#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oxc s THR 2 N 0.00 2.18 0.08 0.00 2.01 -1.26 -5.02 115.64 113.63 1oxc s THR 2 Ca 0.00 0.17 0.02 0.00 0.31 0.00 0.00 61.69 62.19 1oxc s THR 2 Cb 0.00 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.37 1oxc s THR 2 CO 0.00 0.03 -0.08 -1.10 -0.69 0.00 0.00 174.62 172.79 1oxc s GLN 3 N -2.24 0.74 0.00 4.92 -1.52 -1.26 -4.85 119.66 115.46 1oxc s GLN 3 Ca 0.56 -1.13 0.00 0.00 -1.95 0.00 0.00 55.36 52.85 1oxc s GLN 3 Cb -0.44 -0.29 0.00 0.00 -0.22 0.00 0.00 33.01 32.06 1oxc s GLN 3 CO 0.58 0.02 0.00 0.41 -0.25 0.00 0.00 175.29 176.05 1oxc n GLY 4 N 0.52 0.64 3.38 3.09 0.00 -1.26 -4.91 105.19 106.65 1oxc n GLY 4 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1oxc n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oxc s VAL 5 N -2.43 3.15 0.01 1.61 1.01 -1.26 -0.58 120.40 121.90 1oxc s VAL 5 Ca 0.00 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.38 1oxc s VAL 5 Cb 0.00 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 1oxc s VAL 5 CO 0.00 0.52 -0.08 -0.36 0.00 0.00 0.00 175.10 175.18 1oxc s PHE 6 N 0.40 0.68 -0.36 5.22 0.08 0.39 -5.01 117.98 119.38 1oxc s PHE 6 Ca -0.09 -0.19 -0.11 0.00 0.12 0.00 0.00 56.93 56.66 1oxc s PHE 6 Cb -0.16 -0.43 0.02 0.00 -0.57 0.00 0.00 43.02 41.88 1oxc s PHE 6 CO 0.05 -0.02 0.19 0.99 -0.10 0.00 0.00 175.22 176.34 1oxc s THR 7 N -0.39 4.61 0.32 0.64 2.01 -1.26 -1.18 115.64 120.40 1oxc s THR 7 Ca 0.01 -0.72 0.07 0.00 0.31 0.00 0.00 61.69 61.36 1oxc s THR 7 Cb -0.04 -3.51 -0.02 0.00 0.01 0.00 0.00 72.50 68.94 1oxc s THR 7 CO -0.00 -0.15 0.37 -0.76 -0.69 0.00 0.00 174.62 173.39 1oxc s LEU 8 N 1.58 3.82 0.57 4.42 1.02 0.53 -5.02 118.68 125.61 1oxc s LEU 8 Ca 0.03 -0.31 -0.20 0.00 0.02 0.00 0.00 54.13 53.67 1oxc s LEU 8 Cb -0.19 -2.50 -0.04 0.00 0.02 0.00 0.00 46.19 43.48 1oxc s LEU 8 CO 0.07 -0.35 1.28 -2.16 0.02 0.00 0.00 176.35 175.20 1oxc s PRO 9 N -4.07 3.04 0.68 1.29 0.04 -1.26 -4.47 135.00 130.25 1oxc s PRO 9 Ca 0.42 2.02 -0.16 0.00 0.04 0.00 0.00 61.00 63.32 1oxc s PRO 9 Cb -0.08 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.39 1oxc s PRO 9 CO 0.29 -1.21 1.17 0.00 0.04 0.00 0.00 177.00 177.29 1oxc s ALA 10 N -1.44 2.30 -1.53 8.56 0.00 -1.26 -3.75 121.76 124.64 1oxc s ALA 10 Ca 0.75 0.79 -0.02 0.00 0.00 0.00 0.00 51.96 53.48 1oxc s ALA 10 Cb -0.35 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.37 1oxc s ALA 10 CO 0.40 -1.56 0.20 0.09 0.00 0.00 0.00 175.76 174.89 1oxc n ASN 11 N -2.43 0.22 -4.18 0.00 3.02 0.27 -4.88 115.26 107.28 1oxc n ASN 11 Ca 0.12 -1.18 -0.29 0.00 -0.03 0.00 0.00 54.58 53.20 1oxc n ASN 11 Cb 0.51 -2.11 -0.17 0.00 -0.61 0.00 0.00 39.78 37.40 1oxc n ASN 11 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1oxc s THR 12 N -4.14 1.76 0.26 3.41 2.01 -1.25 -4.86 115.64 112.83 1oxc s THR 12 Ca 0.08 -0.87 -0.29 0.00 0.31 0.00 0.00 61.69 60.92 1oxc s THR 12 Cb -0.05 -1.52 -0.09 0.00 0.01 0.00 0.00 72.50 70.85 1oxc s THR 12 CO 0.96 0.49 1.15 -0.13 -0.69 0.00 0.00 174.62 176.41 1oxc s ARG 13 N 0.21 4.56 0.05 4.92 0.52 -1.26 -0.85 118.95 127.09 1oxc s ARG 13 Ca -0.11 1.88 -0.04 0.00 -0.52 0.00 0.00 55.73 56.94 1oxc s ARG 13 Cb -0.15 -3.19 -0.02 0.00 0.52 0.00 0.00 34.95 32.11 1oxc s ARG 13 CO 0.05 0.07 0.05 -0.59 0.02 0.00 0.00 175.30 174.91 1oxc s PHE 14 N -0.84 0.33 -0.01 -0.53 -0.71 0.25 -4.17 117.98 112.30 1oxc s PHE 14 Ca 0.47 -0.76 -0.02 0.00 -1.04 0.00 0.00 56.93 55.59 1oxc s PHE 14 Cb -0.33 -0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.20 1oxc s PHE 14 CO 0.41 -0.39 0.14 0.20 -1.34 0.00 0.00 175.22 174.25 1oxc s GLY 15 N -2.53 2.11 -0.05 1.99 0.00 -0.07 -0.98 107.32 107.79 1oxc s GLY 15 Ca 0.01 -0.81 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1oxc s GLY 15 CO -0.08 -0.70 -0.03 0.54 0.00 0.00 0.00 173.10 172.84 1oxc s VAL 16 N -1.27 0.48 -0.02 1.40 0.11 -0.33 -1.17 120.40 119.61 1oxc s VAL 16 Ca 0.25 -0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.28 1oxc s VAL 16 Cb -0.12 -0.55 0.00 0.00 -1.53 0.00 0.00 36.38 34.18 1oxc s VAL 16 CO 0.17 0.23 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.21 1oxc s THR 17 N 1.25 0.63 -0.01 5.04 2.01 -0.16 -1.31 115.64 123.09 1oxc s THR 17 Ca -0.06 -0.29 0.07 0.00 0.31 0.00 0.00 61.69 61.73 1oxc s THR 17 Cb -0.14 -0.57 -0.02 0.00 0.01 0.00 0.00 72.50 71.78 1oxc s THR 17 CO -0.02 0.20 -0.24 0.00 -0.69 0.00 0.00 174.62 173.88 1oxc s ALA 18 N 0.19 1.98 0.07 7.40 0.00 0.17 -0.77 121.76 130.81 1oxc s ALA 18 Ca -0.02 -1.04 0.08 0.00 0.00 0.00 0.00 51.96 50.98 1oxc s ALA 18 Cb -0.07 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.52 1oxc s ALA 18 CO 0.00 0.48 -0.23 -0.06 0.00 0.00 0.00 175.76 175.96 1oxc s PHE 19 N -0.58 1.98 -0.05 0.00 0.08 0.50 -1.07 117.98 118.84 1oxc s PHE 19 Ca 0.09 -0.39 0.05 0.00 0.12 0.00 0.00 56.93 56.80 1oxc s PHE 19 Cb -0.09 -1.14 -0.02 0.00 -0.57 0.00 0.00 43.02 41.20 1oxc s PHE 19 CO -0.01 0.16 -0.20 0.00 -0.10 0.00 0.00 175.22 175.08 1oxc s ALA 20 N -0.92 2.42 -0.43 5.36 0.00 -0.93 -0.85 121.76 126.41 1oxc s ALA 20 Ca 0.09 -1.02 0.07 0.00 0.00 0.00 0.00 51.96 51.09 1oxc s ALA 20 Cb -0.09 -0.81 0.24 0.00 0.00 0.00 0.00 23.12 22.45 1oxc s ALA 20 CO 0.03 0.49 0.64 0.09 0.00 0.00 0.00 175.76 177.02 1oxc n ASN 21 N 2.59 -1.14 -3.51 0.00 3.02 -0.29 -1.52 115.26 114.40 1oxc n ASN 21 Ca -0.17 -2.89 -0.08 0.00 -0.03 0.00 0.00 54.58 51.41 1oxc n ASN 21 Cb 0.52 0.35 -0.02 0.00 -0.61 0.00 0.00 39.78 40.02 1oxc n ASN 21 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1oxc s SER 22 N -1.15 -0.35 0.46 6.41 0.15 0.49 -3.86 113.70 115.85 1oxc s SER 22 Ca 0.34 0.00 0.26 0.00 0.70 0.00 0.00 55.95 57.25 1oxc s SER 22 Cb 0.17 0.37 0.85 0.00 -1.71 0.00 0.00 66.02 65.70 1oxc s SER 22 CO -0.16 -0.59 1.79 0.77 1.20 0.00 0.00 173.24 176.25 1oxc h SER 23 N 2.01 0.00 -3.40 5.45 4.64 -1.96 -3.33 113.55 116.95 1oxc h SER 23 Ca -0.21 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.56 1oxc h SER 23 Cb 1.24 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.29 1oxc h SER 23 CO 0.30 0.12 -0.14 -0.83 -0.87 0.00 0.00 176.83 175.42 1oxc s GLY 24 N -4.25 2.28 0.01 -0.77 0.00 -1.26 -4.94 107.32 98.39 1oxc s GLY 24 Ca 0.03 -0.30 -0.30 0.00 0.00 0.00 0.00 44.72 44.15 1oxc s GLY 24 CO 0.62 -0.16 1.36 -1.59 0.00 0.00 0.00 173.10 173.34 1oxc s THR 25 N -1.78 3.76 -0.08 0.90 2.01 -1.26 -4.71 115.64 114.48 1oxc s THR 25 Ca 0.46 1.16 -0.15 0.00 0.31 0.00 0.00 61.69 63.47 1oxc s THR 25 Cb -0.11 -3.75 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 1oxc s THR 25 CO 0.21 0.01 0.39 -1.10 -0.69 0.00 0.00 174.62 173.44 1oxc s GLN 26 N 2.17 4.12 -0.28 4.92 -1.52 0.32 -4.22 119.66 125.17 1oxc s GLN 26 Ca 0.63 0.31 -0.02 0.00 -1.95 0.00 0.00 55.36 54.33 1oxc s GLN 26 Cb -0.31 -3.34 0.04 0.00 -0.22 0.00 0.00 33.01 29.18 1oxc s GLN 26 CO 0.26 0.41 -0.02 0.99 -0.25 0.00 0.00 175.29 176.68 1oxc s THR 27 N -0.14 2.92 -0.24 -0.19 2.01 0.22 -1.65 115.64 118.57 1oxc s THR 27 Ca 0.22 -1.28 -0.06 0.00 0.31 0.00 0.00 61.69 60.89 1oxc s THR 27 Cb -0.15 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 1oxc s THR 27 CO 0.09 -0.00 0.03 -0.69 -0.69 0.00 0.00 174.62 173.36 1oxc s VAL 28 N 1.27 3.91 -0.12 3.82 1.01 0.66 -1.16 120.40 129.80 1oxc s VAL 28 Ca -0.04 -0.35 -0.00 0.00 0.00 0.00 0.00 61.98 61.59 1oxc s VAL 28 Cb -0.19 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 1oxc s VAL 28 CO -0.02 0.34 -0.11 0.21 0.00 0.00 0.00 175.10 175.52 1oxc s ASN 29 N 1.55 4.25 -0.24 3.32 2.47 0.11 -0.86 114.94 125.54 1oxc s ASN 29 Ca 0.06 -0.23 -0.03 0.00 0.42 0.00 0.00 52.86 53.08 1oxc s ASN 29 Cb -0.15 -1.49 0.01 0.00 -1.45 0.00 0.00 41.25 38.17 1oxc s ASN 29 CO 0.01 0.21 -0.05 -0.69 -3.72 0.00 0.00 177.10 172.87 1oxc s VAL 30 N 0.07 3.12 -0.17 -5.21 1.01 -0.17 -1.04 120.40 118.02 1oxc s VAL 30 Ca -0.04 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.06 1oxc s VAL 30 Cb -0.14 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 1oxc s VAL 30 CO 0.04 0.28 0.07 -0.76 0.00 0.00 0.00 175.10 174.72 1oxc s LEU 31 N 1.39 3.87 -0.16 3.92 1.02 0.57 -0.27 118.68 129.02 1oxc s LEU 31 Ca 0.03 0.13 0.02 0.00 0.02 0.00 0.00 54.13 54.32 1oxc s LEU 31 Cb -0.16 -1.97 0.02 0.00 0.02 0.00 0.00 46.19 44.10 1oxc s LEU 31 CO -0.04 0.21 -0.21 -0.69 0.02 0.00 0.00 176.35 175.65 1oxc s VAL 32 N 0.16 2.04 -1.45 -1.59 1.01 -0.05 -0.76 120.40 119.76 1oxc s VAL 32 Ca 0.05 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 1oxc s VAL 32 Cb -0.12 -1.83 0.03 0.00 0.00 0.00 0.00 36.38 34.46 1oxc s VAL 32 CO 0.00 0.54 0.95 0.59 0.00 0.00 0.00 175.10 177.19 1oxc n ASN 33 N 4.39 -5.76 -0.72 3.32 3.02 -0.34 -1.94 115.26 117.21 1oxc n ASN 33 Ca -0.20 -0.53 -0.09 0.00 -0.03 0.00 0.00 54.58 53.72 1oxc n ASN 33 Cb 0.51 -4.59 -0.04 0.00 -0.61 0.00 0.00 39.78 35.05 1oxc n ASN 33 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1oxc n ASN 34 N -2.80 -4.53 -4.08 6.41 3.02 -1.26 -5.01 115.26 107.00 1oxc n ASN 34 Ca -0.01 0.23 -0.23 0.00 -0.03 0.00 0.00 54.58 54.54 1oxc n ASN 34 Cb 0.56 -2.87 -0.15 0.00 -0.61 0.00 0.00 39.78 36.71 1oxc n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1oxc s GLU 35 N -2.61 1.28 0.09 3.52 0.41 -0.82 -5.07 118.70 115.50 1oxc s GLU 35 Ca 0.00 -0.47 -0.31 0.00 -0.41 0.00 0.00 54.97 53.78 1oxc s GLU 35 Cb 0.00 -1.17 -0.10 0.00 -1.78 0.00 0.00 34.13 31.08 1oxc s GLU 35 CO 0.00 0.23 1.88 0.99 -0.49 0.00 0.00 175.26 177.87 1oxc s THR 36 N -0.06 2.72 -0.06 3.63 2.01 -1.26 -0.87 115.64 121.75 1oxc s THR 36 Ca 0.00 0.04 0.10 0.00 0.31 0.00 0.00 61.69 62.14 1oxc s THR 36 Cb -0.08 -3.02 -0.15 0.00 0.01 0.00 0.00 72.50 69.25 1oxc s THR 36 CO 0.01 -0.00 0.24 0.00 -0.69 0.00 0.00 174.62 174.18 1oxc n ALA 37 N 6.40 2.46 -3.53 7.40 0.00 0.62 -4.90 120.51 128.97 1oxc n ALA 37 Ca 0.19 -0.25 -0.14 0.00 0.00 0.00 0.00 53.44 53.24 1oxc n ALA 37 Cb 0.39 -0.35 -0.05 0.00 0.00 0.00 0.00 19.45 19.44 1oxc n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oxc s ALA 38 N -2.64 -1.82 -0.10 0.00 0.00 -1.16 -5.01 121.76 111.03 1oxc s ALA 38 Ca -0.03 1.35 -0.05 0.00 0.00 0.00 0.00 51.96 53.22 1oxc s ALA 38 Cb 0.07 -0.18 0.04 0.00 0.00 0.00 0.00 23.12 23.05 1oxc s ALA 38 CO 0.42 -0.39 0.24 0.99 0.00 0.00 0.00 175.76 177.03 1oxc s THR 39 N -1.44 -0.04 -0.03 0.00 2.01 -1.26 -1.00 115.64 113.88 1oxc s THR 39 Ca -0.06 0.14 0.07 0.00 0.31 0.00 0.00 61.69 62.15 1oxc s THR 39 Cb -0.00 -0.38 -0.01 0.00 0.01 0.00 0.00 72.50 72.12 1oxc s THR 39 CO 0.04 0.06 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.44 1oxc s PHE 40 N 1.19 2.13 -0.07 4.92 0.08 -0.04 -4.97 117.98 121.21 1oxc s PHE 40 Ca -0.09 -0.48 -0.01 0.00 0.12 0.00 0.00 56.93 56.46 1oxc s PHE 40 Cb -0.10 -1.38 0.03 0.00 -0.57 0.00 0.00 43.02 41.00 1oxc s PHE 40 CO -0.08 -0.09 0.01 -1.12 -0.10 0.00 0.00 175.22 173.83 1oxc s SER 41 N -0.39 1.59 0.10 1.36 0.01 -1.25 -0.24 113.70 114.87 1oxc s SER 41 Ca 0.05 -0.09 -0.26 0.00 1.31 0.00 0.00 55.95 56.95 1oxc s SER 41 Cb -0.10 -0.42 0.08 0.00 0.21 0.00 0.00 66.02 65.78 1oxc s SER 41 CO 0.01 -0.20 0.94 -0.83 0.41 0.00 0.00 173.24 173.56 1oxc s GLY 42 N 1.99 -0.32 -0.02 3.44 0.00 -0.66 -4.96 107.32 106.79 1oxc s GLY 42 Ca 0.05 0.43 0.03 0.00 0.00 0.00 0.00 44.72 45.22 1oxc s GLY 42 CO -0.05 0.11 -0.09 1.62 0.00 0.00 0.00 173.10 174.69 1oxc s GLN 43 N -3.23 0.97 -0.20 2.90 -0.44 -1.26 -0.52 119.66 117.88 1oxc s GLN 43 Ca 0.10 -0.32 -0.29 0.00 -2.50 0.00 0.00 55.36 52.34 1oxc s GLN 43 Cb -0.01 -0.90 0.14 0.00 -1.64 0.00 0.00 33.01 30.59 1oxc s GLN 43 CO -0.02 0.13 1.08 0.45 0.50 0.00 0.00 175.29 177.44 1oxc s SER 44 N 0.12 -0.31 0.00 6.67 0.15 -1.25 -5.00 113.70 114.08 1oxc s SER 44 Ca -0.02 0.38 0.09 0.00 0.70 0.00 0.00 55.95 57.10 1oxc s SER 44 Cb -0.08 0.32 0.18 0.00 -1.71 0.00 0.00 66.02 64.73 1oxc s SER 44 CO 0.00 -0.25 1.05 0.35 1.20 0.00 0.00 173.24 175.59 1oxc n THR 45 N 0.92 0.64 -1.89 6.45 -2.24 -1.26 -0.38 114.28 116.52 1oxc n THR 45 Ca -0.09 -0.82 -0.05 0.00 -2.27 0.00 0.00 64.05 60.82 1oxc n THR 45 Cb 0.58 0.74 0.12 0.00 -2.10 0.00 0.00 70.33 69.67 1oxc n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1oxc n ASN 46 N 0.37 2.74 -2.18 3.42 3.02 -1.26 -4.78 115.26 116.60 1oxc n ASN 46 Ca 0.08 -3.58 -0.18 0.00 -0.03 0.00 0.00 54.58 50.87 1oxc n ASN 46 Cb 0.33 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 1oxc n ASN 46 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1oxc n ASN 47 N -0.81 -5.24 -4.74 6.41 5.15 -0.58 -4.96 115.26 110.48 1oxc n ASN 47 Ca 0.26 -0.08 -0.38 0.00 -0.60 0.00 0.00 54.58 53.77 1oxc n ASN 47 Cb 0.83 -4.25 0.05 0.00 -0.53 0.00 0.00 39.78 35.88 1oxc n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1oxc s ALA 48 N -2.94 2.72 -0.75 5.20 0.00 -1.24 -4.59 121.76 120.16 1oxc s ALA 48 Ca 0.08 1.33 -0.23 0.00 0.00 0.00 0.00 51.96 53.14 1oxc s ALA 48 Cb -0.03 -3.57 0.07 0.00 0.00 0.00 0.00 23.12 19.58 1oxc s ALA 48 CO 0.09 -1.46 1.09 0.08 0.00 0.00 0.00 175.76 175.57 1oxc s VAL 49 N -1.31 4.26 -1.81 0.00 1.01 -1.26 -2.18 120.40 119.11 1oxc s VAL 49 Ca 0.74 -0.48 0.27 0.00 0.00 0.00 0.00 61.98 62.51 1oxc s VAL 49 Cb -0.40 -4.77 0.68 0.00 0.00 0.00 0.00 36.38 31.88 1oxc s VAL 49 CO 0.47 -1.58 1.97 2.30 0.00 0.00 0.00 175.10 178.26 1oxc n ILE 50 N 6.01 0.05 0.00 2.22 -5.35 -0.23 -4.84 119.36 117.21 1oxc n ILE 50 Ca 0.05 0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 1oxc n ILE 50 Cb 0.47 -0.58 0.00 0.00 -1.74 0.00 0.00 39.64 37.80 1oxc n ILE 50 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1oxc n GLY 51 N 0.82 1.92 3.52 3.28 0.00 -1.23 -4.45 105.19 109.05 1oxc n GLY 51 Ca 0.18 -0.13 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 1oxc n GLY 51 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1oxc s THR 52 N -1.37 -0.68 0.14 2.61 -1.32 -1.26 -0.65 115.64 113.11 1oxc s THR 52 Ca 0.00 0.05 -0.05 0.00 -1.21 0.00 0.00 61.69 60.48 1oxc s THR 52 Cb 0.00 -0.88 -0.02 0.00 -1.51 0.00 0.00 72.50 70.08 1oxc s THR 52 CO 0.00 0.02 0.16 -1.10 -2.21 0.00 0.00 174.62 171.50 1oxc s GLN 53 N 2.51 1.01 -0.19 7.08 -0.21 -0.43 -4.99 119.66 124.45 1oxc s GLN 53 Ca -0.06 -1.28 -0.05 0.00 0.02 0.00 0.00 55.36 53.99 1oxc s GLN 53 Cb -0.11 0.31 -0.03 0.00 1.00 0.00 0.00 33.01 34.19 1oxc s GLN 53 CO -0.17 -0.33 -0.00 0.08 -2.12 0.00 0.00 175.29 172.75 1oxc s VAL 54 N -3.99 4.02 0.32 1.09 1.01 -1.26 -1.18 120.40 120.40 1oxc s VAL 54 Ca 0.19 -0.30 0.06 0.00 0.00 0.00 0.00 61.98 61.93 1oxc s VAL 54 Cb 0.05 -2.80 -0.06 0.00 0.00 0.00 0.00 36.38 33.57 1oxc s VAL 54 CO -0.00 0.45 0.00 -0.76 0.00 0.00 0.00 175.10 174.78 1oxc s LEU 55 N 0.80 2.44 -0.15 3.92 1.43 -0.15 -4.94 118.68 122.03 1oxc s LEU 55 Ca 0.00 -1.30 -0.03 0.00 -1.03 0.00 0.00 54.13 51.78 1oxc s LEU 55 Cb -0.14 -0.59 -0.02 0.00 0.03 0.00 0.00 46.19 45.46 1oxc s LEU 55 CO 0.02 -0.47 -0.07 0.21 0.23 0.00 0.00 176.35 176.28 1oxc s ASN 56 N -3.52 4.54 0.24 2.29 3.84 -1.26 -0.58 114.94 120.49 1oxc s ASN 56 Ca 0.34 -0.19 0.19 0.00 0.21 0.00 0.00 52.86 53.40 1oxc s ASN 56 Cb 0.07 -1.73 0.92 0.00 -0.55 0.00 0.00 41.25 39.96 1oxc s ASN 56 CO 0.15 0.17 1.58 -1.54 -2.79 0.00 0.00 177.10 174.66 1oxc n SER 57 N 3.55 0.48 -0.65 -4.21 3.41 -0.03 -4.89 113.62 111.28 1oxc n SER 57 Ca -0.18 0.68 0.03 0.00 -0.26 0.00 0.00 58.87 59.14 1oxc n SER 57 Cb 0.52 -0.76 -0.01 0.00 -0.26 0.00 0.00 64.21 63.71 1oxc n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oxc n GLY 58 N -0.80 -1.59 0.27 5.00 0.00 -1.26 -1.58 105.19 105.22 1oxc n GLY 58 Ca 0.00 -1.21 0.04 0.00 0.00 0.00 0.00 46.02 44.85 1oxc n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1oxc h SER 59 N -0.21 0.28 0.49 1.61 4.64 -1.93 0.78 113.55 119.20 1oxc h SER 59 Ca 0.00 -0.03 -0.30 0.00 -0.47 0.00 0.00 61.79 60.99 1oxc h SER 59 Cb 0.21 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 1oxc h SER 59 CO 0.00 0.31 -1.54 0.77 -0.87 0.00 0.00 176.83 175.50 1oxc h SER 60 N 0.31 0.30 0.00 4.97 4.64 -1.97 -3.44 113.55 118.35 1oxc h SER 60 Ca 0.07 -0.44 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1oxc h SER 60 Cb 0.16 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1oxc h SER 60 CO 0.00 1.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.94 1oxc n GLY 61 N 1.64 0.76 3.66 -0.77 0.00 -0.62 -4.80 105.19 105.07 1oxc n GLY 61 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1oxc n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oxc s LYS 62 N -0.16 4.27 -0.10 1.61 2.20 -1.26 -0.35 119.74 125.96 1oxc s LYS 62 Ca 0.00 1.17 0.02 0.00 -0.36 0.00 0.00 55.97 56.80 1oxc s LYS 62 Cb 0.00 -3.61 0.01 0.00 -1.51 0.00 0.00 37.83 32.72 1oxc s LYS 62 CO 0.00 -0.48 -0.16 0.08 -0.36 0.00 0.00 175.35 174.43 1oxc s VAL 63 N 2.66 1.52 -0.03 4.02 1.01 -0.32 -1.20 120.40 128.06 1oxc s VAL 63 Ca 0.41 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.75 1oxc s VAL 63 Cb -0.16 -1.37 -0.00 0.00 0.00 0.00 0.00 36.38 34.84 1oxc s VAL 63 CO 0.10 0.44 -0.14 -1.58 0.00 0.00 0.00 175.10 173.92 1oxc s GLN 64 N 0.82 1.44 -0.14 2.72 0.74 0.06 -0.46 119.66 124.85 1oxc s GLN 64 Ca -0.10 -0.50 -0.03 0.00 0.05 0.00 0.00 55.36 54.77 1oxc s GLN 64 Cb -0.16 -1.30 -0.03 0.00 1.10 0.00 0.00 33.01 32.63 1oxc s GLN 64 CO 0.01 0.22 -0.03 0.08 -0.55 0.00 0.00 175.29 175.02 1oxc s VAL 65 N 0.03 3.97 0.00 1.34 1.01 0.26 -0.31 120.40 126.69 1oxc s VAL 65 Ca -0.02 -0.34 0.06 0.00 0.00 0.00 0.00 61.98 61.68 1oxc s VAL 65 Cb -0.10 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 1oxc s VAL 65 CO 0.01 0.51 -0.19 -1.10 0.00 0.00 0.00 175.10 174.33 1oxc s GLN 66 N 0.11 1.49 -0.04 2.72 -0.21 -0.20 -4.75 119.66 118.79 1oxc s GLN 66 Ca -0.00 -0.75 0.02 0.00 0.02 0.00 0.00 55.36 54.66 1oxc s GLN 66 Cb -0.13 -1.48 0.01 0.00 1.00 0.00 0.00 33.01 32.40 1oxc s GLN 66 CO 0.03 0.40 -0.10 0.08 -2.12 0.00 0.00 175.29 173.58 1oxc s VAL 67 N -0.54 0.85 0.05 1.09 1.01 -1.26 -0.71 120.40 120.89 1oxc s VAL 67 Ca 0.07 -0.37 -0.04 0.00 0.00 0.00 0.00 61.98 61.64 1oxc s VAL 67 Cb -0.08 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 1oxc s VAL 67 CO -0.00 0.27 0.06 -0.94 0.00 0.00 0.00 175.10 174.49 1oxc s SER 68 N 0.35 0.30 -0.20 3.32 1.04 -0.31 -0.23 113.70 117.98 1oxc s SER 68 Ca -0.06 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1oxc s SER 68 Cb -0.11 0.23 0.05 0.00 0.10 0.00 0.00 66.02 66.29 1oxc s SER 68 CO 0.01 -0.58 -0.06 -0.69 0.98 0.00 0.00 173.24 172.90 1oxc s VAL 69 N -3.35 1.35 -1.44 5.02 1.01 -0.27 -0.61 120.40 122.11 1oxc s VAL 69 Ca 0.01 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 60.98 1oxc s VAL 69 Cb 0.03 -1.56 0.05 0.00 0.00 0.00 0.00 36.38 34.91 1oxc s VAL 69 CO -0.08 0.03 0.69 0.59 0.00 0.00 0.00 175.10 176.33 1oxc n ASN 70 N 4.77 -4.99 0.00 3.32 4.13 -1.26 -1.50 115.26 119.73 1oxc n ASN 70 Ca -0.12 -0.45 0.00 0.00 1.68 0.00 0.00 54.58 55.69 1oxc n ASN 70 Cb 0.46 -4.04 0.00 0.00 -1.54 0.00 0.00 39.78 34.66 1oxc n ASN 70 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1oxc n GLY 71 N -1.47 1.12 3.55 7.41 0.00 -1.26 -5.04 105.19 109.50 1oxc n GLY 71 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1oxc n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1oxc s ARG 72 N -0.57 3.68 0.30 1.61 3.52 -0.56 -5.05 118.95 121.87 1oxc s ARG 72 Ca 0.00 -0.51 -0.30 0.00 -0.13 0.00 0.00 55.73 54.79 1oxc s ARG 72 Cb 0.00 -3.74 -0.12 0.00 -1.56 0.00 0.00 34.95 29.53 1oxc s ARG 72 CO 0.00 -0.34 1.54 -2.30 -0.81 0.00 0.00 175.30 173.39 1oxc n PRO 73 N 5.08 2.56 -3.09 5.12 -0.02 -1.26 -1.11 135.00 142.28 1oxc n PRO 73 Ca -0.13 0.91 -0.29 0.00 -2.02 0.00 0.00 63.50 61.96 1oxc n PRO 73 Cb 0.51 -2.65 -0.03 0.00 -0.02 0.00 0.00 33.50 31.30 1oxc n PRO 73 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1oxc s SER 74 N 0.33 6.49 0.12 2.55 0.01 0.68 -4.89 113.70 118.99 1oxc s SER 74 Ca 0.63 0.93 -0.30 0.00 1.31 0.00 0.00 55.95 58.52 1oxc s SER 74 Cb -0.52 -2.24 -0.06 0.00 0.21 0.00 0.00 66.02 63.41 1oxc s SER 74 CO 0.52 -0.30 0.98 -0.62 0.41 0.00 0.00 173.24 174.22 1oxc s ASP 75 N -3.16 7.47 0.16 2.44 2.15 -0.91 -4.77 116.67 120.05 1oxc s ASP 75 Ca 0.48 1.83 0.06 0.00 0.43 0.00 0.00 52.55 55.35 1oxc s ASP 75 Cb -0.10 -2.59 -0.04 0.00 -0.30 0.00 0.00 42.92 39.89 1oxc s ASP 75 CO 0.31 -0.09 0.04 -0.76 -0.17 0.00 0.00 175.17 174.50 1oxc s LEU 76 N -0.03 3.47 0.00 -1.34 1.43 -1.26 -1.06 118.68 119.90 1oxc s LEU 76 Ca 0.47 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 1oxc s LEU 76 Cb -0.24 -2.13 -0.01 0.00 0.03 0.00 0.00 46.19 43.85 1oxc s LEU 76 CO 0.30 0.09 -0.07 0.54 0.23 0.00 0.00 176.35 177.45 1oxc s VAL 77 N -1.68 0.56 0.22 -1.59 0.11 -0.50 -4.85 120.40 112.67 1oxc s VAL 77 Ca 0.28 -0.43 -0.19 0.00 -2.93 0.00 0.00 61.98 58.71 1oxc s VAL 77 Cb -0.10 -0.50 0.03 0.00 -1.53 0.00 0.00 36.38 34.29 1oxc s VAL 77 CO 0.20 0.07 0.60 -0.94 -3.33 0.00 0.00 175.10 171.70 1oxc s SER 78 N -0.40 -0.31 -0.04 3.54 1.04 -1.26 -0.58 113.70 115.69 1oxc s SER 78 Ca 0.01 -0.47 -0.30 0.00 0.48 0.00 0.00 55.95 55.67 1oxc s SER 78 Cb -0.04 0.64 0.11 0.00 0.10 0.00 0.00 66.02 66.83 1oxc s SER 78 CO -0.00 -1.15 1.04 0.00 0.98 0.00 0.00 173.24 174.12 1oxc s ALA 79 N -3.88 -1.92 -0.02 5.32 0.00 -0.87 -4.92 121.76 115.48 1oxc s ALA 79 Ca 0.09 1.05 0.06 0.00 0.00 0.00 0.00 51.96 53.16 1oxc s ALA 79 Cb -0.03 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 1oxc s ALA 79 CO -0.01 -0.74 -0.21 -1.14 0.00 0.00 0.00 175.76 173.66 1oxc s GLN 80 N -2.84 1.77 0.00 0.00 0.74 -1.26 -0.38 119.66 117.69 1oxc s GLN 80 Ca 0.08 -0.76 0.03 0.00 0.05 0.00 0.00 55.36 54.76 1oxc s GLN 80 Cb -0.00 -1.69 -0.01 0.00 1.10 0.00 0.00 33.01 32.40 1oxc s GLN 80 CO -0.06 0.45 -0.11 0.54 -0.55 0.00 0.00 175.29 175.57 1oxc s VAL 81 N -0.47 0.84 -0.11 1.34 0.11 -0.10 -5.00 120.40 117.02 1oxc s VAL 81 Ca 0.07 -0.54 0.03 0.00 -2.93 0.00 0.00 61.98 58.61 1oxc s VAL 81 Cb -0.09 -0.72 0.01 0.00 -1.53 0.00 0.00 36.38 34.05 1oxc s VAL 81 CO -0.01 0.17 -0.19 -0.63 -3.33 0.00 0.00 175.10 171.12 1oxc s ILE 82 N -0.37 1.76 -0.08 7.04 1.01 -1.26 -1.31 121.20 127.99 1oxc s ILE 82 Ca 0.03 -0.82 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 1oxc s ILE 82 Cb -0.05 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 1oxc s ILE 82 CO -0.00 0.49 0.02 -0.76 0.00 0.00 0.00 174.94 174.69 1oxc s LEU 83 N 0.71 3.65 -1.54 2.97 1.43 0.17 -4.52 118.68 121.56 1oxc s LEU 83 Ca -0.11 0.16 -0.18 0.00 -1.03 0.00 0.00 54.13 52.97 1oxc s LEU 83 Cb -0.16 -1.87 0.17 0.00 0.03 0.00 0.00 46.19 44.36 1oxc s LEU 83 CO 0.02 0.37 0.57 1.07 0.23 0.00 0.00 176.35 178.61 1oxc n THR 84 N 2.03 -0.40 -1.80 5.49 5.66 -1.26 -1.23 114.28 122.78 1oxc n THR 84 Ca -0.18 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.67 1oxc n THR 84 Cb 0.54 -0.92 -0.04 0.00 -1.55 0.00 0.00 70.33 68.35 1oxc n THR 84 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1oxc n ASN 85 N -2.38 -4.22 0.00 1.09 5.15 -1.26 -4.65 115.26 108.99 1oxc n ASN 85 Ca 0.08 0.29 0.00 0.00 -0.60 0.00 0.00 54.58 54.35 1oxc n ASN 85 Cb 0.48 -3.75 0.00 0.00 -0.53 0.00 0.00 39.78 35.98 1oxc n ASN 85 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1oxc n GLU 86 N -2.32 0.00 -3.30 1.20 -0.58 -0.36 -5.08 120.64 110.20 1oxc n GLU 86 Ca -0.16 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.18 1oxc n GLU 86 Cb 0.55 -0.33 -0.08 0.00 -0.57 0.00 0.00 31.44 31.01 1oxc n GLU 86 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1oxc s LEU 87 N -1.50 4.16 -0.09 -4.62 2.96 -0.44 -4.39 118.68 114.76 1oxc s LEU 87 Ca 0.00 0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 54.14 1oxc s LEU 87 Cb 0.00 -2.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.12 1oxc s LEU 87 CO 0.00 -0.31 -0.03 0.20 -1.32 0.00 0.00 176.35 174.88 1oxc s ASN 88 N 1.65 4.92 -0.08 3.68 -0.87 0.17 -0.65 114.94 123.76 1oxc s ASN 88 Ca 0.18 0.03 0.01 0.00 -1.57 0.00 0.00 52.86 51.50 1oxc s ASN 88 Cb -0.16 -1.41 0.02 0.00 -0.02 0.00 0.00 41.25 39.69 1oxc s ASN 88 CO 0.11 0.33 -0.07 -0.36 -2.57 0.00 0.00 177.10 174.54 1oxc s PHE 89 N -0.61 1.23 -0.22 2.20 0.40 -0.43 -2.04 117.98 118.50 1oxc s PHE 89 Ca 0.10 -0.50 -0.06 0.00 -0.60 0.00 0.00 56.93 55.87 1oxc s PHE 89 Cb -0.12 -1.01 -0.02 0.00 0.51 0.00 0.00 43.02 42.38 1oxc s PHE 89 CO 0.02 -0.35 0.02 0.00 0.70 0.00 0.00 175.22 175.61 1oxc s ALA 90 N 1.25 3.06 -0.07 5.36 0.00 0.48 -0.92 121.76 130.92 1oxc s ALA 90 Ca -0.04 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.88 1oxc s ALA 90 Cb -0.14 -1.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 1oxc s ALA 90 CO -0.02 -0.30 -0.12 -0.51 0.00 0.00 0.00 175.76 174.80 1oxc s LEU 91 N 1.27 2.84 -0.02 0.00 1.43 0.49 -0.64 118.68 124.05 1oxc s LEU 91 Ca 0.04 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.97 1oxc s LEU 91 Cb -0.15 -1.60 0.01 0.00 0.03 0.00 0.00 46.19 44.49 1oxc s LEU 91 CO 0.02 0.31 -0.03 -0.69 0.23 0.00 0.00 176.35 176.19 1oxc s VAL 92 N -0.52 0.30 0.22 -1.59 1.01 0.10 -2.04 120.40 117.88 1oxc s VAL 92 Ca 0.07 -0.08 0.10 0.00 0.00 0.00 0.00 61.98 62.07 1oxc s VAL 92 Cb -0.12 -0.31 -0.05 0.00 0.00 0.00 0.00 36.38 35.91 1oxc s VAL 92 CO 0.02 0.12 -0.18 -0.83 0.00 0.00 0.00 175.10 174.23 1oxc s GLY 93 N 0.39 1.60 -0.00 4.51 0.00 0.25 -0.89 107.32 113.18 1oxc s GLY 93 Ca -0.04 -1.70 -0.14 0.00 0.00 0.00 0.00 44.72 42.84 1oxc s GLY 93 CO -0.01 -1.78 0.29 -1.35 0.00 0.00 0.00 173.10 170.26 1oxc s SER 94 N -3.19 -0.16 -0.11 1.64 1.04 -0.85 -1.41 113.70 110.66 1oxc s SER 94 Ca 0.23 0.01 0.02 0.00 0.48 0.00 0.00 55.95 56.69 1oxc s SER 94 Cb -0.04 0.31 0.02 0.00 0.10 0.00 0.00 66.02 66.40 1oxc s SER 94 CO 0.10 -0.47 -0.15 -0.70 0.98 0.00 0.00 173.24 173.00 1oxc s GLU 95 N -1.53 2.21 0.00 4.02 2.56 -0.23 -2.26 118.70 123.47 1oxc s GLU 95 Ca -0.12 -0.55 0.14 0.00 0.00 0.00 0.00 54.97 54.43 1oxc s GLU 95 Cb -0.05 -1.89 0.08 0.00 2.00 0.00 0.00 34.13 34.28 1oxc s GLU 95 CO 0.03 -0.07 0.90 -0.40 -0.56 0.00 0.00 175.26 175.15 1oxc n ASP 96 N 4.24 1.98 0.00 -1.70 5.68 -1.26 -2.14 116.55 123.35 1oxc n ASP 96 Ca -0.19 -1.49 0.00 0.00 -0.50 0.00 0.00 54.79 52.61 1oxc n ASP 96 Cb 0.51 0.13 0.00 0.00 -1.14 0.00 0.00 41.12 40.62 1oxc n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1oxc n GLY 97 N 0.87 5.20 0.01 6.12 0.00 -1.26 -5.07 105.19 111.06 1oxc n GLY 97 Ca 0.08 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1oxc n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oxc n THR 98 N 0.00 0.00 1.15 2.61 -2.24 -1.26 -4.69 114.28 109.85 1oxc n THR 98 Ca 0.00 -0.49 0.13 0.00 -2.27 0.00 0.00 64.05 61.42 1oxc n THR 98 Cb 0.00 1.01 0.42 0.00 -2.10 0.00 0.00 70.33 69.65 1oxc n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1oxc n ASP 99 N -0.39 0.54 -3.82 3.42 5.75 -1.26 -4.96 116.55 115.82 1oxc n ASP 99 Ca 0.00 -0.35 -0.30 0.00 -0.01 0.00 0.00 54.79 54.13 1oxc n ASP 99 Cb 0.01 0.04 0.01 0.00 -1.03 0.00 0.00 41.12 40.15 1oxc n ASP 99 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1oxc n ASN 100 N -1.18 -4.53 0.04 -1.12 3.02 -1.26 -4.86 115.26 105.36 1oxc n ASN 100 Ca 0.09 -0.72 0.13 0.00 -0.03 0.00 0.00 54.58 54.05 1oxc n ASN 100 Cb 0.33 -3.65 0.34 0.00 -0.61 0.00 0.00 39.78 36.19 1oxc n ASN 100 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1oxc n ASP 101 N -2.70 0.51 -2.40 6.41 3.85 -1.26 -4.94 116.55 116.02 1oxc n ASP 101 Ca 0.03 0.21 -0.09 0.00 -0.71 0.00 0.00 54.79 54.23 1oxc n ASP 101 Cb 0.53 -0.16 -0.01 0.00 -1.35 0.00 0.00 41.12 40.13 1oxc n ASP 101 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 1oxc n TYR 102 N -1.85 -1.52 -0.01 2.11 4.01 -1.26 -4.79 117.16 113.85 1oxc n TYR 102 Ca 0.05 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.80 1oxc n TYR 102 Cb 0.39 -2.31 0.02 0.00 -0.31 0.00 0.00 39.34 37.13 1oxc n TYR 102 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1oxc n ASN 103 N -1.66 2.00 -0.33 7.72 6.94 -1.17 -2.00 115.26 126.77 1oxc n ASN 103 Ca -0.11 -1.86 0.07 0.00 -0.02 0.00 0.00 54.58 52.66 1oxc n ASN 103 Cb 0.57 -0.03 0.23 0.00 -2.36 0.00 0.00 39.78 38.19 1oxc n ASN 103 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 1oxc h ASP 104 N 0.34 0.78 -3.36 0.53 3.32 -1.56 -3.23 116.42 113.23 1oxc h ASP 104 Ca 0.00 0.06 -0.35 0.00 0.02 0.00 0.00 57.03 56.76 1oxc h ASP 104 Cb 0.47 -0.08 -0.38 0.00 0.22 0.00 0.00 39.33 39.56 1oxc h ASP 104 CO 0.00 0.38 -0.74 0.00 -1.72 0.00 0.00 179.24 177.17 1oxc s ALA 105 N -5.96 0.20 -0.11 3.45 0.00 -1.25 -1.14 121.76 116.95 1oxc s ALA 105 Ca -0.12 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.07 1oxc s ALA 105 Cb 0.22 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 1oxc s ALA 105 CO 0.80 -0.39 -0.16 0.08 0.00 0.00 0.00 175.76 176.09 1oxc s VAL 106 N 1.88 2.81 -0.05 0.00 1.01 -0.03 -2.36 120.40 123.66 1oxc s VAL 106 Ca 0.01 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.27 1oxc s VAL 106 Cb -0.12 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.11 1oxc s VAL 106 CO -0.03 0.54 -0.16 -0.69 0.00 0.00 0.00 175.10 174.76 1oxc s VAL 107 N 0.21 1.37 -0.10 2.92 1.01 -0.06 -0.37 120.40 125.38 1oxc s VAL 107 Ca -0.10 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.25 1oxc s VAL 107 Cb -0.16 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.04 1oxc s VAL 107 CO 0.06 0.40 -0.17 -0.69 0.00 0.00 0.00 175.10 174.70 1oxc s VAL 108 N 0.24 1.59 -0.11 2.92 1.01 0.05 -0.72 120.40 125.38 1oxc s VAL 108 Ca -0.08 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.19 1oxc s VAL 108 Cb -0.13 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 1oxc s VAL 108 CO 0.03 0.46 -0.13 -0.63 0.00 0.00 0.00 175.10 174.83 1oxc s ILE 109 N 0.77 3.07 0.02 2.22 1.01 0.19 -0.99 121.20 127.48 1oxc s ILE 109 Ca -0.11 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 59.89 1oxc s ILE 109 Cb -0.16 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 1oxc s ILE 109 CO 0.02 0.54 -0.07 0.54 0.00 0.00 0.00 174.94 175.96 1oxc s ASN 110 N 0.13 0.85 0.11 3.58 4.22 -0.32 -0.39 114.94 123.12 1oxc s ASN 110 Ca -0.06 -0.29 -0.25 0.00 -2.14 0.00 0.00 52.86 50.12 1oxc s ASN 110 Cb -0.15 -0.04 0.07 0.00 1.28 0.00 0.00 41.25 42.41 1oxc s ASN 110 CO 0.05 -0.03 0.64 -1.66 -2.04 0.00 0.00 177.10 174.07 1oxc s TRP 111 N -0.63 -0.53 0.82 1.54 -2.14 -0.87 -0.89 118.94 116.23 1oxc s TRP 111 Ca -0.02 0.42 -0.12 0.00 2.66 0.00 0.00 56.10 59.04 1oxc s TRP 111 Cb -0.05 0.54 0.08 0.00 -3.10 0.00 0.00 33.47 30.94 1oxc s TRP 111 CO 0.00 -0.78 1.14 -1.25 -2.66 0.00 0.00 176.95 173.40 1oxc s PRO 112 N -3.34 1.92 0.49 3.25 0.04 -1.26 -0.65 135.00 135.44 1oxc s PRO 112 Ca -0.00 0.29 0.05 0.00 0.04 0.00 0.00 61.00 61.39 1oxc s PRO 112 Cb -0.01 -1.93 -0.00 0.00 0.04 0.00 0.00 34.50 32.60 1oxc s PRO 112 CO -0.10 -1.66 0.26 -0.51 0.04 0.00 0.00 177.00 175.03 1oxc s LEU 113 N -5.69 2.81 0.00 -3.56 1.43 -1.26 -4.99 118.68 107.42 1oxc s LEU 113 Ca 0.62 -1.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.48 1oxc s LEU 113 Cb -0.12 -1.24 0.00 0.00 0.03 0.00 0.00 46.19 44.85 1oxc s LEU 113 CO 0.51 -0.85 0.00 0.61 0.23 0.00 0.00 176.35 176.86