#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2prv n ILE 2 N 0.00 0.00 -0.14 -0.61 3.06 -1.26 -3.15 119.36 117.26 2prv n ILE 2 Ca 0.00 0.00 -0.09 0.00 -2.50 0.00 0.00 62.75 60.16 2prv n ILE 2 Cb 0.00 0.00 -0.00 0.00 0.54 0.00 0.00 39.64 40.18 2prv n ILE 2 CO 0.00 0.00 0.00 1.88 -2.50 0.00 0.00 176.55 175.93 2prv h TYR 3 N 0.00 0.62 -0.50 9.51 0.05 -1.99 0.15 116.97 124.82 2prv h TYR 3 Ca 0.00 -0.04 -0.07 0.00 0.05 0.00 0.00 58.73 58.67 2prv h TYR 3 Cb 0.00 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.53 2prv h TYR 3 CO 0.00 0.54 0.03 1.03 -1.05 0.00 0.00 178.16 178.71 2prv h SER 4 N 0.53 0.78 -0.33 3.88 0.87 -1.98 -0.12 113.55 117.19 2prv h SER 4 Ca 0.14 -0.18 -0.09 0.00 -1.23 0.00 0.00 61.79 60.43 2prv h SER 4 Cb 0.17 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2prv h SER 4 CO -0.01 0.83 -0.15 0.11 -0.53 0.00 0.00 176.83 177.08 2prv h LYS 5 N 0.77 0.68 -0.33 2.24 1.57 -1.82 -1.32 116.57 118.36 2prv h LYS 5 Ca 0.15 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.55 2prv h LYS 5 Cb 0.42 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2prv h LYS 5 CO 0.02 0.88 -0.14 0.28 -0.57 0.00 0.00 179.45 179.92 2prv h VAL 6 N 0.44 1.29 -0.83 0.50 2.07 -0.79 -0.40 116.25 118.53 2prv h VAL 6 Ca 0.07 -1.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 2prv h VAL 6 Cb 0.68 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 2prv h VAL 6 CO 0.05 0.40 0.40 -0.33 0.02 0.00 0.00 177.57 178.11 2prv h GLU 7 N 0.44 1.18 -0.34 1.57 5.08 -1.03 -0.20 114.58 121.29 2prv h GLU 7 Ca 0.08 -0.17 -0.15 0.00 -1.00 0.00 0.00 59.36 58.12 2prv h GLU 7 Cb 0.66 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2prv h GLU 7 CO 0.04 0.90 -0.38 -0.91 -1.00 0.00 0.00 179.01 177.67 2prv h ASN 8 N 1.18 0.85 -0.07 1.42 2.35 -1.08 0.02 115.58 120.25 2prv h ASN 8 Ca 0.29 -0.38 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 2prv h ASN 8 Cb 0.10 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 2prv h ASN 8 CO -0.04 1.13 0.03 0.15 -1.65 0.00 0.00 177.43 177.06 2prv h PHE 9 N 0.66 0.11 -0.42 1.19 3.04 -0.65 -2.08 116.94 118.80 2prv h PHE 9 Ca 0.06 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.99 2prv h PHE 9 Cb 0.94 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.39 2prv h PHE 9 CO 0.05 0.21 0.21 0.82 -2.02 0.00 0.00 178.31 177.58 2prv h ILE 10 N -0.02 1.17 -0.65 1.41 2.04 -0.94 -1.88 117.51 118.64 2prv h ILE 10 Ca 0.03 -0.48 0.10 0.00 1.00 0.00 0.00 64.86 65.51 2prv h ILE 10 Cb 0.15 0.72 -0.08 0.00 -0.74 0.00 0.00 36.82 36.87 2prv h ILE 10 CO -0.00 0.18 0.26 -1.13 0.00 0.00 0.00 178.15 177.46 2prv h ASN 11 N 0.53 0.26 0.47 1.72 -1.24 -0.67 -1.45 115.58 115.21 2prv h ASN 11 Ca 0.14 0.08 0.00 0.00 0.71 0.00 0.00 56.30 57.23 2prv h ASN 11 Cb 0.10 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.21 2prv h ASN 11 CO -0.02 0.15 -0.30 -0.62 -1.29 0.00 0.00 177.43 175.35 2prv n GLU 12 N -4.98 0.34 -0.03 6.67 1.02 -0.81 -4.06 120.64 118.79 2prv n GLU 12 Ca 0.10 -0.17 0.03 0.00 -0.02 0.00 0.00 57.16 57.10 2prv n GLU 12 Cb 0.30 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.27 2prv n GLU 12 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2prv n ASN 13 N -1.18 2.06 -1.35 1.62 3.02 -0.72 -4.79 115.26 113.93 2prv n ASN 13 Ca 0.09 -2.36 -0.06 0.00 -0.03 0.00 0.00 54.58 52.22 2prv n ASN 13 Cb 0.33 -0.15 0.09 0.00 -0.61 0.00 0.00 39.78 39.44 2prv n ASN 13 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2prv n LYS 14 N -0.81 1.72 -0.35 3.52 2.85 -0.62 -4.49 118.16 119.98 2prv n LYS 14 Ca 0.06 -1.14 0.07 0.00 -1.05 0.00 0.00 58.31 56.25 2prv n LYS 14 Cb 0.39 -1.53 0.25 0.00 -0.65 0.00 0.00 35.03 33.50 2prv n LYS 14 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 2prv h GLN 15 N 0.66 0.95 -0.14 -1.58 7.50 -1.89 -2.44 115.11 118.17 2prv h GLN 15 Ca 0.18 -0.06 -0.15 0.00 0.50 0.00 0.00 58.65 59.12 2prv h GLN 15 Cb 1.54 -0.21 -0.21 0.00 0.05 0.00 0.00 27.48 28.64 2prv h GLN 15 CO 0.36 0.63 -0.76 0.09 -1.50 0.00 0.00 178.83 177.64 2prv n ASN 16 N -4.59 1.92 -4.77 1.46 3.02 -1.26 -5.08 115.26 105.96 2prv n ASN 16 Ca 0.18 -3.14 -0.30 0.00 -0.03 0.00 0.00 54.58 51.29 2prv n ASN 16 Cb 0.34 -0.43 0.11 0.00 -0.61 0.00 0.00 39.78 39.18 2prv n ASN 16 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2prv s ALA 17 N -2.35 2.02 -0.11 5.41 0.00 -0.92 -4.80 121.76 121.02 2prv s ALA 17 Ca 0.38 -0.09 -0.01 0.00 0.00 0.00 0.00 51.96 52.24 2prv s ALA 17 Cb 0.38 -3.16 0.03 0.00 0.00 0.00 0.00 23.12 20.37 2prv s ALA 17 CO -0.08 -1.92 -0.07 -1.50 0.00 0.00 0.00 175.76 172.19 2prv s ILE 18 N -3.05 0.94 0.14 0.00 1.10 -0.50 -5.01 121.20 114.83 2prv s ILE 18 Ca 0.62 -0.24 0.03 0.00 -0.51 0.00 0.00 60.65 60.55 2prv s ILE 18 Cb -0.16 -0.98 -0.04 0.00 0.15 0.00 0.00 42.46 41.43 2prv s ILE 18 CO 0.55 0.35 -0.06 -0.36 -2.11 0.00 0.00 174.94 173.32 2prv s PHE 19 N 1.73 1.14 0.00 3.50 0.08 -1.26 -0.51 117.98 122.66 2prv s PHE 19 Ca 0.05 -0.88 0.00 0.00 0.12 0.00 0.00 56.93 56.22 2prv s PHE 19 Cb -0.13 -0.63 0.00 0.00 -0.57 0.00 0.00 43.02 41.70 2prv s PHE 19 CO -0.08 -0.07 0.00 0.25 -0.10 0.00 0.00 175.22 175.22 2prv n THR 20 N -0.17 0.00 -3.72 0.64 -2.24 -1.04 -4.99 114.28 102.77 2prv n THR 20 Ca -0.10 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 2prv n THR 20 Cb 0.61 -0.14 -0.11 0.00 -2.10 0.00 0.00 70.33 68.60 2prv n THR 20 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2prv s GLU 21 N 0.64 0.38 0.37 -0.78 2.12 -1.24 -4.98 118.70 115.21 2prv s GLU 21 Ca 0.00 0.63 -0.28 0.00 0.36 0.00 0.00 54.97 55.68 2prv s GLU 21 Cb 0.00 0.07 -0.10 0.00 0.26 0.00 0.00 34.13 34.36 2prv s GLU 21 CO 0.00 -0.11 1.36 0.20 -0.54 0.00 0.00 175.26 176.17 2prv s GLY 22 N 0.83 2.96 -0.04 -1.50 0.00 -1.26 -3.50 107.32 104.81 2prv s GLY 22 Ca -0.05 1.35 -0.26 0.00 0.00 0.00 0.00 44.72 45.76 2prv s GLY 22 CO -0.06 1.99 0.82 0.00 0.00 0.00 0.00 173.10 175.86 2prv s ALA 23 N -1.17 3.27 0.97 3.20 0.00 -0.05 -4.89 121.76 123.10 2prv s ALA 23 Ca 0.52 0.30 -0.14 0.00 0.00 0.00 0.00 51.96 52.65 2prv s ALA 23 Cb -0.41 -3.13 0.17 0.00 0.00 0.00 0.00 23.12 19.75 2prv s ALA 23 CO 0.55 -0.18 1.14 -1.54 0.00 0.00 0.00 175.76 175.73 2prv s SER 24 N 0.90 2.97 0.31 0.00 1.04 -1.26 -4.22 113.70 113.45 2prv s SER 24 Ca 0.44 0.88 0.01 0.00 0.48 0.00 0.00 55.95 57.76 2prv s SER 24 Cb -0.19 -1.38 0.51 0.00 0.10 0.00 0.00 66.02 65.06 2prv s SER 24 CO 0.22 -2.88 1.90 0.45 0.98 0.00 0.00 173.24 173.91 2prv h HIS 25 N -1.72 0.79 -0.36 5.02 3.86 -1.99 0.17 115.15 120.92 2prv h HIS 25 Ca -0.50 -0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 58.54 2prv h HIS 25 Cb 1.32 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 29.53 2prv h HIS 25 CO -0.16 0.62 -0.28 0.93 0.86 0.00 0.00 177.93 179.89 2prv h GLU 26 N 0.77 0.75 -0.45 2.45 5.08 -1.98 -0.51 114.58 120.70 2prv h GLU 26 Ca 0.18 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 2prv h GLU 26 Cb 0.17 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2prv h GLU 26 CO -0.02 0.95 0.24 -0.91 -1.00 0.00 0.00 179.01 178.27 2prv h ASN 27 N 0.64 0.56 -0.51 1.42 -0.26 -1.71 -0.51 115.58 115.21 2prv h ASN 27 Ca 0.08 -0.10 -0.09 0.00 -0.56 0.00 0.00 56.30 55.63 2prv h ASN 27 Cb 0.81 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.90 2prv h ASN 27 CO 0.07 0.50 -0.03 0.40 -1.06 0.00 0.00 177.43 177.30 2prv h ILE 28 N 0.59 1.26 -0.78 2.81 2.04 -0.87 -1.45 117.51 121.11 2prv h ILE 28 Ca 0.16 -1.15 -0.02 0.00 1.00 0.00 0.00 64.86 64.85 2prv h ILE 28 Cb 0.06 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 2prv h ILE 28 CO -0.02 0.41 0.40 1.23 0.00 0.00 0.00 178.15 180.17 2prv h GLY 29 N 0.99 1.18 0.99 5.37 0.00 -0.87 0.12 103.07 110.84 2prv h GLY 29 Ca 0.16 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2prv h GLY 29 CO 0.03 0.52 0.07 -0.09 0.00 0.00 0.00 176.54 177.07 2prv h ARG 30 N 1.10 0.14 -0.58 4.80 9.65 -0.83 -0.89 114.38 127.77 2prv h ARG 30 Ca 0.27 -0.01 0.02 0.00 -1.10 0.00 0.00 59.98 59.16 2prv h ARG 30 Cb 0.07 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.58 2prv h ARG 30 CO -0.04 0.11 0.36 0.82 2.80 0.00 0.00 179.97 184.02 2prv h ILE 31 N 0.12 1.09 -0.69 1.20 2.04 -0.76 0.20 117.51 120.72 2prv h ILE 31 Ca 0.04 -0.25 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 2prv h ILE 31 Cb 0.00 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 2prv h ILE 31 CO -0.01 0.13 0.22 -0.33 0.00 0.00 0.00 178.15 178.17 2prv h GLU 32 N 0.73 1.06 -0.53 2.37 5.08 -0.81 0.13 114.58 122.61 2prv h GLU 32 Ca 0.23 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2prv h GLU 32 Cb -0.01 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 2prv h GLU 32 CO -0.08 0.91 0.19 1.49 -1.00 0.00 0.00 179.01 180.52 2prv h GLU 33 N 1.00 0.81 0.00 2.33 4.57 -0.83 0.43 114.58 122.89 2prv h GLU 33 Ca 0.22 -0.16 -0.07 0.00 -1.18 0.00 0.00 59.36 58.17 2prv h GLU 33 Cb 0.29 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.74 2prv h GLU 33 CO -0.01 0.73 -0.32 -0.91 -1.18 0.00 0.00 179.01 177.31 2prv h ASN 34 N 0.73 0.00 1.59 1.04 2.35 -0.51 -2.46 115.58 118.31 2prv h ASN 34 Ca 0.17 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 2prv h ASN 34 Cb 0.24 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2prv h ASN 34 CO -0.01 0.32 -0.42 -0.07 -1.65 0.00 0.00 177.43 175.61 2prv h LEU 35 N 0.00 0.00 1.11 1.61 3.38 -0.58 -3.48 115.31 117.36 2prv h LEU 35 Ca -0.00 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.59 2prv h LEU 35 Cb 0.93 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 2prv h LEU 35 CO 0.04 0.23 -0.55 0.00 0.09 0.00 0.00 178.44 178.25 2prv n GLN 36 N -3.08 -3.89 -4.30 1.13 1.13 0.12 -4.92 117.38 103.56 2prv n GLN 36 Ca 0.02 0.73 -0.18 0.00 -1.94 0.00 0.00 57.00 55.62 2prv n GLN 36 Cb 0.63 -5.49 -0.14 0.00 0.11 0.00 0.00 30.24 25.35 2prv n GLN 36 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2prv s ASP 38 N -0.63 7.32 0.07 0.00 1.01 -1.26 -4.55 116.67 118.63 2prv s ASP 38 Ca 0.01 2.05 -0.04 0.00 0.71 0.00 0.00 52.55 55.29 2prv s ASP 38 Cb -0.05 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.23 2prv s ASP 38 CO 0.00 -0.17 0.28 -0.76 0.21 0.00 0.00 175.17 174.73 2prv s LEU 39 N -0.44 4.33 0.65 1.23 1.43 -1.26 -4.84 118.68 119.78 2prv s LEU 39 Ca 0.48 0.46 -0.14 0.00 -1.03 0.00 0.00 54.13 53.90 2prv s LEU 39 Cb -0.29 -2.97 -0.01 0.00 0.03 0.00 0.00 46.19 42.96 2prv s LEU 39 CO 0.34 0.16 1.08 -2.16 0.23 0.00 0.00 176.35 176.01 2prv s PRO 40 N -2.30 2.94 0.20 1.29 0.04 -1.26 -4.85 135.00 131.05 2prv s PRO 40 Ca 0.34 1.25 -0.11 0.00 0.04 0.00 0.00 61.00 62.52 2prv s PRO 40 Cb -0.13 -1.98 0.22 0.00 0.04 0.00 0.00 34.50 32.65 2prv s PRO 40 CO 0.23 -1.12 1.77 -0.91 0.04 0.00 0.00 177.00 177.01 2prv h ASN 41 N -0.04 0.32 0.53 6.66 2.35 -1.25 -1.56 115.58 122.60 2prv h ASN 41 Ca -0.46 0.05 -0.06 0.00 -0.55 0.00 0.00 56.30 55.28 2prv h ASN 41 Cb 1.23 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.59 2prv h ASN 41 CO 0.55 0.21 -0.29 0.77 -1.65 0.00 0.00 177.43 177.02 2prv h SER 42 N 0.48 0.00 0.23 5.81 4.64 -1.93 -0.52 113.55 122.27 2prv h SER 42 Ca 0.27 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.31 2prv h SER 42 Cb 0.26 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.37 2prv h SER 42 CO -0.23 0.29 -1.17 0.22 -0.87 0.00 0.00 176.83 175.08 2prv h TYR 43 N 0.00 0.86 -0.71 4.77 3.20 -1.81 -2.96 116.97 120.32 2prv h TYR 43 Ca -0.00 -0.53 0.02 0.00 3.14 0.00 0.00 58.73 61.36 2prv h TYR 43 Cb 0.64 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.80 2prv h TYR 43 CO 0.00 1.38 0.47 0.87 -1.64 0.00 0.00 178.16 179.24 2prv h LYS 44 N 0.25 0.88 -0.59 1.82 1.57 -0.87 -1.02 116.57 118.60 2prv h LYS 44 Ca -0.15 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.64 2prv h LYS 44 Cb 1.84 -0.20 -0.06 0.00 0.08 0.00 0.00 32.23 33.89 2prv h LYS 44 CO 0.22 0.58 0.27 2.35 -0.57 0.00 0.00 179.45 182.30 2prv h TRP 45 N 0.91 0.49 -0.31 -1.35 7.01 -1.07 -0.67 115.95 120.96 2prv h TRP 45 Ca 0.27 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.26 2prv h TRP 45 Cb -0.02 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 2prv h TRP 45 CO -0.00 0.19 0.05 0.35 -2.79 0.00 0.00 178.44 176.24 2prv h PHE 46 N 0.50 0.55 -0.75 2.65 3.57 -1.21 -1.51 116.94 120.75 2prv h PHE 46 Ca 0.28 -0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.74 2prv h PHE 46 Cb 0.26 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 2prv h PHE 46 CO -0.12 0.60 0.47 -0.07 -2.23 0.00 0.00 178.31 176.96 2prv h LEU 47 N 0.34 0.77 -0.88 0.59 3.38 -0.91 -0.15 115.31 118.45 2prv h LEU 47 Ca 0.09 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 2prv h LEU 47 Cb 0.35 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2prv h LEU 47 CO 0.01 0.53 -0.38 -0.33 0.09 0.00 0.00 178.44 178.35 2prv h GLU 48 N 0.91 0.35 0.09 1.13 5.08 -0.87 0.15 114.58 121.42 2prv h GLU 48 Ca 0.30 -0.17 -0.37 0.00 -1.00 0.00 0.00 59.36 58.13 2prv h GLU 48 Cb 0.03 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2prv h GLU 48 CO -0.11 0.69 -2.13 1.17 -1.00 0.00 0.00 179.01 177.63 2prv n LYS 49 N -4.04 0.73 -0.00 2.33 4.81 -0.59 -3.86 118.16 117.54 2prv n LYS 49 Ca -0.01 0.23 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 2prv n LYS 49 Cb 0.48 -1.66 -0.01 0.00 0.02 0.00 0.00 35.03 33.86 2prv n LYS 49 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2prv n TYR 50 N -3.40 0.00 0.00 5.64 4.01 -0.10 -4.49 117.16 118.82 2prv n TYR 50 Ca -0.35 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 2prv n TYR 50 Cb 1.03 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 40.04 2prv n TYR 50 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2prv n GLY 51 N 2.60 2.22 3.52 2.72 0.00 -0.66 -2.56 105.19 113.03 2prv n GLY 51 Ca -0.01 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 2prv n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2prv s ALA 52 N -0.06 -1.83 0.00 4.61 0.00 -1.20 -0.78 121.76 122.49 2prv s ALA 52 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.11 2prv s ALA 52 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.24 2prv s ALA 52 CO 0.00 -0.56 0.00 0.41 0.00 0.00 0.00 175.76 175.61 2prv n GLY 53 N 0.12 0.28 0.00 0.00 0.00 -0.03 -2.48 105.19 103.08 2prv n GLY 53 Ca -0.11 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 43.93 2prv n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2prv n GLY 54 N 0.00 -0.38 3.46 -0.02 0.00 0.33 -0.78 105.19 107.81 2prv n GLY 54 Ca 0.00 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.08 2prv n GLY 54 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2prv s LEU 55 N 0.00 -0.45 -1.34 0.99 2.34 -0.81 -1.42 118.68 118.00 2prv s LEU 55 Ca 0.00 -0.10 -0.10 0.00 0.06 0.00 0.00 54.13 53.99 2prv s LEU 55 Cb 0.00 2.55 0.07 0.00 -0.56 0.00 0.00 46.19 48.25 2prv s LEU 55 CO 0.00 -1.01 0.54 0.49 -1.06 0.00 0.00 176.35 175.31 2prv n PHE 56 N -0.38 -1.83 -0.51 3.48 3.72 -1.26 -1.34 117.46 119.35 2prv n PHE 56 Ca -0.15 0.51 0.00 0.00 -0.05 0.00 0.00 57.45 57.76 2prv n PHE 56 Cb 0.64 -3.13 0.00 0.00 -0.94 0.00 0.00 39.48 36.05 2prv n PHE 56 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2prv n GLY 57 N -1.24 1.34 3.29 1.37 0.00 -1.26 -4.82 105.19 103.87 2prv n GLY 57 Ca -0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.55 2prv n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2prv s VAL 58 N -3.27 5.07 -0.15 1.61 1.01 -0.45 -5.04 120.40 119.19 2prv s VAL 58 Ca 0.00 -1.71 0.02 0.00 0.00 0.00 0.00 61.98 60.28 2prv s VAL 58 Cb 0.00 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 32.14 2prv s VAL 58 CO 0.00 -0.88 -0.19 -0.76 0.00 0.00 0.00 175.10 173.27 2prv s LEU 59 N 1.32 2.26 -0.15 3.92 1.43 -1.26 -1.92 118.68 124.29 2prv s LEU 59 Ca 0.06 -0.55 -0.05 0.00 -1.03 0.00 0.00 54.13 52.56 2prv s LEU 59 Cb -0.26 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 2prv s LEU 59 CO 0.01 0.08 0.01 -0.69 0.23 0.00 0.00 176.35 175.98 2prv s VAL 60 N 0.83 4.31 0.79 -1.59 1.01 0.04 -4.77 120.40 121.02 2prv s VAL 60 Ca -0.06 -0.21 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2prv s VAL 60 Cb -0.15 -2.90 0.07 0.00 0.00 0.00 0.00 36.38 33.40 2prv s VAL 60 CO -0.01 0.50 1.12 -0.76 0.00 0.00 0.00 175.10 175.95 2prv s LEU 61 N 0.14 3.07 0.00 3.92 1.43 0.07 -0.85 118.68 126.46 2prv s LEU 61 Ca 0.02 2.02 0.00 0.00 -1.03 0.00 0.00 54.13 55.13 2prv s LEU 61 Cb -0.13 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.54 2prv s LEU 61 CO 0.02 -2.29 0.00 0.61 0.23 0.00 0.00 176.35 174.92 2prv n GLY 62 N -0.52 -0.50 3.74 -3.19 0.00 -1.26 -4.69 105.19 98.76 2prv n GLY 62 Ca 0.11 0.24 -0.35 0.00 0.00 0.00 0.00 46.02 46.02 2prv n GLY 62 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2prv s TYR 63 N 0.00 3.41 -0.25 1.61 5.04 0.04 -1.05 117.35 126.14 2prv s TYR 63 Ca 0.00 0.31 0.18 0.00 -2.44 0.00 0.00 57.07 55.12 2prv s TYR 63 Cb 0.00 -2.10 0.49 0.00 0.35 0.00 0.00 41.96 40.70 2prv s TYR 63 CO 0.00 0.35 1.14 0.09 -1.34 0.00 0.00 175.55 175.79 2prv n ASN 64 N 3.23 2.57 0.00 4.32 4.13 0.34 -3.27 115.26 126.58 2prv n ASN 64 Ca -0.17 -2.62 0.00 0.00 1.68 0.00 0.00 54.58 53.48 2prv n ASN 64 Cb 0.53 -0.43 0.00 0.00 -1.54 0.00 0.00 39.78 38.34 2prv n ASN 64 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2prv n PHE 65 N -0.58 0.00 -0.92 3.10 3.72 -1.26 -3.57 117.46 117.94 2prv n PHE 65 Ca 0.19 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.67 2prv n PHE 65 Cb 0.87 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 39.53 2prv n PHE 65 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2prv n ASP 66 N 3.97 2.26 -3.66 4.37 5.75 -1.26 -5.03 116.55 122.95 2prv n ASP 66 Ca 0.00 -2.91 -0.02 0.00 -0.01 0.00 0.00 54.79 51.85 2prv n ASP 66 Cb 0.00 -0.36 -0.01 0.00 -1.03 0.00 0.00 41.12 39.72 2prv n ASP 66 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2prv s HIS 67 N -2.55 -0.13 -0.33 2.11 -3.43 -1.23 -5.12 115.29 104.60 2prv s HIS 67 Ca 0.27 -0.07 0.03 0.00 -0.80 0.00 0.00 55.06 54.49 2prv s HIS 67 Cb 0.23 0.58 0.10 0.00 -1.43 0.00 0.00 32.58 32.07 2prv s HIS 67 CO 0.03 -0.55 0.05 0.00 -2.00 0.00 0.00 174.74 172.26 2prv s ALA 68 N -2.90 2.66 0.46 -1.38 0.00 -1.26 -0.50 121.76 118.84 2prv s ALA 68 Ca 0.12 -2.36 0.14 0.00 0.00 0.00 0.00 51.96 49.85 2prv s ALA 68 Cb 0.01 -1.89 1.09 0.00 0.00 0.00 0.00 23.12 22.32 2prv s ALA 68 CO -0.02 -1.66 2.06 0.66 0.00 0.00 0.00 175.76 176.80 2prv h SER 69 N 7.70 0.25 -0.56 0.00 4.64 -1.44 -0.83 113.55 123.31 2prv h SER 69 Ca -0.06 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 2prv h SER 69 Cb 1.02 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.03 2prv h SER 69 CO 0.51 0.17 0.31 1.62 -0.87 0.00 0.00 176.83 178.57 2prv h VAL 70 N 0.29 1.18 -0.17 0.95 3.04 -1.70 0.01 116.25 119.85 2prv h VAL 70 Ca 0.15 -0.45 -0.05 0.00 -1.01 0.00 0.00 66.70 65.35 2prv h VAL 70 Cb 0.24 0.47 -0.00 0.00 -2.01 0.00 0.00 31.29 29.99 2prv h VAL 70 CO -0.03 0.19 -0.08 0.58 -1.01 0.00 0.00 177.57 177.23 2prv h VAL 71 N 0.75 1.31 -0.08 1.51 2.07 -1.59 -1.92 116.25 118.30 2prv h VAL 71 Ca 0.20 -1.11 0.03 0.00 0.82 0.00 0.00 66.70 66.63 2prv h VAL 71 Cb 0.03 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 2prv h VAL 71 CO -0.03 0.33 -0.08 0.78 0.02 0.00 0.00 177.57 178.59 2prv h ASN 72 N 0.03 -0.25 0.07 0.57 2.35 -1.07 0.59 115.58 117.87 2prv h ASN 72 Ca 0.04 0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.71 2prv h ASN 72 Cb 0.55 0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 2prv h ASN 72 CO 0.02 -0.12 -0.43 -0.09 -1.65 0.00 0.00 177.43 175.16 2prv h ARG 73 N -0.11 0.45 -0.39 0.81 9.65 -1.05 0.15 114.38 123.89 2prv h ARG 73 Ca 0.06 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 2prv h ARG 73 Cb 0.19 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 2prv h ARG 73 CO -0.14 0.80 0.25 1.15 2.80 0.00 0.00 179.97 184.83 2prv h THR 74 N 0.37 1.10 -0.73 0.20 2.02 -1.09 -0.74 112.91 114.05 2prv h THR 74 Ca 0.03 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 66.97 2prv h THR 74 Cb 0.91 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 2prv h THR 74 CO 0.08 0.10 0.32 0.78 0.37 0.00 0.00 175.52 177.17 2prv h ASN 75 N 0.52 0.97 -0.29 4.18 2.35 -0.53 -0.23 115.58 122.55 2prv h ASN 75 Ca 0.14 -0.13 0.02 0.00 -0.55 0.00 0.00 56.30 55.78 2prv h ASN 75 Cb -0.05 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.05 2prv h ASN 75 CO -0.03 0.84 0.15 -0.08 -1.65 0.00 0.00 177.43 176.67 2prv h GLU 76 N 1.04 0.31 -0.22 0.81 4.57 -0.37 -1.47 114.58 119.25 2prv h GLU 76 Ca 0.25 -0.02 -0.11 0.00 -1.18 0.00 0.00 59.36 58.30 2prv h GLU 76 Cb 0.16 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 2prv h GLU 76 CO -0.03 0.21 -0.32 1.88 -1.18 0.00 0.00 179.01 179.57 2prv h TYR 77 N 0.32 0.53 -0.45 0.92 -1.99 -0.68 0.11 116.97 115.73 2prv h TYR 77 Ca 0.12 -0.13 -0.05 0.00 2.00 0.00 0.00 58.73 60.67 2prv h TYR 77 Cb 0.02 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 38.61 2prv h TYR 77 CO -0.09 0.74 0.09 0.87 -0.00 0.00 0.00 178.16 179.77 2prv h LYS 78 N 0.40 0.73 0.01 4.88 1.57 -0.78 -0.69 116.57 122.69 2prv h LYS 78 Ca 0.05 -0.18 -0.24 0.00 -1.87 0.00 0.00 60.65 58.40 2prv h LYS 78 Cb 0.76 -0.09 0.02 0.00 0.08 0.00 0.00 32.23 33.00 2prv h LYS 78 CO 0.06 0.74 -0.95 1.49 -0.57 0.00 0.00 179.45 180.22 2prv h GLU 79 N 0.59 0.62 0.00 3.15 4.57 -1.14 -3.34 114.58 119.03 2prv h GLU 79 Ca 0.14 -0.69 -0.36 0.00 -1.18 0.00 0.00 59.36 57.27 2prv h GLU 79 Cb 0.35 0.20 -0.07 0.00 -0.16 0.00 0.00 28.75 29.07 2prv h GLU 79 CO 0.00 1.28 -2.35 0.72 -1.18 0.00 0.00 179.01 177.49 2prv n HIS 80 N -3.94 0.00 -1.69 0.92 8.25 0.01 -4.70 115.22 114.06 2prv n HIS 80 Ca -0.11 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.40 2prv n HIS 80 Cb 0.84 -0.97 0.09 0.00 1.12 0.00 0.00 29.99 31.07 2prv n HIS 80 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2prv n TYR 81 N -2.75 0.00 -1.30 4.41 4.01 -0.31 -5.02 117.16 116.20 2prv n TYR 81 Ca -0.33 -0.71 -0.10 0.00 -0.16 0.00 0.00 57.90 56.60 2prv n TYR 81 Cb 1.13 -0.14 -0.04 0.00 -0.31 0.00 0.00 39.34 39.98 2prv n TYR 81 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2prv n GLY 82 N -0.62 1.09 3.63 2.72 0.00 -0.97 -4.82 105.19 106.21 2prv n GLY 82 Ca 0.10 -0.19 -0.53 0.00 0.00 0.00 0.00 46.02 45.40 2prv n GLY 82 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2prv n LEU 83 N -1.17 1.95 -4.76 0.99 7.94 -0.92 -4.89 117.00 116.14 2prv n LEU 83 Ca -0.10 1.10 -0.39 0.00 -1.11 0.00 0.00 56.01 55.50 2prv n LEU 83 Cb 0.46 -1.20 0.03 0.00 0.53 0.00 0.00 43.42 43.24 2prv n LEU 83 CO 0.16 -0.83 1.04 0.41 -1.11 0.00 0.00 177.39 177.06 2prv n THR 84 N 3.13 3.15 -1.65 1.96 -1.04 -1.26 -4.72 114.28 113.84 2prv n THR 84 Ca 0.20 -0.50 -0.46 0.00 -2.04 0.00 0.00 64.05 61.25 2prv n THR 84 Cb 0.18 -1.79 -0.04 0.00 -1.82 0.00 0.00 70.33 66.87 2prv n THR 84 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2prv n ASP 85 N -0.46 2.58 0.00 8.00 8.00 -1.26 -2.35 116.55 131.06 2prv n ASP 85 Ca 0.07 1.12 0.00 0.00 0.71 0.00 0.00 54.79 56.69 2prv n ASP 85 Cb 0.42 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.15 2prv n ASP 85 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2prv n GLY 86 N 2.61 1.01 3.79 0.44 0.00 -1.26 -4.85 105.19 106.93 2prv n GLY 86 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 2prv n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2prv s LEU 87 N 0.00 4.47 -0.14 0.99 1.43 -0.99 -1.62 118.68 122.82 2prv s LEU 87 Ca 0.00 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 54.71 2prv s LEU 87 Cb 0.00 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.72 2prv s LEU 87 CO 0.00 0.10 -0.11 -0.69 0.23 0.00 0.00 176.35 175.88 2prv s VAL 88 N -1.36 1.35 -0.24 -1.59 1.01 -0.57 -4.96 120.40 114.05 2prv s VAL 88 Ca 0.41 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 2prv s VAL 88 Cb -0.20 -1.31 -0.00 0.00 0.00 0.00 0.00 36.38 34.86 2prv s VAL 88 CO 0.24 0.41 1.23 -0.69 0.00 0.00 0.00 175.10 176.29 2prv s VAL 89 N 1.57 4.31 -0.17 2.92 1.01 -1.26 -0.59 120.40 128.19 2prv s VAL 89 Ca 0.05 1.55 0.08 0.00 0.00 0.00 0.00 61.98 63.65 2prv s VAL 89 Cb -0.13 -4.14 -0.11 0.00 0.00 0.00 0.00 36.38 32.01 2prv s VAL 89 CO -0.10 -0.29 0.25 2.30 0.00 0.00 0.00 175.10 177.26 2prv n ILE 90 N 5.70 0.00 -3.72 2.22 -5.35 0.06 -4.62 119.36 113.66 2prv n ILE 90 Ca 0.14 -0.24 -0.12 0.00 -0.27 0.00 0.00 62.75 62.25 2prv n ILE 90 Cb 0.46 0.62 -0.13 0.00 -1.74 0.00 0.00 39.64 38.85 2prv n ILE 90 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2prv s GLU 91 N -2.20 0.22 -0.24 6.28 2.12 -0.96 -0.75 118.70 123.18 2prv s GLU 91 Ca -0.00 0.59 -0.07 0.00 0.36 0.00 0.00 54.97 55.84 2prv s GLU 91 Cb 0.06 -0.10 -0.03 0.00 0.26 0.00 0.00 34.13 34.32 2prv s GLU 91 CO 0.33 -0.18 0.06 0.34 -0.54 0.00 0.00 175.26 175.28 2prv s ASP 92 N 1.41 5.17 -0.30 -1.70 2.15 -1.26 -0.93 116.67 121.20 2prv s ASP 92 Ca -0.08 -0.17 0.13 0.00 0.43 0.00 0.00 52.55 52.85 2prv s ASP 92 Cb -0.10 -1.92 0.47 0.00 -0.30 0.00 0.00 42.92 41.07 2prv s ASP 92 CO -0.09 -0.00 1.14 0.52 -0.17 0.00 0.00 175.17 176.56 2prv n VAL 93 N 4.72 1.98 0.00 1.11 0.31 0.31 -5.01 118.33 121.76 2prv n VAL 93 Ca -0.16 -3.77 0.00 0.00 -0.01 0.00 0.00 64.34 60.40 2prv n VAL 93 Cb 0.52 -0.19 0.00 0.00 -0.91 0.00 0.00 33.84 33.25 2prv n VAL 93 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2prv n ASP 94 N -0.61 0.00 -0.04 4.52 8.00 -1.26 -3.67 116.55 123.50 2prv n ASP 94 Ca 0.29 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.82 2prv n ASP 94 Cb 0.87 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.95 2prv n ASP 94 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2prv n TYR 95 N 0.00 0.00 -3.68 1.24 4.02 -1.26 -5.01 117.16 112.46 2prv n TYR 95 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 2prv n TYR 95 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.30 2prv n TYR 95 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 176.86 175.26 2prv s PHE 96 N -1.47 -0.32 0.09 -0.72 -0.71 -1.24 -1.52 117.98 112.08 2prv s PHE 96 Ca 0.03 -0.03 0.08 0.00 -1.04 0.00 0.00 56.93 55.98 2prv s PHE 96 Cb 0.05 0.65 -0.03 0.00 -1.21 0.00 0.00 43.02 42.47 2prv s PHE 96 CO 0.24 -1.06 -0.21 0.00 -1.34 0.00 0.00 175.22 172.84 2prv s ALA 97 N -3.82 1.85 -0.01 1.99 0.00 -0.30 -0.53 121.76 120.95 2prv s ALA 97 Ca 0.07 -1.22 -0.22 0.00 0.00 0.00 0.00 51.96 50.59 2prv s ALA 97 Cb -0.04 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.75 2prv s ALA 97 CO -0.01 0.39 0.64 0.71 0.00 0.00 0.00 175.76 177.48 2prv s TYR 98 N -1.07 3.66 0.05 0.00 2.02 -0.11 -0.47 117.35 121.44 2prv s TYR 98 Ca 0.07 1.24 0.03 0.00 -0.37 0.00 0.00 57.07 58.04 2prv s TYR 98 Cb -0.10 -2.68 -0.03 0.00 -0.40 0.00 0.00 41.96 38.76 2prv s TYR 98 CO 0.04 0.28 -0.09 0.00 -1.57 0.00 0.00 175.55 174.21 2prv s LEU 100 N -1.71 4.21 -0.95 0.00 1.43 0.25 -0.34 118.68 121.57 2prv s LEU 100 Ca -0.07 1.20 -0.17 0.00 -1.03 0.00 0.00 54.13 54.06 2prv s LEU 100 Cb -0.09 -3.22 0.16 0.00 0.03 0.00 0.00 46.19 43.07 2prv s LEU 100 CO 0.01 -0.34 1.08 -0.62 0.23 0.00 0.00 176.35 176.70 2prv s ASP 101 N 1.09 6.74 0.00 2.29 -1.08 -0.53 -1.52 116.67 123.66 2prv s ASP 101 Ca 0.39 -2.37 0.23 0.00 -0.52 0.00 0.00 52.55 50.27 2prv s ASP 101 Cb -0.17 -2.35 0.98 0.00 -1.46 0.00 0.00 42.92 39.93 2prv s ASP 101 CO 0.14 -0.88 1.73 0.35 0.52 0.00 0.00 175.17 177.03 2prv n THR 102 N 4.92 0.43 0.29 1.71 -2.24 -0.64 -1.70 114.28 117.05 2prv n THR 102 Ca 0.23 0.11 0.17 0.00 -2.27 0.00 0.00 64.05 62.29 2prv n THR 102 Cb 0.47 -0.72 0.89 0.00 -2.10 0.00 0.00 70.33 68.88 2prv n THR 102 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2prv h ASN 103 N 0.00 0.00 -3.42 3.42 2.35 -1.89 -3.47 115.58 112.57 2prv h ASN 103 Ca 0.00 0.00 -0.64 0.00 -0.55 0.00 0.00 56.30 55.11 2prv h ASN 103 Cb 0.37 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 38.51 2prv h ASN 103 CO 0.00 0.04 -0.66 -0.54 -1.65 0.00 0.00 177.43 174.62 2prv s LYS 104 N -4.07 3.62 0.00 0.81 1.02 -0.69 -5.17 119.74 115.26 2prv s LYS 104 Ca -0.03 -0.52 0.00 0.00 0.02 0.00 0.00 55.97 55.44 2prv s LYS 104 Cb 0.12 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.37 2prv s LYS 104 CO 0.51 0.03 0.00 1.17 -0.92 0.00 0.00 175.35 176.15 2prv n LYS 106 N 4.18 0.00 -3.80 1.68 4.81 0.51 -4.09 118.16 121.44 2prv n LYS 106 Ca -0.17 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 56.98 2prv n LYS 106 Cb 0.52 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.59 2prv n LYS 106 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2prv n ASP 107 N 0.00 -4.75 -0.02 3.14 8.00 -1.26 -1.57 116.55 120.09 2prv n ASP 107 Ca 0.00 -0.71 -0.00 0.00 0.71 0.00 0.00 54.79 54.79 2prv n ASP 107 Cb 0.00 -3.81 -0.00 0.00 -0.02 0.00 0.00 41.12 37.29 2prv n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2prv n GLY 108 N -1.61 0.41 3.19 0.44 0.00 -1.26 -4.98 105.19 101.39 2prv n GLY 108 Ca 0.03 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 2prv n GLY 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2prv s GLU 109 N -0.58 0.89 0.06 1.61 0.41 -0.61 -0.62 118.70 119.86 2prv s GLU 109 Ca 0.00 -1.13 -0.00 0.00 -0.41 0.00 0.00 54.97 53.42 2prv s GLU 109 Cb 0.00 -0.70 -0.04 0.00 -1.78 0.00 0.00 34.13 31.61 2prv s GLU 109 CO 0.00 0.13 -0.04 0.00 -0.49 0.00 0.00 175.26 174.86 2prv s PRO 111 N -3.80 2.54 -0.16 0.00 0.04 -1.25 -3.84 135.00 128.53 2prv s PRO 111 Ca 0.07 0.80 -0.07 0.00 0.04 0.00 0.00 61.00 61.85 2prv s PRO 111 Cb 0.07 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 2prv s PRO 111 CO -0.08 -1.34 0.06 0.08 0.04 0.00 0.00 177.00 175.76 2prv s VAL 112 N -3.10 4.81 0.18 -0.36 1.01 -0.54 -1.46 120.40 120.94 2prv s VAL 112 Ca 0.59 -0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.59 2prv s VAL 112 Cb -0.14 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 2prv s VAL 112 CO 0.55 0.49 -0.09 0.68 0.00 0.00 0.00 175.10 176.73 2prv s VAL 113 N 0.08 1.23 -0.17 2.92 -7.23 0.54 -0.48 120.40 117.29 2prv s VAL 113 Ca 0.05 -2.08 -0.11 0.00 -1.81 0.00 0.00 61.98 58.03 2prv s VAL 113 Cb -0.12 -1.99 -0.05 0.00 0.56 0.00 0.00 36.38 34.78 2prv s VAL 113 CO 0.01 -0.63 0.20 -0.70 -0.31 0.00 0.00 175.10 173.67 2prv s GLU 114 N -3.76 4.11 -0.28 4.82 2.12 0.05 -0.52 118.70 125.25 2prv s GLU 114 Ca 0.20 -0.08 0.01 0.00 0.36 0.00 0.00 54.97 55.47 2prv s GLU 114 Cb 0.03 -3.39 0.06 0.00 0.26 0.00 0.00 34.13 31.09 2prv s GLU 114 CO 0.03 0.35 -0.06 -0.46 -0.54 0.00 0.00 175.26 174.59 2prv s TRP 115 N 0.18 3.31 0.14 5.30 -0.11 0.38 -0.93 118.94 127.21 2prv s TRP 115 Ca 0.12 -2.24 -0.30 0.00 1.22 0.00 0.00 56.10 54.91 2prv s TRP 115 Cb -0.12 -2.09 -0.07 0.00 -1.50 0.00 0.00 33.47 29.70 2prv s TRP 115 CO 0.01 -0.86 1.09 0.34 -4.62 0.00 0.00 176.95 172.91 2prv s ASP 116 N 1.15 7.27 0.63 5.86 -1.08 0.26 -1.15 116.67 129.62 2prv s ASP 116 Ca -0.06 2.02 0.37 0.00 -0.52 0.00 0.00 52.55 54.35 2prv s ASP 116 Cb -0.20 -2.60 2.10 0.00 -1.46 0.00 0.00 42.92 40.77 2prv s ASP 116 CO -0.04 -0.24 2.31 0.03 0.52 0.00 0.00 175.17 177.75 2prv h ARG 117 N 5.51 0.00 0.00 4.34 3.08 -1.60 -0.19 114.38 125.53 2prv h ARG 117 Ca -0.44 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.31 2prv h ARG 117 Cb 1.21 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.22 2prv h ARG 117 CO 0.74 0.00 -1.99 0.28 -1.07 0.00 0.00 179.97 177.92 2prv n VAL 118 N -3.50 1.48 0.99 2.04 0.31 -1.26 -4.70 118.33 113.68 2prv n VAL 118 Ca -0.03 -0.20 0.11 0.00 -0.01 0.00 0.00 64.34 64.21 2prv n VAL 118 Cb 0.08 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.00 2prv n VAL 118 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 2prv n ILE 119 N -4.27 0.00 -3.34 2.52 -5.35 -1.20 -5.03 119.36 102.69 2prv n ILE 119 Ca -0.40 -0.28 0.00 0.00 -0.27 0.00 0.00 62.75 61.80 2prv n ILE 119 Cb 0.75 1.28 0.00 0.00 -1.74 0.00 0.00 39.64 39.93 2prv n ILE 119 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2prv n GLY 120 N 1.41 0.45 3.63 3.28 0.00 -0.09 -4.88 105.19 108.98 2prv n GLY 120 Ca 0.10 -1.04 -0.43 0.00 0.00 0.00 0.00 46.02 44.65 2prv n GLY 120 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2prv s TYR 121 N 0.00 2.12 0.00 1.61 6.14 -1.26 -0.57 117.35 125.38 2prv s TYR 121 Ca 0.00 0.57 0.00 0.00 0.64 0.00 0.00 57.07 58.28 2prv s TYR 121 Cb 0.00 -4.00 0.00 0.00 0.42 0.00 0.00 41.96 38.38 2prv s TYR 121 CO 0.00 -2.84 0.00 1.04 0.64 0.00 0.00 175.55 174.39 2prv n GLN 122 N 7.72 0.00 -2.99 4.97 1.13 -0.11 -4.96 117.38 123.15 2prv n GLN 122 Ca 0.19 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.92 2prv n GLN 122 Cb 0.45 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.74 2prv n GLN 122 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2prv s ASP 123 N -0.16 6.83 -0.08 1.08 1.01 -1.26 -4.77 116.67 119.33 2prv s ASP 123 Ca 0.00 1.45 -0.22 0.00 0.71 0.00 0.00 52.55 54.49 2prv s ASP 123 Cb 0.00 -2.44 -0.04 0.00 1.01 0.00 0.00 42.92 41.45 2prv s ASP 123 CO 0.00 -0.28 0.62 -0.89 0.21 0.00 0.00 175.17 174.83 2prv s THR 124 N -2.08 5.08 -0.12 -1.27 2.01 -1.26 -0.77 115.64 117.23 2prv s THR 124 Ca 0.57 1.28 0.04 0.00 0.31 0.00 0.00 61.69 63.89 2prv s THR 124 Cb -0.10 -3.96 -0.06 0.00 0.01 0.00 0.00 72.50 68.39 2prv s THR 124 CO 0.16 0.29 0.15 1.33 -0.69 0.00 0.00 174.62 175.86 2prv n VAL 125 N 3.68 0.00 -3.49 3.82 0.24 0.37 -4.99 118.33 117.96 2prv n VAL 125 Ca -0.03 -0.27 -0.16 0.00 -2.04 0.00 0.00 64.34 61.84 2prv n VAL 125 Cb 0.51 0.74 -0.05 0.00 -1.47 0.00 0.00 33.84 33.58 2prv n VAL 125 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2prv s ALA 126 N -1.79 -1.72 -0.92 2.33 0.00 -1.14 -4.93 121.76 113.58 2prv s ALA 126 Ca 0.00 1.05 0.27 0.00 0.00 0.00 0.00 51.96 53.28 2prv s ALA 126 Cb 0.03 0.28 0.90 0.00 0.00 0.00 0.00 23.12 24.33 2prv s ALA 126 CO 0.18 -0.50 1.72 -0.25 0.00 0.00 0.00 175.76 176.91 2prv n ASP 127 N 0.47 0.33 -3.53 0.00 8.00 -1.26 -1.47 116.55 119.08 2prv n ASP 127 Ca -0.18 0.29 -0.12 0.00 0.71 0.00 0.00 54.79 55.49 2prv n ASP 127 Cb 0.60 -0.30 -0.04 0.00 -0.02 0.00 0.00 41.12 41.36 2prv n ASP 127 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2prv s SER 128 N -3.38 -0.43 0.14 -2.24 1.04 -1.25 -3.89 113.70 103.70 2prv s SER 128 Ca 0.12 -0.06 -0.20 0.00 0.48 0.00 0.00 55.95 56.29 2prv s SER 128 Cb 0.17 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.83 2prv s SER 128 CO 0.60 -0.87 1.67 0.15 0.98 0.00 0.00 173.24 175.78 2prv h PHE 129 N 2.31 -0.29 -0.05 5.02 3.57 -1.91 -1.98 116.94 123.61 2prv h PHE 129 Ca -0.33 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.07 2prv h PHE 129 Cb 1.27 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 40.16 2prv h PHE 129 CO 0.29 -0.18 -0.54 0.97 -2.23 0.00 0.00 178.31 176.63 2prv h ILE 130 N -0.10 1.37 -0.26 1.41 2.10 -1.96 -0.09 117.51 119.99 2prv h ILE 130 Ca 0.12 -1.83 -0.01 0.00 1.08 0.00 0.00 64.86 64.23 2prv h ILE 130 Cb 0.28 1.93 -0.01 0.00 -1.09 0.00 0.00 36.82 37.94 2prv h ILE 130 CO -0.29 0.53 0.14 -0.33 -1.08 0.00 0.00 178.15 177.12 2prv h GLU 131 N 0.11 0.36 -0.08 2.19 5.08 -1.93 0.51 114.58 120.81 2prv h GLU 131 Ca -0.00 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.36 2prv h GLU 131 Cb 0.98 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 30.11 2prv h GLU 131 CO 0.08 0.33 -0.29 0.35 -1.00 0.00 0.00 179.01 178.47 2prv h PHE 132 N 0.30 -0.80 -0.30 4.33 3.57 -0.84 -1.89 116.94 121.31 2prv h PHE 132 Ca 0.09 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2prv h PHE 132 Cb 0.08 0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2prv h PHE 132 CO -0.03 -0.38 0.11 0.35 -2.23 0.00 0.00 178.31 176.13 2prv h PHE 133 N -0.39 0.46 -0.49 0.41 3.57 -0.89 -1.61 116.94 118.00 2prv h PHE 133 Ca 0.08 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 2prv h PHE 133 Cb 0.52 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 2prv h PHE 133 CO -0.36 0.46 0.19 -0.92 -2.23 0.00 0.00 178.31 175.45 2prv h TYR 134 N 0.33 0.75 0.00 0.41 3.20 -0.84 -0.96 116.97 119.86 2prv h TYR 134 Ca 0.10 -0.06 -0.09 0.00 3.14 0.00 0.00 58.73 61.82 2prv h TYR 134 Cb 0.20 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 2prv h TYR 134 CO -0.00 0.64 -0.41 -0.91 -1.64 0.00 0.00 178.16 175.83 2prv h ASN 135 N 0.65 0.00 -0.11 -2.11 -0.26 -1.28 -2.02 115.58 110.44 2prv h ASN 135 Ca 0.16 0.00 -0.16 0.00 -0.56 0.00 0.00 56.30 55.74 2prv h ASN 135 Cb 0.21 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.48 2prv h ASN 135 CO -0.01 0.41 -0.55 0.11 -1.06 0.00 0.00 177.43 176.33 2prv h LYS 136 N 0.00 0.57 -0.21 0.81 1.57 -0.81 -2.69 116.57 115.82 2prv h LYS 136 Ca -0.00 -0.47 -0.12 0.00 -1.87 0.00 0.00 60.65 58.19 2prv h LYS 136 Cb 0.77 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.17 2prv h LYS 136 CO 0.05 1.09 -0.39 -0.84 -0.57 0.00 0.00 179.45 178.79 2prv h ILE 137 N 0.20 1.30 -0.40 1.86 3.07 -1.09 -1.13 117.51 121.32 2prv h ILE 137 Ca -0.04 -1.54 -0.03 0.00 1.55 0.00 0.00 64.86 64.81 2prv h ILE 137 Cb 1.19 1.57 -0.02 0.00 -0.27 0.00 0.00 36.82 39.30 2prv h ILE 137 CO 0.11 0.48 0.15 1.56 -1.05 0.00 0.00 178.15 179.40 2prv h GLN 138 N 0.39 0.60 -0.47 0.16 4.20 -1.42 -0.81 115.11 117.76 2prv h GLN 138 Ca 0.04 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2prv h GLN 138 Cb 0.86 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.52 2prv h GLN 138 CO 0.07 0.58 0.31 0.93 -0.67 0.00 0.00 178.83 180.05 2prv h GLU 139 N 0.50 0.62 -0.39 1.46 5.08 -1.38 -2.05 114.58 118.42 2prv h GLU 139 Ca 0.13 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 2prv h GLU 139 Cb 0.21 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2prv h GLU 139 CO -0.01 0.42 -0.19 0.00 -1.00 0.00 0.00 179.01 178.24 2prv h ALA 140 N 1.17 0.94 -0.73 3.43 0.00 -1.10 -0.21 119.26 122.76 2prv h ALA 140 Ca 0.17 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2prv h ALA 140 Cb -0.06 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2prv h ALA 140 CO -0.04 0.61 0.47 -0.22 0.00 0.00 0.00 179.25 180.08 2prv h LYS 141 N 0.66 0.92 -0.81 0.00 3.64 -0.94 -1.03 116.57 119.00 2prv h LYS 141 Ca 0.10 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2prv h LYS 141 Cb 0.67 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 32.25 2prv h LYS 141 CO 0.05 0.61 0.46 -0.44 -2.27 0.00 0.00 179.45 177.86 2prv h ASP 142 N 0.95 1.00 -0.06 4.20 3.32 -0.60 -0.33 116.42 124.90 2prv h ASP 142 Ca 0.28 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 2prv h ASP 142 Cb -0.06 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.23 2prv h ASP 142 CO -0.08 0.80 -0.06 0.44 -1.72 0.00 0.00 179.24 178.62 2prv h ASP 143 N 1.13 0.27 0.00 6.45 3.32 -0.46 -3.39 116.42 123.73 2prv h ASP 143 Ca 0.29 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.22 2prv h ASP 143 Cb 0.01 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2prv h ASP 143 CO -0.05 0.38 -1.27 0.79 -1.72 0.00 0.00 179.24 177.37 2prv n TRP 144 N -4.31 0.00 -2.51 4.55 7.02 -0.45 -5.03 117.44 116.71 2prv n TRP 144 Ca -0.00 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.10 2prv n TRP 144 Cb 0.23 -0.18 -0.04 0.00 -2.42 0.00 0.00 31.31 28.90 2prv n TRP 144 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2prv s ASP 145 N -4.11 6.90 0.31 -0.99 1.11 -0.17 -4.98 116.67 114.74 2prv s ASP 145 Ca -0.05 2.12 -0.29 0.00 0.18 0.00 0.00 52.55 54.51 2prv s ASP 145 Cb 0.01 -2.60 -0.11 0.00 1.07 0.00 0.00 42.92 41.30 2prv s ASP 145 CO 0.13 -0.40 1.49 -0.70 1.18 0.00 0.00 175.17 176.87 2prv s GLU 146 N -2.16 4.18 0.53 8.23 2.12 -1.26 -4.90 118.70 125.44 2prv s GLU 146 Ca 0.54 2.47 -0.21 0.00 0.36 0.00 0.00 54.97 58.13 2prv s GLU 146 Cb -0.26 -3.03 -0.06 0.00 0.26 0.00 0.00 34.13 31.05 2prv s GLU 146 CO 0.32 -0.50 1.19 -0.51 -0.54 0.00 0.00 175.26 175.22 2prv s ASP 147 N 0.15 5.70 -0.02 -1.70 1.01 -1.26 -4.97 116.67 115.57 2prv s ASP 147 Ca 0.57 2.34 -0.30 0.00 0.71 0.00 0.00 52.55 55.87 2prv s ASP 147 Cb -0.45 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 40.84 2prv s ASP 147 CO 0.52 -1.24 1.18 -1.61 0.21 0.00 0.00 175.17 174.23 2prv s GLU 148 N -3.05 4.39 0.00 8.23 2.02 -1.26 -4.91 118.70 124.11 2prv s GLU 148 Ca 0.71 1.68 0.29 0.00 0.02 0.00 0.00 54.97 57.66 2prv s GLU 148 Cb -0.29 -3.50 1.33 0.00 0.10 0.00 0.00 34.13 31.77 2prv s GLU 148 CO 0.33 -0.37 1.91 -0.25 0.02 0.00 0.00 175.26 176.89 2prv n ASP 149 N 4.81 0.69 -4.59 -0.19 8.00 -1.26 -4.87 116.55 119.14 2prv n ASP 149 Ca 0.10 -0.98 -0.24 0.00 0.71 0.00 0.00 54.79 54.38 2prv n ASP 149 Cb 0.47 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.46 2prv n ASP 149 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 2prv s TRP 150 N -2.21 2.57 0.03 1.24 -2.14 -1.26 -5.15 118.94 112.03 2prv s TRP 150 Ca 0.36 -0.25 0.03 0.00 2.66 0.00 0.00 56.10 58.90 2prv s TRP 150 Cb 0.21 -1.15 -0.04 0.00 -3.10 0.00 0.00 33.47 29.40 2prv s TRP 150 CO 0.41 0.64 -0.04 -0.51 -2.66 0.00 0.00 176.95 174.78 2prv s ASP 151 N -3.53 4.79 0.00 -2.66 1.01 -1.26 -5.24 116.67 109.78 2prv s ASP 151 Ca 0.30 -0.14 0.24 0.00 0.71 0.00 0.00 52.55 53.67 2prv s ASP 151 Cb -0.06 -1.14 0.24 0.00 1.01 0.00 0.00 42.92 42.96 2prv s ASP 151 CO 0.18 0.25 1.29 0.47 0.21 0.00 0.00 175.17 177.57