00 0.00 0.87 0.24 -2.62 113.55 112.96 2g7r h SER 78 Ca -0.31 -0.33 0.00 0.00 -1.23 0.00 0.00 61.79 59.92 2g7r h SER 78 Cb 2.09 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 63.83 2g7r h SER 78 CO 0.18 0.95 0.00 0.18 -0.53 0.00 0.00 176.83 177.62 2g7r n LEU 79 N -4.33 0.00 0.16 2.23 4.77 -0.58 -3.02 117.00 116.23 2g7r n LEU 79 Ca -0.00 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.00 2g7r n LEU 79 Cb 0.33 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.69 2g7r n LEU 79 CO 0.42 0.00 0.60 0.11 -1.33 0.00 0.00 177.39 177.20 2g7r h LYS 80 N 0.00 0.00 0.00 3.23 1.79 -1.61 -3.06 116.57 116.93 2g7r h LYS 80 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2g7r h LYS 80 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2g7r h LYS 80 CO 0.00 0.49 -0.03 -0.24 -1.08 0.00 0.00 179.45 178.59 2g7r h VAL 81 N 0.00 0.15 0.00 0.50 3.04 -1.75 -0.97 116.25 117.22 2g7r h VAL 81 Ca -0.00 -0.27 -0.06 0.00 -1.01 0.00 0.00 66.70 65.36 2g7r h VAL 81 Cb 0.93 1.23 -0.01 0.00 -2.01 0.00 0.00 31.29 31.43 2g7r h VAL 81 CO 0.06 0.03 -0.28 -0.07 -1.01 0.00 0.00 177.57 176.30 2g7r h LEU 82 N 0.00 0.00 -9.32 3.16 3.38 -1.80 -3.42 115.31 107.31 2g7r h LEU 82 Ca -0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 2g7r h LEU 82 Cb 0.22 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2g7r h LEU 82 CO 0.00 0.28 0.40 -1.61 0.09 0.00 0.00 178.44 177.61 2g7r s GLU 83 N -4.12 4.46 0.35 1.13 2.02 -0.37 -4.93 118.70 117.24 2g7r s GLU 83 Ca -0.02 1.29 0.15 0.00 0.02 0.00 0.00 54.97 56.41 2g7r s GLU 83 Cb 0.13 -3.50 1.13 0.00 0.10 0.00 0.00 34.13 32.00 2g7r s GLU 83 CO 0.68 -0.16 1.62 -1.35 0.02 0.00 0.00 175.26 176.06 2g7r h PRO 84 N 6.96 0.14 -0.00 0.39 0.11 -1.85 0.26 132.00 138.01 2g7r h PRO 84 Ca -0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2g7r h PRO 84 Cb 1.18 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2g7r h PRO 84 CO 0.80 0.09 -0.36 -1.91 -0.21 0.00 0.00 178.00 176.40 2g7r n GLU 85 N -5.20 2.60 -1.28 1.05 0.00 -1.26 -5.07 120.64 111.46 2g7r n GLU 85 Ca 0.33 -0.37 -0.36 0.00 0.00 0.00 0.00 57.16 56.76 2g7r n GLU 85 Cb 1.07 -1.08 0.07 0.00 0.00 0.00 0.00 31.44 31.49 2g7r n GLU 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2g7r n GLY 86 N 1.09 -1.44 2.77 8.31 0.00 0.93 -5.06 105.19 111.79 2g7r n GLY 86 Ca 0.04 -0.36 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 2g7r n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g7r s SER 87 N -1.46 1.18 0.31 1.61 1.04 -1.26 -4.54 113.70 110.57 2g7r s SER 87 Ca 0.66 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 57.07 2g7r s SER 87 Cb -0.36 -0.33 0.50 0.00 0.10 0.00 0.00 66.02 65.94 2g7r s SER 87 CO 0.57 -0.17 1.86 -0.65 0.98 0.00 0.00 173.24 175.82 2g7r h PRO 88 N 8.02 0.69 -0.59 4.02 0.11 -1.89 -2.37 132.00 139.99 2g7r h PRO 88 Ca -0.24 -0.14 0.04 0.00 0.11 0.00 0.00 66.00 65.77 2g7r h PRO 88 Cb 1.13 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 2g7r h PRO 88 CO 0.30 0.65 0.34 0.77 -0.21 0.00 0.00 178.00 179.84 2g7r h SER 89 N 0.66 0.52 0.02 -2.05 0.02 -1.85 0.70 113.55 111.57 2g7r h SER 89 Ca 0.15 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2g7r h SER 89 Cb 0.29 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.75 2g7r h SER 89 CO 0.00 0.35 -0.01 0.25 -1.14 0.00 0.00 176.83 176.29 2g7r h LEU 90 N 0.65 -0.02 -0.37 5.07 5.85 -1.72 0.23 115.31 124.99 2g7r h LEU 90 Ca 0.25 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 59.02 2g7r h LEU 90 Cb 0.10 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.06 2g7r h LEU 90 CO -0.14 0.02 -0.10 0.00 -0.34 0.00 0.00 178.44 177.88 2g7r h LEU 92 N -0.01 0.80 -0.19 0.00 5.85 0.17 -1.07 115.31 120.85 2g7r h LEU 92 Ca 0.18 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 2g7r h LEU 92 Cb 0.29 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2g7r h LEU 92 CO -0.39 0.65 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.21 2g7r h LEU 93 N 0.88 0.40 -0.16 2.25 3.38 -0.48 0.28 115.31 121.86 2g7r h LEU 93 Ca 0.23 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.83 2g7r h LEU 93 Cb 0.03 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2g7r h LEU 93 CO -0.04 0.71 -0.05 0.11 0.09 0.00 0.00 178.44 179.26 2g7r h LYS 94 N 0.09 -0.02 -0.45 1.13 1.57 -1.27 0.77 116.57 118.40 2g7r h LYS 94 Ca 0.04 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.91 2g7r h LYS 94 Cb 0.55 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.79 2g7r h LYS 94 CO 0.03 -0.01 -0.06 1.25 -0.57 0.00 0.00 179.45 180.08 2g7r h LEU 95 N -0.02 -0.31 -1.08 2.94 5.85 -1.11 0.80 115.31 122.38 2g7r h LEU 95 Ca 0.08 0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2g7r h LEU 95 Cb 0.14 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 2g7r h LEU 95 CO -0.18 -0.11 0.31 0.24 -0.34 0.00 0.00 178.44 178.36 2g7r h MET 96 N 0.05 0.96 0.57 1.25 2.86 0.49 -1.86 114.93 119.25 2g7r h MET 96 Ca 0.22 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.70 2g7r h MET 96 Cb 0.33 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 2g7r h MET 96 CO -0.42 0.75 -0.36 0.78 1.06 0.00 0.00 176.91 178.72 2g7r h GLY 97 N 1.03 -0.95 -0.13 8.32 0.00 0.13 -1.64 103.07 109.83 2g7r h GLY 97 Ca 0.23 0.40 0.25 0.00 0.00 0.00 0.00 47.33 48.20 2g7r h GLY 97 CO -0.03 -0.34 0.61 0.83 0.00 0.00 0.00 176.54 177.61 2g7r h GLU 98 N -0.88 0.55 0.00 4.80 5.08 -0.71 0.65 114.58 124.08 2g7r h GLU 98 Ca -0.07 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2g7r h GLU 98 Cb 0.72 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2g7r h GLU 98 CO 0.06 0.37 0.00 1.63 -1.00 0.00 0.00 179.01 180.07 2g7r n LYS 99 N -4.85 0.21 0.00 2.33 4.76 -0.71 -4.88 118.16 115.02 2g7r n LYS 99 Ca 0.27 0.35 0.00 0.00 -2.87 0.00 0.00 58.31 56.06 2g7r n LYS 99 Cb 0.75 -1.84 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 2g7r n LYS 99 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2g7r n GLY 100 N 0.42 1.61 3.74 0.72 0.00 0.22 -5.09 105.19 106.81 2g7r n GLY 100 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 2g7r n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g7r s THR 102 N -0.34 2.92 -0.07 0.00 2.01 -1.26 -1.27 115.64 117.62 2g7r s THR 102 Ca 0.43 -0.92 0.29 0.00 0.31 0.00 0.00 61.69 61.80 2g7r s THR 102 Cb -0.23 -2.99 0.31 0.00 0.01 0.00 0.00 72.50 69.60 2g7r s THR 102 CO 0.28 0.00 1.88 0.58 -0.69 0.00 0.00 174.62 176.68 2g7r h VAL 103 N 0.50 0.00 0.06 3.82 2.07 -1.97 -2.32 116.25 118.41 2g7r h VAL 103 Ca -0.40 -0.20 -0.28 0.00 0.82 0.00 0.00 66.70 66.64 2g7r h VAL 103 Cb 1.28 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 2g7r h VAL 103 CO 0.47 0.00 -1.43 0.71 0.02 0.00 0.00 177.57 177.34 2g7r h THR 104 N 0.00 1.24 -0.28 2.57 1.35 -2.00 -3.03 112.91 112.76 2g7r h THR 104 Ca 0.00 -2.94 -0.12 0.00 -0.55 0.00 0.00 66.41 62.80 2g7r h THR 104 Cb 0.25 2.71 -0.01 0.00 -1.73 0.00 0.00 68.15 69.36 2g7r h THR 104 CO 0.00 0.79 -0.33 -0.33 -0.25 0.00 0.00 175.52 175.40 2g7r h GLU 105 N 0.03 0.59 -0.45 4.72 5.08 -1.88 -2.49 114.58 120.19 2g7r h GLU 105 Ca -0.19 -0.27 0.04 0.00 -1.00 0.00 0.00 59.36 57.94 2g7r h GLU 105 Cb 1.95 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 31.15 2g7r h GLU 105 CO 0.13 0.84 0.23 1.25 -1.00 0.00 0.00 179.01 180.46 2g7r h LEU 106 N 0.50 0.33 -0.38 1.33 5.85 -1.50 -1.60 115.31 119.85 2g7r h LEU 106 Ca 0.06 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2g7r h LEU 106 Cb 0.81 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 2g7r h LEU 106 CO 0.07 0.23 0.15 0.28 -0.34 0.00 0.00 178.44 178.84 2g7r h SER 107 N 0.45 0.52 -0.88 1.25 0.02 -1.44 0.30 113.55 113.77 2g7r h SER 107 Ca 0.19 -0.16 0.19 0.00 -0.84 0.00 0.00 61.79 61.17 2g7r h SER 107 Cb 0.09 -0.13 -0.16 0.00 0.14 0.00 0.00 62.40 62.34 2g7r h SER 107 CO -0.13 0.54 -0.14 0.44 -1.14 0.00 0.00 176.83 176.39 2g7r h ASP 108 N 0.46 -0.69 -0.06 3.07 5.19 -0.97 0.12 116.42 123.55 2g7r h ASP 108 Ca 0.13 0.26 -0.02 0.00 -0.62 0.00 0.00 57.03 56.78 2g7r h ASP 108 Cb 0.18 0.51 -0.00 0.00 0.18 0.00 0.00 39.33 40.19 2g7r h ASP 108 CO -0.01 -0.29 -0.03 -0.26 -3.12 0.00 0.00 179.24 175.53 2g7r h PHE 109 N 0.02 0.14 -0.07 4.55 0.04 -0.67 -2.37 116.94 118.58 2g7r h PHE 109 Ca 0.45 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 61.17 2g7r h PHE 109 Cb 0.76 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.87 2g7r h PHE 109 CO -0.62 0.52 -0.02 -0.07 -0.60 0.00 0.00 178.31 177.53 2g7r h LEU 110 N -0.28 0.08 0.30 1.54 3.38 -0.59 0.76 115.31 120.51 2g7r h LEU 110 Ca 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2g7r h LEU 110 Cb 0.49 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2g7r h LEU 110 CO 0.01 0.12 -0.15 -0.61 0.09 0.00 0.00 178.44 177.91 2g7r h GLN 111 N 0.09 -0.39 -0.93 1.13 5.75 -0.99 -2.55 115.11 117.21 2g7r h GLN 111 Ca 0.02 0.03 0.22 0.00 -0.15 0.00 0.00 58.65 58.77 2g7r h GLN 111 Cb 0.10 0.09 -0.12 0.00 1.07 0.00 0.00 27.48 28.62 2g7r h GLN 111 CO 0.00 -0.06 0.48 0.00 -2.65 0.00 0.00 178.83 176.60 2g7r h ALA 112 N -0.48 1.55 0.33 3.38 0.00 -1.30 0.11 119.26 122.85 2g7r h ALA 112 Ca -0.04 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2g7r h ALA 112 Cb 0.52 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2g7r h ALA 112 CO 0.07 -0.28 -0.16 1.98 0.00 0.00 0.00 179.25 180.86 2g7r h MET 113 N 0.50 -0.43 -0.77 0.00 -1.53 -0.79 0.28 114.93 112.19 2g7r h MET 113 Ca 0.58 0.03 0.07 0.00 -3.44 0.00 0.00 59.70 56.94 2g7r h MET 113 Cb 1.07 0.10 -0.06 0.00 -0.55 0.00 0.00 31.60 32.16 2g7r h MET 113 CO -0.49 -0.29 0.45 0.93 0.14 0.00 0.00 176.91 177.65 2g7r h GLU 114 N -0.44 0.77 -0.01 0.39 5.08 -1.10 -1.36 114.58 117.91 2g7r h GLU 114 Ca -0.04 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.08 2g7r h GLU 114 Cb 0.34 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2g7r h GLU 114 CO 0.07 0.51 -0.83 0.45 -1.00 0.00 0.00 179.01 178.22 2g7r h HIS 115 N 0.80 0.29 0.00 4.33 3.86 -0.28 -3.11 115.15 121.03 2g7r h HIS 115 Ca 0.35 -0.15 -0.14 0.00 -1.16 0.00 0.00 60.37 59.27 2g7r h HIS 115 Cb 0.24 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 2g7r h HIS 115 CO -0.06 0.94 -0.65 1.79 0.86 0.00 0.00 177.93 180.81 2g7r h THR 116 N 0.12 1.11 -0.55 2.45 1.35 -0.38 -3.02 112.91 113.99 2g7r h THR 116 Ca -0.04 -2.57 0.04 0.00 -0.55 0.00 0.00 66.41 63.30 2g7r h THR 116 Cb 1.43 2.55 -0.04 0.00 -1.73 0.00 0.00 68.15 70.36 2g7r h THR 116 CO 0.13 0.63 0.31 -0.08 -0.25 0.00 0.00 175.52 176.25 2g7r h GLU 117 N 0.00 0.58 0.05 4.72 4.81 -1.18 0.11 114.58 123.67 2g7r h GLU 117 Ca -0.01 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2g7r h GLU 117 Cb 1.50 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.75 2g7r h GLU 117 CO 0.08 0.38 -0.03 -0.39 -0.73 0.00 0.00 179.01 178.33 2g7r h VAL 118 N 0.59 1.22 -1.01 0.32 -1.51 -1.65 -2.04 116.25 112.17 2g7r h VAL 118 Ca 0.23 -0.96 0.24 0.00 -1.23 0.00 0.00 66.70 64.99 2g7r h VAL 118 Cb 0.09 1.84 -0.12 0.00 -2.13 0.00 0.00 31.29 30.98 2g7r h VAL 118 CO -0.13 0.24 0.61 -0.07 -1.23 0.00 0.00 177.57 176.98 2g7r h LEU 119 N -0.51 0.65 0.21 4.19 -0.00 -1.38 0.28 115.31 118.76 2g7r h LEU 119 Ca -0.01 0.12 -0.01 0.00 -0.00 0.00 0.00 57.88 57.99 2g7r h LEU 119 Cb 0.45 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.13 2g7r h LEU 119 CO 0.01 0.12 -0.10 -0.61 -0.00 0.00 0.00 178.44 177.86 2g7r h GLN 120 N 0.57 -0.28 0.00 1.13 -0.00 -0.76 -3.00 115.11 112.77 2g7r h GLN 120 Ca 0.63 0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 59.29 2g7r h GLN 120 Cb 1.24 0.06 -0.00 0.00 0.00 0.00 0.00 27.48 28.78 2g7r h GLN 120 CO -0.44 -0.05 -0.04 -0.07 0.00 0.00 0.00 178.83 178.23 2g7r h LEU 121 N -0.47 0.00 -3.34 -2.39 3.38 -0.23 0.54 115.31 112.80 2g7r h LEU 121 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2g7r h LEU 121 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2g7r h LEU 121 CO 0.05 0.04 0.00 0.18 0.09 0.00 0.00 178.44 178.80 2g7r n LEU 122 N -4.06 5.28 -4.83 1.67 4.77 -0.52 -4.97 117.00 114.34 2g7r n LEU 122 Ca -0.03 -2.67 -0.36 0.00 -0.03 0.00 0.00 56.01 52.92 2g7r n LEU 122 Cb 0.12 -0.64 -0.07 0.00 -2.33 0.00 0.00 43.42 40.51 2g7r n LEU 122 CO 0.31 0.73 -0.18 -0.44 -1.33 0.00 0.00 177.39 176.48 2g7r s SER 123 N -0.84 6.29 0.00 -1.43 0.01 0.18 -5.04 113.70 112.87 2g7r s SER 123 Ca 0.54 0.39 0.32 0.00 1.31 0.00 0.00 55.95 58.50 2g7r s SER 123 Cb 0.37 -2.05 1.82 0.00 0.21 0.00 0.00 66.02 66.37 2g7r s SER 123 CO 0.21 0.35 2.18 -2.65 0.41 0.00 0.00 173.24 173.74