#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2byr h ALA 4 N 0.00 1.96 0.35 -1.58 0.00 -2.03 -0.07 119.26 117.89 2byr h ALA 4 Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2byr h ALA 4 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2byr h ALA 4 CO 0.00 -0.21 -0.17 -0.91 0.00 0.00 0.00 179.25 177.96 2byr h ASN 5 N 0.58 -0.40 -0.49 0.00 2.35 -1.99 -2.24 115.58 113.38 2byr h ASN 5 Ca 0.44 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 56.10 2byr h ASN 5 Cb 0.85 0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.30 2byr h ASN 5 CO -0.19 -0.21 0.17 0.25 -1.65 0.00 0.00 177.43 175.80 2byr h LEU 6 N -0.57 0.75 -1.17 1.61 5.85 -1.69 -0.26 115.31 119.83 2byr h LEU 6 Ca -0.05 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.59 2byr h LEU 6 Cb 0.42 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 2byr h LEU 6 CO 0.08 0.71 0.57 0.24 -0.34 0.00 0.00 178.44 179.70 2byr h MET 7 N 0.79 1.05 0.02 1.25 2.86 -0.95 -1.91 114.93 118.03 2byr h MET 7 Ca 0.18 -0.06 -0.26 0.00 -2.06 0.00 0.00 59.70 57.50 2byr h MET 7 Cb 0.24 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 2byr h MET 7 CO -0.01 0.69 -1.39 -0.09 1.06 0.00 0.00 176.91 177.18 2byr h ARG 8 N 1.08 0.04 -0.25 1.72 2.43 -0.83 -2.91 114.38 115.67 2byr h ARG 8 Ca 0.35 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.46 2byr h ARG 8 Cb 0.03 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 2byr h ARG 8 CO -0.10 0.81 0.13 1.25 -1.51 0.00 0.00 179.97 180.55 2byr h LEU 9 N 0.01 0.21 -0.90 3.80 5.85 -0.82 0.19 115.31 123.65 2byr h LEU 9 Ca -0.17 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.48 2byr h LEU 9 Cb 1.91 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.89 2byr h LEU 9 CO 0.11 0.16 -0.01 0.11 -0.34 0.00 0.00 178.44 178.47 2byr h LYS 10 N 0.28 0.79 -0.44 1.25 1.57 -1.47 -1.58 116.57 116.97 2byr h LYS 10 Ca 0.10 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 2byr h LYS 10 Cb 0.01 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 2byr h LYS 10 CO -0.06 0.81 0.22 1.03 -0.57 0.00 0.00 179.45 180.88 2byr h SER 11 N 0.74 0.58 0.07 0.86 0.87 -1.26 -1.30 113.55 114.10 2byr h SER 11 Ca 0.14 -0.12 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 2byr h SER 11 Cb 0.47 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2byr h SER 11 CO 0.02 0.54 -0.28 0.44 -0.53 0.00 0.00 176.83 177.02 2byr h ASP 12 N 0.57 0.33 0.01 6.23 5.19 -0.30 -2.23 116.42 126.23 2byr h ASP 12 Ca 0.15 -0.11 -0.00 0.00 -0.62 0.00 0.00 57.03 56.45 2byr h ASP 12 Cb 0.11 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.53 2byr h ASP 12 CO -0.02 0.61 -0.01 -0.07 -3.12 0.00 0.00 179.24 176.63 2byr h LEU 13 N 0.29 -0.02 0.00 1.55 3.38 -1.22 -3.25 115.31 116.04 2byr h LEU 13 Ca 0.04 -0.68 -0.12 0.00 0.09 0.00 0.00 57.88 57.21 2byr h LEU 13 Cb 0.65 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2byr h LEU 13 CO 0.05 0.80 -0.76 -0.26 0.09 0.00 0.00 178.44 178.37 2byr h PHE 14 N -0.97 0.00 0.00 1.13 0.05 -1.31 -3.30 116.94 112.54 2byr h PHE 14 Ca -0.00 0.00 -0.11 0.00 3.82 0.00 0.00 57.97 61.68 2byr h PHE 14 Cb 0.70 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 38.63 2byr h PHE 14 CO 0.19 0.95 -0.61 -0.91 -0.18 0.00 0.00 178.31 177.75 2byr h ASN 15 N -1.00 0.00 0.00 2.17 -0.26 -1.57 -3.37 115.58 111.56 2byr h ASN 15 Ca -0.18 0.00 -0.23 0.00 -0.56 0.00 0.00 56.30 55.33 2byr h ASN 15 Cb 0.96 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 38.18 2byr h ASN 15 CO -0.11 0.51 -2.24 0.54 -1.06 0.00 0.00 177.43 175.07 2byr n ARG 16 N -3.19 0.68 -3.42 0.81 3.00 -0.94 -4.89 116.66 108.72 2byr n ARG 16 Ca 0.01 -0.08 -0.37 0.00 -0.01 0.00 0.00 57.85 57.39 2byr n ARG 16 Cb 0.75 -1.52 -0.06 0.00 0.00 0.00 0.00 32.46 31.62 2byr n ARG 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2byr s SER 17 N -5.12 6.60 0.67 0.55 0.01 -1.23 -5.05 113.70 110.14 2byr s SER 17 Ca -0.09 0.71 -0.17 0.00 1.31 0.00 0.00 55.95 57.71 2byr s SER 17 Cb 0.09 -2.24 -0.05 0.00 0.21 0.00 0.00 66.02 64.03 2byr s SER 17 CO 0.86 0.08 0.57 -2.65 0.41 0.00 0.00 173.24 172.51 2byr n PRO 18 N 3.41 0.41 -1.74 12.44 -0.02 -1.26 -4.76 135.00 143.48 2byr n PRO 18 Ca -0.10 0.18 -0.42 0.00 -2.02 0.00 0.00 63.50 61.14 2byr n PRO 18 Cb 0.52 -1.83 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 2byr n PRO 18 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2byr s MET 19 N -2.59 4.13 -0.02 -0.52 -1.94 -1.26 -4.91 119.30 112.18 2byr s MET 19 Ca 0.67 2.60 -0.32 0.00 -1.71 0.00 0.00 55.69 56.93 2byr s MET 19 Cb -0.38 -3.07 -0.10 0.00 2.01 0.00 0.00 34.83 33.29 2byr s MET 19 CO 0.56 -0.73 1.95 0.98 -0.01 0.00 0.00 175.02 177.76 2byr n TYR 20 N 3.71 2.42 1.20 -0.03 9.36 -1.26 -4.86 117.16 127.71 2byr n TYR 20 Ca 0.15 -0.22 0.04 0.00 3.32 0.00 0.00 57.90 61.19 2byr n TYR 20 Cb 0.36 -2.75 0.11 0.00 -0.63 0.00 0.00 39.34 36.43 2byr n TYR 20 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2byr n PRO 21 N 7.22 1.58 0.00 2.98 -0.04 -1.26 -4.95 135.00 140.54 2byr n PRO 21 Ca 0.21 -0.90 0.00 0.00 -0.04 0.00 0.00 63.50 62.77 2byr n PRO 21 Cb 0.36 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 2byr n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2byr n GLY 22 N 0.90 0.27 3.84 0.55 0.00 -1.26 -5.02 105.19 104.48 2byr n GLY 22 Ca 0.08 -1.90 -0.32 0.00 0.00 0.00 0.00 46.02 43.88 2byr n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2byr s PRO 23 N -1.63 3.82 0.33 1.61 0.04 -1.26 -5.08 135.00 132.83 2byr s PRO 23 Ca 0.00 0.93 0.05 0.00 0.04 0.00 0.00 61.00 62.02 2byr s PRO 23 Cb 0.00 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 2byr s PRO 23 CO 0.00 -0.38 0.01 0.95 0.04 0.00 0.00 177.00 177.62 2byr s THR 24 N -2.73 1.50 0.25 1.26 -4.23 -1.05 -4.96 115.64 105.69 2byr s THR 24 Ca 0.58 -2.04 -0.04 0.00 -1.18 0.00 0.00 61.69 59.02 2byr s THR 24 Cb -0.11 -2.73 0.22 0.00 1.34 0.00 0.00 72.50 71.23 2byr s THR 24 CO 0.36 -0.09 1.80 0.11 -0.54 0.00 0.00 174.62 176.26 2byr h LYS 25 N 2.10 0.75 -0.01 3.99 1.57 -1.92 -1.60 116.57 121.45 2byr h LYS 25 Ca -0.41 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2byr h LYS 25 Cb 1.24 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2byr h LYS 25 CO 0.71 0.50 -0.07 -0.25 -0.57 0.00 0.00 179.45 179.77 2byr n ASP 26 N -4.75 0.84 -3.04 0.86 8.00 -1.26 -4.16 116.55 113.03 2byr n ASP 26 Ca 0.14 -1.04 -0.19 0.00 0.71 0.00 0.00 54.79 54.42 2byr n ASP 26 Cb 0.30 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.37 2byr n ASP 26 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2byr n ASP 27 N -0.50 -0.91 -4.61 -2.24 2.03 -0.68 -5.15 116.55 104.49 2byr n ASP 27 Ca 0.18 -2.89 -0.29 0.00 0.52 0.00 0.00 54.79 52.30 2byr n ASP 27 Cb 0.29 0.21 0.14 0.00 -0.72 0.00 0.00 41.12 41.04 2byr n ASP 27 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 2byr s PRO 28 N -0.50 1.04 -0.02 -0.67 0.02 -0.77 -2.52 135.00 131.58 2byr s PRO 28 Ca 0.34 0.08 0.03 0.00 0.02 0.00 0.00 61.00 61.47 2byr s PRO 28 Cb 0.19 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.86 2byr s PRO 28 CO -0.16 -2.23 -0.09 -1.17 -0.33 0.00 0.00 177.00 173.03 2byr s LEU 29 N -5.98 1.85 -0.25 -5.54 2.96 0.37 -4.91 118.68 107.18 2byr s LEU 29 Ca 0.66 -0.18 -0.08 0.00 -0.22 0.00 0.00 54.13 54.31 2byr s LEU 29 Cb -0.11 -0.53 -0.03 0.00 0.50 0.00 0.00 46.19 46.02 2byr s LEU 29 CO 0.52 0.08 0.08 -0.89 -1.32 0.00 0.00 176.35 174.82 2byr s THR 30 N 0.08 4.36 -0.17 3.68 2.01 -1.26 -0.42 115.64 123.93 2byr s THR 30 Ca -0.01 -0.17 -0.08 0.00 0.31 0.00 0.00 61.69 61.74 2byr s THR 30 Cb -0.07 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 2byr s THR 30 CO 0.00 0.33 0.11 -0.69 -0.69 0.00 0.00 174.62 173.68 2byr s VAL 31 N 1.62 5.23 -0.29 3.82 1.01 0.36 -4.41 120.40 127.74 2byr s VAL 31 Ca 0.06 0.12 -0.10 0.00 0.00 0.00 0.00 61.98 62.06 2byr s VAL 31 Cb -0.15 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 2byr s VAL 31 CO 0.04 0.49 0.16 -0.89 0.00 0.00 0.00 175.10 174.90 2byr s THR 32 N 0.01 4.89 -0.02 3.92 2.01 0.14 -1.43 115.64 125.15 2byr s THR 32 Ca 0.08 -0.12 -0.01 0.00 0.31 0.00 0.00 61.69 61.96 2byr s THR 32 Cb -0.12 -3.39 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 2byr s THR 32 CO -0.00 0.19 0.09 -0.76 -0.69 0.00 0.00 174.62 173.45 2byr s LEU 33 N 1.68 3.96 -0.16 4.42 1.02 -0.57 -1.47 118.68 127.55 2byr s LEU 33 Ca 0.06 0.20 -0.13 0.00 0.02 0.00 0.00 54.13 54.28 2byr s LEU 33 Cb -0.16 -2.25 0.05 0.00 0.02 0.00 0.00 46.19 43.85 2byr s LEU 33 CO 0.08 0.29 0.42 -0.83 0.02 0.00 0.00 176.35 176.34 2byr s GLY 34 N -1.61 -0.33 -0.11 -3.19 0.00 -0.78 -4.35 107.32 96.95 2byr s GLY 34 Ca 0.22 1.32 -0.01 0.00 0.00 0.00 0.00 44.72 46.25 2byr s GLY 34 CO 0.12 1.27 -0.05 -1.36 0.00 0.00 0.00 173.10 173.08 2byr s PHE 35 N 0.63 2.99 -0.28 1.90 0.08 -1.26 0.08 117.98 122.12 2byr s PHE 35 Ca -0.03 -0.10 0.01 0.00 0.12 0.00 0.00 56.93 56.92 2byr s PHE 35 Cb -0.05 -1.82 0.06 0.00 -0.57 0.00 0.00 43.02 40.64 2byr s PHE 35 CO -0.04 0.19 -0.06 0.99 -0.10 0.00 0.00 175.22 176.20 2byr s THR 36 N -0.34 2.52 -0.23 0.64 2.01 -0.35 -1.84 115.64 118.04 2byr s THR 36 Ca 0.05 -1.55 -0.22 0.00 0.31 0.00 0.00 61.69 60.29 2byr s THR 36 Cb -0.12 -2.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.90 2byr s THR 36 CO 0.02 -0.07 0.69 -0.22 -0.69 0.00 0.00 174.62 174.35 2byr s LEU 37 N 1.16 4.09 -0.25 4.42 2.96 -0.72 -1.29 118.68 129.05 2byr s LEU 37 Ca -0.07 0.85 -0.09 0.00 -0.22 0.00 0.00 54.13 54.60 2byr s LEU 37 Cb -0.20 -2.97 -0.16 0.00 0.50 0.00 0.00 46.19 43.36 2byr s LEU 37 CO -0.03 -0.38 -0.17 0.00 -1.32 0.00 0.00 176.35 174.44 2byr n GLN 38 N 5.60 0.63 -3.62 1.98 1.13 -0.64 -3.46 117.38 119.00 2byr n GLN 38 Ca 0.01 0.26 -0.12 0.00 -1.94 0.00 0.00 57.00 55.22 2byr n GLN 38 Cb 0.49 -1.56 -0.07 0.00 0.11 0.00 0.00 30.24 29.22 2byr n GLN 38 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2byr s ASP 39 N -7.03 -0.54 -0.43 1.08 2.15 -1.06 0.47 116.67 111.31 2byr s ASP 39 Ca -0.35 0.95 -0.17 0.00 0.43 0.00 0.00 52.55 53.41 2byr s ASP 39 Cb 0.11 0.93 0.03 0.00 -0.30 0.00 0.00 42.92 43.68 2byr s ASP 39 CO 0.57 -0.25 0.44 -0.63 -0.17 0.00 0.00 175.17 175.13 2byr s ILE 40 N -0.06 5.09 0.01 4.11 1.01 -1.26 -1.11 121.20 128.99 2byr s ILE 40 Ca 0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 2byr s ILE 40 Cb -0.04 -4.06 -0.27 0.00 0.01 0.00 0.00 42.46 38.10 2byr s ILE 40 CO -0.02 -0.46 0.87 0.58 0.00 0.00 0.00 174.94 175.91 2byr h VAL 41 N 5.74 1.16 -2.57 2.92 2.07 -1.60 -3.42 116.25 120.55 2byr h VAL 41 Ca -0.27 -2.82 -0.10 0.00 0.82 0.00 0.00 66.70 64.34 2byr h VAL 41 Cb 1.11 2.74 -0.22 0.00 -1.52 0.00 0.00 31.29 33.41 2byr h VAL 41 CO 0.81 0.81 -0.11 -0.75 0.02 0.00 0.00 177.57 178.35 2byr s LYS 42 N -2.62 0.70 -0.31 1.57 2.20 -1.23 -4.97 119.74 115.07 2byr s LYS 42 Ca -0.08 0.37 -0.02 0.00 -0.36 0.00 0.00 55.97 55.87 2byr s LYS 42 Cb 0.07 0.33 0.11 0.00 -1.51 0.00 0.00 37.83 36.83 2byr s LYS 42 CO 0.85 -0.15 0.13 0.00 -0.36 0.00 0.00 175.35 175.82 2byr s ALA 43 N -0.44 0.99 -0.38 3.13 0.00 -1.26 -1.29 121.76 122.50 2byr s ALA 43 Ca -0.06 -1.41 -0.20 0.00 0.00 0.00 0.00 51.96 50.29 2byr s ALA 43 Cb -0.03 -1.50 0.01 0.00 0.00 0.00 0.00 23.12 21.59 2byr s ALA 43 CO 0.03 -1.73 0.63 0.34 0.00 0.00 0.00 175.76 175.04 2byr s ASP 44 N 1.77 6.39 0.42 0.00 -1.08 0.11 -4.93 116.67 119.33 2byr s ASP 44 Ca 0.11 -0.01 0.25 0.00 -0.52 0.00 0.00 52.55 52.37 2byr s ASP 44 Cb -0.18 -2.32 0.52 0.00 -1.46 0.00 0.00 42.92 39.49 2byr s ASP 44 CO -0.28 -0.65 1.67 0.77 0.52 0.00 0.00 175.17 177.21 2byr h SER 45 N 8.59 0.00 0.89 -0.34 4.64 -1.94 0.14 113.55 125.53 2byr h SER 45 Ca -0.26 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.86 2byr h SER 45 Cb 1.11 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.17 2byr h SER 45 CO 0.85 0.00 -0.92 0.77 -0.87 0.00 0.00 176.83 176.66 2byr h SER 46 N 0.00 0.02 0.00 4.97 4.64 -1.97 -3.36 113.55 117.85 2byr h SER 46 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2byr h SER 46 Cb 0.90 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 2byr h SER 46 CO 0.00 0.93 -1.13 0.35 -0.87 0.00 0.00 176.83 176.10 2byr n THR 47 N -3.47 0.00 -3.40 2.95 -2.24 -1.22 -5.03 114.28 101.88 2byr n THR 47 Ca -0.01 -0.25 -0.18 0.00 -2.27 0.00 0.00 64.05 61.34 2byr n THR 47 Cb 0.87 0.54 0.07 0.00 -2.10 0.00 0.00 70.33 69.71 2byr n THR 47 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2byr n ASN 48 N -1.65 -4.62 -4.20 3.42 3.02 0.46 -4.94 115.26 106.75 2byr n ASN 48 Ca -0.00 -0.73 -0.27 0.00 -0.03 0.00 0.00 54.58 53.55 2byr n ASN 48 Cb 0.25 -4.87 -0.16 0.00 -0.61 0.00 0.00 39.78 34.40 2byr n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2byr s GLU 49 N -5.00 1.68 -0.04 3.52 2.02 -1.11 -1.87 118.70 117.90 2byr s GLU 49 Ca 0.28 -0.72 0.05 0.00 0.02 0.00 0.00 54.97 54.61 2byr s GLU 49 Cb -0.05 -1.60 -0.01 0.00 0.10 0.00 0.00 34.13 32.58 2byr s GLU 49 CO 0.76 0.41 -0.18 0.08 0.02 0.00 0.00 175.26 176.35 2byr s VAL 50 N -0.41 1.52 -0.23 2.63 1.01 -0.58 -0.72 120.40 123.63 2byr s VAL 50 Ca 0.06 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 2byr s VAL 50 Cb -0.08 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2byr s VAL 50 CO -0.00 0.43 0.08 -1.81 0.00 0.00 0.00 175.10 173.80 2byr s ASP 51 N -0.07 5.41 -0.04 3.32 1.11 -0.41 -1.73 116.67 124.26 2byr s ASP 51 Ca -0.02 -0.08 0.05 0.00 0.18 0.00 0.00 52.55 52.68 2byr s ASP 51 Cb -0.11 -1.96 -0.02 0.00 1.07 0.00 0.00 42.92 41.90 2byr s ASP 51 CO 0.02 0.04 -0.20 -0.76 1.18 0.00 0.00 175.17 175.45 2byr s LEU 52 N 1.19 2.40 -0.14 1.23 1.43 -0.06 -1.38 118.68 123.35 2byr s LEU 52 Ca 0.05 -0.34 -0.04 0.00 -1.03 0.00 0.00 54.13 52.77 2byr s LEU 52 Cb -0.14 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 2byr s LEU 52 CO 0.04 0.32 -0.02 -0.69 0.23 0.00 0.00 176.35 176.22 2byr s VAL 53 N -0.58 4.04 0.15 -1.59 1.01 -0.26 -0.86 120.40 122.30 2byr s VAL 53 Ca 0.09 -0.31 -0.22 0.00 0.00 0.00 0.00 61.98 61.53 2byr s VAL 53 Cb -0.11 -2.76 0.06 0.00 0.00 0.00 0.00 36.38 33.58 2byr s VAL 53 CO 0.00 0.51 0.56 -0.72 0.00 0.00 0.00 175.10 175.46 2byr s TYR 54 N 0.11 -0.47 -0.18 5.22 -0.85 -0.83 -1.62 117.35 118.73 2byr s TYR 54 Ca 0.00 0.24 -0.10 0.00 -0.52 0.00 0.00 57.07 56.69 2byr s TYR 54 Cb -0.13 0.50 -0.05 0.00 0.38 0.00 0.00 41.96 42.66 2byr s TYR 54 CO 0.02 -0.82 0.15 0.71 -1.52 0.00 0.00 175.55 174.09 2byr s TYR 55 N -3.76 3.44 -0.32 -3.49 4.12 -0.42 -1.21 117.35 115.71 2byr s TYR 55 Ca 0.01 0.39 -0.04 0.00 0.02 0.00 0.00 57.07 57.45 2byr s TYR 55 Cb -0.00 -2.15 0.04 0.00 -1.52 0.00 0.00 41.96 38.33 2byr s TYR 55 CO -0.13 0.34 0.06 -2.00 0.02 0.00 0.00 175.55 173.85 2byr s GLU 56 N 0.19 2.56 -0.18 -0.62 2.12 -0.97 -1.21 118.70 120.59 2byr s GLU 56 Ca 0.10 -1.20 -0.22 0.00 0.36 0.00 0.00 54.97 54.01 2byr s GLU 56 Cb -0.11 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 2byr s GLU 56 CO -0.01 -0.64 0.67 -1.14 -0.54 0.00 0.00 175.26 173.60 2byr s GLN 57 N 1.34 4.25 -0.11 4.30 0.74 0.11 -3.30 119.66 127.00 2byr s GLN 57 Ca -0.03 0.70 0.03 0.00 0.05 0.00 0.00 55.36 56.11 2byr s GLN 57 Cb -0.20 -3.56 0.01 0.00 1.10 0.00 0.00 33.01 30.36 2byr s GLN 57 CO 0.01 -0.22 -0.21 -0.65 -0.55 0.00 0.00 175.29 173.67 2byr s GLN 58 N 1.83 2.77 -0.03 1.67 -0.21 0.64 -1.87 119.66 124.47 2byr s GLN 58 Ca 0.31 -0.78 0.01 0.00 0.02 0.00 0.00 55.36 54.93 2byr s GLN 58 Cb -0.16 -2.17 0.01 0.00 1.00 0.00 0.00 33.01 31.69 2byr s GLN 58 CO 0.11 0.08 -0.05 0.50 -2.12 0.00 0.00 175.29 173.82 2byr s ARG 59 N 0.57 0.67 0.25 2.91 3.00 -0.54 -0.70 118.95 125.11 2byr s ARG 59 Ca -0.14 -0.15 -0.12 0.00 -1.00 0.00 0.00 55.73 54.32 2byr s ARG 59 Cb -0.17 -0.67 -0.00 0.00 0.00 0.00 0.00 34.95 34.11 2byr s ARG 59 CO 0.04 0.01 0.48 1.67 0.00 0.00 0.00 175.30 177.50 2byr s TRP 60 N 0.45 0.38 -0.05 5.12 -2.14 -1.05 0.27 118.94 121.93 2byr s TRP 60 Ca -0.06 -0.74 0.00 0.00 2.66 0.00 0.00 56.10 57.96 2byr s TRP 60 Cb -0.09 0.18 0.02 0.00 -3.10 0.00 0.00 33.47 30.48 2byr s TRP 60 CO -0.00 -1.00 -0.03 0.21 -2.66 0.00 0.00 176.95 173.48 2byr s LYS 61 N -3.99 0.68 -0.08 3.25 2.20 -1.26 -0.39 119.74 120.15 2byr s LYS 61 Ca 0.23 -0.03 0.04 0.00 -0.36 0.00 0.00 55.97 55.85 2byr s LYS 61 Cb -0.01 -0.79 0.00 0.00 -1.51 0.00 0.00 37.83 35.53 2byr s LYS 61 CO 0.09 -0.13 -0.21 -0.51 -0.36 0.00 0.00 175.35 174.24 2byr s LEU 62 N 1.12 1.96 0.31 5.43 1.43 -0.41 -4.91 118.68 123.61 2byr s LEU 62 Ca -0.08 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 2byr s LEU 62 Cb -0.14 -1.22 0.52 0.00 0.03 0.00 0.00 46.19 45.39 2byr s LEU 62 CO -0.01 0.14 1.93 0.78 0.23 0.00 0.00 176.35 179.42 2byr h ASN 63 N 6.64 0.90 0.35 2.29 2.35 -1.91 -2.48 115.58 123.72 2byr h ASN 63 Ca -0.25 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2byr h ASN 63 Cb 1.21 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 39.38 2byr h ASN 63 CO 0.47 0.60 -0.02 0.77 -1.65 0.00 0.00 177.43 177.60 2byr h SER 64 N 1.03 0.00 -0.64 5.81 4.64 -1.95 -2.47 113.55 119.98 2byr h SER 64 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2byr h SER 64 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2byr h SER 64 CO -0.12 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.04 2byr n LEU 65 N -3.19 4.74 -4.83 5.97 4.77 -0.94 -4.97 117.00 118.56 2byr n LEU 65 Ca -0.02 -2.45 -0.33 0.00 -0.03 0.00 0.00 56.01 53.17 2byr n LEU 65 Cb 0.16 -0.57 -0.07 0.00 -2.33 0.00 0.00 43.42 40.61 2byr n LEU 65 CO 0.24 0.81 0.54 -0.04 -1.33 0.00 0.00 177.39 177.61 2byr s MET 66 N -1.86 4.18 0.14 3.23 -1.94 -0.93 -3.81 119.30 118.31 2byr s MET 66 Ca 0.51 0.95 -0.20 0.00 -1.71 0.00 0.00 55.69 55.23 2byr s MET 66 Cb 0.33 -2.39 0.05 0.00 2.01 0.00 0.00 34.83 34.84 2byr s MET 66 CO 0.24 0.10 0.51 1.67 -0.01 0.00 0.00 175.02 177.54 2byr s TRP 67 N -2.00 -0.39 -0.32 -0.03 -2.14 -0.85 -4.97 118.94 108.23 2byr s TRP 67 Ca 0.56 0.16 -0.20 0.00 2.66 0.00 0.00 56.10 59.28 2byr s TRP 67 Cb -0.11 0.42 -0.01 0.00 -3.10 0.00 0.00 33.47 30.67 2byr s TRP 67 CO 0.16 -0.78 0.60 0.34 -2.66 0.00 0.00 176.95 174.62 2byr s ASP 68 N -2.72 6.44 0.43 -2.66 2.15 -1.26 -4.69 116.67 114.35 2byr s ASP 68 Ca 0.01 0.30 0.15 0.00 0.43 0.00 0.00 52.55 53.44 2byr s ASP 68 Cb 0.00 -2.31 1.04 0.00 -0.30 0.00 0.00 42.92 41.35 2byr s ASP 68 CO -0.12 -0.48 1.95 -0.65 -0.17 0.00 0.00 175.17 175.69 2byr h PRO 69 N 8.28 0.41 -1.00 4.34 0.11 -1.92 -2.99 132.00 139.22 2byr h PRO 69 Ca -0.27 -0.02 0.20 0.00 0.11 0.00 0.00 66.00 66.02 2byr h PRO 69 Cb 1.12 -0.09 -0.11 0.00 0.11 0.00 0.00 31.00 32.03 2byr h PRO 69 CO 0.79 0.27 0.60 -0.91 -0.21 0.00 0.00 178.00 178.54 2byr h ASN 70 N 0.42 0.75 -0.49 -2.05 4.21 -1.93 0.16 115.58 116.65 2byr h ASN 70 Ca 0.33 0.11 0.00 0.00 1.21 0.00 0.00 56.30 57.94 2byr h ASN 70 Cb 0.70 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.88 2byr h ASN 70 CO -0.10 0.23 0.00 -1.84 -1.29 0.00 0.00 177.43 174.43 2byr n GLU 71 N -4.80 3.62 -2.84 0.81 0.28 -1.13 -4.26 120.64 112.31 2byr n GLU 71 Ca 0.24 -2.38 -0.12 0.00 -0.16 0.00 0.00 57.16 54.74 2byr n GLU 71 Cb 0.61 -1.93 0.02 0.00 1.43 0.00 0.00 31.44 31.57 2byr n GLU 71 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2byr n TYR 72 N 0.69 0.19 -1.87 -1.84 4.01 0.33 -4.98 117.16 113.68 2byr n TYR 72 Ca 0.21 -2.99 -0.18 0.00 -0.16 0.00 0.00 57.90 54.78 2byr n TYR 72 Cb 0.86 -0.05 -0.05 0.00 -0.31 0.00 0.00 39.34 39.79 2byr n TYR 72 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2byr n GLY 73 N 0.02 0.86 3.49 2.72 0.00 -1.20 -1.65 105.19 109.42 2byr n GLY 73 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2byr n GLY 73 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2byr n ASN 74 N -1.40 -5.37 -4.69 1.61 5.03 0.17 -4.98 115.26 105.64 2byr n ASN 74 Ca -0.19 -0.51 -0.42 0.00 0.87 0.00 0.00 54.58 54.32 2byr n ASN 74 Cb 0.62 -4.30 -0.03 0.00 -1.02 0.00 0.00 39.78 35.05 2byr n ASN 74 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2byr s ILE 75 N -3.20 4.49 -0.05 2.41 1.01 -0.66 -4.93 121.20 120.27 2byr s ILE 75 Ca 0.50 1.79 0.17 0.00 0.00 0.00 0.00 60.65 63.11 2byr s ILE 75 Cb -0.24 -4.15 -0.26 0.00 0.01 0.00 0.00 42.46 37.82 2byr s ILE 75 CO 0.62 0.04 0.33 0.35 0.00 0.00 0.00 174.94 176.28 2byr n THR 76 N 4.39 0.19 -4.19 2.92 -2.24 -1.26 -4.45 114.28 109.65 2byr n THR 76 Ca 0.09 -0.45 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 2byr n THR 76 Cb 0.48 -0.01 -0.10 0.00 -2.10 0.00 0.00 70.33 68.59 2byr n THR 76 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2byr s ASP 77 N -4.19 1.45 -0.12 3.42 1.01 -1.26 -1.01 116.67 115.97 2byr s ASP 77 Ca -0.07 -0.89 -0.25 0.00 0.71 0.00 0.00 52.55 52.05 2byr s ASP 77 Cb 0.10 0.02 0.06 0.00 1.01 0.00 0.00 42.92 44.11 2byr s ASP 77 CO 0.72 -0.32 0.61 0.72 0.21 0.00 0.00 175.17 177.12 2byr s PHE 78 N -2.87 -0.61 0.06 4.23 -0.12 -0.48 -5.01 117.98 113.19 2byr s PHE 78 Ca 0.09 1.25 -0.23 0.00 -0.05 0.00 0.00 56.93 57.99 2byr s PHE 78 Cb -0.00 0.30 -0.06 0.00 -0.63 0.00 0.00 43.02 42.63 2byr s PHE 78 CO -0.01 -0.47 0.69 1.03 -0.05 0.00 0.00 175.22 176.41 2byr s ARG 79 N -0.60 4.41 0.03 1.99 3.00 -1.26 -1.45 118.95 125.07 2byr s ARG 79 Ca -0.07 0.94 -0.11 0.00 0.00 0.00 0.00 55.73 56.49 2byr s ARG 79 Cb -0.02 -3.32 0.01 0.00 0.00 0.00 0.00 34.95 31.62 2byr s ARG 79 CO 0.06 0.43 0.22 -0.08 0.00 0.00 0.00 175.30 175.93 2byr s THR 80 N -0.49 0.10 0.26 0.02 -1.32 -0.50 -5.00 115.64 108.70 2byr s THR 80 Ca 0.34 -0.81 -0.30 0.00 -1.21 0.00 0.00 61.69 59.71 2byr s THR 80 Cb -0.20 -0.87 -0.11 0.00 -1.51 0.00 0.00 72.50 69.81 2byr s THR 80 CO 0.21 -0.44 1.53 -0.55 -2.21 0.00 0.00 174.62 173.16 2byr s SER 81 N -1.99 6.52 0.61 8.08 0.15 -1.26 -0.68 113.70 125.13 2byr s SER 81 Ca -0.06 2.79 0.39 0.00 0.70 0.00 0.00 55.95 59.77 2byr s SER 81 Cb -0.02 -2.62 2.14 0.00 -1.71 0.00 0.00 66.02 63.80 2byr s SER 81 CO -0.03 -0.81 2.20 0.00 1.20 0.00 0.00 173.24 175.80 2byr h ALA 82 N 5.21 1.04 0.00 5.45 0.00 -1.23 0.35 119.26 130.07 2byr h ALA 82 Ca -0.46 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.34 2byr h ALA 82 Cb 1.22 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2byr h ALA 82 CO 0.80 -0.04 -0.53 0.00 0.00 0.00 0.00 179.25 179.49 2byr h ALA 83 N 1.91 0.90 0.00 0.00 0.00 -1.90 -3.31 119.26 116.86 2byr h ALA 83 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2byr h ALA 83 Cb 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2byr h ALA 83 CO 0.00 0.66 0.00 -0.44 0.00 0.00 0.00 179.25 179.47 2byr h ASP 84 N 0.00 0.00 -2.61 0.00 3.32 -1.29 -3.45 116.42 112.39 2byr h ASP 84 Ca -0.01 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.51 2byr h ASP 84 Cb 1.09 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.50 2byr h ASP 84 CO 0.07 0.00 -0.68 0.27 -1.72 0.00 0.00 179.24 177.18 2byr s ILE 85 N -3.38 1.84 0.38 0.35 -4.36 -1.25 -5.00 121.20 109.79 2byr s ILE 85 Ca 0.05 -2.15 -0.26 0.00 -0.26 0.00 0.00 60.65 58.03 2byr s ILE 85 Cb 0.09 -2.51 -0.09 0.00 1.25 0.00 0.00 42.46 41.20 2byr s ILE 85 CO 0.54 -0.27 1.16 0.86 0.24 0.00 0.00 174.94 177.47 2byr s TRP 86 N -2.88 3.14 0.05 1.37 -0.00 -1.26 -4.96 118.94 114.39 2byr s TRP 86 Ca 0.30 1.57 0.03 0.00 -0.00 0.00 0.00 56.10 58.00 2byr s TRP 86 Cb 0.03 -3.37 -0.02 0.00 -0.00 0.00 0.00 33.47 30.11 2byr s TRP 86 CO 0.13 -1.20 -0.09 0.95 -0.00 0.00 0.00 176.95 176.75 2byr s THR 87 N -1.40 0.63 0.54 5.86 -4.23 -1.26 -5.11 115.64 110.66 2byr s THR 87 Ca 0.55 -1.10 -0.18 0.00 -1.18 0.00 0.00 61.69 59.79 2byr s THR 87 Cb -0.30 -0.67 -0.06 0.00 1.34 0.00 0.00 72.50 72.80 2byr s THR 87 CO 0.38 -0.35 1.05 -2.16 -0.54 0.00 0.00 174.62 173.01 2byr s PRO 88 N -1.57 3.56 -0.57 3.99 0.04 -1.26 -4.95 135.00 134.24 2byr s PRO 88 Ca -0.08 1.32 -0.04 0.00 0.04 0.00 0.00 61.00 62.23 2byr s PRO 88 Cb -0.10 -2.06 0.09 0.00 0.04 0.00 0.00 34.50 32.47 2byr s PRO 88 CO 0.01 -0.63 2.67 -0.40 0.04 0.00 0.00 177.00 178.69 2byr n ASP 89 N -1.44 6.70 -4.72 6.66 5.75 -1.26 -4.97 116.55 123.28 2byr n ASP 89 Ca 0.09 -3.26 -0.42 0.00 -0.01 0.00 0.00 54.79 51.19 2byr n ASP 89 Cb 0.52 -1.23 -0.03 0.00 -1.03 0.00 0.00 41.12 39.36 2byr n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2byr s ILE 90 N -2.42 3.47 0.01 2.12 -1.09 -1.26 -2.87 121.20 119.16 2byr s ILE 90 Ca 0.58 1.09 0.01 0.00 -2.23 0.00 0.00 60.65 60.09 2byr s ILE 90 Cb 0.37 -3.70 -0.01 0.00 -1.58 0.00 0.00 42.46 37.54 2byr s ILE 90 CO -0.23 0.10 -0.03 -0.89 -1.23 0.00 0.00 174.94 172.66 2byr s THR 91 N 0.84 0.24 -0.08 2.92 2.01 0.18 -4.91 115.64 116.84 2byr s THR 91 Ca 0.61 -0.38 -0.30 0.00 0.31 0.00 0.00 61.69 61.93 2byr s THR 91 Cb -0.35 -0.26 -0.03 0.00 0.01 0.00 0.00 72.50 71.87 2byr s THR 91 CO 0.32 -0.10 1.32 0.00 -0.69 0.00 0.00 174.62 175.47 2byr s ALA 92 N -0.48 3.58 -0.31 7.40 0.00 -1.26 -1.78 121.76 128.91 2byr s ALA 92 Ca -0.03 0.66 0.27 0.00 0.00 0.00 0.00 51.96 52.86 2byr s ALA 92 Cb -0.04 -3.59 0.83 0.00 0.00 0.00 0.00 23.12 20.32 2byr s ALA 92 CO -0.00 -1.00 1.77 1.88 0.00 0.00 0.00 175.76 178.41 2byr h TYR 93 N 8.00 0.00 0.00 0.00 0.99 -0.99 -3.28 116.97 121.68 2byr h TYR 93 Ca -0.33 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.40 2byr h TYR 93 Cb 1.15 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.87 2byr h TYR 93 CO 0.77 0.00 -0.22 -1.13 -0.00 0.00 0.00 178.16 177.59 2byr n SER 94 N -2.86 2.03 -4.76 3.88 3.41 -1.26 -5.02 113.62 109.04 2byr n SER 94 Ca 0.03 -3.36 -0.36 0.00 -0.26 0.00 0.00 58.87 54.92 2byr n SER 94 Cb 0.41 -0.46 0.02 0.00 -0.26 0.00 0.00 64.21 63.92 2byr n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2byr s SER 95 N -2.96 5.40 -0.00 4.04 1.04 -1.24 -1.68 113.70 118.30 2byr s SER 95 Ca 0.34 2.39 0.06 0.00 0.48 0.00 0.00 55.95 59.22 2byr s SER 95 Cb 0.31 -2.60 -0.07 0.00 0.10 0.00 0.00 66.02 63.75 2byr s SER 95 CO -0.01 -1.45 0.26 0.35 0.98 0.00 0.00 173.24 173.37 2byr n THR 96 N -1.34 0.00 -4.08 2.02 -2.24 0.22 -4.85 114.28 104.01 2byr n THR 96 Ca 0.12 -0.32 -0.07 0.00 -2.27 0.00 0.00 64.05 61.51 2byr n THR 96 Cb 0.49 0.92 -0.10 0.00 -2.10 0.00 0.00 70.33 69.54 2byr n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2byr s ARG 97 N -1.72 0.62 0.31 -0.78 0.52 -1.25 -5.05 118.95 111.60 2byr s ARG 97 Ca 0.02 -1.20 -0.29 0.00 -0.52 0.00 0.00 55.73 53.74 2byr s ARG 97 Cb 0.05 0.22 -0.11 0.00 0.52 0.00 0.00 34.95 35.63 2byr s ARG 97 CO 0.27 -0.12 1.47 -2.14 0.02 0.00 0.00 175.30 174.81 2byr s PRO 98 N -3.89 4.20 0.30 3.54 0.02 -1.26 -4.66 135.00 133.23 2byr s PRO 98 Ca 0.07 2.44 -0.30 0.00 0.02 0.00 0.00 61.00 63.23 2byr s PRO 98 Cb 0.08 -3.04 -0.13 0.00 0.02 0.00 0.00 34.50 31.43 2byr s PRO 98 CO -0.10 -0.47 1.39 0.28 -0.33 0.00 0.00 177.00 177.77 2byr n VAL 99 N 1.49 1.43 -4.09 3.83 0.31 -1.26 -4.87 118.33 115.17 2byr n VAL 99 Ca 0.04 -0.36 -0.34 0.00 -0.01 0.00 0.00 64.34 63.67 2byr n VAL 99 Cb 0.39 -1.61 -0.10 0.00 -0.91 0.00 0.00 33.84 31.61 2byr n VAL 99 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2byr s GLN 100 N -1.09 3.82 -0.05 5.55 -0.21 -0.79 -4.97 119.66 121.92 2byr s GLN 100 Ca 0.62 -0.36 -0.19 0.00 0.02 0.00 0.00 55.36 55.44 2byr s GLN 100 Cb -0.58 -3.13 -0.05 0.00 1.00 0.00 0.00 33.01 30.25 2byr s GLN 100 CO 0.55 0.33 0.54 0.08 -2.12 0.00 0.00 175.29 174.67 2byr s VAL 101 N 0.19 5.04 -0.07 1.09 1.01 -1.26 -0.80 120.40 125.60 2byr s VAL 101 Ca 0.03 1.10 0.12 0.00 0.00 0.00 0.00 61.98 63.23 2byr s VAL 101 Cb -0.12 -3.87 -0.17 0.00 0.00 0.00 0.00 36.38 32.21 2byr s VAL 101 CO 0.01 0.38 0.28 0.18 0.00 0.00 0.00 175.10 175.95 2byr n LEU 102 N 3.09 0.06 -4.58 3.92 4.77 0.23 -4.96 117.00 119.53 2byr n LEU 102 Ca -0.07 -0.05 -0.25 0.00 -0.03 0.00 0.00 56.01 55.61 2byr n LEU 102 Cb 0.51 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 2byr n LEU 102 CO 0.43 0.01 -0.39 -0.94 -1.33 0.00 0.00 177.39 175.18 2byr s SER 103 N -3.19 4.26 0.60 -1.43 1.04 -1.24 -4.95 113.70 108.80 2byr s SER 103 Ca -0.03 -0.69 -0.19 0.00 0.48 0.00 0.00 55.95 55.52 2byr s SER 103 Cb 0.07 -0.70 -0.04 0.00 0.10 0.00 0.00 66.02 65.46 2byr s SER 103 CO 0.48 0.05 1.15 -2.65 0.98 0.00 0.00 173.24 173.24 2byr n PRO 104 N -0.47 1.12 -3.13 4.02 -0.02 -1.26 -4.81 135.00 130.45 2byr n PRO 104 Ca -0.08 0.43 -0.44 0.00 -2.02 0.00 0.00 63.50 61.39 2byr n PRO 104 Cb 0.58 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2byr n PRO 104 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2byr n GLN 105 N -1.28 3.61 -4.17 -0.52 1.13 -1.26 -4.90 117.38 109.98 2byr n GLN 105 Ca 0.14 -4.24 -0.18 0.00 -1.94 0.00 0.00 57.00 50.78 2byr n GLN 105 Cb 0.47 -2.71 -0.15 0.00 0.11 0.00 0.00 30.24 27.96 2byr n GLN 105 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2byr s ILE 106 N -0.55 0.48 0.34 5.09 1.01 -1.26 -0.69 121.20 125.62 2byr s ILE 106 Ca 0.35 -0.18 0.09 0.00 0.00 0.00 0.00 60.65 60.91 2byr s ILE 106 Cb -0.05 -0.46 -0.05 0.00 0.01 0.00 0.00 42.46 41.90 2byr s ILE 106 CO -0.03 0.18 0.04 0.00 0.00 0.00 0.00 174.94 175.12 2byr s ALA 107 N 0.39 3.26 -0.17 9.38 0.00 0.15 -4.61 121.76 130.15 2byr s ALA 107 Ca -0.05 -1.94 -0.01 0.00 0.00 0.00 0.00 51.96 49.96 2byr s ALA 107 Cb -0.09 -0.44 -0.00 0.00 0.00 0.00 0.00 23.12 22.60 2byr s ALA 107 CO -0.00 0.06 -0.12 0.08 0.00 0.00 0.00 175.76 175.78 2byr s VAL 108 N -2.50 2.89 -0.14 0.00 1.01 -0.43 -1.41 120.40 119.81 2byr s VAL 108 Ca 0.35 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.63 2byr s VAL 108 Cb -0.00 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 2byr s VAL 108 CO 0.20 0.49 -0.07 -0.69 0.00 0.00 0.00 175.10 175.03 2byr s VAL 109 N 0.96 3.57 0.20 2.92 1.01 -0.53 -0.66 120.40 127.87 2byr s VAL 109 Ca -0.02 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.54 2byr s VAL 109 Cb -0.15 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2byr s VAL 109 CO -0.01 0.51 0.15 -0.89 0.00 0.00 0.00 175.10 174.86 2byr s THR 110 N 0.29 4.43 0.54 3.92 2.01 -0.13 -1.38 115.64 125.32 2byr s THR 110 Ca -0.06 -1.22 0.29 0.00 0.31 0.00 0.00 61.69 61.01 2byr s THR 110 Cb -0.15 -3.31 0.45 0.00 0.01 0.00 0.00 72.50 69.50 2byr s THR 110 CO 0.04 -0.20 1.93 1.12 -0.69 0.00 0.00 174.62 176.82 2byr h HIS 111 N 2.09 0.00 0.00 4.92 2.07 -1.38 0.13 115.15 122.99 2byr h HIS 111 Ca -0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 2byr h HIS 111 Cb 1.21 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.19 2byr h HIS 111 CO 0.57 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.03 2byr n ASP 112 N -4.29 0.00 0.00 3.10 5.75 -1.26 -2.01 116.55 117.84 2byr n ASP 112 Ca 0.15 -0.87 0.00 0.00 -0.01 0.00 0.00 54.79 54.06 2byr n ASP 112 Cb 0.81 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.90 2byr n ASP 112 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2byr n GLY 113 N 0.64 0.75 3.80 6.12 0.00 0.47 -4.75 105.19 112.22 2byr n GLY 113 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2byr n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2byr s SER 114 N -2.56 7.04 -0.06 1.61 1.04 -1.23 -1.28 113.70 118.26 2byr s SER 114 Ca 0.00 1.77 0.02 0.00 0.48 0.00 0.00 55.95 58.22 2byr s SER 114 Cb 0.00 -2.56 0.01 0.00 0.10 0.00 0.00 66.02 63.58 2byr s SER 114 CO 0.00 -0.28 -0.12 -0.69 0.98 0.00 0.00 173.24 173.13 2byr s VAL 115 N -1.95 1.09 -0.11 5.02 1.01 0.47 -0.96 120.40 124.97 2byr s VAL 115 Ca 0.58 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 62.14 2byr s VAL 115 Cb -0.13 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.25 2byr s VAL 115 CO 0.18 0.34 -0.23 -0.32 0.00 0.00 0.00 175.10 175.07 2byr s MET 116 N 0.63 3.03 -0.06 2.72 1.75 0.17 -2.53 119.30 125.01 2byr s MET 116 Ca -0.13 -0.87 -0.00 0.00 -1.25 0.00 0.00 55.69 53.43 2byr s MET 116 Cb -0.15 -2.34 0.02 0.00 2.84 0.00 0.00 34.83 35.21 2byr s MET 116 CO 0.03 0.12 -0.02 0.12 -0.65 0.00 0.00 175.02 174.62 2byr s PHE 117 N 0.49 0.73 -0.52 4.11 5.36 0.13 -1.32 117.98 126.96 2byr s PHE 117 Ca -0.15 -0.21 0.06 0.00 -0.96 0.00 0.00 56.93 55.66 2byr s PHE 117 Cb -0.17 -0.74 0.20 0.00 -0.34 0.00 0.00 43.02 41.97 2byr s PHE 117 CO 0.06 -0.27 0.49 -0.89 -1.46 0.00 0.00 175.22 173.15 2byr n ILE 118 N 4.59 0.24 -2.33 3.12 5.41 -1.26 -0.26 119.36 128.88 2byr n ILE 118 Ca -0.16 -4.24 -0.42 0.00 1.00 0.00 0.00 62.75 58.93 2byr n ILE 118 Cb 0.50 -1.94 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 2byr n ILE 118 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2byr s PRO 119 N -1.06 4.40 0.07 0.38 0.04 -1.21 -4.75 135.00 132.87 2byr s PRO 119 Ca 0.33 1.89 -0.24 0.00 0.04 0.00 0.00 61.00 63.01 2byr s PRO 119 Cb 0.07 -3.30 -0.06 0.00 0.04 0.00 0.00 34.50 31.25 2byr s PRO 119 CO -0.14 -0.31 0.74 0.00 0.04 0.00 0.00 177.00 177.33 2byr s ALA 120 N 0.99 3.41 0.00 8.56 0.00 -1.26 -2.29 121.76 131.18 2byr s ALA 120 Ca 0.60 0.26 -0.02 0.00 0.00 0.00 0.00 51.96 52.80 2byr s ALA 120 Cb -0.32 -2.94 -0.01 0.00 0.00 0.00 0.00 23.12 19.85 2byr s ALA 120 CO 0.30 0.14 0.04 -0.65 0.00 0.00 0.00 175.76 175.59 2byr s GLN 121 N -0.37 0.28 -0.23 0.00 -0.21 -0.35 -0.60 119.66 118.19 2byr s GLN 121 Ca 0.37 -0.35 -0.06 0.00 0.02 0.00 0.00 55.36 55.34 2byr s GLN 121 Cb -0.21 0.11 -0.03 0.00 1.00 0.00 0.00 33.01 33.88 2byr s GLN 121 CO 0.23 -0.05 0.03 0.50 -2.12 0.00 0.00 175.29 173.88 2byr s ARG 122 N -0.98 3.63 -0.13 2.91 3.52 0.02 -1.96 118.95 125.97 2byr s ARG 122 Ca -0.11 -0.50 0.02 0.00 -0.13 0.00 0.00 55.73 55.02 2byr s ARG 122 Cb -0.06 -3.21 0.00 0.00 -1.56 0.00 0.00 34.95 30.12 2byr s ARG 122 CO -0.00 -0.10 -0.21 -1.17 -0.81 0.00 0.00 175.30 173.01 2byr s LEU 123 N 1.34 2.24 -0.23 -0.88 2.96 -0.04 -1.89 118.68 122.18 2byr s LEU 123 Ca 0.05 -0.53 -0.11 0.00 -0.22 0.00 0.00 54.13 53.31 2byr s LEU 123 Cb -0.15 -1.47 -0.05 0.00 0.50 0.00 0.00 46.19 45.02 2byr s LEU 123 CO 0.02 0.12 0.18 -0.44 -1.32 0.00 0.00 176.35 174.91 2byr s SER 124 N 0.59 6.17 0.16 3.68 0.01 -1.26 -0.88 113.70 122.17 2byr s SER 124 Ca -0.12 0.18 -0.03 0.00 1.31 0.00 0.00 55.95 57.30 2byr s SER 124 Cb -0.16 -2.12 -0.03 0.00 0.21 0.00 0.00 66.02 63.92 2byr s SER 124 CO 0.03 0.07 0.13 0.72 0.41 0.00 0.00 173.24 174.60 2byr s PHE 125 N 0.94 0.87 -0.00 2.43 -0.12 -0.70 -0.61 117.98 120.78 2byr s PHE 125 Ca 0.09 -1.20 -0.30 0.00 -0.05 0.00 0.00 56.93 55.47 2byr s PHE 125 Cb -0.13 -0.42 -0.05 0.00 -0.63 0.00 0.00 43.02 41.79 2byr s PHE 125 CO 0.04 -0.60 1.31 -1.64 -0.05 0.00 0.00 175.22 174.27 2byr s MET 126 N -4.07 4.33 -0.30 1.99 -1.94 -0.68 -1.53 119.30 117.10 2byr s MET 126 Ca 0.28 1.85 -0.16 0.00 -1.71 0.00 0.00 55.69 55.94 2byr s MET 126 Cb 0.06 -3.52 0.17 0.00 2.01 0.00 0.00 34.83 33.56 2byr s MET 126 CO 0.05 -0.48 1.08 0.00 -0.01 0.00 0.00 175.02 175.66 2byr s ASP 128 N 2.29 6.64 -0.03 0.00 3.68 -1.26 -3.53 116.67 124.45 2byr s ASP 128 Ca -0.02 0.47 0.06 0.00 2.13 0.00 0.00 52.55 55.20 2byr s ASP 128 Cb -0.04 -2.47 0.23 0.00 -1.45 0.00 0.00 42.92 39.19 2byr s ASP 128 CO -0.17 -0.92 1.06 -0.81 0.13 0.00 0.00 175.17 174.46 2byr n PRO 129 N 6.92 1.84 -1.67 4.34 -0.04 -1.26 -4.70 135.00 140.43 2byr n PRO 129 Ca 0.07 -0.92 -0.43 0.00 -0.04 0.00 0.00 63.50 62.18 2byr n PRO 129 Cb 0.48 -1.42 -0.01 0.00 -0.04 0.00 0.00 33.50 32.51 2byr n PRO 129 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2byr n THR 130 N 0.20 1.82 -0.11 0.52 -1.04 -1.26 -1.34 114.28 113.06 2byr n THR 130 Ca 0.08 -0.45 0.00 0.00 -2.04 0.00 0.00 64.05 61.64 2byr n THR 130 Cb 0.35 -1.41 0.00 0.00 -1.82 0.00 0.00 70.33 67.44 2byr n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2byr n GLY 131 N 1.11 1.82 0.29 3.41 0.00 -1.26 -4.27 105.19 106.29 2byr n GLY 131 Ca 0.07 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.25 2byr n GLY 131 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2byr h VAL 132 N 0.00 0.44 -0.56 1.61 3.04 -1.41 -1.00 116.25 118.37 2byr h VAL 132 Ca 0.00 -0.21 -0.20 0.00 -1.01 0.00 0.00 66.70 65.28 2byr h VAL 132 Cb 0.00 1.14 -0.12 0.00 -2.01 0.00 0.00 31.29 30.30 2byr h VAL 132 CO 0.00 0.04 0.26 -0.90 -1.01 0.00 0.00 177.57 175.96 2byr n ASP 133 N -3.63 3.85 -4.19 3.17 5.75 -1.26 -1.62 116.55 118.63 2byr n ASP 133 Ca -0.02 -2.91 -0.25 0.00 -0.01 0.00 0.00 54.79 51.60 2byr n ASP 133 Cb 0.14 -0.69 -0.09 0.00 -1.03 0.00 0.00 41.12 39.46 2byr n ASP 133 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2byr s SER 134 N -0.56 2.66 0.19 -1.12 1.04 -0.40 -5.05 113.70 110.46 2byr s SER 134 Ca 0.39 -1.62 -0.04 0.00 0.48 0.00 0.00 55.95 55.17 2byr s SER 134 Cb 0.31 0.40 0.13 0.00 0.10 0.00 0.00 66.02 66.96 2byr s SER 134 CO 0.09 -0.87 1.53 -0.33 0.98 0.00 0.00 173.24 174.64 2byr h GLU 135 N 1.86 0.61 -0.38 4.02 4.39 -1.90 -3.10 114.58 120.07 2byr h GLU 135 Ca -0.36 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 58.99 2byr h GLU 135 Cb 1.27 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.93 2byr h GLU 135 CO 0.59 0.96 0.23 1.49 -1.16 0.00 0.00 179.01 181.11 2byr h GLU 136 N 0.48 0.51 -0.35 2.33 4.81 -1.97 -3.49 114.58 116.90 2byr h GLU 136 Ca 0.02 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 2byr h GLU 136 Cb 1.02 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2byr h GLU 136 CO 0.09 0.36 -0.06 0.41 -0.73 0.00 0.00 179.01 179.08 2byr n GLY 137 N -1.41 -1.43 3.80 1.92 0.00 -1.07 -4.91 105.19 102.08 2byr n GLY 137 Ca 0.03 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 2byr n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2byr s ALA 138 N -1.27 3.62 -0.10 4.61 0.00 0.03 -4.34 121.76 124.32 2byr s ALA 138 Ca 0.00 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.93 2byr s ALA 138 Cb 0.00 -1.46 -0.00 0.00 0.00 0.00 0.00 23.12 21.65 2byr s ALA 138 CO 0.00 0.67 -0.22 0.99 0.00 0.00 0.00 175.76 177.19 2byr s THR 139 N -1.53 2.23 0.02 0.00 2.01 -1.26 -1.34 115.64 115.77 2byr s THR 139 Ca 0.31 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 61.35 2byr s THR 139 Cb -0.12 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.52 2byr s THR 139 CO 0.23 0.56 -0.04 0.00 -0.69 0.00 0.00 174.62 174.67 2byr s ALA 141 N -1.01 1.50 -0.01 0.00 0.00 -1.26 -0.85 121.76 120.13 2byr s ALA 141 Ca -0.09 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.05 2byr s ALA 141 Cb -0.07 -0.35 0.02 0.00 0.00 0.00 0.00 23.12 22.71 2byr s ALA 141 CO -0.00 0.36 0.01 0.54 0.00 0.00 0.00 175.76 176.66 2byr s VAL 142 N -0.53 0.03 -0.11 0.00 0.11 -0.02 -4.93 120.40 114.95 2byr s VAL 142 Ca 0.06 0.10 -0.04 0.00 -2.93 0.00 0.00 61.98 59.18 2byr s VAL 142 Cb -0.07 -0.11 -0.04 0.00 -1.53 0.00 0.00 36.38 34.63 2byr s VAL 142 CO -0.00 0.08 0.04 -0.54 -3.33 0.00 0.00 175.10 171.34 2byr s LYS 143 N 0.68 3.27 0.07 1.54 1.02 -1.26 -0.39 119.74 124.67 2byr s LYS 143 Ca -0.06 -0.34 0.09 0.00 0.02 0.00 0.00 55.97 55.68 2byr s LYS 143 Cb -0.09 -2.95 -0.03 0.00 -0.52 0.00 0.00 37.83 34.24 2byr s LYS 143 CO -0.02 0.63 -0.21 -0.06 -0.92 0.00 0.00 175.35 174.77 2byr s PHE 144 N -0.67 2.46 -1.71 3.18 0.08 -0.45 -0.25 117.98 120.63 2byr s PHE 144 Ca 0.11 -0.31 0.00 0.00 0.12 0.00 0.00 56.93 56.85 2byr s PHE 144 Cb -0.12 -1.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.95 2byr s PHE 144 CO 0.02 0.27 0.00 0.41 -0.10 0.00 0.00 175.22 175.82 2byr n GLY 145 N 1.32 -1.50 3.76 4.36 0.00 -0.73 -0.49 105.19 111.91 2byr n GLY 145 Ca -0.16 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 2byr n GLY 145 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2byr s SER 146 N -2.04 6.73 0.11 1.61 0.15 -1.26 -0.65 113.70 118.35 2byr s SER 146 Ca 0.00 2.67 -0.09 0.00 0.70 0.00 0.00 55.95 59.23 2byr s SER 146 Cb 0.00 -2.64 -0.14 0.00 -1.71 0.00 0.00 66.02 61.53 2byr s SER 146 CO 0.00 -0.60 1.27 -0.25 1.20 0.00 0.00 173.24 174.86 2byr h TRP 147 N 4.07 0.84 0.00 3.44 2.91 -1.89 -3.41 115.95 121.91 2byr h TRP 147 Ca -0.48 -0.44 0.00 0.00 1.13 0.00 0.00 58.89 59.11 2byr h TRP 147 Cb 1.22 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 29.77 2byr h TRP 147 CO 0.58 1.26 -0.61 1.33 -1.03 0.00 0.00 178.44 179.97 2byr n VAL 148 N -3.82 0.00 -3.68 2.65 0.24 -1.26 -5.04 118.33 107.42 2byr n VAL 148 Ca -0.08 -0.19 -0.36 0.00 -2.04 0.00 0.00 64.34 61.66 2byr n VAL 148 Cb 0.83 0.69 -0.07 0.00 -1.47 0.00 0.00 33.84 33.82 2byr n VAL 148 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2byr s TYR 149 N -1.60 3.51 0.95 6.34 2.02 -1.26 -5.09 117.35 122.22 2byr s TYR 149 Ca 0.00 0.54 -0.15 0.00 -0.37 0.00 0.00 57.07 57.09 2byr s TYR 149 Cb 0.00 -2.18 0.17 0.00 -0.40 0.00 0.00 41.96 39.56 2byr s TYR 149 CO 0.00 0.43 1.24 -1.54 -1.57 0.00 0.00 175.55 174.11 2byr s SER 150 N -0.13 3.24 0.60 2.29 1.04 -1.26 -4.71 113.70 114.77 2byr s SER 150 Ca 0.14 0.52 0.37 0.00 0.48 0.00 0.00 55.95 57.47 2byr s SER 150 Cb -0.13 -0.76 1.86 0.00 0.10 0.00 0.00 66.02 67.09 2byr s SER 150 CO 0.03 -2.68 2.18 1.23 0.98 0.00 0.00 173.24 174.98 2byr h GLY 151 N -1.60 0.00 2.00 7.32 0.00 -0.41 -1.03 103.07 109.36 2byr h GLY 151 Ca -0.46 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 2byr h GLY 151 CO 0.47 0.00 -0.09 0.74 0.00 0.00 0.00 176.54 177.66 2byr h PHE 152 N 0.00 0.00 0.00 5.60 0.04 -1.93 -3.35 116.94 117.30 2byr h PHE 152 Ca -0.00 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.53 2byr h PHE 152 Cb 0.24 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.36 2byr h PHE 152 CO 0.00 0.09 -1.84 0.39 -0.60 0.00 0.00 178.31 176.35 2byr n GLU 153 N -3.32 0.35 -3.97 1.51 4.71 -0.80 -4.21 120.64 114.92 2byr n GLU 153 Ca -0.01 0.11 -0.31 0.00 -0.01 0.00 0.00 57.16 56.94 2byr n GLU 153 Cb 0.29 -1.20 -0.15 0.00 -1.01 0.00 0.00 31.44 29.37 2byr n GLU 153 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2byr s ILE 154 N -2.29 1.67 0.17 -3.67 1.01 -0.46 -0.48 121.20 117.16 2byr s ILE 154 Ca -0.20 -1.33 -0.13 0.00 0.00 0.00 0.00 60.65 58.99 2byr s ILE 154 Cb 0.06 -1.91 -0.07 0.00 0.01 0.00 0.00 42.46 40.55 2byr s ILE 154 CO 0.31 -0.10 0.54 -0.62 0.00 0.00 0.00 174.94 175.08 2byr s ASP 155 N 1.33 6.77 0.07 3.58 2.15 0.44 -4.00 116.67 127.01 2byr s ASP 155 Ca -0.06 1.03 0.05 0.00 0.43 0.00 0.00 52.55 53.99 2byr s ASP 155 Cb -0.19 -2.27 -0.04 0.00 -0.30 0.00 0.00 42.92 40.12 2byr s ASP 155 CO -0.06 0.06 -0.02 -0.76 -0.17 0.00 0.00 175.17 174.22 2byr s LEU 156 N -2.18 3.40 0.05 -1.34 1.43 -1.26 -0.49 118.68 118.29 2byr s LEU 156 Ca 0.40 -0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 53.28 2byr s LEU 156 Cb -0.14 -2.10 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 2byr s LEU 156 CO 0.20 0.20 0.07 -1.59 0.23 0.00 0.00 176.35 175.45 2byr s LYS 157 N -2.13 0.64 0.08 1.70 -2.85 -0.52 -4.92 119.74 111.73 2byr s LYS 157 Ca 0.24 -0.93 0.07 0.00 -1.00 0.00 0.00 55.97 54.35 2byr s LYS 157 Cb -0.12 0.24 -0.04 0.00 -2.06 0.00 0.00 37.83 35.86 2byr s LYS 157 CO 0.16 -0.16 -0.13 0.95 0.10 0.00 0.00 175.35 176.27 2byr s THR 158 N -3.22 3.15 0.11 3.79 -4.23 -1.26 -1.52 115.64 112.45 2byr s THR 158 Ca 0.00 -1.25 -0.03 0.00 -1.18 0.00 0.00 61.69 59.24 2byr s THR 158 Cb 0.03 -2.42 -0.22 0.00 1.34 0.00 0.00 72.50 71.22 2byr s THR 158 CO -0.07 0.19 1.24 0.44 -0.54 0.00 0.00 174.62 175.88 2byr h ASP 159 N 3.95 0.42 -4.72 3.99 3.45 -1.98 -3.47 116.42 118.08 2byr h ASP 159 Ca -0.49 -0.39 -0.18 0.00 0.43 0.00 0.00 57.03 56.40 2byr h ASP 159 Cb 1.16 -0.13 -0.22 0.00 -0.56 0.00 0.00 39.33 39.58 2byr h ASP 159 CO 0.50 1.24 -0.70 0.28 -1.57 0.00 0.00 179.24 179.00 2byr s THR 160 N -2.96 0.09 -0.77 0.35 -1.32 -1.26 -5.04 115.64 104.73 2byr s THR 160 Ca -0.04 -0.71 0.26 0.00 -1.21 0.00 0.00 61.69 59.99 2byr s THR 160 Cb 0.08 -0.21 0.24 0.00 -1.51 0.00 0.00 72.50 71.10 2byr s THR 160 CO 0.87 -0.39 1.73 0.47 -2.21 0.00 0.00 174.62 175.09 2byr n ASP 161 N 1.91 0.66 -4.60 8.08 10.43 -1.26 -4.79 116.55 126.98 2byr n ASP 161 Ca -0.21 0.48 -0.40 0.00 2.57 0.00 0.00 54.79 57.23 2byr n ASP 161 Cb 0.56 -0.60 -0.08 0.00 1.84 0.00 0.00 41.12 42.85 2byr n ASP 161 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 2byr s GLN 162 N -3.09 3.92 0.32 -1.24 -1.52 -1.26 -0.70 119.66 116.09 2byr s GLN 162 Ca 0.11 0.13 -0.29 0.00 -1.95 0.00 0.00 55.36 53.35 2byr s GLN 162 Cb 0.14 -3.70 -0.11 0.00 -0.22 0.00 0.00 33.01 29.11 2byr s GLN 162 CO 0.60 -0.44 1.51 0.08 -0.25 0.00 0.00 175.29 176.80 2byr s VAL 163 N 2.31 2.19 -0.32 1.09 1.01 -0.67 -4.90 120.40 121.11 2byr s VAL 163 Ca 0.20 0.18 -0.29 0.00 0.00 0.00 0.00 61.98 62.06 2byr s VAL 163 Cb -0.16 -3.11 -0.00 0.00 0.00 0.00 0.00 36.38 33.11 2byr s VAL 163 CO 0.11 0.03 1.41 -0.62 0.00 0.00 0.00 175.10 176.03 2byr s ASP 164 N 0.17 6.49 -0.01 3.32 2.15 -0.77 -4.87 116.67 123.15 2byr s ASP 164 Ca 0.58 1.16 0.15 0.00 0.43 0.00 0.00 52.55 54.86 2byr s ASP 164 Cb -0.46 -2.54 0.44 0.00 -0.30 0.00 0.00 42.92 40.06 2byr s ASP 164 CO 0.53 -1.25 1.36 0.18 -0.17 0.00 0.00 175.17 175.83 2byr n LEU 165 N 8.24 3.35 -0.18 -1.34 4.77 -1.26 -1.76 117.00 128.82 2byr n LEU 165 Ca 0.16 -2.04 -0.09 0.00 -0.03 0.00 0.00 56.01 54.01 2byr n LEU 165 Cb 0.47 -0.33 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2byr n LEU 165 CO 0.66 0.82 0.88 0.77 -1.33 0.00 0.00 177.39 179.18 2byr h SER 166 N 2.81 0.78 -0.44 -1.43 4.64 -1.89 -2.92 113.55 115.10 2byr h SER 166 Ca 0.00 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 2byr h SER 166 Cb 0.86 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2byr h SER 166 CO 0.01 0.83 0.00 -1.54 -0.87 0.00 0.00 176.83 175.26 2byr n SER 167 N -4.43 2.59 -4.77 4.97 3.41 -1.26 -4.96 113.62 109.16 2byr n SER 167 Ca 0.01 -2.07 -0.41 0.00 -0.26 0.00 0.00 58.87 56.15 2byr n SER 167 Cb 0.24 -0.34 -0.01 0.00 -0.26 0.00 0.00 64.21 63.84 2byr n SER 167 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2byr s TYR 168 N -1.48 2.80 -0.12 7.33 5.04 -1.11 -4.74 117.35 125.08 2byr s TYR 168 Ca 0.31 1.30 -0.29 0.00 -2.44 0.00 0.00 57.07 55.94 2byr s TYR 168 Cb 0.17 -3.85 -0.06 0.00 0.35 0.00 0.00 41.96 38.57 2byr s TYR 168 CO 0.19 -2.43 2.06 -0.47 -1.34 0.00 0.00 175.55 173.56 2byr s TYR 169 N -1.14 1.29 0.26 4.97 5.04 0.18 -4.86 117.35 123.09 2byr s TYR 169 Ca 0.52 0.14 0.37 0.00 -2.44 0.00 0.00 57.07 55.65 2byr s TYR 169 Cb -0.43 -4.06 1.68 0.00 0.35 0.00 0.00 41.96 39.50 2byr s TYR 169 CO 0.58 -4.58 2.10 0.00 -1.34 0.00 0.00 175.55 172.30 2byr h ALA 170 N 12.90 1.00 -0.22 3.97 0.00 -1.90 -2.78 119.26 132.23 2byr h ALA 170 Ca -0.44 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 2byr h ALA 170 Cb 1.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2byr h ALA 170 CO 0.96 0.00 -0.01 0.43 0.00 0.00 0.00 179.25 180.62 2byr n SER 171 N -3.09 3.40 -4.57 0.00 7.64 -1.26 -5.04 113.62 110.70 2byr n SER 171 Ca -0.00 -3.13 -0.32 0.00 1.01 0.00 0.00 58.87 56.42 2byr n SER 171 Cb 0.24 -0.53 0.14 0.00 -1.01 0.00 0.00 64.21 63.04 2byr n SER 171 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2byr n SER 172 N -0.77 -0.53 0.28 6.43 2.88 -1.05 -4.91 113.62 115.94 2byr n SER 172 Ca 0.22 0.42 0.18 0.00 -1.33 0.00 0.00 58.87 58.36 2byr n SER 172 Cb 0.86 -1.37 0.81 0.00 -0.75 0.00 0.00 64.21 63.77 2byr n SER 172 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2byr h LYS 173 N -1.53 0.00 -5.04 -1.46 1.79 -1.92 -3.44 116.57 104.97 2byr h LYS 173 Ca -0.44 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.52 2byr h LYS 173 Cb 1.28 0.00 -0.31 0.00 -1.58 0.00 0.00 32.23 31.62 2byr h LYS 173 CO 0.39 0.00 -0.82 0.71 -1.08 0.00 0.00 179.45 178.66 2byr s TYR 174 N -3.76 1.41 0.15 -1.35 2.02 -1.26 -0.76 117.35 113.80 2byr s TYR 174 Ca -0.00 -0.38 -0.04 0.00 -0.37 0.00 0.00 57.07 56.27 2byr s TYR 174 Cb 0.10 -0.97 -0.05 0.00 -0.40 0.00 0.00 41.96 40.64 2byr s TYR 174 CO 0.48 -0.14 0.38 -1.83 -1.57 0.00 0.00 175.55 172.87 2byr s GLU 175 N 0.08 3.60 -0.27 -0.62 -1.05 0.11 -4.78 118.70 115.78 2byr s GLU 175 Ca -0.03 -0.12 -0.12 0.00 -0.15 0.00 0.00 54.97 54.54 2byr s GLU 175 Cb -0.10 -2.85 -0.05 0.00 -0.44 0.00 0.00 34.13 30.70 2byr s GLU 175 CO 0.01 0.46 0.26 0.42 0.95 0.00 0.00 175.26 177.36 2byr s ILE 176 N -1.69 5.26 -0.05 1.83 -1.09 -1.26 -1.80 121.20 122.40 2byr s ILE 176 Ca 0.41 0.33 -0.13 0.00 -2.23 0.00 0.00 60.65 59.02 2byr s ILE 176 Cb -0.12 -3.59 -0.31 0.00 -1.58 0.00 0.00 42.46 36.86 2byr s ILE 176 CO 0.25 0.23 0.69 -0.07 -1.23 0.00 0.00 174.94 174.81 2byr h LEU 177 N 8.35 0.60 -7.25 2.97 3.38 -1.26 -3.48 115.31 118.61 2byr h LEU 177 Ca -0.34 -0.92 -0.06 0.00 0.09 0.00 0.00 57.88 56.65 2byr h LEU 177 Cb 1.18 -0.19 -0.16 0.00 0.09 0.00 0.00 40.66 41.58 2byr h LEU 177 CO 0.60 1.73 0.00 -0.94 0.09 0.00 0.00 178.44 179.92 2byr s SER 178 N -7.27 -0.39 -0.25 -0.43 1.04 -1.03 -5.00 113.70 100.37 2byr s SER 178 Ca -0.16 0.07 -0.04 0.00 0.48 0.00 0.00 55.95 56.30 2byr s SER 178 Cb 0.05 0.48 0.13 0.00 0.10 0.00 0.00 66.02 66.78 2byr s SER 178 CO 0.85 -0.74 0.45 0.00 0.98 0.00 0.00 173.24 174.78 2byr s ALA 179 N -2.68 -1.41 0.15 5.32 0.00 -1.26 -0.59 121.76 121.31 2byr s ALA 179 Ca -0.04 1.35 0.09 0.00 0.00 0.00 0.00 51.96 53.35 2byr s ALA 179 Cb -0.00 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 2byr s ALA 179 CO -0.04 -1.13 -0.20 0.95 0.00 0.00 0.00 175.76 175.35 2byr s THR 180 N 2.65 1.88 -0.21 0.00 -4.23 -0.24 -1.68 115.64 113.81 2byr s THR 180 Ca 0.09 -1.84 -0.02 0.00 -1.18 0.00 0.00 61.69 58.74 2byr s THR 180 Cb -0.14 -1.82 0.06 0.00 1.34 0.00 0.00 72.50 71.94 2byr s THR 180 CO -0.16 -0.22 0.03 0.00 -0.54 0.00 0.00 174.62 173.72 2byr s GLN 181 N -2.56 0.79 -0.11 3.99 -2.07 0.12 -0.79 119.66 119.04 2byr s GLN 181 Ca 0.14 -0.54 0.02 0.00 -1.82 0.00 0.00 55.36 53.15 2byr s GLN 181 Cb -0.07 -2.17 0.02 0.00 -1.09 0.00 0.00 33.01 29.69 2byr s GLN 181 CO 0.06 -0.66 -0.15 0.99 -1.32 0.00 0.00 175.29 174.22 2byr s THR 182 N 1.78 1.47 0.18 3.63 2.01 -0.46 -4.36 115.64 119.88 2byr s THR 182 Ca -0.01 -0.62 -0.31 0.00 0.31 0.00 0.00 61.69 61.06 2byr s THR 182 Cb -0.17 -1.35 -0.10 0.00 0.01 0.00 0.00 72.50 70.89 2byr s THR 182 CO -0.09 0.43 1.51 -0.60 -0.69 0.00 0.00 174.62 175.19 2byr s ARG 183 N 1.02 4.24 0.09 4.92 3.52 -1.26 -0.03 118.95 131.44 2byr s ARG 183 Ca -0.06 2.31 0.06 0.00 -0.13 0.00 0.00 55.73 57.91 2byr s ARG 183 Cb -0.15 -3.16 -0.03 0.00 -1.56 0.00 0.00 34.95 30.05 2byr s ARG 183 CO -0.02 -0.54 -0.15 -0.65 -0.81 0.00 0.00 175.30 173.13 2byr s GLN 184 N 0.77 0.92 -0.14 5.12 -0.21 0.36 -4.93 119.66 121.55 2byr s GLN 184 Ca 0.67 -1.06 0.02 0.00 0.02 0.00 0.00 55.36 55.02 2byr s GLN 184 Cb -0.42 -0.94 0.01 0.00 1.00 0.00 0.00 33.01 32.65 2byr s GLN 184 CO 0.34 0.21 -0.22 0.08 -2.12 0.00 0.00 175.29 173.58 2byr s VAL 185 N -1.45 2.07 0.13 1.09 1.01 -1.26 -2.02 120.40 119.98 2byr s VAL 185 Ca 0.02 -0.98 0.08 0.00 0.00 0.00 0.00 61.98 61.11 2byr s VAL 185 Cb -0.09 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 2byr s VAL 185 CO 0.03 0.55 -0.14 -1.10 0.00 0.00 0.00 175.10 174.44 2byr s GLN 186 N 0.81 1.94 -0.14 2.72 -0.21 0.14 -4.94 119.66 119.99 2byr s GLN 186 Ca -0.07 -1.17 -0.01 0.00 0.02 0.00 0.00 55.36 54.13 2byr s GLN 186 Cb -0.16 -2.17 0.04 0.00 1.00 0.00 0.00 33.01 31.72 2byr s GLN 186 CO -0.02 0.47 -0.03 -1.01 -2.12 0.00 0.00 175.29 172.59 2byr s HIS 187 N -1.32 1.33 0.24 0.91 3.76 -1.26 -1.03 115.29 117.91 2byr s HIS 187 Ca 0.21 -0.80 -0.10 0.00 -0.15 0.00 0.00 55.06 54.22 2byr s HIS 187 Cb -0.10 -1.14 -0.07 0.00 1.11 0.00 0.00 32.58 32.38 2byr s HIS 187 CO 0.12 -0.54 0.56 0.71 -0.85 0.00 0.00 174.74 174.74 2byr s TYR 188 N 1.76 3.43 0.22 1.40 2.02 -1.26 -4.99 117.35 119.92 2byr s TYR 188 Ca 0.02 0.88 -0.08 0.00 -0.37 0.00 0.00 57.07 57.52 2byr s TYR 188 Cb -0.15 -2.26 0.30 0.00 -0.40 0.00 0.00 41.96 39.45 2byr s TYR 188 CO -0.07 0.25 1.78 0.77 -1.57 0.00 0.00 175.55 176.71 2byr h SER 189 N 2.47 0.46 -0.98 2.29 0.02 -2.00 -2.80 113.55 113.00 2byr h SER 189 Ca -0.47 0.05 0.21 0.00 -0.84 0.00 0.00 61.79 60.75 2byr h SER 189 Cb 1.17 -0.03 -0.09 0.00 0.14 0.00 0.00 62.40 63.59 2byr h SER 189 CO 0.69 0.27 0.62 0.00 -1.14 0.00 0.00 176.83 177.27 2byr h PRO 192 N 5.53 0.00 -7.07 0.00 0.14 -1.89 -3.40 132.00 125.31 2byr h PRO 192 Ca -0.33 0.00 -0.45 0.00 0.14 0.00 0.00 66.00 65.36 2byr h PRO 192 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.32 2byr h PRO 192 CO 0.47 0.05 0.36 -1.21 0.14 0.00 0.00 178.00 177.81 2byr s GLU 193 N -3.20 4.03 0.32 0.86 8.01 -1.26 -5.05 118.70 122.42 2byr s GLU 193 Ca 0.06 1.21 -0.22 0.00 0.01 0.00 0.00 54.97 56.03 2byr s GLU 193 Cb 0.06 -2.14 -0.10 0.00 -4.31 0.00 0.00 34.13 27.64 2byr s GLU 193 CO 0.69 -0.21 0.86 -1.25 0.01 0.00 0.00 175.26 175.36 2byr s PRO 194 N -3.25 4.33 -0.06 0.39 0.04 -1.26 -4.67 135.00 130.51 2byr s PRO 194 Ca 0.64 1.07 0.04 0.00 0.04 0.00 0.00 61.00 62.79 2byr s PRO 194 Cb -0.12 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.80 2byr s PRO 194 CO 0.17 0.22 -0.18 0.71 0.04 0.00 0.00 177.00 177.96 2byr s TYR 195 N -1.78 1.88 -0.11 0.56 2.02 -0.20 0.17 117.35 119.89 2byr s TYR 195 Ca 0.52 -0.64 -0.01 0.00 -0.37 0.00 0.00 57.07 56.57 2byr s TYR 195 Cb -0.15 -1.28 -0.02 0.00 -0.40 0.00 0.00 41.96 40.11 2byr s TYR 195 CO 0.20 -0.25 -0.08 0.42 -1.57 0.00 0.00 175.55 174.27 2byr s ILE 196 N 0.26 3.57 0.15 2.71 -1.09 -1.26 0.29 121.20 125.82 2byr s ILE 196 Ca -0.10 -0.50 0.02 0.00 -2.23 0.00 0.00 60.65 57.84 2byr s ILE 196 Cb -0.14 -2.51 -0.04 0.00 -1.58 0.00 0.00 42.46 38.19 2byr s ILE 196 CO 0.04 0.54 -0.02 1.51 -1.23 0.00 0.00 174.94 175.78 2byr s ASP 197 N -0.09 1.17 -0.25 3.58 1.47 -0.86 -4.46 116.67 117.24 2byr s ASP 197 Ca 0.00 -1.11 -0.03 0.00 1.18 0.00 0.00 52.55 52.60 2byr s ASP 197 Cb -0.13 0.11 0.02 0.00 -0.34 0.00 0.00 42.92 42.58 2byr s ASP 197 CO 0.03 -0.53 -0.04 -0.69 0.68 0.00 0.00 175.17 174.61 2byr s VAL 198 N -3.65 3.09 -0.40 2.11 1.01 0.36 -0.49 120.40 122.43 2byr s VAL 198 Ca 0.20 -0.86 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 2byr s VAL 198 Cb 0.06 -2.53 0.02 0.00 0.00 0.00 0.00 36.38 33.93 2byr s VAL 198 CO 0.01 0.25 0.78 0.21 0.00 0.00 0.00 175.10 176.35 2byr s ASN 199 N 1.38 6.49 -0.46 3.32 2.47 0.95 -1.34 114.94 127.75 2byr s ASN 199 Ca 0.02 0.17 -0.20 0.00 0.42 0.00 0.00 52.86 53.27 2byr s ASN 199 Cb -0.16 -2.39 0.04 0.00 -1.45 0.00 0.00 41.25 37.28 2byr s ASN 199 CO -0.04 -0.80 0.61 -0.22 -3.72 0.00 0.00 177.10 172.93 2byr s LEU 200 N 3.18 4.72 -0.25 3.21 0.20 0.48 -1.36 118.68 128.85 2byr s LEU 200 Ca 0.31 -0.60 -0.05 0.00 0.69 0.00 0.00 54.13 54.48 2byr s LEU 200 Cb -0.13 -2.57 0.00 0.00 -0.43 0.00 0.00 46.19 43.07 2byr s LEU 200 CO 0.19 -0.79 -0.00 -0.69 -0.29 0.00 0.00 176.35 174.77 2byr s VAL 201 N 2.66 3.52 -0.12 1.68 1.01 0.03 -0.84 120.40 128.34 2byr s VAL 201 Ca 0.18 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.54 2byr s VAL 201 Cb -0.16 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 2byr s VAL 201 CO 0.16 0.27 -0.18 -0.69 0.00 0.00 0.00 175.10 174.66 2byr s VAL 202 N 1.46 2.63 -0.17 2.92 1.01 -0.03 -1.08 120.40 127.15 2byr s VAL 202 Ca 0.04 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 2byr s VAL 202 Cb -0.16 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 2byr s VAL 202 CO -0.01 0.54 -0.04 -0.75 0.00 0.00 0.00 175.10 174.83 2byr s LYS 203 N 0.34 3.60 0.10 2.72 2.20 0.24 -0.98 119.74 127.96 2byr s LYS 203 Ca -0.14 -0.55 -0.07 0.00 -0.36 0.00 0.00 55.97 54.85 2byr s LYS 203 Cb -0.17 -2.92 -0.01 0.00 -1.51 0.00 0.00 37.83 33.22 2byr s LYS 203 CO 0.07 0.15 0.16 -0.59 -0.36 0.00 0.00 175.35 174.79 2byr s PHE 204 N 0.59 0.32 0.15 4.03 -0.12 -0.45 -0.69 117.98 121.81 2byr s PHE 204 Ca -0.03 -0.75 -0.09 0.00 -0.05 0.00 0.00 56.93 56.01 2byr s PHE 204 Cb -0.14 -0.15 -0.01 0.00 -0.63 0.00 0.00 43.02 42.09 2byr s PHE 204 CO 0.03 -0.55 0.27 -0.98 -0.05 0.00 0.00 175.22 173.93 2byr s ARG 205 N -3.91 1.10 0.24 1.99 1.70 -0.75 -0.79 118.95 118.53 2byr s ARG 205 Ca 0.09 -1.14 -0.31 0.00 -0.47 0.00 0.00 55.73 53.90 2byr s ARG 205 Cb 0.05 0.37 -0.13 0.00 -0.57 0.00 0.00 34.95 34.68 2byr s ARG 205 CO -0.07 -0.39 1.55 0.39 -1.08 0.00 0.00 175.30 175.69 2byr n GLU 206 N -0.19 2.39 0.00 3.89 1.02 -0.64 -0.71 120.64 126.40 2byr n GLU 206 Ca -0.09 0.85 0.04 0.00 -0.02 0.00 0.00 57.16 57.94 2byr n GLU 206 Cb 0.63 -2.60 0.22 0.00 -0.02 0.00 0.00 31.44 29.67 2byr n GLU 206 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18