#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v9x s ARG 2 N 0.00 3.66 0.14 2.12 1.81 -1.26 -4.02 118.95 121.39 2v9x s ARG 2 Ca 0.00 -0.00 -0.31 0.00 -1.72 0.00 0.00 55.73 53.70 2v9x s ARG 2 Cb 0.00 -2.78 -0.08 0.00 -0.45 0.00 0.00 34.95 31.63 2v9x s ARG 2 CO 0.00 0.41 1.41 -0.51 -0.68 0.00 0.00 175.30 175.93 2v9x s LEU 3 N -2.79 4.37 0.74 2.53 1.43 -0.39 -5.01 118.68 119.55 2v9x s LEU 3 Ca 0.43 2.39 -0.11 0.00 -1.03 0.00 0.00 54.13 55.81 2v9x s LEU 3 Cb -0.12 -3.59 0.03 0.00 0.03 0.00 0.00 46.19 42.54 2v9x s LEU 3 CO 0.24 -0.67 1.08 0.00 0.23 0.00 0.00 176.35 177.23 2v9x h ASP 5 N -0.82 -0.67 -0.60 0.00 3.04 0.00 -0.73 116.42 116.64 2v9x h ASP 5 Ca -0.45 0.24 0.03 0.00 -3.24 0.00 0.00 57.03 53.61 2v9x h ASP 5 Cb 1.24 0.48 -0.04 0.00 -1.04 0.00 0.00 39.33 39.97 2v9x h ASP 5 CO 0.60 -0.26 0.36 -0.09 -2.04 0.00 0.00 179.24 177.81 2v9x h ARG 6 N 0.02 0.68 -0.15 4.15 9.65 -1.93 -1.26 114.38 125.55 2v9x h ARG 6 Ca 0.41 -0.04 -0.12 0.00 -1.10 0.00 0.00 59.98 59.14 2v9x h ARG 6 Cb 0.67 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 2v9x h ARG 6 CO -0.82 0.45 -0.41 -0.44 2.80 0.00 0.00 179.97 181.55 2v9x h ASP 7 N 0.70 0.35 -0.27 -3.80 3.32 -1.59 -1.93 116.42 113.21 2v9x h ASP 7 Ca 0.25 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2v9x h ASP 7 Cb 0.05 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2v9x h ASP 7 CO -0.12 0.73 0.18 0.40 -1.72 0.00 0.00 179.24 178.71 2v9x h ILE 8 N 0.28 1.06 -0.96 0.35 2.04 -0.65 0.59 117.51 120.23 2v9x h ILE 8 Ca 0.02 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.77 2v9x h ILE 8 Cb 0.85 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 2v9x h ILE 8 CO 0.07 0.07 0.63 -0.33 0.00 0.00 0.00 178.15 178.59 2v9x h GLU 9 N 0.36 1.25 -0.62 2.37 5.08 -1.13 -0.97 114.58 120.92 2v9x h GLU 9 Ca 0.10 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 2v9x h GLU 9 Cb -0.04 -0.28 -0.03 0.00 0.50 0.00 0.00 28.75 28.90 2v9x h GLU 9 CO -0.03 0.83 0.15 0.00 -1.00 0.00 0.00 179.01 178.97 2v9x h ALA 10 N 1.41 0.82 -0.64 3.43 0.00 -0.87 -0.06 119.26 123.35 2v9x h ALA 10 Ca 0.35 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2v9x h ALA 10 Cb -0.15 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.38 2v9x h ALA 10 CO -0.08 0.53 0.14 -1.49 0.00 0.00 0.00 179.25 178.35 2v9x h TRP 11 N 0.91 1.06 -0.25 0.00 4.06 -0.63 -0.90 115.95 120.20 2v9x h TRP 11 Ca 0.20 -0.12 -0.04 0.00 2.06 0.00 0.00 58.89 60.99 2v9x h TRP 11 Cb 0.35 -0.30 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 2v9x h TRP 11 CO 0.03 0.88 0.02 -0.07 -3.56 0.00 0.00 178.44 175.73 2v9x h LEU 12 N 0.96 0.42 -0.37 -4.49 3.38 -0.90 -1.87 115.31 112.44 2v9x h LEU 12 Ca 0.20 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.89 2v9x h LEU 12 Cb 0.36 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2v9x h LEU 12 CO 0.00 0.60 0.24 0.44 0.09 0.00 0.00 178.44 179.81 2v9x h ASP 13 N 0.22 0.40 0.43 -0.43 3.32 -0.90 -1.99 116.42 117.48 2v9x h ASP 13 Ca 0.07 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2v9x h ASP 13 Cb 0.38 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2v9x h ASP 13 CO 0.01 0.29 0.00 1.21 -1.72 0.00 0.00 179.24 179.03 2v9x n GLU 14 N -4.85 0.08 -1.03 3.56 2.13 -0.35 -4.87 120.64 115.30 2v9x n GLU 14 Ca 0.00 0.39 -0.01 0.00 0.66 0.00 0.00 57.16 58.20 2v9x n GLU 14 Cb 0.04 -1.67 -0.00 0.00 0.27 0.00 0.00 31.44 30.08 2v9x n GLU 14 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2v9x n GLY 15 N -0.39 0.47 0.09 8.31 0.00 -0.75 -4.91 105.19 108.00 2v9x n GLY 15 Ca 0.02 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 2v9x n GLY 15 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2v9x h ARG 16 N 0.59 -0.11 -6.15 1.61 3.08 -1.61 -3.43 114.38 108.36 2v9x h ARG 16 Ca -0.02 0.01 -0.67 0.00 0.07 0.00 0.00 59.98 59.36 2v9x h ARG 16 Cb 0.25 0.02 -0.16 0.00 0.08 0.00 0.00 29.97 30.17 2v9x h ARG 16 CO 0.03 0.18 -0.67 -1.17 -1.07 0.00 0.00 179.97 177.28 2v9x s LEU 17 N -9.63 3.36 0.03 3.04 2.96 -1.18 -3.85 118.68 113.41 2v9x s LEU 17 Ca -0.15 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.78 2v9x s LEU 17 Cb 0.03 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 2v9x s LEU 17 CO 0.64 0.32 -0.11 -0.94 -1.32 0.00 0.00 176.35 174.94 2v9x s SER 18 N -1.23 1.24 -0.08 3.68 1.04 -0.85 -4.24 113.70 113.26 2v9x s SER 18 Ca 0.16 -0.40 0.01 0.00 0.48 0.00 0.00 55.95 56.20 2v9x s SER 18 Cb -0.11 -0.06 0.02 0.00 0.10 0.00 0.00 66.02 65.96 2v9x s SER 18 CO 0.06 -0.02 -0.07 -0.63 0.98 0.00 0.00 173.24 173.56 2v9x s ILE 19 N -0.82 0.88 -0.11 -1.02 1.01 -1.26 -0.66 121.20 119.23 2v9x s ILE 19 Ca -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 60.65 60.37 2v9x s ILE 19 Cb -0.07 -0.88 0.03 0.00 0.01 0.00 0.00 42.46 41.54 2v9x s ILE 19 CO 0.01 0.32 -0.06 0.20 0.00 0.00 0.00 174.94 175.41 2v9x s ASN 20 N 1.25 2.07 0.51 3.58 0.01 0.27 -2.15 114.94 120.48 2v9x s ASN 20 Ca -0.04 -0.26 -0.22 0.00 -0.71 0.00 0.00 52.86 51.63 2v9x s ASN 20 Cb -0.14 -0.77 -0.06 0.00 0.41 0.00 0.00 41.25 40.69 2v9x s ASN 20 CO -0.02 -0.13 1.21 -2.16 -1.51 0.00 0.00 177.10 174.48 2v9x s PRO 21 N 1.76 3.44 0.01 -0.60 0.04 -1.26 -0.73 135.00 137.66 2v9x s PRO 21 Ca 0.05 1.87 -0.30 0.00 0.04 0.00 0.00 61.00 62.66 2v9x s PRO 21 Cb -0.12 -2.25 -0.06 0.00 0.04 0.00 0.00 34.50 32.11 2v9x s PRO 21 CO -0.08 -0.84 1.38 0.50 0.04 0.00 0.00 177.00 178.00 2v9x s ARG 22 N -2.91 4.30 0.50 4.56 3.52 -0.92 -4.91 118.95 123.08 2v9x s ARG 22 Ca 0.69 1.95 -0.21 0.00 -0.13 0.00 0.00 55.73 58.03 2v9x s ARG 22 Cb -0.31 -3.52 -0.07 0.00 -1.56 0.00 0.00 34.95 29.49 2v9x s ARG 22 CO 0.37 -0.53 1.14 -2.14 -0.81 0.00 0.00 175.30 173.32 2v9x s PRO 23 N 2.15 3.58 0.82 5.12 0.02 -1.26 -5.02 135.00 140.42 2v9x s PRO 23 Ca 0.63 1.67 -0.11 0.00 0.02 0.00 0.00 61.00 63.21 2v9x s PRO 23 Cb -0.32 -2.21 0.08 0.00 0.02 0.00 0.00 34.50 32.08 2v9x s PRO 23 CO 0.27 -0.67 1.09 -1.25 -0.33 0.00 0.00 177.00 176.11 2v9x s PRO 24 N -2.99 1.89 0.42 5.54 0.04 -1.26 -4.88 135.00 133.75 2v9x s PRO 24 Ca 0.68 0.90 0.22 0.00 0.04 0.00 0.00 61.00 62.84 2v9x s PRO 24 Cb -0.26 -1.87 1.18 0.00 0.04 0.00 0.00 34.50 33.59 2v9x s PRO 24 CO 0.30 -1.83 1.77 0.28 0.04 0.00 0.00 177.00 177.56 2v9x h VAL 25 N -1.25 0.49 0.00 -0.36 2.07 -1.95 0.37 116.25 115.62 2v9x h VAL 25 Ca -0.47 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 2v9x h VAL 25 Cb 1.26 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2v9x h VAL 25 CO 0.55 0.06 -0.02 -0.33 0.02 0.00 0.00 177.57 177.85 2v9x h GLU 26 N 0.32 0.00 -0.19 1.57 3.07 -2.04 -2.23 114.58 115.08 2v9x h GLU 26 Ca 0.60 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.46 2v9x h GLU 26 Cb 1.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.57 2v9x h GLU 26 CO -0.26 0.02 0.00 0.54 -1.40 0.00 0.00 179.01 177.90 2v9x n ARG 27 N -3.47 2.36 -4.07 2.33 5.12 0.13 -4.78 116.66 114.28 2v9x n ARG 27 Ca -0.03 -2.01 -0.32 0.00 -1.93 0.00 0.00 57.85 53.56 2v9x n ARG 27 Cb 0.11 -1.48 -0.15 0.00 -1.16 0.00 0.00 32.46 29.78 2v9x n ARG 27 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2v9x s ILE 28 N -1.77 2.16 -0.00 0.55 1.01 -0.84 -1.37 121.20 120.93 2v9x s ILE 28 Ca 0.33 -1.61 -0.24 0.00 0.00 0.00 0.00 60.65 59.13 2v9x s ILE 28 Cb 0.21 -2.26 0.05 0.00 0.01 0.00 0.00 42.46 40.48 2v9x s ILE 28 CO 0.31 -0.01 0.54 0.54 0.00 0.00 0.00 174.94 176.32 2v9x s ASN 29 N 1.11 -0.47 1.60 3.58 2.20 -0.54 -4.90 114.94 117.52 2v9x s ASN 29 Ca -0.08 0.37 0.00 0.00 -0.94 0.00 0.00 52.86 52.20 2v9x s ASN 29 Cb -0.20 0.47 0.00 0.00 -2.00 0.00 0.00 41.25 39.53 2v9x s ASN 29 CO -0.05 -0.62 0.00 0.61 -2.94 0.00 0.00 177.10 174.10 2v9x n GLY 30 N 0.79 1.39 0.19 0.45 0.00 -1.26 -1.90 105.19 104.85 2v9x n GLY 30 Ca -0.19 0.20 0.06 0.00 0.00 0.00 0.00 46.02 46.09 2v9x n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v9x n ALA 31 N 8.86 2.14 -2.34 4.61 0.00 -1.26 0.73 120.51 133.25 2v9x n ALA 31 Ca 0.00 -2.02 -0.08 0.00 0.00 0.00 0.00 53.44 51.34 2v9x n ALA 31 Cb 0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.96 2v9x n ALA 31 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2v9x s THR 32 N -1.87 0.19 -0.14 0.00 -4.23 -0.80 -4.45 115.64 104.34 2v9x s THR 32 Ca 0.20 -1.53 0.01 0.00 -1.18 0.00 0.00 61.69 59.19 2v9x s THR 32 Cb 0.18 -1.23 -0.00 0.00 1.34 0.00 0.00 72.50 72.78 2v9x s THR 32 CO 0.02 -0.85 -0.18 -0.69 -0.54 0.00 0.00 174.62 172.38 2v9x s VAL 33 N -3.38 2.48 0.24 2.29 1.01 -0.29 -1.47 120.40 121.27 2v9x s VAL 33 Ca 0.02 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 2v9x s VAL 33 Cb 0.04 -2.02 -0.09 0.00 0.00 0.00 0.00 36.38 34.31 2v9x s VAL 33 CO -0.08 0.53 1.04 -1.81 0.00 0.00 0.00 175.10 174.78 2v9x s ASP 34 N 0.68 7.40 0.21 3.32 1.01 -0.47 -0.27 116.67 128.55 2v9x s ASP 34 Ca -0.09 2.11 0.11 0.00 0.71 0.00 0.00 52.55 55.39 2v9x s ASP 34 Cb -0.16 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.11 2v9x s ASP 34 CO 0.02 -0.06 -0.17 0.68 0.21 0.00 0.00 175.17 175.85 2v9x s VAL 35 N -0.90 2.72 0.23 -1.27 -7.23 -0.29 -4.92 120.40 108.73 2v9x s VAL 35 Ca 0.45 -1.99 0.09 0.00 -1.81 0.00 0.00 61.98 58.71 2v9x s VAL 35 Cb -0.29 -2.36 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 2v9x s VAL 35 CO 0.36 -0.20 0.01 -0.13 -0.31 0.00 0.00 175.10 174.84 2v9x s ARG 36 N -2.99 2.39 0.11 4.82 0.52 -1.26 -0.63 118.95 121.91 2v9x s ARG 36 Ca 0.25 -1.27 -0.30 0.00 -0.52 0.00 0.00 55.73 53.89 2v9x s ARG 36 Cb -0.07 -2.27 -0.06 0.00 0.52 0.00 0.00 34.95 33.07 2v9x s ARG 36 CO 0.13 0.40 0.96 -1.17 0.02 0.00 0.00 175.30 175.65 2v9x s LEU 37 N -3.40 4.50 0.00 2.53 2.96 0.03 -1.16 118.68 124.13 2v9x s LEU 37 Ca 0.30 1.80 0.00 0.00 -0.22 0.00 0.00 54.13 56.01 2v9x s LEU 37 Cb -0.08 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.02 2v9x s LEU 37 CO 0.20 -0.07 0.00 0.61 -1.32 0.00 0.00 176.35 175.77 2v9x n GLY 38 N 2.24 -0.79 0.33 7.98 0.00 0.66 0.11 105.19 115.72 2v9x n GLY 38 Ca 0.02 -1.65 0.07 0.00 0.00 0.00 0.00 46.02 44.46 2v9x n GLY 38 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2v9x n ASN 39 N -0.73 1.65 -4.38 1.61 6.94 -1.26 -4.22 115.26 114.86 2v9x n ASN 39 Ca 0.00 -2.90 -0.33 0.00 -0.02 0.00 0.00 54.58 51.33 2v9x n ASN 39 Cb 0.00 -0.39 -0.14 0.00 -2.36 0.00 0.00 39.78 36.89 2v9x n ASN 39 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2v9x s LYS 40 N -2.12 3.06 0.13 -3.83 1.02 -1.26 -2.24 119.74 114.50 2v9x s LYS 40 Ca 0.26 -0.72 0.01 0.00 0.02 0.00 0.00 55.97 55.54 2v9x s LYS 40 Cb 0.24 -2.50 -0.04 0.00 -0.52 0.00 0.00 37.83 35.00 2v9x s LYS 40 CO -0.00 0.34 -0.03 -0.06 -0.92 0.00 0.00 175.35 174.68 2v9x s PHE 41 N 0.01 0.98 -0.05 3.18 0.40 0.31 -3.48 117.98 119.33 2v9x s PHE 41 Ca -0.05 -1.00 -0.07 0.00 -0.60 0.00 0.00 56.93 55.21 2v9x s PHE 41 Cb -0.14 -0.57 0.01 0.00 0.51 0.00 0.00 43.02 42.83 2v9x s PHE 41 CO 0.04 -0.23 0.18 0.50 0.70 0.00 0.00 175.22 176.42 2v9x s ARG 42 N -3.89 0.30 0.53 0.44 3.52 -0.57 -0.33 118.95 118.94 2v9x s ARG 42 Ca 0.17 0.10 0.01 0.00 -0.13 0.00 0.00 55.73 55.88 2v9x s ARG 42 Cb 0.06 0.14 -0.00 0.00 -1.56 0.00 0.00 34.95 33.59 2v9x s ARG 42 CO -0.01 -0.05 0.04 0.95 -0.81 0.00 0.00 175.30 175.41 2v9x s THR 43 N -0.29 1.11 -0.01 4.11 -4.23 -1.26 -0.81 115.64 114.25 2v9x s THR 43 Ca -0.04 -1.96 0.05 0.00 -1.18 0.00 0.00 61.69 58.57 2v9x s THR 43 Cb -0.03 -2.06 -0.03 0.00 1.34 0.00 0.00 72.50 71.72 2v9x s THR 43 CO 0.01 0.00 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.56 2v9x s PHE 44 N -2.89 2.62 -0.54 3.99 0.40 -1.26 -1.14 117.98 119.16 2v9x s PHE 44 Ca 0.05 -0.22 -0.00 0.00 -0.60 0.00 0.00 56.93 56.16 2v9x s PHE 44 Cb 0.00 -1.56 0.14 0.00 0.51 0.00 0.00 43.02 42.12 2v9x s PHE 44 CO 0.03 0.20 0.33 1.03 0.70 0.00 0.00 175.22 177.50 2v9x s ARG 45 N -1.01 2.24 0.45 0.44 0.52 0.22 -4.90 118.95 116.91 2v9x s ARG 45 Ca 0.13 -2.40 0.22 0.00 -0.52 0.00 0.00 55.73 53.16 2v9x s ARG 45 Cb -0.11 -3.56 1.07 0.00 0.52 0.00 0.00 34.95 32.88 2v9x s ARG 45 CO 0.02 -1.12 1.92 0.78 0.02 0.00 0.00 175.30 176.92 2v9x h GLY 46 N 7.08 0.00 2.00 -3.53 0.00 -1.91 -3.29 103.07 103.42 2v9x h GLY 46 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2v9x h GLY 46 CO 0.69 0.00 0.00 -2.39 0.00 0.00 0.00 176.54 174.84 2v9x n HIS 47 N -3.66 0.06 0.79 5.60 1.44 -1.26 -2.65 115.22 115.54 2v9x n HIS 47 Ca -0.01 0.02 0.11 0.00 -2.01 0.00 0.00 57.72 55.83 2v9x n HIS 47 Cb 0.35 -0.54 0.08 0.00 0.12 0.00 0.00 29.99 30.01 2v9x n HIS 47 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 2v9x n THR 48 N -1.55 0.09 -3.84 0.61 -2.24 -1.24 -4.94 114.28 101.16 2v9x n THR 48 Ca 0.04 -0.12 -0.10 0.00 -2.27 0.00 0.00 64.05 61.60 2v9x n THR 48 Cb 0.19 0.34 -0.08 0.00 -2.10 0.00 0.00 70.33 68.69 2v9x n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2v9x s ALA 49 N -3.09 -0.35 0.03 6.98 0.00 -1.08 -4.97 121.76 119.27 2v9x s ALA 49 Ca 0.07 -0.33 -0.06 0.00 0.00 0.00 0.00 51.96 51.63 2v9x s ALA 49 Cb 0.16 0.32 -0.30 0.00 0.00 0.00 0.00 23.12 23.30 2v9x s ALA 49 CO 0.77 -0.39 0.97 0.00 0.00 0.00 0.00 175.76 177.11 2v9x h ALA 50 N 3.30 0.12 -2.18 0.00 0.00 -1.92 -3.47 119.26 115.10 2v9x h ALA 50 Ca -0.32 -0.99 0.19 0.00 0.00 0.00 0.00 54.91 53.79 2v9x h ALA 50 Cb 1.19 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 19.06 2v9x h ALA 50 CO 0.50 0.99 0.54 -0.59 0.00 0.00 0.00 179.25 180.69 2v9x s PHE 51 N -2.62 -0.16 -0.21 0.00 -0.12 -1.26 -5.14 117.98 108.47 2v9x s PHE 51 Ca -0.08 -0.08 -0.04 0.00 -0.05 0.00 0.00 56.93 56.69 2v9x s PHE 51 Cb 0.06 0.60 -0.01 0.00 -0.63 0.00 0.00 43.02 43.05 2v9x s PHE 51 CO 0.88 -0.68 -0.05 0.42 -0.05 0.00 0.00 175.22 175.74 2v9x s ILE 52 N -3.11 3.37 -0.84 -4.49 1.01 -1.26 -5.03 121.20 110.84 2v9x s ILE 52 Ca 0.11 -0.50 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 2v9x s ILE 52 Cb -0.00 -2.52 0.12 0.00 0.01 0.00 0.00 42.46 40.06 2v9x s ILE 52 CO -0.01 0.43 1.04 -0.62 0.00 0.00 0.00 174.94 175.79 2v9x s ASP 53 N 1.37 6.50 0.23 3.58 -1.08 -1.26 -4.93 116.67 121.07 2v9x s ASP 53 Ca 0.04 -1.80 -0.08 0.00 -0.52 0.00 0.00 52.55 50.19 2v9x s ASP 53 Cb -0.14 -2.39 0.22 0.00 -1.46 0.00 0.00 42.92 39.15 2v9x s ASP 53 CO -0.03 -1.13 1.89 -0.07 0.52 0.00 0.00 175.17 176.35 2v9x h LEU 54 N 10.47 0.93 -3.99 -1.34 3.38 -1.99 -0.97 115.31 121.80 2v9x h LEU 54 Ca 0.03 -0.02 -0.59 0.00 0.09 0.00 0.00 57.88 57.39 2v9x h LEU 54 Cb 1.04 -0.22 -0.39 0.00 0.09 0.00 0.00 40.66 41.17 2v9x h LEU 54 CO 1.11 0.66 -0.40 -1.54 0.09 0.00 0.00 178.44 178.36 2v9x n SER 55 N -4.53 5.54 -1.97 -0.43 3.41 -1.26 -4.80 113.62 109.58 2v9x n SER 55 Ca 0.09 -3.76 0.00 0.00 -0.26 0.00 0.00 58.87 54.95 2v9x n SER 55 Cb 0.05 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 2v9x n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2v9x n GLY 56 N -0.70 0.14 3.70 5.00 0.00 -0.37 -5.03 105.19 107.93 2v9x n GLY 56 Ca 0.47 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 2v9x n GLY 56 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2v9x s PRO 57 N -2.05 4.19 0.28 1.61 0.02 -1.26 -4.86 135.00 132.93 2v9x s PRO 57 Ca 0.00 2.38 0.02 0.00 0.02 0.00 0.00 61.00 63.42 2v9x s PRO 57 Cb 0.00 -3.42 0.69 0.00 0.02 0.00 0.00 34.50 31.80 2v9x s PRO 57 CO 0.00 -0.70 1.68 -0.22 -0.33 0.00 0.00 177.00 177.43 2v9x h LYS 58 N 7.74 0.30 -0.51 5.54 3.64 -1.96 -0.11 116.57 131.21 2v9x h LYS 58 Ca -0.43 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 58.82 2v9x h LYS 58 Cb 1.20 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 2v9x h LYS 58 CO 0.93 0.20 -0.14 0.38 -2.27 0.00 0.00 179.45 178.55 2v9x h ASP 59 N 0.31 0.98 -0.33 4.20 2.03 -1.91 -0.27 116.42 121.43 2v9x h ASP 59 Ca 0.54 -0.33 -0.04 0.00 -0.73 0.00 0.00 57.03 56.47 2v9x h ASP 59 Cb 1.04 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 39.26 2v9x h ASP 59 CO -0.57 1.11 0.06 -0.33 -1.03 0.00 0.00 179.24 178.48 2v9x h GLU 60 N 0.86 0.55 -0.42 4.15 5.08 -1.43 -1.76 114.58 121.61 2v9x h GLU 60 Ca 0.13 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2v9x h GLU 60 Cb 0.70 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 2v9x h GLU 60 CO 0.05 0.62 0.20 0.28 -1.00 0.00 0.00 179.01 179.17 2v9x h VAL 61 N 0.38 1.18 -0.83 3.13 2.07 -1.25 -1.39 116.25 119.54 2v9x h VAL 61 Ca 0.10 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 2v9x h VAL 61 Cb 0.34 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2v9x h VAL 61 CO 0.00 0.19 0.43 -1.28 0.02 0.00 0.00 177.57 176.94 2v9x h SER 62 N 0.54 1.05 -0.36 0.57 0.87 -0.99 -0.99 113.55 114.25 2v9x h SER 62 Ca 0.14 -0.10 -0.11 0.00 -1.23 0.00 0.00 61.79 60.49 2v9x h SER 62 Cb 0.12 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 2v9x h SER 62 CO -0.02 0.86 -0.21 0.00 -0.53 0.00 0.00 176.83 176.94 2v9x h ALA 63 N 1.31 0.51 -0.18 6.23 0.00 -1.08 -2.15 119.26 123.89 2v9x h ALA 63 Ca 0.29 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2v9x h ALA 63 Cb 0.06 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2v9x h ALA 63 CO -0.04 0.46 0.11 0.00 0.00 0.00 0.00 179.25 179.78 2v9x h ALA 64 N 0.78 0.24 -0.88 0.00 0.00 -0.98 -1.98 119.26 116.43 2v9x h ALA 64 Ca 0.08 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2v9x h ALA 64 Cb 0.76 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2v9x h ALA 64 CO 0.06 -0.25 0.59 -0.07 0.00 0.00 0.00 179.25 179.58 2v9x h LEU 65 N 0.21 1.02 -0.95 0.00 3.38 -1.18 -0.53 115.31 117.26 2v9x h LEU 65 Ca 0.07 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2v9x h LEU 65 Cb 0.04 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 2v9x h LEU 65 CO -0.01 0.73 -0.07 0.44 0.09 0.00 0.00 178.44 179.62 2v9x h ASP 66 N 1.20 0.67 -0.37 -0.43 3.32 -1.22 -2.36 116.42 117.23 2v9x h ASP 66 Ca 0.32 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 2v9x h ASP 66 Cb -0.14 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.22 2v9x h ASP 66 CO -0.07 0.79 0.01 0.03 -1.72 0.00 0.00 179.24 178.28 2v9x h ARG 67 N 0.64 0.65 0.00 3.56 3.08 -0.57 -3.34 114.38 118.40 2v9x h ARG 67 Ca 0.12 -0.20 -0.12 0.00 0.07 0.00 0.00 59.98 59.84 2v9x h ARG 67 Cb 0.50 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 2v9x h ARG 67 CO 0.03 0.75 -0.79 -0.39 -1.07 0.00 0.00 179.97 178.50 2v9x h VAL 68 N 0.48 0.76 -3.44 2.04 -1.51 -0.93 -3.44 116.25 110.19 2v9x h VAL 68 Ca 0.11 -2.15 -0.54 0.00 -1.23 0.00 0.00 66.70 62.88 2v9x h VAL 68 Cb 0.45 2.30 -0.04 0.00 -2.13 0.00 0.00 31.29 31.87 2v9x h VAL 68 CO 0.02 0.43 0.18 -0.04 -1.23 0.00 0.00 177.57 176.93 2v9x s MET 69 N -2.95 4.52 0.85 5.19 -1.94 -0.91 0.69 119.30 124.75 2v9x s MET 69 Ca 0.02 1.11 -0.11 0.00 -1.71 0.00 0.00 55.69 55.00 2v9x s MET 69 Cb 0.08 -3.37 0.10 0.00 2.01 0.00 0.00 34.83 33.66 2v9x s MET 69 CO 0.77 0.27 1.09 -1.54 -0.01 0.00 0.00 175.02 175.60 2v9x s SER 70 N -0.04 3.88 0.77 3.03 1.04 -0.29 -4.88 113.70 117.20 2v9x s SER 70 Ca 0.40 1.56 -0.13 0.00 0.48 0.00 0.00 55.95 58.25 2v9x s SER 70 Cb -0.21 -2.25 0.06 0.00 0.10 0.00 0.00 66.02 63.72 2v9x s SER 70 CO 0.24 -2.39 1.16 -1.81 0.98 0.00 0.00 173.24 171.41 2v9x s ASP 71 N -3.47 4.09 0.24 7.02 1.01 -1.26 -4.75 116.67 119.55 2v9x s ASP 71 Ca 0.62 2.18 -0.31 0.00 0.71 0.00 0.00 52.55 55.75 2v9x s ASP 71 Cb -0.17 -2.57 -0.12 0.00 1.01 0.00 0.00 42.92 41.07 2v9x s ASP 71 CO 0.56 -2.32 1.67 -0.70 0.21 0.00 0.00 175.17 174.59 2v9x s GLU 72 N -4.26 4.13 -0.23 8.23 2.12 -1.26 -4.74 118.70 122.68 2v9x s GLU 72 Ca 0.69 2.59 -0.11 0.00 0.36 0.00 0.00 54.97 58.50 2v9x s GLU 72 Cb -0.24 -3.06 -0.05 0.00 0.26 0.00 0.00 34.13 31.04 2v9x s GLU 72 CO 0.49 -0.70 0.18 0.42 -0.54 0.00 0.00 175.26 175.11 2v9x s ILE 73 N 0.70 5.35 -0.14 -3.70 1.01 0.54 -4.94 121.20 120.03 2v9x s ILE 73 Ca 0.70 0.24 0.01 0.00 0.00 0.00 0.00 60.65 61.60 2v9x s ILE 73 Cb -0.49 -3.52 -0.00 0.00 0.01 0.00 0.00 42.46 38.46 2v9x s ILE 73 CO 0.38 0.34 -0.18 -0.69 0.00 0.00 0.00 174.94 174.80 2v9x s VAL 74 N 1.01 2.49 -0.12 2.92 1.01 -1.26 -0.53 120.40 125.93 2v9x s VAL 74 Ca 0.09 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 2v9x s VAL 74 Cb -0.13 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 2v9x s VAL 74 CO 0.04 0.53 0.28 -0.76 0.00 0.00 0.00 175.10 175.19 2v9x s LEU 75 N 0.68 4.32 1.28 3.92 1.43 -0.95 -5.05 118.68 124.31 2v9x s LEU 75 Ca -0.08 0.59 -0.19 0.00 -1.03 0.00 0.00 54.13 53.42 2v9x s LEU 75 Cb -0.16 -2.35 0.31 0.00 0.03 0.00 0.00 46.19 44.03 2v9x s LEU 75 CO 0.02 0.22 1.01 -1.81 0.23 0.00 0.00 176.35 176.02 2v9x s ASP 76 N -0.19 0.19 0.40 2.29 1.01 -1.26 -4.95 116.67 114.16 2v9x s ASP 76 Ca 0.17 0.94 -0.24 0.00 0.71 0.00 0.00 52.55 54.13 2v9x s ASP 76 Cb -0.14 -1.38 -0.09 0.00 1.01 0.00 0.00 42.92 42.32 2v9x s ASP 76 CO 0.06 -4.61 1.04 -1.83 0.21 0.00 0.00 175.17 170.04 2v9x s GLU 77 N -5.04 4.19 0.00 8.23 1.03 -1.26 -3.11 118.70 122.74 2v9x s GLU 77 Ca 0.69 1.47 0.00 0.00 0.03 0.00 0.00 54.97 57.16 2v9x s GLU 77 Cb -0.15 -2.53 0.00 0.00 -0.80 0.00 0.00 34.13 30.65 2v9x s GLU 77 CO 0.59 -0.11 0.00 0.41 -1.33 0.00 0.00 175.26 174.82 2v9x n GLY 78 N 0.29 3.19 3.81 -3.83 0.00 -1.26 -5.04 105.19 102.34 2v9x n GLY 78 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 2v9x n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2v9x s GLU 79 N -0.38 4.28 0.04 1.61 2.02 -1.18 -5.09 118.70 120.00 2v9x s GLU 79 Ca 0.00 0.91 0.04 0.00 0.02 0.00 0.00 54.97 55.94 2v9x s GLU 79 Cb 0.00 -2.87 -0.04 0.00 0.10 0.00 0.00 34.13 31.32 2v9x s GLU 79 CO 0.00 0.38 -0.06 0.00 0.02 0.00 0.00 175.26 175.61 2v9x s ALA 80 N -1.53 3.07 -0.21 5.21 0.00 -1.26 -4.52 121.76 122.51 2v9x s ALA 80 Ca 0.44 -1.09 -0.17 0.00 0.00 0.00 0.00 51.96 51.14 2v9x s ALA 80 Cb -0.17 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 2v9x s ALA 80 CO 0.21 0.64 0.47 0.12 0.00 0.00 0.00 175.76 177.20 2v9x s PHE 81 N -1.11 3.35 -0.43 0.00 5.36 0.45 -4.91 117.98 120.69 2v9x s PHE 81 Ca 0.20 0.68 -0.19 0.00 -0.96 0.00 0.00 56.93 56.66 2v9x s PHE 81 Cb -0.11 -2.63 0.02 0.00 -0.34 0.00 0.00 43.02 39.96 2v9x s PHE 81 CO 0.11 -0.11 0.57 0.71 -1.46 0.00 0.00 175.22 175.04 2v9x s TYR 82 N 1.66 3.10 -0.48 10.12 1.51 -1.26 -0.36 117.35 131.65 2v9x s TYR 82 Ca 0.22 -0.18 -0.19 0.00 -1.01 0.00 0.00 57.07 55.91 2v9x s TYR 82 Cb -0.15 -3.18 0.04 0.00 -0.11 0.00 0.00 41.96 38.56 2v9x s TYR 82 CO 0.09 -0.81 0.59 -1.17 -1.11 0.00 0.00 175.55 173.14 2v9x s LEU 83 N 2.57 4.85 0.34 -1.29 2.96 -0.17 -4.94 118.68 123.00 2v9x s LEU 83 Ca 0.19 -0.75 -0.14 0.00 -0.22 0.00 0.00 54.13 53.20 2v9x s LEU 83 Cb -0.15 -2.49 -0.09 0.00 0.50 0.00 0.00 46.19 43.96 2v9x s LEU 83 CO 0.17 -0.81 0.75 -1.00 -1.32 0.00 0.00 176.35 174.14 2v9x s HIS 84 N 2.57 3.38 0.07 5.38 3.76 -1.26 -1.50 115.29 127.69 2v9x s HIS 84 Ca 0.16 1.20 -0.35 0.00 -0.15 0.00 0.00 55.06 55.92 2v9x s HIS 84 Cb -0.18 -2.53 -0.15 0.00 1.11 0.00 0.00 32.58 30.84 2v9x s HIS 84 CO 0.14 0.05 1.56 -2.30 -0.85 0.00 0.00 174.74 173.34 2v9x n PRO 85 N -0.52 1.78 -0.46 8.40 -0.02 -1.26 -1.77 135.00 141.14 2v9x n PRO 85 Ca 0.03 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2v9x n PRO 85 Cb 0.53 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 2v9x n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2v9x n GLY 86 N 3.35 0.75 3.63 -1.23 0.00 -0.07 -5.00 105.19 106.61 2v9x n GLY 86 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2v9x n GLY 86 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2v9x s GLU 87 N -0.54 3.26 -0.18 1.61 0.41 -0.73 -4.96 118.70 117.57 2v9x s GLU 87 Ca 0.00 -0.43 -0.09 0.00 -0.41 0.00 0.00 54.97 54.04 2v9x s GLU 87 Cb 0.00 -2.87 -0.05 0.00 -1.78 0.00 0.00 34.13 29.43 2v9x s GLU 87 CO 0.00 0.55 0.12 -1.17 -0.49 0.00 0.00 175.26 174.27 2v9x s LEU 88 N -0.45 4.21 0.06 1.80 2.96 -1.26 -2.99 118.68 123.00 2v9x s LEU 88 Ca 0.08 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.27 2v9x s LEU 88 Cb -0.12 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 2v9x s LEU 88 CO 0.02 0.23 -0.06 0.00 -1.32 0.00 0.00 176.35 175.22 2v9x s ALA 89 N 0.03 0.67 -0.02 5.97 0.00 -0.63 -4.64 121.76 123.14 2v9x s ALA 89 Ca 0.09 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 50.95 2v9x s ALA 89 Cb -0.11 0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.08 2v9x s ALA 89 CO -0.00 -0.15 0.28 -0.51 0.00 0.00 0.00 175.76 175.37 2v9x s LEU 90 N -2.26 4.39 0.00 0.00 1.43 0.01 -0.79 118.68 121.46 2v9x s LEU 90 Ca -0.01 0.64 0.01 0.00 -1.03 0.00 0.00 54.13 53.74 2v9x s LEU 90 Cb -0.02 -2.54 -0.00 0.00 0.03 0.00 0.00 46.19 43.66 2v9x s LEU 90 CO -0.03 0.30 0.06 0.00 0.23 0.00 0.00 176.35 176.92 2v9x n ALA 91 N 1.45 0.10 -3.07 4.21 0.00 -0.28 -1.51 120.51 121.41 2v9x n ALA 91 Ca -0.14 -0.37 -0.11 0.00 0.00 0.00 0.00 53.44 52.82 2v9x n ALA 91 Cb 0.53 0.30 -0.10 0.00 0.00 0.00 0.00 19.45 20.18 2v9x n ALA 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2v9x s VAL 92 N -2.32 0.09 0.49 0.00 0.11 -1.23 -0.52 120.40 117.02 2v9x s VAL 92 Ca 0.07 -0.74 -0.19 0.00 -2.93 0.00 0.00 61.98 58.19 2v9x s VAL 92 Cb 0.00 -0.45 -0.09 0.00 -1.53 0.00 0.00 36.38 34.31 2v9x s VAL 92 CO 0.05 -0.41 0.99 0.42 -3.33 0.00 0.00 175.10 172.82 2v9x s THR 93 N -1.49 4.28 0.10 5.04 -4.23 -0.29 -0.24 115.64 118.80 2v9x s THR 93 Ca -0.14 1.26 -0.16 0.00 -1.18 0.00 0.00 61.69 61.47 2v9x s THR 93 Cb -0.07 -3.59 -0.07 0.00 1.34 0.00 0.00 72.50 70.10 2v9x s THR 93 CO 0.01 -0.46 1.47 0.25 -0.54 0.00 0.00 174.62 175.35 2v9x h LEU 94 N 1.34 0.63 -9.85 4.79 5.85 -1.35 -3.39 115.31 113.33 2v9x h LEU 94 Ca -0.48 -0.40 -0.49 0.00 0.84 0.00 0.00 57.88 57.35 2v9x h LEU 94 Cb 1.19 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 42.06 2v9x h LEU 94 CO 0.60 0.88 0.43 -1.61 -0.34 0.00 0.00 178.44 178.41 2v9x s GLU 95 N -4.64 4.53 0.02 1.25 8.01 -1.26 -4.77 118.70 121.83 2v9x s GLU 95 Ca -0.13 1.66 -0.14 0.00 0.01 0.00 0.00 54.97 56.36 2v9x s GLU 95 Cb 0.08 -2.99 -0.06 0.00 -4.31 0.00 0.00 34.13 26.85 2v9x s GLU 95 CO 0.79 0.15 0.42 0.45 0.01 0.00 0.00 175.26 177.09 2v9x s SER 96 N -1.15 6.81 -0.05 -0.19 0.15 0.09 -4.19 113.70 115.16 2v9x s SER 96 Ca 0.48 0.97 0.05 0.00 0.70 0.00 0.00 55.95 58.14 2v9x s SER 96 Cb -0.28 -2.25 -0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2v9x s SER 96 CO 0.35 0.30 -0.19 -0.69 1.20 0.00 0.00 173.24 174.21 2v9x s VAL 97 N -1.13 1.61 -0.14 4.45 1.01 -0.44 -0.56 120.40 125.20 2v9x s VAL 97 Ca 0.26 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.45 2v9x s VAL 97 Cb -0.16 -1.38 0.01 0.00 0.00 0.00 0.00 36.38 34.84 2v9x s VAL 97 CO 0.14 0.46 -0.21 -0.89 0.00 0.00 0.00 175.10 174.60 2v9x s THR 98 N 0.06 2.02 -0.05 3.92 2.01 0.17 -0.87 115.64 122.91 2v9x s THR 98 Ca -0.06 -0.95 0.02 0.00 0.31 0.00 0.00 61.69 61.01 2v9x s THR 98 Cb -0.13 -1.80 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 2v9x s THR 98 CO 0.03 0.54 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.67 2v9x s LEU 99 N 0.90 3.17 0.88 4.42 1.43 0.81 -2.01 118.68 128.28 2v9x s LEU 99 Ca -0.05 -0.06 -0.13 0.00 -1.03 0.00 0.00 54.13 52.86 2v9x s LEU 99 Cb -0.15 -1.73 0.12 0.00 0.03 0.00 0.00 46.19 44.46 2v9x s LEU 99 CO -0.04 0.34 1.17 -2.16 0.23 0.00 0.00 176.35 175.90 2v9x s PRO 100 N -1.00 1.39 0.32 1.29 0.04 -1.25 -1.86 135.00 133.93 2v9x s PRO 100 Ca 0.14 0.13 0.24 0.00 0.04 0.00 0.00 61.00 61.54 2v9x s PRO 100 Cb -0.11 -1.88 1.15 0.00 0.04 0.00 0.00 34.50 33.70 2v9x s PRO 100 CO 0.03 -1.99 1.72 0.00 0.04 0.00 0.00 177.00 176.80 2v9x h ALA 101 N -1.34 1.00 -0.28 8.56 0.00 -1.93 -2.97 119.26 122.30 2v9x h ALA 101 Ca -0.48 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 2v9x h ALA 101 Cb 1.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2v9x h ALA 101 CO 0.61 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.46 2v9x n ASP 102 N -2.31 3.83 -3.96 0.00 5.75 -1.26 -0.56 116.55 118.04 2v9x n ASP 102 Ca -0.00 -3.08 -0.16 0.00 -0.01 0.00 0.00 54.79 51.54 2v9x n ASP 102 Cb 0.12 -0.56 -0.14 0.00 -1.03 0.00 0.00 41.12 39.51 2v9x n ASP 102 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2v9x s LEU 103 N -2.87 2.02 0.05 -2.12 2.96 -1.13 -0.78 118.68 116.81 2v9x s LEU 103 Ca 0.43 -0.11 0.08 0.00 -0.22 0.00 0.00 54.13 54.30 2v9x s LEU 103 Cb 0.35 -0.27 -0.03 0.00 0.50 0.00 0.00 46.19 46.74 2v9x s LEU 103 CO 0.08 0.06 -0.20 0.54 -1.32 0.00 0.00 176.35 175.51 2v9x s VAL 104 N -0.17 2.66 0.24 1.68 0.11 -0.47 -3.08 120.40 121.37 2v9x s VAL 104 Ca 0.02 -1.26 0.09 0.00 -2.93 0.00 0.00 61.98 57.90 2v9x s VAL 104 Cb -0.02 -2.12 -0.04 0.00 -1.53 0.00 0.00 36.38 32.67 2v9x s VAL 104 CO -0.00 0.32 -0.03 -0.83 -3.33 0.00 0.00 175.10 171.23 2v9x s GLY 105 N -1.47 1.68 -0.04 6.54 0.00 0.17 -0.74 107.32 113.47 2v9x s GLY 105 Ca 0.14 -1.58 -0.01 0.00 0.00 0.00 0.00 44.72 43.28 2v9x s GLY 105 CO 0.05 -1.63 0.02 -0.98 0.00 0.00 0.00 173.10 170.56 2v9x s TRP 106 N -2.11 0.32 -0.07 1.90 0.52 -0.27 -0.31 118.94 118.92 2v9x s TRP 106 Ca 0.29 0.03 -0.21 0.00 0.02 0.00 0.00 56.10 56.24 2v9x s TRP 106 Cb -0.07 -0.51 -0.04 0.00 -1.15 0.00 0.00 33.47 31.70 2v9x s TRP 106 CO 0.19 -0.19 0.60 -1.17 0.02 0.00 0.00 176.95 176.40 2v9x s LEU 107 N 1.51 4.32 0.23 2.99 2.96 -0.12 -1.45 118.68 129.12 2v9x s LEU 107 Ca -0.03 1.05 0.09 0.00 -0.22 0.00 0.00 54.13 55.02 2v9x s LEU 107 Cb -0.13 -2.91 -0.05 0.00 0.50 0.00 0.00 46.19 43.60 2v9x s LEU 107 CO -0.03 -0.03 -0.16 -1.81 -1.32 0.00 0.00 176.35 173.00 2v9x s ASP 108 N 0.52 2.92 0.05 3.68 1.01 0.12 -4.85 116.67 120.11 2v9x s ASP 108 Ca 0.32 -1.03 0.00 0.00 0.71 0.00 0.00 52.55 52.55 2v9x s ASP 108 Cb -0.17 -0.19 0.00 0.00 1.01 0.00 0.00 42.92 43.57 2v9x s ASP 108 CO 0.15 -0.10 0.00 0.61 0.21 0.00 0.00 175.17 176.04 2v9x n GLY 109 N -0.46 -0.46 3.25 0.21 0.00 -1.26 -1.33 105.19 105.13 2v9x n GLY 109 Ca -0.07 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 43.97 2v9x n GLY 109 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2v9x s ARG 110 N 0.17 2.40 0.34 1.61 0.52 -1.26 -4.30 118.95 118.43 2v9x s ARG 110 Ca 0.00 -0.86 0.10 0.00 -0.52 0.00 0.00 55.73 54.45 2v9x s ARG 110 Cb 0.00 -2.05 0.85 0.00 0.52 0.00 0.00 34.95 34.26 2v9x s ARG 110 CO 0.00 0.37 1.80 1.03 0.02 0.00 0.00 175.30 178.51 2v9x h SER 111 N 6.06 0.67 -0.12 0.23 0.87 -1.98 -0.29 113.55 119.00 2v9x h SER 111 Ca -0.32 0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.31 2v9x h SER 111 Cb 1.17 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.09 2v9x h SER 111 CO 0.47 0.24 0.07 0.28 -0.53 0.00 0.00 176.83 177.36 2v9x h SER 112 N 0.66 0.17 0.17 6.23 0.02 -1.99 -0.76 113.55 118.04 2v9x h SER 112 Ca 0.55 -0.01 -0.36 0.00 -0.84 0.00 0.00 61.79 61.14 2v9x h SER 112 Cb 1.00 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 2v9x h SER 112 CO -0.32 0.15 -1.88 -0.07 -1.14 0.00 0.00 176.83 173.57 2v9x h LEU 113 N 0.20 0.50 -1.06 5.07 3.38 -1.57 -3.36 115.31 118.46 2v9x h LEU 113 Ca 0.05 -0.92 0.09 0.00 0.09 0.00 0.00 57.88 57.20 2v9x h LEU 113 Cb 0.02 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.54 2v9x h LEU 113 CO -0.01 1.80 0.63 0.00 0.09 0.00 0.00 178.44 180.95 2v9x h ALA 114 N 0.12 1.50 0.00 1.53 0.00 -0.87 -0.83 119.26 120.72 2v9x h ALA 114 Ca -0.38 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2v9x h ALA 114 Cb 2.06 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.60 2v9x h ALA 114 CO 0.13 0.31 0.00 0.54 0.00 0.00 0.00 179.25 180.23 2v9x n ARG 115 N -4.54 0.04 -0.05 0.00 1.74 -0.31 -0.84 116.66 112.70 2v9x n ARG 115 Ca 0.16 0.34 0.09 0.00 -0.77 0.00 0.00 57.85 57.67 2v9x n ARG 115 Cb 0.27 -1.58 0.10 0.00 -1.02 0.00 0.00 32.46 30.23 2v9x n ARG 115 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2v9x n LEU 116 N -1.65 2.64 0.00 0.55 4.77 -0.39 -5.01 117.00 117.92 2v9x n LEU 116 Ca 0.02 -1.17 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 2v9x n LEU 116 Cb 0.14 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2v9x n LEU 116 CO 0.12 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 2v9x n GLY 117 N 1.01 0.76 3.62 -0.72 0.00 -0.02 -4.09 105.19 105.76 2v9x n GLY 117 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2v9x n GLY 117 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2v9x s LEU 118 N 0.00 3.87 -0.08 0.99 2.96 -0.79 -0.38 118.68 125.25 2v9x s LEU 118 Ca 0.00 0.76 -0.17 0.00 -0.22 0.00 0.00 54.13 54.50 2v9x s LEU 118 Cb 0.00 -3.47 -0.05 0.00 0.50 0.00 0.00 46.19 43.17 2v9x s LEU 118 CO 0.00 -0.98 0.44 -0.04 -1.32 0.00 0.00 176.35 174.45 2v9x s MET 119 N 3.83 4.20 0.00 1.98 -1.94 -0.16 -3.95 119.30 123.25 2v9x s MET 119 Ca 0.44 0.41 0.22 0.00 -1.71 0.00 0.00 55.69 55.05 2v9x s MET 119 Cb -0.11 -3.36 -0.15 0.00 2.01 0.00 0.00 34.83 33.22 2v9x s MET 119 CO 0.21 0.35 0.89 1.33 -0.01 0.00 0.00 175.02 177.79 2v9x n VAL 120 N 2.99 0.02 -4.05 -6.03 0.24 -1.26 -1.86 118.33 108.38 2v9x n VAL 120 Ca -0.10 -0.12 -0.10 0.00 -2.04 0.00 0.00 64.34 61.98 2v9x n VAL 120 Cb 0.52 0.67 -0.07 0.00 -1.47 0.00 0.00 33.84 33.48 2v9x n VAL 120 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 2v9x s HIS 121 N -3.11 0.62 -0.54 6.34 -3.43 -1.21 -3.23 115.29 110.73 2v9x s HIS 121 Ca 0.05 -0.94 0.07 0.00 -0.80 0.00 0.00 55.06 53.43 2v9x s HIS 121 Cb 0.16 -0.12 0.32 0.00 -1.43 0.00 0.00 32.58 31.51 2v9x s HIS 121 CO 0.85 -0.80 0.85 0.28 -2.00 0.00 0.00 174.74 173.92 2v9x n VAL 122 N -0.30 2.17 -1.06 -5.38 0.31 -1.26 -4.88 118.33 107.93 2v9x n VAL 122 Ca -0.02 -5.25 -0.02 0.00 -0.01 0.00 0.00 64.34 59.03 2v9x n VAL 122 Cb 0.63 -1.37 -0.01 0.00 -0.91 0.00 0.00 33.84 32.18 2v9x n VAL 122 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2v9x n THR 123 N 0.15 0.00 -3.90 2.52 -2.24 -1.26 -4.97 114.28 104.57 2v9x n THR 123 Ca 0.29 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.77 2v9x n THR 123 Cb 0.45 -0.69 -0.15 0.00 -2.10 0.00 0.00 70.33 67.84 2v9x n THR 123 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2v9x s ALA 124 N -1.63 2.21 -0.02 6.98 0.00 -1.26 -4.96 121.76 123.07 2v9x s ALA 124 Ca 0.00 -1.95 0.03 0.00 0.00 0.00 0.00 51.96 50.04 2v9x s ALA 124 Cb 0.00 -1.72 0.05 0.00 0.00 0.00 0.00 23.12 21.46 2v9x s ALA 124 CO 0.00 -1.56 0.93 -2.39 0.00 0.00 0.00 175.76 172.75 2v9x n HIS 125 N 4.56 0.00 -3.36 0.00 -0.00 -1.26 -4.92 115.22 110.23 2v9x n HIS 125 Ca -0.02 -0.21 -0.38 0.00 -0.00 0.00 0.00 57.72 57.11 2v9x n HIS 125 Cb 0.42 -0.06 -0.06 0.00 -0.00 0.00 0.00 29.99 30.30 2v9x n HIS 125 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2v9x s ARG 126 N -0.59 4.20 -0.28 -1.40 3.52 -1.26 -0.95 118.95 122.19 2v9x s ARG 126 Ca 0.06 0.48 -0.05 0.00 -0.13 0.00 0.00 55.73 56.09 2v9x s ARG 126 Cb 0.05 -3.35 0.02 0.00 -1.56 0.00 0.00 34.95 30.11 2v9x s ARG 126 CO 0.01 0.38 0.03 0.42 -0.81 0.00 0.00 175.30 175.32 2v9x s ILE 127 N -0.11 3.53 0.48 4.11 -1.09 0.58 -4.98 121.20 123.72 2v9x s ILE 127 Ca 0.26 -0.86 -0.19 0.00 -2.23 0.00 0.00 60.65 57.63 2v9x s ILE 127 Cb -0.16 -2.83 -0.09 0.00 -1.58 0.00 0.00 42.46 37.80 2v9x s ILE 127 CO 0.12 0.10 0.99 -1.81 -1.23 0.00 0.00 174.94 173.12 2v9x s ASP 128 N 1.42 6.60 0.32 3.58 1.01 -1.26 -0.65 116.67 127.69 2v9x s ASP 128 Ca 0.01 1.74 -0.29 0.00 0.71 0.00 0.00 52.55 54.72 2v9x s ASP 128 Cb -0.17 -2.54 -0.12 0.00 1.01 0.00 0.00 42.92 41.10 2v9x s ASP 128 CO -0.00 -0.60 1.45 -0.81 0.21 0.00 0.00 175.17 175.42 2v9x n PRO 129 N -1.08 2.44 -0.61 8.23 -0.04 -1.18 -1.04 135.00 141.72 2v9x n PRO 129 Ca 0.08 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.40 2v9x n PRO 129 Cb 0.53 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 2v9x n PRO 129 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2v9x n GLY 130 N 1.29 1.10 3.77 0.55 0.00 -0.78 -0.41 105.19 110.71 2v9x n GLY 130 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 2v9x n GLY 130 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2v9x s TRP 131 N -3.35 2.83 -0.10 1.61 -0.11 -0.21 -2.74 118.94 116.89 2v9x s TRP 131 Ca 0.00 1.41 -0.04 0.00 1.22 0.00 0.00 56.10 58.69 2v9x s TRP 131 Cb 0.00 -3.68 0.05 0.00 -1.50 0.00 0.00 33.47 28.34 2v9x s TRP 131 CO 0.00 -2.09 0.19 0.45 -4.62 0.00 0.00 176.95 170.88 2v9x s SER 132 N -0.71 0.63 0.00 5.86 0.15 -1.25 -0.14 113.70 118.24 2v9x s SER 132 Ca 0.56 0.40 0.00 0.00 0.70 0.00 0.00 55.95 57.61 2v9x s SER 132 Cb -0.38 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.31 2v9x s SER 132 CO 0.49 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.30 2v9x n GLY 133 N 5.31 2.51 3.77 9.45 0.00 -0.04 -2.81 105.19 123.38 2v9x n GLY 133 Ca -0.05 -1.38 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 2v9x n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v9x s ILE 135 N -1.78 5.38 0.03 0.00 1.01 -1.26 -4.71 121.20 119.86 2v9x s ILE 135 Ca 0.73 0.18 -0.27 0.00 0.00 0.00 0.00 60.65 61.29 2v9x s ILE 135 Cb -0.24 -3.47 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 2v9x s ILE 135 CO 0.27 0.42 0.85 -0.69 0.00 0.00 0.00 174.94 175.80 2v9x s VAL 136 N 0.51 4.77 -0.11 2.92 1.01 -1.26 -1.14 120.40 127.10 2v9x s VAL 136 Ca 0.08 1.80 -0.03 0.00 0.00 0.00 0.00 61.98 63.83 2v9x s VAL 136 Cb -0.12 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 2v9x s VAL 136 CO -0.01 0.28 0.00 -0.76 0.00 0.00 0.00 175.10 174.62 2v9x s LEU 137 N 0.38 3.56 -0.46 3.92 1.43 0.32 -4.96 118.68 122.87 2v9x s LEU 137 Ca 0.44 0.08 -0.09 0.00 -1.03 0.00 0.00 54.13 53.53 2v9x s LEU 137 Cb -0.21 -1.84 0.12 0.00 0.03 0.00 0.00 46.19 44.29 2v9x s LEU 137 CO 0.25 0.31 0.33 -1.81 0.23 0.00 0.00 176.35 175.65 2v9x s ASP 138 N -0.44 5.67 0.10 2.29 1.01 -1.20 -1.12 116.67 122.99 2v9x s ASP 138 Ca 0.08 -1.88 -0.25 0.00 0.71 0.00 0.00 52.55 51.21 2v9x s ASP 138 Cb -0.12 -2.00 -0.07 0.00 1.01 0.00 0.00 42.92 41.74 2v9x s ASP 138 CO 0.02 -0.67 0.78 -0.36 0.21 0.00 0.00 175.17 175.15 2v9x s PHE 139 N 1.36 3.82 -0.03 4.23 2.99 0.03 -3.31 117.98 127.07 2v9x s PHE 139 Ca 0.06 1.56 0.01 0.00 0.00 0.00 0.00 56.93 58.56 2v9x s PHE 139 Cb -0.26 -2.80 0.02 0.00 0.00 0.00 0.00 43.02 39.98 2v9x s PHE 139 CO -0.01 0.39 -0.01 -0.47 -0.00 0.00 0.00 175.22 175.12 2v9x s TYR 140 N -0.57 0.37 -0.49 0.36 5.04 -0.78 -1.61 117.35 119.67 2v9x s TYR 140 Ca 0.38 -0.03 -0.17 0.00 -2.44 0.00 0.00 57.07 54.81 2v9x s TYR 140 Cb -0.22 -0.41 0.07 0.00 0.35 0.00 0.00 41.96 41.75 2v9x s TYR 140 CO 0.25 -0.12 0.47 1.21 -1.34 0.00 0.00 175.55 176.02 2v9x s ASN 141 N 0.85 6.17 0.00 4.32 3.84 -1.16 -0.99 114.94 127.97 2v9x s ASN 141 Ca -0.09 -1.24 0.24 0.00 0.21 0.00 0.00 52.86 51.98 2v9x s ASN 141 Cb -0.12 -2.22 0.60 0.00 -0.55 0.00 0.00 41.25 38.96 2v9x s ASN 141 CO -0.01 -0.73 1.49 -1.54 -2.79 0.00 0.00 177.10 173.51 2v9x n SER 142 N 5.49 2.40 -1.78 -4.21 3.41 0.48 -0.89 113.62 118.53 2v9x n SER 142 Ca -0.11 -1.81 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 2v9x n SER 142 Cb 0.44 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 2v9x n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2v9x n GLY 143 N 1.29 0.65 0.00 5.00 0.00 -1.25 -4.92 105.19 105.96 2v9x n GLY 143 Ca 0.17 -1.91 0.09 0.00 0.00 0.00 0.00 46.02 44.37 2v9x n GLY 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2v9x n LYS 144 N -0.69 0.70 -4.74 1.61 4.76 -1.26 -4.65 118.16 113.89 2v9x n LYS 144 Ca 0.00 -0.05 -0.27 0.00 -2.87 0.00 0.00 58.31 55.12 2v9x n LYS 144 Cb 0.00 -1.41 -0.14 0.00 -1.84 0.00 0.00 35.03 31.63 2v9x n LYS 144 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2v9x s LEU 145 N -3.29 2.17 0.47 -0.35 1.02 -1.26 -4.90 118.68 112.53 2v9x s LEU 145 Ca 0.03 -0.55 -0.24 0.00 0.02 0.00 0.00 54.13 53.39 2v9x s LEU 145 Cb 0.14 -1.09 -0.08 0.00 0.02 0.00 0.00 46.19 45.18 2v9x s LEU 145 CO 0.79 0.20 1.29 -2.65 0.02 0.00 0.00 176.35 175.99 2v9x n PRO 146 N 1.82 1.83 -5.14 1.29 -0.02 -1.26 -4.53 135.00 128.98 2v9x n PRO 146 Ca -0.17 0.66 -0.32 0.00 -2.02 0.00 0.00 63.50 61.65 2v9x n PRO 146 Cb 0.53 -2.45 -0.17 0.00 -0.02 0.00 0.00 33.50 31.39 2v9x n PRO 146 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2v9x s LEU 147 N -2.29 2.18 -0.37 2.45 1.43 -0.56 -4.96 118.68 116.57 2v9x s LEU 147 Ca 0.65 -0.53 -0.21 0.00 -1.03 0.00 0.00 54.13 53.01 2v9x s LEU 147 Cb -0.47 -1.44 0.01 0.00 0.03 0.00 0.00 46.19 44.32 2v9x s LEU 147 CO 0.55 0.16 0.67 0.00 0.23 0.00 0.00 176.35 177.96 2v9x s ALA 148 N 0.35 3.44 -0.17 4.21 0.00 -1.26 -1.00 121.76 127.33 2v9x s ALA 148 Ca -0.17 -0.84 -0.09 0.00 0.00 0.00 0.00 51.96 50.86 2v9x s ALA 148 Cb -0.18 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.67 2v9x s ALA 148 CO 0.08 -1.42 0.12 -0.51 0.00 0.00 0.00 175.76 174.04 2v9x s LEU 149 N 2.81 4.20 -0.04 0.00 1.43 0.52 -4.92 118.68 122.68 2v9x s LEU 149 Ca 0.26 0.28 0.07 0.00 -1.03 0.00 0.00 54.13 53.70 2v9x s LEU 149 Cb -0.14 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 2v9x s LEU 149 CO 0.16 0.25 -0.25 -0.13 0.23 0.00 0.00 176.35 176.60 2v9x s ARG 150 N -0.04 2.34 0.25 1.70 0.52 -1.26 -0.41 118.95 122.05 2v9x s ARG 150 Ca 0.09 -0.90 -0.30 0.00 -0.52 0.00 0.00 55.73 54.11 2v9x s ARG 150 Cb -0.11 -2.08 -0.14 0.00 0.52 0.00 0.00 34.95 33.13 2v9x s ARG 150 CO -0.00 0.44 1.08 -2.30 0.02 0.00 0.00 175.30 174.54 2v9x n PRO 151 N 2.76 1.34 0.00 3.54 -0.02 -1.26 -2.30 135.00 139.07 2v9x n PRO 151 Ca -0.17 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2v9x n PRO 151 Cb 0.52 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2v9x n PRO 151 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2v9x n GLY 152 N 1.53 0.92 3.79 -1.23 0.00 0.12 -4.98 105.19 105.34 2v9x n GLY 152 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2v9x n GLY 152 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2v9x s MET 153 N -0.75 3.37 -0.13 1.61 0.23 -0.97 -4.64 119.30 118.02 2v9x s MET 153 Ca 0.00 1.32 -0.29 0.00 -1.03 0.00 0.00 55.69 55.69 2v9x s MET 153 Cb 0.00 -2.03 -0.03 0.00 -1.53 0.00 0.00 34.83 31.24 2v9x s MET 153 CO 0.00 -0.79 1.34 -0.51 -2.03 0.00 0.00 175.02 173.03 2v9x s LEU 154 N -4.21 4.22 -0.00 0.18 1.43 -1.26 -0.79 118.68 118.25 2v9x s LEU 154 Ca 0.66 1.83 0.01 0.00 -1.03 0.00 0.00 54.13 55.60 2v9x s LEU 154 Cb -0.18 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.49 2v9x s LEU 154 CO 0.32 -0.78 0.02 0.00 0.23 0.00 0.00 176.35 176.14 2v9x n ILE 155 N 5.30 0.01 -3.08 -0.59 0.13 0.20 -4.93 119.36 116.40 2v9x n ILE 155 Ca 0.14 -0.02 0.00 0.00 -1.10 0.00 0.00 62.75 61.77 2v9x n ILE 155 Cb 0.44 0.21 0.00 0.00 -0.84 0.00 0.00 39.64 39.46 2v9x n ILE 155 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2v9x n GLY 156 N 2.54 1.26 3.20 4.50 0.00 -1.14 -4.18 105.19 111.38 2v9x n GLY 156 Ca -0.00 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.15 2v9x n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v9x s ALA 157 N -1.00 -0.73 -0.09 4.61 0.00 -0.44 -1.14 121.76 122.96 2v9x s ALA 157 Ca 0.00 0.69 0.01 0.00 0.00 0.00 0.00 51.96 52.66 2v9x s ALA 157 Cb 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 2v9x s ALA 157 CO 0.00 -0.17 -0.13 -0.51 0.00 0.00 0.00 175.76 174.95 2v9x s LEU 158 N -0.24 2.79 0.32 0.00 1.43 0.62 -0.70 118.68 122.90 2v9x s LEU 158 Ca -0.04 -0.23 0.10 0.00 -1.03 0.00 0.00 54.13 52.93 2v9x s LEU 158 Cb -0.03 -1.60 -0.06 0.00 0.03 0.00 0.00 46.19 44.53 2v9x s LEU 158 CO 0.01 0.26 -0.13 -0.94 0.23 0.00 0.00 176.35 175.78 2v9x s SER 159 N -0.24 3.67 -0.03 2.29 1.04 -0.53 -1.14 113.70 118.76 2v9x s SER 159 Ca 0.01 -1.14 0.02 0.00 0.48 0.00 0.00 55.95 55.32 2v9x s SER 159 Cb -0.13 -0.33 0.01 0.00 0.10 0.00 0.00 66.02 65.67 2v9x s SER 159 CO 0.03 -0.12 -0.05 -0.36 0.98 0.00 0.00 173.24 173.72 2v9x s PHE 160 N -2.58 0.68 -0.15 5.02 0.40 -1.26 -1.12 117.98 118.97 2v9x s PHE 160 Ca 0.32 -0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.49 2v9x s PHE 160 Cb -0.00 -0.54 0.03 0.00 0.51 0.00 0.00 43.02 43.02 2v9x s PHE 160 CO 0.16 -0.11 -0.10 -2.00 0.70 0.00 0.00 175.22 173.87 2v9x s GLU 161 N 0.46 1.86 0.34 0.44 2.12 0.08 -1.26 118.70 122.75 2v9x s GLU 161 Ca -0.06 -0.49 -0.28 0.00 0.36 0.00 0.00 54.97 54.49 2v9x s GLU 161 Cb -0.10 -1.97 -0.12 0.00 0.26 0.00 0.00 34.13 32.20 2v9x s GLU 161 CO 0.00 -0.31 1.37 -2.30 -0.54 0.00 0.00 175.26 173.48 2v9x n PRO 162 N 4.83 2.31 -2.07 4.30 -0.02 -1.26 -1.37 135.00 141.72 2v9x n PRO 162 Ca -0.14 0.81 -0.29 0.00 -2.02 0.00 0.00 63.50 61.86 2v9x n PRO 162 Cb 0.49 -2.45 0.04 0.00 -0.02 0.00 0.00 33.50 31.56 2v9x n PRO 162 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2v9x s LEU 163 N -1.22 3.01 0.55 2.45 1.43 0.04 -4.86 118.68 120.09 2v9x s LEU 163 Ca 0.56 0.97 0.23 0.00 -1.03 0.00 0.00 54.13 54.86 2v9x s LEU 163 Cb -0.54 -3.77 1.54 0.00 0.03 0.00 0.00 46.19 43.45 2v9x s LEU 163 CO 0.61 -1.25 2.20 0.77 0.23 0.00 0.00 176.35 178.91 2v9x h SER 164 N -0.49 0.00 -2.76 2.29 4.64 -1.95 -3.45 113.55 111.82 2v9x h SER 164 Ca -0.45 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 60.94 2v9x h SER 164 Cb 1.26 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 2v9x h SER 164 CO 0.63 0.01 0.45 0.61 -0.87 0.00 0.00 176.83 177.65 2v9x n GLY 165 N -1.40 0.77 3.77 -0.77 0.00 -1.26 -5.13 105.19 101.17 2v9x n GLY 165 Ca -0.03 -1.20 -0.40 0.00 0.00 0.00 0.00 46.02 44.39 2v9x n GLY 165 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2v9x s PRO 166 N -2.07 4.26 0.31 1.61 0.04 -1.26 -4.67 135.00 133.23 2v9x s PRO 166 Ca 0.20 2.21 -0.29 0.00 0.04 0.00 0.00 61.00 63.15 2v9x s PRO 166 Cb -0.04 -2.99 -0.10 0.00 0.04 0.00 0.00 34.50 31.40 2v9x s PRO 166 CO 0.09 -0.26 1.37 0.00 0.04 0.00 0.00 177.00 178.23 2v9x s ALA 167 N -1.17 3.54 0.11 8.56 0.00 0.28 -4.94 121.76 128.15 2v9x s ALA 167 Ca 0.51 1.32 -0.03 0.00 0.00 0.00 0.00 51.96 53.76 2v9x s ALA 167 Cb -0.39 -3.52 -0.15 0.00 0.00 0.00 0.00 23.12 19.05 2v9x s ALA 167 CO 0.52 -0.73 1.25 0.28 0.00 0.00 0.00 175.76 177.09 2v9x h VAL 168 N 3.17 1.46 -2.46 0.00 2.07 -1.92 -3.38 116.25 115.18 2v9x h VAL 168 Ca -0.48 -2.72 -0.61 0.00 0.82 0.00 0.00 66.70 63.71 2v9x h VAL 168 Cb 1.23 2.63 -0.42 0.00 -1.52 0.00 0.00 31.29 33.21 2v9x h VAL 168 CO 0.69 0.80 -0.59 0.54 0.02 0.00 0.00 177.57 179.02 2v9x n ARG 169 N -3.65 2.29 -1.70 1.57 1.74 -1.26 -5.07 116.66 110.59 2v9x n ARG 169 Ca -0.07 -4.60 -0.29 0.00 -0.77 0.00 0.00 57.85 52.12 2v9x n ARG 169 Cb 0.90 -2.25 0.10 0.00 -1.02 0.00 0.00 32.46 30.19 2v9x n ARG 169 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2v9x s PRO 170 N -2.15 1.85 0.19 5.56 0.04 -1.26 -4.83 135.00 134.39 2v9x s PRO 170 Ca 0.35 0.34 -0.09 0.00 0.04 0.00 0.00 61.00 61.64 2v9x s PRO 170 Cb 0.09 -1.92 0.09 0.00 0.04 0.00 0.00 34.50 32.80 2v9x s PRO 170 CO -0.06 -1.72 1.68 -0.92 0.04 0.00 0.00 177.00 176.02 2v9x h TYR 171 N -1.15 1.14 0.00 0.56 3.20 -0.93 -2.09 116.97 117.69 2v9x h TYR 171 Ca -0.48 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.24 2v9x h TYR 171 Cb 1.31 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.26 2v9x h TYR 171 CO 0.37 0.96 0.00 -2.95 -1.64 0.00 0.00 178.16 174.89 2v9x h ASN 172 N 1.00 0.00 -0.00 -2.11 -1.07 -1.75 -2.86 115.58 108.78 2v9x h ASN 172 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.57 2v9x h ASN 172 Cb 0.42 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.67 2v9x h ASN 172 CO 0.01 0.00 -0.73 0.54 0.07 0.00 0.00 177.43 177.32 2v9x n ARG 173 N -3.02 1.27 -2.58 4.14 1.74 -0.82 -4.94 116.66 112.46 2v9x n ARG 173 Ca -0.02 -0.20 -0.42 0.00 -0.77 0.00 0.00 57.85 56.44 2v9x n ARG 173 Cb 0.16 -1.33 -0.03 0.00 -1.02 0.00 0.00 32.46 30.24 2v9x n ARG 173 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2v9x s ARG 174 N -2.53 4.39 0.16 5.56 0.52 -1.03 -4.93 118.95 121.08 2v9x s ARG 174 Ca 0.09 1.52 -0.13 0.00 -0.52 0.00 0.00 55.73 56.68 2v9x s ARG 174 Cb 0.14 -3.55 0.05 0.00 0.52 0.00 0.00 34.95 32.11 2v9x s ARG 174 CO 0.66 -0.38 1.72 1.05 0.02 0.00 0.00 175.30 178.37 2v9x h GLU 175 N 7.27 0.80 -0.56 3.54 4.11 -1.92 -2.98 114.58 124.84 2v9x h GLU 175 Ca -0.32 -0.14 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2v9x h GLU 175 Cb 1.15 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2v9x h GLU 175 CO 0.87 0.69 0.00 -0.40 0.07 0.00 0.00 179.01 180.24 2v9x n ASP 176 N -4.53 2.86 -4.72 3.06 5.75 -1.26 -4.90 116.55 112.81 2v9x n ASP 176 Ca 0.02 -2.21 -0.42 0.00 -0.01 0.00 0.00 54.79 52.17 2v9x n ASP 176 Cb 0.15 -0.41 -0.03 0.00 -1.03 0.00 0.00 41.12 39.80 2v9x n ASP 176 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2v9x s ALA 177 N -1.66 3.74 -0.05 2.12 0.00 -1.13 -4.94 121.76 119.83 2v9x s ALA 177 Ca 0.30 1.32 0.13 0.00 0.00 0.00 0.00 51.96 53.72 2v9x s ALA 177 Cb 0.18 -3.60 -0.18 0.00 0.00 0.00 0.00 23.12 19.52 2v9x s ALA 177 CO 0.15 -0.75 0.83 0.87 0.00 0.00 0.00 175.76 176.86 2v9x h LYS 178 N 6.68 0.00 -0.17 0.00 1.57 -1.91 -3.40 116.57 119.34 2v9x h LYS 178 Ca -0.43 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.31 2v9x h LYS 178 Cb 1.21 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 2v9x h LYS 178 CO 0.90 0.49 -0.09 0.66 -0.57 0.00 0.00 179.45 180.84 2v9x n TYR 179 N -3.04 0.57 -1.68 -1.35 4.02 -1.26 -5.02 117.16 109.40 2v9x n TYR 179 Ca -0.12 -1.18 -0.45 0.00 -0.01 0.00 0.00 57.90 56.14 2v9x n TYR 179 Cb 0.96 -0.30 -0.04 0.00 -0.02 0.00 0.00 39.34 39.93 2v9x n TYR 179 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2v9x n ARG 180 N -1.02 2.34 -3.47 -0.72 1.74 -1.26 -3.01 116.66 111.25 2v9x n ARG 180 Ca 0.22 0.85 -0.19 0.00 -0.77 0.00 0.00 57.85 57.96 2v9x n ARG 180 Cb 0.83 -2.66 0.09 0.00 -1.02 0.00 0.00 32.46 29.69 2v9x n ARG 180 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2v9x n ASN 181 N 4.58 -3.54 -4.77 0.55 5.03 -1.12 -4.95 115.26 111.04 2v9x n ASN 181 Ca 0.18 -0.58 -0.39 0.00 0.87 0.00 0.00 54.58 54.66 2v9x n ASN 181 Cb 0.31 -5.03 -0.05 0.00 -1.02 0.00 0.00 39.78 33.99 2v9x n ASN 181 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 2v9x s GLN 182 N -5.68 4.48 0.00 3.52 0.74 -1.16 -4.97 119.66 116.59 2v9x s GLN 182 Ca 0.20 1.62 0.00 0.00 0.05 0.00 0.00 55.36 57.23 2v9x s GLN 182 Cb -0.09 -2.92 0.00 0.00 1.10 0.00 0.00 33.01 31.10 2v9x s GLN 182 CO 0.72 0.12 0.00 1.04 -0.55 0.00 0.00 175.29 176.62 2v9x n GLN 183 N 0.70 0.00 0.00 1.67 6.02 -1.26 -2.83 117.38 121.68 2v9x n GLN 183 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 2v9x n GLN 183 Cb 0.47 -0.78 0.00 0.00 1.02 0.00 0.00 30.24 30.95 2v9x n GLN 183 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2v9x n GLY 184 N 2.94 3.19 3.50 1.08 0.00 -1.26 -4.83 105.19 109.81 2v9x n GLY 184 Ca 0.00 -2.03 -0.40 0.00 0.00 0.00 0.00 46.02 43.58 2v9x n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v9x n ALA 185 N -3.00 3.38 -2.38 4.61 0.00 -1.26 -4.85 120.51 117.01 2v9x n ALA 185 Ca 0.00 -3.69 -0.42 0.00 0.00 0.00 0.00 53.44 49.33 2v9x n ALA 185 Cb 0.00 -3.58 -0.03 0.00 0.00 0.00 0.00 19.45 15.84 2v9x n ALA 185 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2v9x s VAL 186 N 5.43 3.96 0.98 0.00 1.01 -1.26 -4.80 120.40 125.71 2v9x s VAL 186 Ca 0.56 1.39 -0.12 0.00 0.00 0.00 0.00 61.98 63.81 2v9x s VAL 186 Cb 0.04 -3.89 0.18 0.00 0.00 0.00 0.00 36.38 32.71 2v9x s VAL 186 CO 0.08 0.08 1.09 0.00 0.00 0.00 0.00 175.10 176.34 2v9x s ALA 187 N 1.36 1.01 0.22 5.51 0.00 -1.26 -4.96 121.76 123.65 2v9x s ALA 187 Ca 0.59 -0.16 -0.31 0.00 0.00 0.00 0.00 51.96 52.09 2v9x s ALA 187 Cb -0.30 -3.18 -0.14 0.00 0.00 0.00 0.00 23.12 19.50 2v9x s ALA 187 CO 0.28 -2.79 1.28 0.45 0.00 0.00 0.00 175.76 174.99 2v9x n SER 188 N -4.17 2.13 -1.94 0.00 2.88 -1.26 -4.91 113.62 106.36 2v9x n SER 188 Ca 0.06 1.15 -0.23 0.00 -1.33 0.00 0.00 58.87 58.52 2v9x n SER 188 Cb 0.56 -1.34 0.09 0.00 -0.75 0.00 0.00 64.21 62.76 2v9x n SER 188 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2v9x n ARG 189 N 1.75 2.82 0.25 -1.46 1.74 -1.26 -4.75 116.66 115.76 2v9x n ARG 189 Ca 0.12 -3.59 0.14 0.00 -0.77 0.00 0.00 57.85 53.75 2v9x n ARG 189 Cb 0.29 -2.17 0.82 0.00 -1.02 0.00 0.00 32.46 30.38 2v9x n ARG 189 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 2v9x h ILE 190 N 1.45 0.63 0.00 0.55 6.09 -1.95 -0.75 117.51 123.53 2v9x h ILE 190 Ca 0.43 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.92 2v9x h ILE 190 Cb 1.39 0.94 0.00 0.00 0.47 0.00 0.00 36.82 39.62 2v9x h ILE 190 CO 0.97 0.00 0.00 -0.90 -3.07 0.00 0.00 178.15 175.15 2v9x n ASP 191 N -4.02 0.48 -0.01 2.19 5.75 -1.26 -2.04 116.55 117.64 2v9x n ASP 191 Ca -0.01 0.70 0.13 0.00 -0.01 0.00 0.00 54.79 55.59 2v9x n ASP 191 Cb 0.17 -0.77 0.36 0.00 -1.03 0.00 0.00 41.12 39.85 2v9x n ASP 191 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2v9x n LYS 192 N -2.12 0.06 0.00 0.11 4.76 -0.29 -4.81 118.16 115.87 2v9x n LYS 192 Ca -0.00 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 2v9x n LYS 192 Cb 0.07 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 2v9x n LYS 192 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78