#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oxg s SER 201 N 0.00 4.78 0.72 1.61 1.04 -1.26 -5.07 113.70 115.52 2oxg s SER 201 Ca 0.00 -0.00 -0.12 0.00 0.48 0.00 0.00 55.95 56.30 2oxg s SER 201 Cb 0.00 -0.63 0.03 0.00 0.10 0.00 0.00 66.02 65.52 2oxg s SER 201 CO 0.00 -1.55 1.09 -0.94 0.98 0.00 0.00 173.24 172.82 2oxg s SER 1 N -4.57 4.89 0.21 7.02 1.04 -1.26 -4.86 113.70 116.17 2oxg s SER 1 Ca 0.62 1.85 -0.10 0.00 0.48 0.00 0.00 55.95 58.80 2oxg s SER 1 Cb -0.09 -2.53 0.15 0.00 0.10 0.00 0.00 66.02 63.66 2oxg s SER 1 CO 0.42 -1.78 1.82 0.74 0.98 0.00 0.00 173.24 175.43 2oxg h THR 2 N -0.62 1.23 -0.68 2.02 2.02 -1.99 -0.25 112.91 114.64 2oxg h THR 2 Ca -0.45 -0.57 0.04 0.00 0.77 0.00 0.00 66.41 66.20 2oxg h THR 2 Cb 1.23 0.23 -0.05 0.00 -1.74 0.00 0.00 68.15 67.82 2oxg h THR 2 CO 0.53 0.25 0.41 0.58 0.37 0.00 0.00 175.52 177.67 2oxg h VAL 3 N 1.04 1.05 -0.63 3.16 2.07 -1.95 -0.38 116.25 120.62 2oxg h VAL 3 Ca 0.27 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 2oxg h VAL 3 Cb 0.03 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 29.97 2oxg h VAL 3 CO -0.04 0.14 0.17 0.44 0.02 0.00 0.00 177.57 178.30 2oxg h ASP 4 N 0.79 0.93 -0.42 0.57 3.32 -1.78 -0.34 116.42 119.50 2oxg h ASP 4 Ca 0.28 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2oxg h ASP 4 Cb 0.08 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 2oxg h ASP 4 CO -0.13 0.91 0.22 -0.33 -1.72 0.00 0.00 179.24 178.19 2oxg h GLU 5 N 0.91 0.59 -0.57 3.56 5.08 -0.65 0.80 114.58 124.30 2oxg h GLU 5 Ca 0.20 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2oxg h GLU 5 Cb 0.33 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2oxg h GLU 5 CO -0.00 0.48 0.06 -0.07 -1.00 0.00 0.00 179.01 178.48 2oxg h LEU 6 N 0.54 0.93 -0.41 1.33 3.38 -0.94 -2.06 115.31 118.08 2oxg h LEU 6 Ca 0.15 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2oxg h LEU 6 Cb 0.07 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2oxg h LEU 6 CO -0.02 0.98 0.23 0.74 0.09 0.00 0.00 178.44 180.45 2oxg h THR 7 N 0.85 1.15 -0.64 0.22 2.02 -0.85 -1.99 112.91 113.67 2oxg h THR 7 Ca 0.17 -0.38 -0.06 0.00 0.77 0.00 0.00 66.41 66.91 2oxg h THR 7 Cb 0.46 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2oxg h THR 7 CO 0.02 0.15 0.17 0.00 0.37 0.00 0.00 175.52 176.23 2oxg h ALA 8 N 1.09 1.10 -0.79 6.16 0.00 -0.75 -0.86 119.26 125.20 2oxg h ALA 8 Ca 0.14 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2oxg h ALA 8 Cb 0.04 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2oxg h ALA 8 CO -0.02 0.61 0.39 0.00 0.00 0.00 0.00 179.25 180.23 2oxg h ALA 9 N 1.23 1.02 -0.50 0.00 0.00 -1.12 -1.07 119.26 118.83 2oxg h ALA 9 Ca 0.21 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2oxg h ALA 9 Cb 0.31 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2oxg h ALA 9 CO -0.00 0.57 -0.16 0.35 0.00 0.00 0.00 179.25 180.01 2oxg h PHE 10 N 1.11 1.09 0.00 0.00 3.57 -0.72 -3.21 116.94 118.79 2oxg h PHE 10 Ca 0.27 -0.24 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2oxg h PHE 10 Cb 0.10 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.57 2oxg h PHE 10 CO 0.01 1.04 -0.43 0.25 -2.23 0.00 0.00 178.31 176.96 2oxg n THR 11 N -4.13 0.15 -1.34 4.41 -2.24 -0.39 -4.93 114.28 105.82 2oxg n THR 11 Ca 0.01 -0.10 -0.12 0.00 -2.27 0.00 0.00 64.05 61.57 2oxg n THR 11 Cb 0.42 -0.04 -0.05 0.00 -2.10 0.00 0.00 70.33 68.56 2oxg n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oxg n GLY 12 N 1.44 1.27 0.67 3.38 0.00 -0.42 -2.57 105.19 108.96 2oxg n GLY 12 Ca 0.05 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2oxg n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oxg n GLY 13 N -1.54 0.65 3.84 -0.02 0.00 -1.12 -5.06 105.19 101.96 2oxg n GLY 13 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 2oxg n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oxg s ALA 14 N -2.29 2.41 0.68 4.61 0.00 -1.06 -5.04 121.76 121.06 2oxg s ALA 14 Ca 0.00 -0.40 -0.11 0.00 0.00 0.00 0.00 51.96 51.45 2oxg s ALA 14 Cb 0.00 -3.04 -0.00 0.00 0.00 0.00 0.00 23.12 20.08 2oxg s ALA 14 CO 0.00 -1.67 1.06 0.00 0.00 0.00 0.00 175.76 175.15 2oxg s ALA 15 N -3.32 2.86 0.07 0.00 0.00 -1.26 -4.82 121.76 115.29 2oxg s ALA 15 Ca 0.61 -0.15 -0.21 0.00 0.00 0.00 0.00 51.96 52.20 2oxg s ALA 15 Cb -0.13 -3.08 -0.07 0.00 0.00 0.00 0.00 23.12 19.84 2oxg s ALA 15 CO 0.52 -1.05 0.64 0.95 0.00 0.00 0.00 175.76 176.82 2oxg s THR 16 N -3.21 4.69 0.36 0.00 -4.23 -1.26 -4.51 115.64 107.48 2oxg s THR 16 Ca 0.57 1.37 0.02 0.00 -1.18 0.00 0.00 61.69 62.47 2oxg s THR 16 Cb -0.12 -3.98 0.07 0.00 1.34 0.00 0.00 72.50 69.81 2oxg s THR 16 CO 0.53 0.50 0.49 0.61 -0.54 0.00 0.00 174.62 176.21 2oxg n GLY 17 N 1.91 1.14 3.43 3.99 0.00 0.57 -4.86 105.19 111.36 2oxg n GLY 17 Ca -0.08 -2.06 -0.22 0.00 0.00 0.00 0.00 46.02 43.67 2oxg n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oxg s GLU 18 N -3.66 1.55 0.00 1.61 0.41 -1.26 -0.78 118.70 116.56 2oxg s GLU 18 Ca 0.34 -1.76 0.00 0.00 -0.41 0.00 0.00 54.97 53.14 2oxg s GLU 18 Cb -0.02 -1.28 0.00 0.00 -1.78 0.00 0.00 34.13 31.04 2oxg s GLU 18 CO 0.22 0.11 0.00 0.41 -0.49 0.00 0.00 175.26 175.52 2oxg n GLY 19 N -0.57 -1.66 2.36 -1.39 0.00 -1.26 -4.91 105.19 97.76 2oxg n GLY 19 Ca -0.06 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.41 2oxg n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oxg n GLY 20 N -1.91 0.89 3.30 -0.02 0.00 -1.26 -4.67 105.19 101.51 2oxg n GLY 20 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2oxg n GLY 20 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2oxg s LEU 21 N 0.00 0.57 -0.07 0.99 2.34 -1.26 -3.83 118.68 117.42 2oxg s LEU 21 Ca 0.00 -0.28 0.04 0.00 0.06 0.00 0.00 54.13 53.96 2oxg s LEU 21 Cb 0.00 1.68 -0.00 0.00 -0.56 0.00 0.00 46.19 47.30 2oxg s LEU 21 CO 0.00 -0.78 -0.21 -0.89 -1.06 0.00 0.00 176.35 173.42 2oxg s THR 22 N -3.41 1.74 -0.18 5.48 2.01 0.10 -4.97 115.64 116.41 2oxg s THR 22 Ca 0.01 -0.87 0.00 0.00 0.31 0.00 0.00 61.69 61.14 2oxg s THR 22 Cb 0.01 -1.50 0.01 0.00 0.01 0.00 0.00 72.50 71.04 2oxg s THR 22 CO -0.09 0.49 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.94 2oxg s LEU 23 N 0.16 2.31 -0.19 4.42 2.96 -1.26 -1.23 118.68 125.84 2oxg s LEU 23 Ca -0.10 -0.58 -0.01 0.00 -0.22 0.00 0.00 54.13 53.22 2oxg s LEU 23 Cb -0.15 -1.53 0.00 0.00 0.50 0.00 0.00 46.19 45.02 2oxg s LEU 23 CO 0.05 0.01 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.07 2oxg s THR 24 N 1.22 2.70 0.01 3.68 2.01 0.59 -4.98 115.64 120.87 2oxg s THR 24 Ca 0.03 -0.73 -0.13 0.00 0.31 0.00 0.00 61.69 61.17 2oxg s THR 24 Cb -0.14 -2.18 0.02 0.00 0.01 0.00 0.00 72.50 70.21 2oxg s THR 24 CO -0.09 0.49 0.27 0.00 -0.69 0.00 0.00 174.62 174.61 2oxg s ALA 25 N 1.28 -0.65 0.51 7.40 0.00 -1.26 -1.36 121.76 127.67 2oxg s ALA 25 Ca 0.04 0.12 -0.22 0.00 0.00 0.00 0.00 51.96 51.90 2oxg s ALA 25 Cb -0.14 0.16 -0.06 0.00 0.00 0.00 0.00 23.12 23.08 2oxg s ALA 25 CO -0.07 -0.30 1.23 -1.25 0.00 0.00 0.00 175.76 175.37 2oxg s PRO 26 N -1.77 3.45 0.21 0.00 0.04 -1.26 -4.93 135.00 130.74 2oxg s PRO 26 Ca -0.11 1.93 -0.09 0.00 0.04 0.00 0.00 61.00 62.77 2oxg s PRO 26 Cb -0.04 -2.29 0.16 0.00 0.04 0.00 0.00 34.50 32.37 2oxg s PRO 26 CO 0.01 -0.84 1.84 1.49 0.04 0.00 0.00 177.00 179.54 2oxg h GLU 27 N 1.70 1.10 -4.52 4.56 4.81 -1.94 -3.42 114.58 116.87 2oxg h GLU 27 Ca -0.50 -0.12 -0.56 0.00 -0.13 0.00 0.00 59.36 58.05 2oxg h GLU 27 Cb 1.27 -0.22 -0.36 0.00 0.63 0.00 0.00 28.75 30.07 2oxg h GLU 27 CO 0.59 0.80 -0.82 0.42 -0.73 0.00 0.00 179.01 179.26 2oxg s ILE 28 N -5.89 1.33 -0.46 2.32 -1.09 -1.26 -1.15 121.20 115.00 2oxg s ILE 28 Ca -0.13 -0.50 -0.14 0.00 -2.23 0.00 0.00 60.65 57.65 2oxg s ILE 28 Cb 0.15 -1.26 0.07 0.00 -1.58 0.00 0.00 42.46 39.84 2oxg s ILE 28 CO 0.81 0.41 0.37 0.00 -1.23 0.00 0.00 174.94 175.30 2oxg s ALA 29 N 1.38 3.51 0.25 9.38 0.00 0.21 -4.93 121.76 131.55 2oxg s ALA 29 Ca 0.01 -2.11 -0.06 0.00 0.00 0.00 0.00 51.96 49.80 2oxg s ALA 29 Cb -0.13 -2.98 0.46 0.00 0.00 0.00 0.00 23.12 20.46 2oxg s ALA 29 CO -0.07 -1.70 1.64 1.05 0.00 0.00 0.00 175.76 176.67 2oxg h GLU 30 N 8.68 0.11 -4.08 0.00 4.11 -1.95 -2.20 114.58 119.24 2oxg h GLU 30 Ca -0.27 -0.01 -0.61 0.00 0.07 0.00 0.00 59.36 58.54 2oxg h GLU 30 Cb 1.11 -0.02 -0.39 0.00 0.50 0.00 0.00 28.75 29.94 2oxg h GLU 30 CO 0.85 0.07 -0.76 1.21 0.07 0.00 0.00 179.01 180.45 2oxg s ASN 31 N -5.18 4.07 0.00 3.06 3.84 -1.26 -2.45 114.94 117.02 2oxg s ASN 31 Ca -0.13 -1.56 0.10 0.00 0.21 0.00 0.00 52.86 51.48 2oxg s ASN 31 Cb 0.23 -1.13 0.52 0.00 -0.55 0.00 0.00 41.25 40.31 2oxg s ASN 31 CO 0.76 -0.34 1.25 0.61 -2.79 0.00 0.00 177.10 176.58 2oxg n GLY 32 N 4.66 -0.67 0.23 1.21 0.00 0.12 -1.75 105.19 108.99 2oxg n GLY 32 Ca -0.04 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.05 2oxg n GLY 32 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2oxg h ASN 33 N 0.00 0.00 -1.52 1.61 2.35 -1.80 0.11 115.58 116.34 2oxg h ASN 33 Ca 0.00 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.55 2oxg h ASN 33 Cb 0.11 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 38.22 2oxg h ASN 33 CO 0.00 0.16 -0.56 0.28 -1.65 0.00 0.00 177.43 175.67 2oxg s THR 34 N -3.58 -0.66 -0.21 2.81 -1.32 -0.72 -4.31 115.64 107.65 2oxg s THR 34 Ca 0.01 -0.45 -0.03 0.00 -1.21 0.00 0.00 61.69 60.01 2oxg s THR 34 Cb 0.09 -0.55 -0.01 0.00 -1.51 0.00 0.00 72.50 70.53 2oxg s THR 34 CO 0.62 -0.29 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.99 2oxg s VAL 35 N 1.90 3.22 0.18 5.08 1.01 0.74 -4.77 120.40 127.77 2oxg s VAL 35 Ca 0.15 -0.55 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 2oxg s VAL 35 Cb -0.11 -2.45 -0.08 0.00 0.00 0.00 0.00 36.38 33.74 2oxg s VAL 35 CO -0.12 0.44 1.19 -2.16 0.00 0.00 0.00 175.10 174.45 2oxg s PRO 36 N 1.38 4.50 -0.03 2.72 0.04 -1.26 -0.67 135.00 141.68 2oxg s PRO 36 Ca 0.05 1.86 0.02 0.00 0.04 0.00 0.00 61.00 62.96 2oxg s PRO 36 Cb -0.14 -3.25 0.01 0.00 0.04 0.00 0.00 34.50 31.16 2oxg s PRO 36 CO -0.04 -0.07 -0.06 0.42 0.04 0.00 0.00 177.00 177.29 2oxg s ILE 37 N -0.06 0.54 -0.01 0.56 -1.09 -0.30 -4.29 121.20 116.54 2oxg s ILE 37 Ca 0.52 -0.20 0.06 0.00 -2.23 0.00 0.00 60.65 58.81 2oxg s ILE 37 Cb -0.32 -0.51 -0.01 0.00 -1.58 0.00 0.00 42.46 40.03 2oxg s ILE 37 CO 0.36 0.19 -0.19 -0.70 -1.23 0.00 0.00 174.94 173.38 2oxg s GLU 38 N 0.45 1.53 0.03 2.79 2.12 -0.46 -1.25 118.70 123.90 2oxg s GLU 38 Ca -0.06 -0.68 0.06 0.00 0.36 0.00 0.00 54.97 54.66 2oxg s GLU 38 Cb -0.10 -1.48 -0.02 0.00 0.26 0.00 0.00 34.13 32.79 2oxg s GLU 38 CO 0.00 0.41 -0.18 0.14 -0.54 0.00 0.00 175.26 175.08 2oxg s VAL 39 N -0.45 1.47 -0.01 3.70 -7.23 0.08 -0.30 120.40 117.67 2oxg s VAL 39 Ca 0.07 -1.04 0.01 0.00 -1.81 0.00 0.00 61.98 59.21 2oxg s VAL 39 Cb -0.07 -1.28 0.00 0.00 0.56 0.00 0.00 36.38 35.59 2oxg s VAL 39 CO -0.01 0.21 -0.02 -0.54 -0.31 0.00 0.00 175.10 174.44 2oxg s LYS 40 N -0.97 0.21 -0.42 4.82 1.02 -0.37 -1.04 119.74 122.99 2oxg s LYS 40 Ca 0.06 -0.05 0.06 0.00 0.02 0.00 0.00 55.97 56.05 2oxg s LYS 40 Cb -0.08 -0.25 0.17 0.00 -0.52 0.00 0.00 37.83 37.16 2oxg s LYS 40 CO 0.01 0.01 0.53 0.00 -0.92 0.00 0.00 175.35 174.98 2oxg s ALA 41 N 0.17 -1.13 -0.03 5.17 0.00 -0.55 0.00 121.76 125.38 2oxg s ALA 41 Ca -0.01 -0.72 -0.38 0.00 0.00 0.00 0.00 51.96 50.85 2oxg s ALA 41 Cb -0.04 -2.35 -0.16 0.00 0.00 0.00 0.00 23.12 20.58 2oxg s ALA 41 CO -0.00 -2.17 1.50 -2.30 0.00 0.00 0.00 175.76 172.79 2oxg n PRO 42 N 3.77 1.24 -0.18 0.00 -0.02 -1.25 -0.83 135.00 137.73 2oxg n PRO 42 Ca 0.15 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2oxg n PRO 42 Cb 0.51 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 2oxg n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oxg n GLY 43 N 3.18 1.45 3.77 -1.23 0.00 -1.26 -5.03 105.19 106.06 2oxg n GLY 43 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 2oxg n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oxg s ALA 44 N -2.76 3.32 -0.17 4.61 0.00 -0.01 -4.14 121.76 122.61 2oxg s ALA 44 Ca 0.00 1.24 0.17 0.00 0.00 0.00 0.00 51.96 53.37 2oxg s ALA 44 Cb 0.00 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.64 2oxg s ALA 44 CO 0.00 -0.78 1.20 -0.39 0.00 0.00 0.00 175.76 175.80 2oxg h VAL 45 N 2.60 0.61 -2.17 0.00 -1.51 -0.53 -3.44 116.25 111.81 2oxg h VAL 45 Ca -0.49 -1.95 -0.07 0.00 -1.23 0.00 0.00 66.70 62.95 2oxg h VAL 45 Cb 1.24 2.18 -0.20 0.00 -2.13 0.00 0.00 31.29 32.38 2oxg h VAL 45 CO 0.63 0.34 0.10 0.00 -1.23 0.00 0.00 177.57 177.42 2oxg s ALA 46 N -3.00 -1.61 -0.10 5.19 0.00 -1.19 -1.72 121.76 119.34 2oxg s ALA 46 Ca 0.01 1.28 0.01 0.00 0.00 0.00 0.00 51.96 53.26 2oxg s ALA 46 Cb 0.08 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 23.03 2oxg s ALA 46 CO 0.77 -0.34 -0.13 0.42 0.00 0.00 0.00 175.76 176.47 2oxg s ILE 47 N -0.94 1.32 -0.12 0.00 1.01 0.22 -0.83 121.20 121.86 2oxg s ILE 47 Ca -0.09 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 59.99 2oxg s ILE 47 Cb -0.02 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.20 2oxg s ILE 47 CO 0.08 0.41 -0.01 -0.32 0.00 0.00 0.00 174.94 175.10 2oxg s MET 48 N 1.05 3.32 -0.13 2.79 1.75 0.47 -0.35 119.30 128.20 2oxg s MET 48 Ca -0.06 -0.44 -0.01 0.00 -1.25 0.00 0.00 55.69 53.93 2oxg s MET 48 Cb -0.15 -2.88 -0.02 0.00 2.84 0.00 0.00 34.83 34.62 2oxg s MET 48 CO -0.02 0.50 -0.08 -0.51 -0.65 0.00 0.00 175.02 174.27 2oxg s LEU 49 N -0.33 3.01 0.10 4.11 1.43 -0.04 -0.97 118.68 125.99 2oxg s LEU 49 Ca 0.07 -0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.06 2oxg s LEU 49 Cb -0.12 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 2oxg s LEU 49 CO 0.02 0.21 -0.22 -0.76 0.23 0.00 0.00 176.35 175.83 2oxg s LEU 50 N 0.11 2.29 -0.31 1.79 1.43 0.15 -0.89 118.68 123.25 2oxg s LEU 50 Ca -0.03 -0.68 0.03 0.00 -1.03 0.00 0.00 54.13 52.41 2oxg s LEU 50 Cb -0.14 -0.94 0.09 0.00 0.03 0.00 0.00 46.19 45.23 2oxg s LEU 50 CO 0.04 0.08 0.03 0.00 0.23 0.00 0.00 176.35 176.73 2oxg s ALA 51 N -1.12 2.48 -0.30 4.21 0.00 0.24 -0.82 121.76 126.45 2oxg s ALA 51 Ca 0.08 -2.15 0.27 0.00 0.00 0.00 0.00 51.96 50.16 2oxg s ALA 51 Cb -0.10 -1.80 1.06 0.00 0.00 0.00 0.00 23.12 22.28 2oxg s ALA 51 CO 0.04 -1.57 1.81 0.00 0.00 0.00 0.00 175.76 176.04 2oxg h ALA 52 N 7.76 1.00 -0.37 0.00 0.00 -1.44 -2.17 119.26 124.04 2oxg h ALA 52 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2oxg h ALA 52 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2oxg h ALA 52 CO 0.49 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.15 2oxg n GLY 53 N 0.22 1.71 3.85 0.00 0.00 -1.26 -4.98 105.19 104.74 2oxg n GLY 53 Ca 0.02 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 2oxg n GLY 53 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2oxg s ASN 54 N -1.35 6.73 0.43 1.61 0.01 -0.82 -4.77 114.94 116.80 2oxg s ASN 54 Ca 0.35 1.22 0.10 0.00 -0.71 0.00 0.00 52.86 53.82 2oxg s ASN 54 Cb 0.21 -2.35 0.96 0.00 0.41 0.00 0.00 41.25 40.48 2oxg s ASN 54 CO 0.28 -0.20 2.05 1.55 -1.51 0.00 0.00 177.10 179.28 2oxg h PRO 55 N 2.22 0.42 -3.72 -0.60 0.13 -1.93 -3.25 132.00 125.27 2oxg h PRO 55 Ca -0.48 -0.03 -0.64 0.00 -0.87 0.00 0.00 66.00 63.99 2oxg h PRO 55 Cb 1.17 -0.10 -0.41 0.00 0.13 0.00 0.00 31.00 31.80 2oxg h PRO 55 CO 0.66 0.28 -0.68 -2.00 -0.23 0.00 0.00 178.00 176.03 2oxg s GLU 56 N -5.41 1.66 0.54 0.86 2.12 -1.26 -5.02 118.70 112.19 2oxg s GLU 56 Ca -0.08 -2.23 0.29 0.00 0.36 0.00 0.00 54.97 53.32 2oxg s GLU 56 Cb 0.18 -3.07 1.51 0.00 0.26 0.00 0.00 34.13 33.01 2oxg s GLU 56 CO 0.73 -1.06 2.08 -1.35 -0.54 0.00 0.00 175.26 175.12 2oxg h PRO 57 N 6.95 0.00 -6.61 4.30 0.11 -1.75 -3.44 132.00 131.56 2oxg h PRO 57 Ca -0.06 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.52 2oxg h PRO 57 Cb 0.94 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.09 2oxg h PRO 57 CO 0.60 0.10 0.86 0.00 -0.21 0.00 0.00 178.00 179.35 2oxg s ALA 58 N -4.13 3.75 -0.17 -0.75 0.00 -1.26 -0.59 121.76 118.61 2oxg s ALA 58 Ca -0.03 1.35 -0.13 0.00 0.00 0.00 0.00 51.96 53.15 2oxg s ALA 58 Cb 0.13 -3.61 -0.07 0.00 0.00 0.00 0.00 23.12 19.57 2oxg s ALA 58 CO 0.57 -0.76 -0.29 0.28 0.00 0.00 0.00 175.76 175.55 2oxg n VAL 59 N 3.85 1.37 -3.53 0.00 0.31 -0.07 -4.88 118.33 115.37 2oxg n VAL 59 Ca 0.13 -0.02 -0.09 0.00 -0.01 0.00 0.00 64.34 64.36 2oxg n VAL 59 Cb 0.39 -2.05 -0.03 0.00 -0.91 0.00 0.00 33.84 31.24 2oxg n VAL 59 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oxg s ALA 60 N -2.61 -1.88 -0.13 3.52 0.00 -1.16 -5.01 121.76 114.49 2oxg s ALA 60 Ca -0.27 1.25 0.00 0.00 0.00 0.00 0.00 51.96 52.94 2oxg s ALA 60 Cb 0.07 0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.22 2oxg s ALA 60 CO 0.37 -0.56 -0.13 0.99 0.00 0.00 0.00 175.76 176.44 2oxg s THR 61 N -2.40 1.43 -0.28 0.00 2.01 -1.26 -0.86 115.64 114.28 2oxg s THR 61 Ca 0.03 -0.55 -0.14 0.00 0.31 0.00 0.00 61.69 61.34 2oxg s THR 61 Cb -0.01 -1.35 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 2oxg s THR 61 CO -0.05 0.43 0.31 -0.36 -0.69 0.00 0.00 174.62 174.26 2oxg s PHE 62 N 1.42 3.23 -0.24 4.92 0.08 0.53 -4.96 117.98 122.96 2oxg s PHE 62 Ca 0.02 0.27 -0.06 0.00 0.12 0.00 0.00 56.93 57.28 2oxg s PHE 62 Cb -0.13 -2.51 -0.01 0.00 -0.57 0.00 0.00 43.02 39.79 2oxg s PHE 62 CO -0.08 -0.22 0.02 1.21 -0.10 0.00 0.00 175.22 176.04 2oxg s ASN 63 N 1.69 4.74 -0.11 1.36 3.84 -1.26 -0.61 114.94 124.59 2oxg s ASN 63 Ca 0.12 -0.37 -0.21 0.00 0.21 0.00 0.00 52.86 52.60 2oxg s ASN 63 Cb -0.16 -1.83 -0.04 0.00 -0.55 0.00 0.00 41.25 38.68 2oxg s ASN 63 CO 0.10 -0.05 0.61 -0.36 -2.79 0.00 0.00 177.10 174.61 2oxg s PHE 64 N 1.53 3.52 0.67 0.43 0.40 -0.70 -5.01 117.98 118.82 2oxg s PHE 64 Ca 0.05 1.06 0.03 0.00 -0.60 0.00 0.00 56.93 57.48 2oxg s PHE 64 Cb -0.15 -2.71 0.13 0.00 0.51 0.00 0.00 43.02 40.79 2oxg s PHE 64 CO 0.00 0.07 0.92 0.41 0.70 0.00 0.00 175.22 177.32 2oxg n GLY 65 N 3.28 1.13 0.30 4.36 0.00 -1.26 -4.90 105.19 108.11 2oxg n GLY 65 Ca -0.03 -2.10 0.17 0.00 0.00 0.00 0.00 46.02 44.05 2oxg n GLY 65 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2oxg h PRO 66 N 0.00 0.00 -0.13 1.61 0.11 -2.02 -2.09 132.00 129.48 2oxg h PRO 66 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2oxg h PRO 66 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2oxg h PRO 66 CO 0.36 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 178.17 2oxg n ALA 67 N -2.26 2.50 -1.92 -0.75 0.00 -1.26 -4.87 120.51 111.96 2oxg n ALA 67 Ca -0.03 -0.63 -0.41 0.00 0.00 0.00 0.00 53.44 52.38 2oxg n ALA 67 Cb 0.10 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 2oxg n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oxg s ALA 68 N -1.85 3.51 0.14 0.00 0.00 -0.79 -4.93 121.76 117.84 2oxg s ALA 68 Ca 0.34 1.13 0.08 0.00 0.00 0.00 0.00 51.96 53.52 2oxg s ALA 68 Cb 0.20 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 2oxg s ALA 68 CO 0.30 -0.53 1.36 0.00 0.00 0.00 0.00 175.76 176.89 2oxg h ALA 69 N 4.75 0.50 -2.86 0.00 0.00 -1.89 -3.48 119.26 116.27 2oxg h ALA 69 Ca -0.46 -0.81 0.05 0.00 0.00 0.00 0.00 54.91 53.69 2oxg h ALA 69 Cb 1.22 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2oxg h ALA 69 CO 0.74 1.12 0.34 0.16 0.00 0.00 0.00 179.25 181.60 2oxg s ASP 70 N -6.72 -0.07 -0.70 0.00 1.47 -1.26 -5.08 116.67 104.30 2oxg s ASP 70 Ca 0.01 -0.88 0.02 0.00 1.18 0.00 0.00 52.55 52.88 2oxg s ASP 70 Cb 0.10 0.73 0.36 0.00 -0.34 0.00 0.00 42.92 43.77 2oxg s ASP 70 CO 0.80 -1.42 1.41 0.00 0.68 0.00 0.00 175.17 176.65 2oxg n GLN 71 N -0.54 3.72 -4.40 2.11 3.00 -1.26 -4.97 117.38 115.04 2oxg n GLN 71 Ca -0.06 -4.46 -0.34 0.00 -0.01 0.00 0.00 57.00 52.12 2oxg n GLN 71 Cb 0.60 -2.30 -0.10 0.00 0.00 0.00 0.00 30.24 28.44 2oxg n GLN 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 2oxg s ARG 72 N -3.82 2.92 -0.04 -1.09 3.52 -1.26 -1.48 118.95 117.70 2oxg s ARG 72 Ca 0.47 -0.46 -0.07 0.00 -0.13 0.00 0.00 55.73 55.54 2oxg s ARG 72 Cb 0.32 -2.75 0.01 0.00 -1.56 0.00 0.00 34.95 30.98 2oxg s ARG 72 CO -0.21 0.69 0.17 0.00 -0.81 0.00 0.00 175.30 175.14 2oxg s ALA 73 N -0.91 -0.40 0.06 6.12 0.00 -0.21 -5.01 121.76 121.42 2oxg s ALA 73 Ca 0.14 0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.40 2oxg s ALA 73 Cb -0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 2oxg s ALA 73 CO 0.03 -0.14 -0.15 0.00 0.00 0.00 0.00 175.76 175.51 2oxg s ALA 74 N -0.52 1.23 0.17 0.00 0.00 -1.26 -0.74 121.76 120.63 2oxg s ALA 74 Ca -0.06 -0.95 -0.03 0.00 0.00 0.00 0.00 51.96 50.91 2oxg s ALA 74 Cb -0.04 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.95 2oxg s ALA 74 CO 0.01 0.21 0.28 -2.37 0.00 0.00 0.00 175.76 173.89 2oxg n THR 75 N 1.51 0.00 -4.86 0.00 5.66 -0.38 -5.01 114.28 111.20 2oxg n THR 75 Ca -0.20 -0.64 -0.26 0.00 -3.05 0.00 0.00 64.05 59.91 2oxg n THR 75 Cb 0.54 0.47 -0.16 0.00 -1.55 0.00 0.00 70.33 69.64 2oxg n THR 75 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2oxg s ARG 76 N -2.22 1.63 0.28 1.09 0.52 -1.26 -1.15 118.95 117.85 2oxg s ARG 76 Ca 0.10 -0.63 0.04 0.00 -0.52 0.00 0.00 55.73 54.72 2oxg s ARG 76 Cb -0.01 -1.49 -0.06 0.00 0.52 0.00 0.00 34.95 33.91 2oxg s ARG 76 CO 0.08 0.32 0.02 0.96 0.02 0.00 0.00 175.30 176.70 2oxg s ILE 77 N -0.20 1.17 -0.14 1.52 -4.36 0.15 -4.80 121.20 114.55 2oxg s ILE 77 Ca 0.02 -2.03 -0.05 0.00 -0.26 0.00 0.00 60.65 58.32 2oxg s ILE 77 Cb -0.09 -2.59 -0.04 0.00 1.25 0.00 0.00 42.46 40.99 2oxg s ILE 77 CO 0.01 -0.14 0.05 -0.13 0.24 0.00 0.00 174.94 174.96 2oxg s ARG 78 N -3.87 3.57 -0.11 0.37 0.52 -1.26 -0.18 118.95 117.98 2oxg s ARG 78 Ca 0.33 -0.34 0.01 0.00 -0.52 0.00 0.00 55.73 55.21 2oxg s ARG 78 Cb 0.07 -3.06 0.02 0.00 0.52 0.00 0.00 34.95 32.50 2oxg s ARG 78 CO 0.13 0.48 -0.13 -0.51 0.02 0.00 0.00 175.30 175.29 2oxg s LEU 79 N -0.24 1.59 0.39 2.53 1.43 0.40 -4.94 118.68 119.83 2oxg s LEU 79 Ca 0.07 -0.39 0.15 0.00 -1.03 0.00 0.00 54.13 52.93 2oxg s LEU 79 Cb -0.12 -1.02 0.78 0.00 0.03 0.00 0.00 46.19 45.87 2oxg s LEU 79 CO 0.02 -0.02 1.84 0.00 0.23 0.00 0.00 176.35 178.41 2oxg h ALA 80 N 7.63 1.34 -2.11 4.21 0.00 -1.86 0.09 119.26 128.55 2oxg h ALA 80 Ca -0.32 -0.32 0.24 0.00 0.00 0.00 0.00 54.91 54.51 2oxg h ALA 80 Cb 1.16 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 2oxg h ALA 80 CO 0.48 0.44 0.68 1.14 0.00 0.00 0.00 179.25 181.98 2oxg s GLN 81 N -4.14 0.88 0.16 0.00 0.00 -1.26 -4.20 119.66 111.10 2oxg s GLN 81 Ca -0.03 -0.53 -0.34 0.00 -0.00 0.00 0.00 55.36 54.47 2oxg s GLN 81 Cb 0.14 0.27 -0.15 0.00 0.00 0.00 0.00 33.01 33.27 2oxg s GLN 81 CO 0.71 -0.41 1.38 2.41 0.00 0.00 0.00 175.29 179.38 2oxg n THR 82 N -0.61 0.41 -3.74 3.63 -1.04 -1.26 -4.71 114.28 106.96 2oxg n THR 82 Ca -0.04 -0.10 -0.02 0.00 -2.04 0.00 0.00 64.05 61.85 2oxg n THR 82 Cb 0.61 -1.17 -0.01 0.00 -1.82 0.00 0.00 70.33 67.94 2oxg n THR 82 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2oxg s GLN 83 N 0.21 0.96 -0.04 -2.82 -2.07 -0.92 -4.92 119.66 110.05 2oxg s GLN 83 Ca 0.77 -0.55 -0.18 0.00 -1.82 0.00 0.00 55.36 53.58 2oxg s GLN 83 Cb -0.79 0.31 -0.05 0.00 -1.09 0.00 0.00 33.01 31.40 2oxg s GLN 83 CO 0.46 -0.44 0.50 -0.51 -1.32 0.00 0.00 175.29 173.98 2oxg s ASP 84 N -3.04 6.82 -0.15 12.60 1.11 -1.26 -0.85 116.67 131.89 2oxg s ASP 84 Ca 0.15 0.98 -0.07 0.00 0.18 0.00 0.00 52.55 53.78 2oxg s ASP 84 Cb 0.00 -2.30 -0.04 0.00 1.07 0.00 0.00 42.92 41.65 2oxg s ASP 84 CO 0.01 0.13 0.11 -0.69 1.18 0.00 0.00 175.17 175.91 2oxg s VAL 85 N -0.16 5.25 -0.07 -1.27 1.01 0.24 -1.22 120.40 124.18 2oxg s VAL 85 Ca 0.27 0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.42 2oxg s VAL 85 Cb -0.17 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.88 2oxg s VAL 85 CO 0.13 0.54 -0.23 -0.63 0.00 0.00 0.00 175.10 174.91 2oxg s ILE 86 N -0.38 1.93 -0.11 2.22 1.01 -0.00 -1.24 121.20 124.63 2oxg s ILE 86 Ca 0.11 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 59.80 2oxg s ILE 86 Cb -0.12 -1.66 -0.02 0.00 0.01 0.00 0.00 42.46 40.68 2oxg s ILE 86 CO 0.01 0.54 -0.15 0.00 0.00 0.00 0.00 174.94 175.34 2oxg s ALA 87 N 0.12 2.56 -0.12 9.38 0.00 0.10 -0.67 121.76 133.14 2oxg s ALA 87 Ca -0.11 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 50.95 2oxg s ALA 87 Cb -0.15 -1.10 -0.00 0.00 0.00 0.00 0.00 23.12 21.86 2oxg s ALA 87 CO 0.06 0.32 -0.19 -0.51 0.00 0.00 0.00 175.76 175.44 2oxg s LEU 88 N 0.10 2.33 -0.07 0.00 1.43 -0.15 -1.13 118.68 121.20 2oxg s LEU 88 Ca -0.07 -0.48 0.05 0.00 -1.03 0.00 0.00 54.13 52.60 2oxg s LEU 88 Cb -0.15 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.57 2oxg s LEU 88 CO 0.05 0.15 -0.23 0.00 0.23 0.00 0.00 176.35 176.55 2oxg s ALA 89 N 0.41 2.01 -0.15 4.21 0.00 -0.01 -0.40 121.76 127.84 2oxg s ALA 89 Ca -0.14 -0.93 -0.04 0.00 0.00 0.00 0.00 51.96 50.85 2oxg s ALA 89 Cb -0.17 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2oxg s ALA 89 CO 0.06 0.34 -0.03 0.21 0.00 0.00 0.00 175.76 176.34 2oxg s LYS 90 N 0.06 3.61 0.48 0.00 2.20 -0.01 -1.05 119.74 125.03 2oxg s LYS 90 Ca -0.09 -0.51 0.04 0.00 -0.36 0.00 0.00 55.97 55.05 2oxg s LYS 90 Cb -0.15 -2.90 0.02 0.00 -1.51 0.00 0.00 37.83 33.29 2oxg s LYS 90 CO 0.05 0.29 0.67 -1.64 -0.36 0.00 0.00 175.35 174.35 2oxg s MET 91 N 0.24 2.73 0.51 4.03 -1.94 0.21 0.20 119.30 125.29 2oxg s MET 91 Ca -0.02 -0.95 0.20 0.00 -1.71 0.00 0.00 55.69 53.21 2oxg s MET 91 Cb -0.14 -2.62 1.30 0.00 2.01 0.00 0.00 34.83 35.38 2oxg s MET 91 CO 0.03 -0.45 2.06 0.00 -0.01 0.00 0.00 175.02 176.64 2oxg h ALA 92 N 0.37 2.23 -0.02 3.03 0.00 -1.89 0.52 119.26 123.50 2oxg h ALA 92 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2oxg h ALA 92 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2oxg h ALA 92 CO 0.50 -0.32 0.00 -0.40 0.00 0.00 0.00 179.25 179.03 2oxg n ASP 93 N -4.46 0.42 0.00 0.00 5.75 -1.26 -4.89 116.55 112.11 2oxg n ASP 93 Ca 0.04 -1.31 0.00 0.00 -0.01 0.00 0.00 54.79 53.51 2oxg n ASP 93 Cb 0.36 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 2oxg n ASP 93 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2oxg n GLY 94 N 0.96 1.16 3.77 6.12 0.00 0.17 -5.05 105.19 112.32 2oxg n GLY 94 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2oxg n GLY 94 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oxg s SER 95 N -2.78 5.29 -0.02 1.61 1.04 -1.26 -4.69 113.70 112.89 2oxg s SER 95 Ca 0.00 2.15 0.05 0.00 0.48 0.00 0.00 55.95 58.62 2oxg s SER 95 Cb 0.00 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.54 2oxg s SER 95 CO 0.00 -1.51 -0.17 -0.69 0.98 0.00 0.00 173.24 171.85 2oxg s VAL 96 N -2.00 1.33 0.16 5.02 1.01 -1.26 -0.61 120.40 124.05 2oxg s VAL 96 Ca 0.71 -0.70 0.11 0.00 0.00 0.00 0.00 61.98 62.10 2oxg s VAL 96 Cb -0.24 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 2oxg s VAL 96 CO 0.35 0.38 -0.25 0.68 0.00 0.00 0.00 175.10 176.26 2oxg s VAL 97 N -0.24 2.36 0.01 2.92 -7.23 -0.21 -0.32 120.40 117.69 2oxg s VAL 97 Ca 0.03 -1.88 0.05 0.00 -1.81 0.00 0.00 61.98 58.38 2oxg s VAL 97 Cb -0.08 -2.09 -0.02 0.00 0.56 0.00 0.00 36.38 34.75 2oxg s VAL 97 CO 0.00 -0.01 -0.17 -0.75 -0.31 0.00 0.00 175.10 173.86 2oxg s LYS 98 N -2.38 1.23 0.07 4.82 2.20 0.04 -0.83 119.74 124.88 2oxg s LYS 98 Ca 0.18 -0.70 0.03 0.00 -0.36 0.00 0.00 55.97 55.12 2oxg s LYS 98 Cb -0.09 -1.23 -0.03 0.00 -1.51 0.00 0.00 37.83 34.97 2oxg s LYS 98 CO 0.08 0.33 -0.10 0.00 -0.36 0.00 0.00 175.35 175.30 2oxg s ALA 99 N -0.59 0.92 -0.14 3.13 0.00 -0.29 -4.47 121.76 120.32 2oxg s ALA 99 Ca 0.05 -0.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.91 2oxg s ALA 99 Cb -0.07 0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.09 2oxg s ALA 99 CO 0.00 0.02 0.38 -1.14 0.00 0.00 0.00 175.76 175.02 2oxg s GLN 100 N -2.07 0.42 0.03 0.00 0.74 -1.26 -0.72 119.66 116.80 2oxg s GLN 100 Ca -0.02 0.57 -0.10 0.00 0.05 0.00 0.00 55.36 55.86 2oxg s GLN 100 Cb -0.07 0.15 0.01 0.00 1.10 0.00 0.00 33.01 34.20 2oxg s GLN 100 CO 0.01 -0.08 0.20 -0.08 -0.55 0.00 0.00 175.29 174.79 2oxg s THR 101 N 0.47 0.10 -0.07 -0.34 -1.32 -0.37 -4.98 115.64 109.12 2oxg s THR 101 Ca -0.02 -0.79 -0.17 0.00 -1.21 0.00 0.00 61.69 59.50 2oxg s THR 101 Cb -0.04 -0.77 -0.05 0.00 -1.51 0.00 0.00 72.50 70.13 2oxg s THR 101 CO -0.02 -0.44 0.45 -0.89 -2.21 0.00 0.00 174.62 171.51 2oxg s THR 102 N -2.16 5.12 -0.18 5.08 2.01 -1.26 -0.59 115.64 123.66 2oxg s THR 102 Ca -0.08 0.91 -0.00 0.00 0.31 0.00 0.00 61.69 62.83 2oxg s THR 102 Cb -0.03 -3.78 0.01 0.00 0.01 0.00 0.00 72.50 68.71 2oxg s THR 102 CO -0.02 0.42 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.49 2oxg s VAL 103 N -0.02 2.55 0.09 3.82 1.01 -0.03 -4.73 120.40 123.09 2oxg s VAL 103 Ca 0.25 -0.79 -0.27 0.00 0.00 0.00 0.00 61.98 61.17 2oxg s VAL 103 Cb -0.16 -2.09 -0.06 0.00 0.00 0.00 0.00 36.38 34.07 2oxg s VAL 103 CO 0.11 0.51 0.85 -0.54 0.00 0.00 0.00 175.10 176.03 2oxg s LYS 104 N 1.13 4.60 -0.07 2.72 1.02 -0.30 -2.17 119.74 126.66 2oxg s LYS 104 Ca 0.01 1.24 0.04 0.00 0.02 0.00 0.00 55.97 57.27 2oxg s LYS 104 Cb -0.14 -3.35 -0.00 0.00 -0.52 0.00 0.00 37.83 33.82 2oxg s LYS 104 CO -0.06 0.30 -0.21 0.08 -0.92 0.00 0.00 175.35 174.55 2oxg s VAL 105 N -0.22 1.77 0.00 3.17 1.01 -1.26 0.64 120.40 125.51 2oxg s VAL 105 Ca 0.41 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2oxg s VAL 105 Cb -0.22 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.63 2oxg s VAL 105 CO 0.26 0.50 0.00 0.41 0.00 0.00 0.00 175.10 176.27 2oxg n THR 106 N 3.39 0.00 -2.85 3.92 -1.04 -0.83 -4.41 114.28 112.47 2oxg n THR 106 Ca -0.19 0.46 -0.42 0.00 -2.04 0.00 0.00 64.05 61.86 2oxg n THR 106 Cb 0.53 -1.42 -0.04 0.00 -1.82 0.00 0.00 70.33 67.58 2oxg n THR 106 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2oxg s ILE 107 N -0.91 4.84 0.33 12.58 1.01 -1.03 -4.95 121.20 133.08 2oxg s ILE 107 Ca 0.00 1.71 -0.28 0.00 0.00 0.00 0.00 60.65 62.07 2oxg s ILE 107 Cb 0.00 -4.17 -0.10 0.00 0.01 0.00 0.00 42.46 38.20 2oxg s ILE 107 CO 0.00 -0.01 1.25 -0.83 0.00 0.00 0.00 174.94 175.35 2oxg s GLY 108 N 1.18 3.00 -0.13 6.18 0.00 -1.26 0.11 107.32 116.41 2oxg s GLY 108 Ca 0.39 1.16 0.15 0.00 0.00 0.00 0.00 44.72 46.43 2oxg s GLY 108 CO 0.12 1.78 1.46 0.61 0.00 0.00 0.00 173.10 177.07 2oxg n GLY 109 N 0.86 3.34 0.00 0.20 0.00 0.02 -4.52 105.19 105.09 2oxg n GLY 109 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2oxg n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32