#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ocq h VAL 5 N 0.00 0.54 -0.20 -3.33 2.07 -1.88 -0.41 116.25 113.05 1ocq h VAL 5 Ca 0.00 -0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.40 1ocq h VAL 5 Cb 0.00 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1ocq h VAL 5 CO 0.00 0.00 -0.39 0.58 0.02 0.00 0.00 177.57 177.78 1ocq h VAL 6 N -0.63 1.30 -0.63 2.57 2.07 -1.74 -0.35 116.25 118.84 1ocq h VAL 6 Ca -0.06 -1.53 -0.05 0.00 0.82 0.00 0.00 66.70 65.88 1ocq h VAL 6 Cb 0.48 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 1ocq h VAL 6 CO 0.11 0.47 0.20 -0.08 0.02 0.00 0.00 177.57 178.29 1ocq h GLU 7 N 0.37 0.98 -0.18 1.57 4.81 -1.80 0.25 114.58 120.57 1ocq h GLU 7 Ca 0.04 -0.21 -0.11 0.00 -0.13 0.00 0.00 59.36 58.94 1ocq h GLU 7 Cb 0.85 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.09 1ocq h GLU 7 CO 0.07 0.86 -0.33 1.49 -0.73 0.00 0.00 179.01 180.37 1ocq h GLU 8 N 0.91 0.55 0.00 1.92 4.57 -0.80 -3.35 114.58 118.39 1ocq h GLU 8 Ca 0.21 -0.35 -0.29 0.00 -1.18 0.00 0.00 59.36 57.75 1ocq h GLU 8 Cb 0.29 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.86 1ocq h GLU 8 CO -0.01 0.95 -1.93 0.72 -1.18 0.00 0.00 179.01 177.56 1ocq n HIS 9 N -4.32 0.59 -2.81 0.92 8.25 -0.17 -4.91 115.22 112.78 1ocq n HIS 9 Ca -0.06 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1ocq n HIS 9 Cb 0.49 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.53 1ocq n HIS 9 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ocq n GLY 10 N 1.59 3.03 3.65 -1.41 0.00 0.87 -1.80 105.19 111.13 1ocq n GLY 10 Ca -0.21 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1ocq n GLY 10 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ocq s GLN 11 N 0.00 4.05 0.36 1.61 2.00 -1.26 -4.80 119.66 121.62 1ocq s GLN 11 Ca 0.00 1.99 -0.17 0.00 -2.00 0.00 0.00 55.36 55.19 1ocq s GLN 11 Cb 0.00 -3.99 -0.10 0.00 0.80 0.00 0.00 33.01 29.72 1ocq s GLN 11 CO 0.00 -1.00 0.80 -0.51 -0.50 0.00 0.00 175.29 174.09 1ocq s LEU 12 N 4.44 4.02 0.31 3.68 1.43 -1.26 -2.11 118.68 129.19 1ocq s LEU 12 Ca 0.72 1.41 -0.12 0.00 -1.03 0.00 0.00 54.13 55.11 1ocq s LEU 12 Cb -0.30 -4.23 0.01 0.00 0.03 0.00 0.00 46.19 41.71 1ocq s LEU 12 CO 0.28 -0.26 0.58 -0.94 0.23 0.00 0.00 176.35 176.25 1ocq s SER 13 N -2.26 0.18 -0.19 2.29 1.04 -0.61 -4.64 113.70 109.50 1ocq s SER 13 Ca 0.57 -1.09 -0.06 0.00 0.48 0.00 0.00 55.95 55.85 1ocq s SER 13 Cb -0.10 0.69 -0.03 0.00 0.10 0.00 0.00 66.02 66.68 1ocq s SER 13 CO 0.16 -1.34 0.03 -0.63 0.98 0.00 0.00 173.24 172.44 1ocq s ILE 14 N -3.34 4.35 -0.10 -1.02 -1.09 -1.26 -1.15 121.20 117.59 1ocq s ILE 14 Ca 0.21 -0.18 -0.01 0.00 -2.23 0.00 0.00 60.65 58.45 1ocq s ILE 14 Cb -0.02 -2.96 0.03 0.00 -1.58 0.00 0.00 42.46 37.92 1ocq s ILE 14 CO 0.12 0.44 -0.06 -0.55 -1.23 0.00 0.00 174.94 173.66 1ocq s SER 15 N 0.74 1.97 -1.53 3.58 0.15 -0.37 -4.82 113.70 113.42 1ocq s SER 15 Ca 0.02 -0.24 -0.11 0.00 0.70 0.00 0.00 55.95 56.32 1ocq s SER 15 Cb -0.14 -0.72 0.08 0.00 -1.71 0.00 0.00 66.02 63.53 1ocq s SER 15 CO 0.02 -0.13 0.81 -3.20 1.20 0.00 0.00 173.24 171.94 1ocq n ASN 16 N 4.94 -3.26 -0.00 5.45 5.15 -1.26 -1.58 115.26 124.70 1ocq n ASN 16 Ca -0.12 -0.88 -0.00 0.00 -0.60 0.00 0.00 54.58 52.98 1ocq n ASN 16 Cb 0.50 -3.48 -0.00 0.00 -0.53 0.00 0.00 39.78 36.27 1ocq n ASN 16 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ocq n GLY 17 N -1.64 0.48 3.25 8.20 0.00 -1.26 -4.99 105.19 109.23 1ocq n GLY 17 Ca -0.05 -0.06 -0.27 0.00 0.00 0.00 0.00 46.02 45.65 1ocq n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ocq s GLU 18 N -0.15 1.62 -0.02 1.61 0.41 -0.61 -3.97 118.70 117.58 1ocq s GLU 18 Ca 0.00 -0.86 -0.30 0.00 -0.41 0.00 0.00 54.97 53.40 1ocq s GLU 18 Cb 0.00 -1.64 -0.05 0.00 -1.78 0.00 0.00 34.13 30.66 1ocq s GLU 18 CO 0.00 0.44 1.35 -1.17 -0.49 0.00 0.00 175.26 175.39 1ocq s LEU 19 N -0.82 4.30 0.14 1.80 2.96 -1.26 -1.24 118.68 124.56 1ocq s LEU 19 Ca 0.08 2.03 0.04 0.00 -0.22 0.00 0.00 54.13 56.07 1ocq s LEU 19 Cb -0.09 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 1ocq s LEU 19 CO 0.00 -0.69 -0.10 0.68 -1.32 0.00 0.00 176.35 174.92 1ocq s VAL 20 N 2.41 1.14 0.31 1.68 -7.23 -0.30 -2.14 120.40 116.28 1ocq s VAL 20 Ca 0.62 -1.97 -0.03 0.00 -1.81 0.00 0.00 61.98 58.78 1ocq s VAL 20 Cb -0.29 -1.75 0.07 0.00 0.56 0.00 0.00 36.38 34.96 1ocq s VAL 20 CO 0.25 -0.70 0.43 -0.46 -0.31 0.00 0.00 175.10 174.31 1ocq n ASN 21 N -0.03 0.28 0.00 4.85 0.23 0.08 -1.58 115.26 119.10 1ocq n ASN 21 Ca -0.11 -1.31 0.10 0.00 -0.53 0.00 0.00 54.58 52.73 1ocq n ASN 21 Cb 0.60 -0.30 0.50 0.00 -2.08 0.00 0.00 39.78 38.49 1ocq n ASN 21 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1ocq n GLU 22 N -1.85 0.15 -0.27 -3.83 0.28 -0.74 -0.97 120.64 113.41 1ocq n GLU 22 Ca 0.06 0.11 0.11 0.00 -0.16 0.00 0.00 57.16 57.28 1ocq n GLU 22 Cb 0.22 -1.50 0.25 0.00 1.43 0.00 0.00 31.44 31.84 1ocq n GLU 22 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1ocq n ARG 23 N -1.39 2.59 -1.03 3.44 1.74 -1.26 -4.97 116.66 115.77 1ocq n ARG 23 Ca 0.08 -2.40 -0.01 0.00 -0.77 0.00 0.00 57.85 54.74 1ocq n ARG 23 Cb 0.21 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.14 1ocq n ARG 23 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ocq n GLY 24 N 1.44 0.50 3.85 -0.13 0.00 -0.15 -5.04 105.19 105.66 1ocq n GLY 24 Ca 0.20 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 1ocq n GLY 24 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ocq s GLU 25 N -1.28 3.86 0.36 1.61 2.02 -1.26 -4.77 118.70 119.25 1ocq s GLU 25 Ca 0.00 0.33 -0.28 0.00 0.02 0.00 0.00 54.97 55.04 1ocq s GLU 25 Cb 0.00 -3.13 -0.11 0.00 0.10 0.00 0.00 34.13 30.99 1ocq s GLU 25 CO 0.00 0.64 1.49 1.04 0.02 0.00 0.00 175.26 178.45 1ocq n GLN 26 N 1.47 2.63 -4.12 1.61 6.02 -1.26 -0.74 117.38 122.99 1ocq n GLN 26 Ca -0.12 0.93 -0.15 0.00 -0.01 0.00 0.00 57.00 57.65 1ocq n GLN 26 Cb 0.52 -2.65 -0.13 0.00 1.02 0.00 0.00 30.24 29.00 1ocq n GLN 26 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1ocq s VAL 27 N -0.93 0.52 -0.16 5.09 0.11 -0.91 -4.82 120.40 119.31 1ocq s VAL 27 Ca 0.55 -0.71 0.02 0.00 -2.93 0.00 0.00 61.98 58.91 1ocq s VAL 27 Cb -0.49 -0.53 0.02 0.00 -1.53 0.00 0.00 36.38 33.85 1ocq s VAL 27 CO 0.61 -0.14 -0.21 -1.58 -3.33 0.00 0.00 175.10 170.45 1ocq s GLN 28 N -0.93 2.99 -0.00 1.54 0.74 -1.26 -4.69 119.66 118.04 1ocq s GLN 28 Ca -0.04 -0.83 -0.15 0.00 0.05 0.00 0.00 55.36 54.38 1ocq s GLN 28 Cb -0.06 -2.49 -0.06 0.00 1.10 0.00 0.00 33.01 31.49 1ocq s GLN 28 CO 0.00 -0.12 0.43 -0.51 -0.55 0.00 0.00 175.29 174.54 1ocq s LEU 29 N 1.07 4.47 -0.03 3.68 1.43 -1.26 -4.99 118.68 123.05 1ocq s LEU 29 Ca -0.01 0.98 -0.00 0.00 -1.03 0.00 0.00 54.13 54.07 1ocq s LEU 29 Cb -0.14 -2.62 0.03 0.00 0.03 0.00 0.00 46.19 43.48 1ocq s LEU 29 CO -0.08 0.30 0.02 -0.54 0.23 0.00 0.00 176.35 176.28 1ocq s LYS 30 N -0.95 0.13 0.00 1.70 1.02 -1.25 -0.96 119.74 119.43 1ocq s LYS 30 Ca 0.24 0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.40 1ocq s LYS 30 Cb -0.17 -0.42 0.00 0.00 -0.52 0.00 0.00 37.83 36.72 1ocq s LYS 30 CO 0.14 -0.19 0.00 0.41 -0.92 0.00 0.00 175.35 174.79 1ocq n GLY 31 N 4.39 2.30 3.47 -3.33 0.00 -0.67 -1.92 105.19 109.43 1ocq n GLY 31 Ca -0.22 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.76 1ocq n GLY 31 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ocq s MET 32 N 0.69 1.91 -0.02 1.61 -1.94 -1.20 -1.43 119.30 118.92 1ocq s MET 32 Ca 0.00 -1.09 -0.06 0.00 -1.71 0.00 0.00 55.69 52.83 1ocq s MET 32 Cb 0.00 -2.14 -0.05 0.00 2.01 0.00 0.00 34.83 34.65 1ocq s MET 32 CO 0.00 0.51 0.23 0.45 -0.01 0.00 0.00 175.02 176.20 1ocq s SER 33 N -1.80 6.47 0.94 3.03 0.15 0.15 -0.96 113.70 121.68 1ocq s SER 33 Ca 0.16 0.53 -0.11 0.00 0.70 0.00 0.00 55.95 57.23 1ocq s SER 33 Cb -0.11 -2.08 0.16 0.00 -1.71 0.00 0.00 66.02 62.28 1ocq s SER 33 CO 0.08 0.29 1.10 -0.94 1.20 0.00 0.00 173.24 174.97 1ocq s SER 34 N -1.55 2.86 0.43 5.45 1.04 -0.07 -0.83 113.70 121.03 1ocq s SER 34 Ca 0.24 1.86 0.00 0.00 0.48 0.00 0.00 55.95 58.53 1ocq s SER 34 Cb -0.13 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1ocq s SER 34 CO 0.14 -3.09 0.00 1.57 0.98 0.00 0.00 173.24 172.84 1ocq n HIS 35 N -4.20 -1.82 -1.83 5.02 -0.00 -1.26 -4.56 115.22 106.57 1ocq n HIS 35 Ca 0.09 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.85 1ocq n HIS 35 Cb 0.53 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.37 1ocq n HIS 35 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1ocq s GLY 36 N -1.90 1.48 0.53 1.57 0.00 -1.26 -4.40 107.32 103.34 1ocq s GLY 36 Ca 0.00 1.48 0.34 0.00 0.00 0.00 0.00 44.72 46.54 1ocq s GLY 36 CO 0.00 2.72 2.01 1.41 0.00 0.00 0.00 173.10 179.24 1ocq h LEU 37 N 6.57 0.00 -0.03 0.66 3.38 -1.80 -0.66 115.31 123.43 1ocq h LEU 37 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1ocq h LEU 37 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1ocq h LEU 37 CO 0.92 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.45 1ocq n GLN 38 N -2.94 0.09 -0.03 1.13 0.00 -1.26 -3.20 117.38 111.17 1ocq n GLN 38 Ca 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 57.00 57.07 1ocq n GLN 38 Cb 0.24 -1.61 -0.02 0.00 0.00 0.00 0.00 30.24 28.85 1ocq n GLN 38 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1ocq n TRP 39 N -1.77 0.00 -2.31 2.61 8.01 -0.55 -4.85 117.44 118.58 1ocq n TRP 39 Ca 0.06 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.23 1ocq n TRP 39 Cb 0.35 -0.20 0.07 0.00 -2.01 0.00 0.00 31.31 29.52 1ocq n TRP 39 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1ocq n TYR 40 N -2.63 0.88 0.32 -5.99 4.01 -0.37 -4.85 117.16 108.52 1ocq n TYR 40 Ca -0.09 -1.50 0.13 0.00 -0.16 0.00 0.00 57.90 56.28 1ocq n TYR 40 Cb 0.60 -0.23 0.58 0.00 -0.31 0.00 0.00 39.34 39.97 1ocq n TYR 40 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1ocq h GLY 41 N 1.68 0.00 2.00 2.72 0.00 -1.70 -2.78 103.07 104.99 1ocq h GLY 41 Ca -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 1ocq h GLY 41 CO 0.23 0.00 -0.02 0.06 0.00 0.00 0.00 176.54 176.81 1ocq h GLN 42 N 0.00 0.00 -0.00 4.80 -0.00 -1.88 -1.67 115.11 116.35 1ocq h GLN 42 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1ocq h GLN 42 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.75 1ocq h GLN 42 CO 0.00 0.02 -0.02 1.19 -0.00 0.00 0.00 178.83 180.02 1ocq n PHE 43 N -3.15 0.00 -3.74 0.06 3.72 -1.05 -4.66 117.46 108.65 1ocq n PHE 43 Ca -0.01 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.02 1ocq n PHE 43 Cb 0.24 -0.10 -0.11 0.00 -0.94 0.00 0.00 39.48 38.56 1ocq n PHE 43 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1ocq s VAL 44 N -2.23 3.57 0.15 -4.37 1.01 -0.63 -4.76 120.40 113.13 1ocq s VAL 44 Ca 0.39 -1.70 -0.24 0.00 0.00 0.00 0.00 61.98 60.42 1ocq s VAL 44 Cb 0.21 -3.28 0.06 0.00 0.00 0.00 0.00 36.38 33.38 1ocq s VAL 44 CO 0.41 -0.52 0.78 0.54 0.00 0.00 0.00 175.10 176.30 1ocq s ASN 45 N 1.84 -0.35 0.20 3.32 2.20 -1.26 -4.88 114.94 116.00 1ocq s ASN 45 Ca 0.04 -0.25 -0.10 0.00 -0.94 0.00 0.00 52.86 51.61 1ocq s ASN 45 Cb -0.22 0.56 0.25 0.00 -2.00 0.00 0.00 41.25 39.84 1ocq s ASN 45 CO -0.01 -0.98 1.75 0.22 -2.94 0.00 0.00 177.10 175.14 1ocq h TYR 46 N 2.00 0.40 -0.36 1.54 3.20 -1.95 -1.30 116.97 120.50 1ocq h TYR 46 Ca -0.25 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.60 1ocq h TYR 46 Cb 1.26 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.43 1ocq h TYR 46 CO 0.32 0.12 0.05 0.93 -1.64 0.00 0.00 178.16 177.94 1ocq h GLU 47 N 0.42 0.60 -0.51 1.82 4.39 -1.95 0.63 114.58 119.98 1ocq h GLU 47 Ca 0.29 -0.16 -0.08 0.00 0.34 0.00 0.00 59.36 59.74 1ocq h GLU 47 Cb 0.34 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1ocq h GLU 47 CO -0.28 0.67 -0.03 0.66 -1.16 0.00 0.00 179.01 178.87 1ocq h SER 48 N 0.43 0.84 -0.19 1.42 4.64 -1.48 -1.46 113.55 117.75 1ocq h SER 48 Ca 0.11 -0.23 -0.11 0.00 -0.47 0.00 0.00 61.79 61.09 1ocq h SER 48 Cb 0.37 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 1ocq h SER 48 CO 0.01 0.92 -0.26 -0.03 -0.87 0.00 0.00 176.83 176.60 1ocq h MET 49 N 0.80 0.66 -0.57 4.77 1.85 -1.04 -0.53 114.93 120.86 1ocq h MET 49 Ca 0.15 -0.27 -0.07 0.00 -0.61 0.00 0.00 59.70 58.90 1ocq h MET 49 Cb 0.52 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.50 1ocq h MET 49 CO 0.03 0.85 0.07 -0.22 -0.40 0.00 0.00 176.91 177.24 1ocq h LYS 50 N 0.57 0.96 -0.47 0.39 3.64 -0.67 -0.24 116.57 120.75 1ocq h LYS 50 Ca 0.08 -0.27 -0.03 0.00 -1.27 0.00 0.00 60.65 59.16 1ocq h LYS 50 Cb 0.74 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1ocq h LYS 50 CO 0.06 0.93 0.20 2.35 -2.27 0.00 0.00 179.45 180.71 1ocq h TRP 51 N 0.85 0.71 -0.84 1.91 2.91 -0.97 0.08 115.95 120.61 1ocq h TRP 51 Ca 0.17 -0.05 0.01 0.00 1.13 0.00 0.00 58.89 60.15 1ocq h TRP 51 Cb 0.45 -0.22 -0.04 0.00 -0.51 0.00 0.00 29.16 28.84 1ocq h TRP 51 CO 0.03 0.60 0.55 -0.07 -1.03 0.00 0.00 178.44 178.52 1ocq h LEU 52 N 0.62 0.95 0.04 0.65 3.38 -0.87 0.21 115.31 120.29 1ocq h LEU 52 Ca 0.16 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ocq h LEU 52 Cb 0.18 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1ocq h LEU 52 CO -0.01 0.68 -0.02 -0.09 0.09 0.00 0.00 178.44 179.09 1ocq h ARG 53 N 1.12 -0.05 0.23 1.13 2.43 -0.66 -0.99 114.38 117.59 1ocq h ARG 53 Ca 0.31 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 59.14 1ocq h ARG 53 Cb -0.11 0.01 0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1ocq h ARG 53 CO -0.07 0.02 -1.56 -0.44 -1.51 0.00 0.00 179.97 176.41 1ocq h ASP 54 N -0.11 0.77 0.18 -3.80 3.32 -0.73 -2.25 116.42 113.79 1ocq h ASP 54 Ca -0.01 -0.90 -0.35 0.00 0.02 0.00 0.00 57.03 55.79 1ocq h ASP 54 Cb 0.09 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.35 1ocq h ASP 54 CO 0.01 1.72 -2.09 -0.67 -1.72 0.00 0.00 179.24 176.49 1ocq n ASP 55 N -3.67 1.42 -0.00 6.45 2.03 0.71 -4.42 116.55 119.07 1ocq n ASP 55 Ca -0.19 0.16 0.01 0.00 0.52 0.00 0.00 54.79 55.29 1ocq n ASP 55 Cb 1.10 -0.26 -0.11 0.00 -0.72 0.00 0.00 41.12 41.12 1ocq n ASP 55 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 1ocq n TRP 56 N -3.20 0.55 -0.63 -0.67 7.02 -0.67 -4.92 117.44 114.92 1ocq n TRP 56 Ca -0.31 0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.35 1ocq n TRP 56 Cb 1.05 -0.93 0.00 0.00 -2.42 0.00 0.00 31.31 29.01 1ocq n TRP 56 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1ocq n GLY 57 N 1.43 0.61 3.74 6.99 0.00 -0.47 -2.85 105.19 114.65 1ocq n GLY 57 Ca -0.13 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 44.87 1ocq n GLY 57 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ocq s ILE 58 N -2.00 2.16 0.00 -0.61 -4.36 -1.01 -4.92 121.20 110.46 1ocq s ILE 58 Ca 0.00 0.10 0.00 0.00 -0.26 0.00 0.00 60.65 60.49 1ocq s ILE 58 Cb 0.00 -3.03 0.00 0.00 1.25 0.00 0.00 42.46 40.68 1ocq s ILE 58 CO 0.00 -0.02 0.73 -0.46 0.24 0.00 0.00 174.94 175.43 1ocq n ASN 59 N -1.85 1.13 -3.70 4.36 0.23 -0.81 -4.55 115.26 110.07 1ocq n ASN 59 Ca 0.15 -1.52 -0.15 0.00 -0.53 0.00 0.00 54.58 52.54 1ocq n ASN 59 Cb 0.48 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.10 1ocq n ASN 59 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1ocq s VAL 60 N -0.52 0.04 -0.03 3.53 0.11 -1.25 -1.74 120.40 120.54 1ocq s VAL 60 Ca 0.00 -0.33 0.02 0.00 -2.93 0.00 0.00 61.98 58.73 1ocq s VAL 60 Cb 0.00 -0.72 0.01 0.00 -1.53 0.00 0.00 36.38 34.15 1ocq s VAL 60 CO 0.00 -0.18 -0.05 0.12 -3.33 0.00 0.00 175.10 171.65 1ocq s PHE 61 N -1.23 0.68 -0.22 1.54 5.36 -0.68 -3.21 117.98 120.22 1ocq s PHE 61 Ca -0.12 -0.16 -0.07 0.00 -0.96 0.00 0.00 56.93 55.62 1ocq s PHE 61 Cb -0.04 -0.55 -0.03 0.00 -0.34 0.00 0.00 43.02 42.06 1ocq s PHE 61 CO 0.06 -0.11 0.05 0.50 -1.46 0.00 0.00 175.22 174.25 1ocq s ARG 62 N 0.48 3.70 -0.53 10.12 3.52 -0.13 -0.86 118.95 135.25 1ocq s ARG 62 Ca -0.06 -0.47 -0.18 0.00 -0.13 0.00 0.00 55.73 54.89 1ocq s ARG 62 Cb -0.10 -3.23 0.08 0.00 -1.56 0.00 0.00 34.95 30.14 1ocq s ARG 62 CO 0.00 -0.05 0.60 0.00 -0.81 0.00 0.00 175.30 175.04 1ocq s ALA 63 N 1.21 3.45 -0.88 6.12 0.00 -0.24 -0.89 121.76 130.52 1ocq s ALA 63 Ca 0.04 -2.01 -0.19 0.00 0.00 0.00 0.00 51.96 49.80 1ocq s ALA 63 Cb -0.14 -3.35 0.12 0.00 0.00 0.00 0.00 23.12 19.75 1ocq s ALA 63 CO 0.03 -2.06 1.08 0.00 0.00 0.00 0.00 175.76 174.81 1ocq s ALA 64 N 2.39 3.35 -0.88 0.00 0.00 -1.26 -2.00 121.76 123.36 1ocq s ALA 64 Ca 0.11 -2.64 -0.17 0.00 0.00 0.00 0.00 51.96 49.26 1ocq s ALA 64 Cb -0.22 -3.99 0.15 0.00 0.00 0.00 0.00 23.12 19.06 1ocq s ALA 64 CO 0.09 -2.91 1.00 1.41 0.00 0.00 0.00 175.76 175.35 1ocq s MET 65 N 2.81 3.57 0.33 0.00 1.75 -0.58 -2.33 119.30 124.85 1ocq s MET 65 Ca 0.30 -1.93 -0.27 0.00 -1.25 0.00 0.00 55.69 52.54 1ocq s MET 65 Cb -0.07 -4.74 -0.13 0.00 2.84 0.00 0.00 34.83 32.73 1ocq s MET 65 CO -0.06 -1.62 1.03 0.66 -0.65 0.00 0.00 175.02 174.38 1ocq n TYR 66 N 5.81 1.34 -0.08 4.11 4.02 -1.26 -1.07 117.16 130.02 1ocq n TYR 66 Ca 0.19 0.65 -0.16 0.00 -0.01 0.00 0.00 57.90 58.57 1ocq n TYR 66 Cb 0.48 -2.26 -0.11 0.00 -0.02 0.00 0.00 39.34 37.44 1ocq n TYR 66 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 1ocq h THR 67 N 1.93 1.13 -3.07 -0.72 1.35 -1.88 -0.04 112.91 111.60 1ocq h THR 67 Ca -0.42 -2.07 0.00 0.00 -0.55 0.00 0.00 66.41 63.37 1ocq h THR 67 Cb 1.33 2.36 0.00 0.00 -1.73 0.00 0.00 68.15 70.11 1ocq h THR 67 CO 0.60 0.38 0.00 -0.24 -0.25 0.00 0.00 175.52 176.01 1ocq n SER 68 N -4.54 0.00 -3.77 5.36 2.88 -1.26 -1.00 113.62 111.29 1ocq n SER 68 Ca -0.19 -0.20 -0.27 0.00 -1.33 0.00 0.00 58.87 56.88 1ocq n SER 68 Cb 0.52 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.03 1ocq n SER 68 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ocq n SER 69 N -0.59 -5.14 0.00 -3.46 7.64 -1.26 -0.99 113.62 109.82 1ocq n SER 69 Ca 0.00 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.20 1ocq n SER 69 Cb 0.00 -4.38 0.00 0.00 -1.01 0.00 0.00 64.21 58.82 1ocq n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ocq n GLY 70 N -1.79 0.81 0.00 0.23 0.00 -1.26 -5.02 105.19 98.15 1ocq n GLY 70 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ocq n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ocq n GLY 71 N -2.26 0.95 0.37 -0.02 0.00 -0.16 -4.45 105.19 99.62 1ocq n GLY 71 Ca 0.00 -1.48 0.04 0.00 0.00 0.00 0.00 46.02 44.58 1ocq n GLY 71 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ocq h TYR 72 N 0.00 1.15 -0.64 1.61 3.20 -0.73 0.95 116.97 122.52 1ocq h TYR 72 Ca 0.00 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.82 1ocq h TYR 72 Cb 0.00 -0.38 -0.02 0.00 1.54 0.00 0.00 36.73 37.87 1ocq h TYR 72 CO 0.00 0.57 0.10 0.82 -1.64 0.00 0.00 178.16 178.00 1ocq h ILE 73 N 1.10 1.26 -0.14 1.81 1.08 -1.33 -2.67 117.51 118.62 1ocq h ILE 73 Ca 0.44 -1.03 -0.20 0.00 -0.39 0.00 0.00 64.86 63.68 1ocq h ILE 73 Cb 0.25 0.69 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 1ocq h ILE 73 CO -0.19 0.38 -0.73 0.44 -0.69 0.00 0.00 178.15 177.37 1ocq h ASP 74 N 0.97 0.76 -1.70 1.72 3.32 -1.45 -3.43 116.42 116.61 1ocq h ASP 74 Ca 0.19 -0.48 -0.21 0.00 0.02 0.00 0.00 57.03 56.56 1ocq h ASP 74 Cb 0.44 -0.22 -0.28 0.00 0.22 0.00 0.00 39.33 39.49 1ocq h ASP 74 CO 0.01 1.25 -0.55 -0.62 -1.72 0.00 0.00 179.24 177.62 1ocq s ASP 75 N -7.03 0.39 0.00 6.45 -1.08 0.23 -5.02 116.67 110.61 1ocq s ASP 75 Ca -0.08 -0.56 0.24 0.00 -0.52 0.00 0.00 52.55 51.62 1ocq s ASP 75 Cb 0.10 1.08 1.27 0.00 -1.46 0.00 0.00 42.92 43.91 1ocq s ASP 75 CO 0.88 -0.33 1.79 -0.81 0.52 0.00 0.00 175.17 177.21 1ocq n PRO 76 N 5.17 0.47 0.29 4.34 -0.04 -1.02 -3.43 135.00 140.78 1ocq n PRO 76 Ca 0.02 0.04 0.18 0.00 -0.04 0.00 0.00 63.50 63.71 1ocq n PRO 76 Cb 0.49 -1.50 0.98 0.00 -0.04 0.00 0.00 33.50 33.44 1ocq n PRO 76 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ocq h SER 77 N 0.00 0.00 0.08 3.54 4.64 -1.93 -1.30 113.55 118.58 1ocq h SER 77 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ocq h SER 77 Cb 0.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1ocq h SER 77 CO 0.00 0.00 -0.01 1.62 -0.87 0.00 0.00 176.83 177.57 1ocq h VAL 78 N 0.00 0.22 -0.12 0.95 3.04 -1.93 -1.20 116.25 117.21 1ocq h VAL 78 Ca 0.02 -0.07 0.03 0.00 -1.01 0.00 0.00 66.70 65.67 1ocq h VAL 78 Cb 0.18 1.06 -0.00 0.00 -2.01 0.00 0.00 31.29 30.51 1ocq h VAL 78 CO -0.00 0.01 0.10 0.07 -1.01 0.00 0.00 177.57 176.74 1ocq h LYS 79 N 0.00 0.00 0.00 4.17 2.10 -1.54 -1.25 116.57 120.05 1ocq h LYS 79 Ca -0.00 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.56 1ocq h LYS 79 Cb 0.05 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.37 1ocq h LYS 79 CO 0.00 0.00 -0.41 0.93 -2.00 0.00 0.00 179.45 177.97 1ocq h GLU 80 N 0.00 0.00 -0.19 0.07 4.39 -1.43 -1.68 114.58 115.74 1ocq h GLU 80 Ca 0.06 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.60 1ocq h GLU 80 Cb 0.25 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1ocq h GLU 80 CO -0.00 0.41 -0.53 -0.22 -1.16 0.00 0.00 179.01 177.51 1ocq h LYS 81 N 0.00 0.56 -0.46 2.33 1.63 -1.36 -0.70 116.57 118.57 1ocq h LYS 81 Ca -0.00 -0.34 0.03 0.00 -0.85 0.00 0.00 60.65 59.48 1ocq h LYS 81 Cb 0.82 0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.45 1ocq h LYS 81 CO 0.05 0.95 0.25 0.28 -3.45 0.00 0.00 179.45 177.54 1ocq h VAL 82 N 0.43 1.02 -0.74 2.00 2.07 -1.11 -1.19 116.25 118.73 1ocq h VAL 82 Ca 0.01 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1ocq h VAL 82 Cb 1.07 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 1ocq h VAL 82 CO 0.10 0.09 0.42 0.11 0.02 0.00 0.00 177.57 178.31 1ocq h LYS 83 N 0.51 1.02 -0.71 1.57 1.57 -1.09 -0.40 116.57 119.04 1ocq h LYS 83 Ca 0.19 -0.11 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1ocq h LYS 83 Cb 0.05 -0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.11 1ocq h LYS 83 CO -0.10 0.75 0.43 1.49 -0.57 0.00 0.00 179.45 181.45 1ocq h GLU 84 N 1.02 0.79 -0.41 3.15 4.81 -0.82 -0.43 114.58 122.69 1ocq h GLU 84 Ca 0.26 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.41 1ocq h GLU 84 Cb 0.01 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1ocq h GLU 84 CO -0.04 0.53 0.11 0.00 -0.73 0.00 0.00 179.01 178.88 1ocq h ALA 85 N 1.33 0.54 -0.51 2.92 0.00 -0.49 -0.66 119.26 122.38 1ocq h ALA 85 Ca 0.30 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1ocq h ALA 85 Cb 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1ocq h ALA 85 CO -0.14 0.20 0.26 0.28 0.00 0.00 0.00 179.25 179.85 1ocq h VAL 86 N 0.52 1.19 -0.56 0.00 2.07 -0.76 -1.09 116.25 117.62 1ocq h VAL 86 Ca 0.13 -0.52 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 1ocq h VAL 86 Cb 0.29 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1ocq h VAL 86 CO -0.00 0.21 0.05 -0.33 0.02 0.00 0.00 177.57 177.52 1ocq h GLU 87 N 0.68 0.93 -0.52 1.57 5.08 -0.97 -0.69 114.58 120.66 1ocq h GLU 87 Ca 0.18 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1ocq h GLU 87 Cb 0.10 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1ocq h GLU 87 CO -0.02 0.89 0.30 0.00 -1.00 0.00 0.00 179.01 179.17 1ocq h ALA 88 N 1.18 0.67 -0.78 3.43 0.00 -0.90 -0.83 119.26 122.03 1ocq h ALA 88 Ca 0.17 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1ocq h ALA 88 Cb 0.44 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1ocq h ALA 88 CO 0.02 0.18 0.39 0.00 0.00 0.00 0.00 179.25 179.83 1ocq h ALA 89 N 1.13 1.01 -0.39 0.00 0.00 -0.71 0.79 119.26 121.09 1ocq h ALA 89 Ca 0.19 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ocq h ALA 89 Cb 0.03 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1ocq h ALA 89 CO -0.03 0.56 0.25 0.82 0.00 0.00 0.00 179.25 180.85 1ocq h ILE 90 N 1.10 1.11 0.00 0.00 2.04 -0.91 0.18 117.51 121.04 1ocq h ILE 90 Ca 0.27 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 1ocq h ILE 90 Cb 0.10 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1ocq h ILE 90 CO -0.04 0.11 -0.35 0.44 0.00 0.00 0.00 178.15 178.32 1ocq h ASP 91 N 0.52 0.00 0.08 1.72 3.32 -0.61 -2.77 116.42 118.68 1ocq h ASP 91 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1ocq h ASP 91 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1ocq h ASP 91 CO -0.03 0.35 -0.24 0.18 -1.72 0.00 0.00 179.24 177.77 1ocq n LEU 92 N -4.08 1.65 -3.38 1.55 4.77 0.22 -4.97 117.00 112.76 1ocq n LEU 92 Ca -0.02 -0.54 -0.21 0.00 -0.03 0.00 0.00 56.01 55.21 1ocq n LEU 92 Cb 0.39 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.51 1ocq n LEU 92 CO 0.38 0.30 0.20 -0.67 -1.33 0.00 0.00 177.39 176.27 1ocq n ASP 93 N -0.07 -5.06 -4.50 -1.43 2.03 -0.03 -4.53 116.55 102.96 1ocq n ASP 93 Ca 0.13 -0.53 -0.24 0.00 0.52 0.00 0.00 54.79 54.67 1ocq n ASP 93 Cb 0.42 -4.79 -0.10 0.00 -0.72 0.00 0.00 41.12 35.92 1ocq n ASP 93 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1ocq s ILE 94 N -3.31 1.96 0.59 5.18 -4.36 -0.68 -1.92 121.20 118.66 1ocq s ILE 94 Ca 0.41 -2.15 -0.10 0.00 -0.26 0.00 0.00 60.65 58.54 1ocq s ILE 94 Cb -0.18 -2.61 -0.04 0.00 1.25 0.00 0.00 42.46 40.88 1ocq s ILE 94 CO 0.69 -0.21 0.98 -0.31 0.24 0.00 0.00 174.94 176.33 1ocq s TYR 95 N -2.79 3.62 -0.05 1.37 2.02 -0.71 -4.39 117.35 116.42 1ocq s TYR 95 Ca 0.32 1.21 -0.03 0.00 -0.37 0.00 0.00 57.07 58.19 1ocq s TYR 95 Cb 0.04 -2.65 0.02 0.00 -0.40 0.00 0.00 41.96 38.97 1ocq s TYR 95 CO 0.15 -0.61 0.11 0.54 -1.57 0.00 0.00 175.55 174.17 1ocq s VAL 96 N -3.09 -0.02 -0.23 0.71 0.11 -0.13 -1.69 120.40 116.05 1ocq s VAL 96 Ca 0.54 0.08 -0.08 0.00 -2.93 0.00 0.00 61.98 59.59 1ocq s VAL 96 Cb -0.11 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.53 1ocq s VAL 96 CO 0.52 0.03 0.08 -0.63 -3.33 0.00 0.00 175.10 171.77 1ocq s ILE 97 N 0.53 4.56 -0.50 7.04 1.01 -0.04 -0.89 121.20 132.90 1ocq s ILE 97 Ca -0.04 -0.09 -0.21 0.00 0.00 0.00 0.00 60.65 60.31 1ocq s ILE 97 Cb -0.05 -3.11 0.05 0.00 0.01 0.00 0.00 42.46 39.35 1ocq s ILE 97 CO -0.02 0.37 0.70 -0.63 0.00 0.00 0.00 174.94 175.36 1ocq s ILE 98 N 1.25 4.75 -0.34 2.92 1.01 -0.27 -1.08 121.20 129.43 1ocq s ILE 98 Ca 0.05 -0.19 -0.07 0.00 0.00 0.00 0.00 60.65 60.44 1ocq s ILE 98 Cb -0.14 -4.34 0.03 0.00 0.01 0.00 0.00 42.46 38.02 1ocq s ILE 98 CO 0.04 -0.84 0.13 -0.62 0.00 0.00 0.00 174.94 173.65 1ocq s ASP 99 N 2.58 5.40 -0.89 3.58 2.15 -0.85 -0.59 116.67 128.06 1ocq s ASP 99 Ca 0.20 -1.08 -0.25 0.00 0.43 0.00 0.00 52.55 51.85 1ocq s ASP 99 Cb -0.17 -1.90 0.02 0.00 -0.30 0.00 0.00 42.92 40.57 1ocq s ASP 99 CO 0.15 -0.33 1.53 0.86 -0.17 0.00 0.00 175.17 177.21 1ocq s TRP 100 N 1.44 2.26 -1.21 -5.34 -0.11 -0.34 -1.53 118.94 114.11 1ocq s TRP 100 Ca -0.01 -0.23 -0.10 0.00 1.22 0.00 0.00 56.10 56.99 1ocq s TRP 100 Cb -0.19 -4.51 0.20 0.00 -1.50 0.00 0.00 33.47 27.47 1ocq s TRP 100 CO 0.04 -1.98 1.60 1.58 -4.62 0.00 0.00 176.95 173.56 1ocq n HIS 101 N 10.25 3.70 -2.35 5.86 -0.00 -0.23 -1.57 115.22 130.89 1ocq n HIS 101 Ca 0.25 -3.05 -0.35 0.00 0.46 0.00 0.00 57.72 55.03 1ocq n HIS 101 Cb 0.50 -1.88 -0.01 0.00 -0.12 0.00 0.00 29.99 28.48 1ocq n HIS 101 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 1ocq s ILE 102 N 0.02 3.36 0.00 3.57 -4.36 -1.26 -2.95 121.20 119.58 1ocq s ILE 102 Ca 0.38 0.85 0.00 0.00 -0.26 0.00 0.00 60.65 61.62 1ocq s ILE 102 Cb 0.03 -3.34 0.00 0.00 1.25 0.00 0.00 42.46 40.40 1ocq s ILE 102 CO 0.01 -0.18 0.00 -0.11 0.24 0.00 0.00 174.94 174.90 1ocq n LEU 103 N -1.18 0.00 0.06 0.37 7.94 -1.26 -3.24 117.00 119.68 1ocq n LEU 103 Ca 0.11 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 55.00 1ocq n LEU 103 Cb 0.51 0.04 0.29 0.00 0.53 0.00 0.00 43.42 44.80 1ocq n LEU 103 CO 0.41 -0.05 0.81 0.77 -1.11 0.00 0.00 177.39 178.23 1ocq h SER 104 N 0.00 0.35 -0.81 1.96 4.64 -1.92 -3.17 113.55 114.60 1ocq h SER 104 Ca 0.00 -0.10 -0.62 0.00 -0.47 0.00 0.00 61.79 60.60 1ocq h SER 104 Cb 0.00 -0.09 -0.07 0.00 -0.31 0.00 0.00 62.40 61.92 1ocq h SER 104 CO 0.00 0.56 2.01 1.51 -0.87 0.00 0.00 176.83 180.04 1ocq s ASP 105 N -6.83 6.55 0.38 4.97 -4.77 -1.26 -4.82 116.67 110.88 1ocq s ASP 105 Ca -0.06 -2.30 0.24 0.00 -3.30 0.00 0.00 52.55 47.13 1ocq s ASP 105 Cb 0.15 -2.58 0.43 0.00 -1.09 0.00 0.00 42.92 39.82 1ocq s ASP 105 CO 0.76 -1.48 1.62 -0.55 0.70 0.00 0.00 175.17 176.23 1ocq h ASN 106 N 7.97 0.00 -3.57 2.11 -1.07 -1.85 -3.41 115.58 115.76 1ocq h ASN 106 Ca 0.41 -0.00 -0.63 0.00 0.07 0.00 0.00 56.30 56.15 1ocq h ASN 106 Cb 0.88 0.00 -0.17 0.00 -2.07 0.00 0.00 38.32 36.96 1ocq h ASN 106 CO 1.42 0.00 -0.55 -0.62 0.07 0.00 0.00 177.43 177.75 1ocq s ASP 107 N -5.83 5.75 0.51 6.14 -1.08 -1.26 -1.61 116.67 119.30 1ocq s ASP 107 Ca 0.08 0.01 0.34 0.00 -0.52 0.00 0.00 52.55 52.46 1ocq s ASP 107 Cb 0.07 -2.03 1.71 0.00 -1.46 0.00 0.00 42.92 41.21 1ocq s ASP 107 CO 0.66 0.05 2.04 1.55 0.52 0.00 0.00 175.17 179.99 1ocq h PRO 108 N 7.61 0.00 0.00 4.34 0.13 -1.91 -1.99 132.00 140.17 1ocq h PRO 108 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1ocq h PRO 108 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ocq h PRO 108 CO 0.63 0.00 0.00 -0.91 -0.23 0.00 0.00 178.00 177.49 1ocq h ASN 109 N 0.00 0.00 -0.46 1.44 2.35 -1.94 -3.17 115.58 113.80 1ocq h ASN 109 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1ocq h ASN 109 Cb 0.17 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 1ocq h ASN 109 CO 0.00 0.00 0.25 0.40 -1.65 0.00 0.00 177.43 176.43 1ocq h ILE 110 N 0.00 1.01 -0.45 2.81 2.04 -1.73 -2.82 117.51 118.36 1ocq h ILE 110 Ca 0.00 -0.17 -0.28 0.00 1.00 0.00 0.00 64.86 65.40 1ocq h ILE 110 Cb 0.45 0.46 -0.18 0.00 -0.74 0.00 0.00 36.82 36.81 1ocq h ILE 110 CO 0.00 0.09 -0.21 -1.22 0.00 0.00 0.00 178.15 176.81 1ocq n TYR 111 N -4.87 1.51 -0.17 1.37 4.01 -1.23 -4.79 117.16 112.99 1ocq n TYR 111 Ca 0.03 -1.86 -0.03 0.00 -0.16 0.00 0.00 57.90 55.87 1ocq n TYR 111 Cb 0.09 -0.52 0.17 0.00 -0.31 0.00 0.00 39.34 38.77 1ocq n TYR 111 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1ocq h LYS 112 N 1.35 0.92 -0.28 -0.72 3.64 -1.47 0.17 116.57 120.18 1ocq h LYS 112 Ca 0.26 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1ocq h LYS 112 Cb 1.48 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 33.14 1ocq h LYS 112 CO 0.53 0.79 0.18 0.93 -2.27 0.00 0.00 179.45 179.62 1ocq h GLU 113 N 0.89 0.38 -0.46 1.90 4.39 -1.86 -0.66 114.58 119.16 1ocq h GLU 113 Ca 0.20 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.80 1ocq h GLU 113 Cb 0.26 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1ocq h GLU 113 CO -0.01 0.27 -0.02 0.93 -1.16 0.00 0.00 179.01 179.02 1ocq h GLU 114 N 0.38 0.78 -0.54 2.33 3.07 -1.83 -2.33 114.58 116.43 1ocq h GLU 114 Ca 0.10 -0.22 -0.03 0.00 -0.50 0.00 0.00 59.36 58.72 1ocq h GLU 114 Cb -0.02 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 1ocq h GLU 114 CO -0.02 0.80 0.22 0.00 -1.40 0.00 0.00 179.01 178.61 1ocq h ALA 115 N 1.25 0.70 -0.25 3.43 0.00 -0.60 -0.21 119.26 123.58 1ocq h ALA 115 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ocq h ALA 115 Cb 0.47 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1ocq h ALA 115 CO 0.02 0.31 0.16 0.87 0.00 0.00 0.00 179.25 180.61 1ocq h LYS 116 N 0.73 0.33 -0.71 0.00 1.57 -0.95 0.33 116.57 117.88 1ocq h LYS 116 Ca 0.18 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1ocq h LYS 116 Cb 0.20 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1ocq h LYS 116 CO -0.02 0.24 0.30 -0.44 -0.57 0.00 0.00 179.45 178.96 1ocq h ASP 117 N 0.33 0.97 -0.27 0.86 3.32 -1.22 -0.24 116.42 120.17 1ocq h ASP 117 Ca 0.09 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 1ocq h ASP 117 Cb -0.02 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1ocq h ASP 117 CO -0.02 0.86 0.08 0.15 -1.72 0.00 0.00 179.24 178.59 1ocq h PHE 118 N 1.02 0.44 0.00 4.55 3.57 -0.75 -1.85 116.94 123.92 1ocq h PHE 118 Ca 0.24 -0.05 -0.11 0.00 3.53 0.00 0.00 57.97 61.58 1ocq h PHE 118 Cb 0.18 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 1ocq h PHE 118 CO 0.01 0.48 -0.53 0.74 -2.23 0.00 0.00 178.31 176.78 1ocq h PHE 119 N 0.27 0.00 -0.12 0.41 0.04 -0.86 -0.67 116.94 116.01 1ocq h PHE 119 Ca 0.09 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.87 1ocq h PHE 119 Cb 0.25 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 1ocq h PHE 119 CO 0.01 0.53 0.03 0.22 -0.60 0.00 0.00 178.31 178.49 1ocq h ASP 120 N 0.00 0.02 -0.17 2.17 3.58 -0.91 -1.28 116.42 119.83 1ocq h ASP 120 Ca -0.01 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 1ocq h ASP 120 Cb 1.06 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 42.12 1ocq h ASP 120 CO 0.07 0.03 0.08 -0.08 -2.88 0.00 0.00 179.24 176.46 1ocq h GLU 121 N 0.08 0.25 -0.47 0.28 4.81 -0.87 -0.77 114.58 117.89 1ocq h GLU 121 Ca 0.05 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 1ocq h GLU 121 Cb 0.04 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1ocq h GLU 121 CO -0.07 0.29 -0.09 0.52 -0.73 0.00 0.00 179.01 178.94 1ocq h MET 122 N 0.14 0.88 0.00 1.92 2.86 -1.09 -1.52 114.93 118.12 1ocq h MET 122 Ca 0.06 -0.33 -0.13 0.00 -2.06 0.00 0.00 59.70 57.25 1ocq h MET 122 Cb 0.13 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1ocq h MET 122 CO -0.01 0.97 -0.60 0.66 1.06 0.00 0.00 176.91 178.99 1ocq h SER 123 N 0.73 0.00 -0.37 1.22 4.64 -1.19 -0.66 113.55 117.93 1ocq h SER 123 Ca 0.12 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.38 1ocq h SER 123 Cb 0.63 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1ocq h SER 123 CO 0.04 0.60 -0.01 -0.08 -0.87 0.00 0.00 176.83 176.51 1ocq h GLU 124 N 0.00 0.65 -0.27 4.77 4.57 -0.92 -0.08 114.58 123.30 1ocq h GLU 124 Ca -0.01 -0.21 -0.11 0.00 -1.18 0.00 0.00 59.36 57.85 1ocq h GLU 124 Cb 1.08 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.61 1ocq h GLU 124 CO 0.08 0.77 -0.25 -0.07 -1.18 0.00 0.00 179.01 178.36 1ocq h LEU 125 N 0.47 0.69 -1.71 1.64 3.38 -1.08 -3.38 115.31 115.31 1ocq h LEU 125 Ca 0.10 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1ocq h LEU 125 Cb 0.48 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1ocq h LEU 125 CO 0.02 1.01 0.00 -1.22 0.09 0.00 0.00 178.44 178.34 1ocq n TYR 126 N -4.32 0.02 0.43 1.13 4.01 -0.27 -4.73 117.16 113.43 1ocq n TYR 126 Ca -0.04 -0.17 0.06 0.00 -0.16 0.00 0.00 57.90 57.59 1ocq n TYR 126 Cb 0.44 -0.02 0.26 0.00 -0.31 0.00 0.00 39.34 39.72 1ocq n TYR 126 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ocq n GLY 127 N -0.05 -0.86 1.55 2.72 0.00 -0.05 -1.77 105.19 106.74 1ocq n GLY 127 Ca 0.01 -0.04 0.01 0.00 0.00 0.00 0.00 46.02 46.00 1ocq n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ocq n ASP 128 N -1.46 4.45 -4.53 1.61 2.03 -1.26 -4.69 116.55 112.70 1ocq n ASP 128 Ca 0.03 -3.18 -0.32 0.00 0.52 0.00 0.00 54.79 51.84 1ocq n ASP 128 Cb 0.13 -0.66 -0.12 0.00 -0.72 0.00 0.00 41.12 39.75 1ocq n ASP 128 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1ocq s TYR 129 N -2.94 2.77 -1.29 -0.67 2.02 -0.73 -5.03 117.35 111.48 1ocq s TYR 129 Ca 0.50 -0.11 0.29 0.00 -0.37 0.00 0.00 57.07 57.38 1ocq s TYR 129 Cb 0.40 -1.60 1.40 0.00 -0.40 0.00 0.00 41.96 41.77 1ocq s TYR 129 CO 0.11 0.28 1.99 -0.35 -1.57 0.00 0.00 175.55 176.01 1ocq n PRO 130 N 1.88 0.28 0.18 -1.71 -0.04 -1.26 -3.91 135.00 130.42 1ocq n PRO 130 Ca -0.16 0.01 0.04 0.00 -0.04 0.00 0.00 63.50 63.34 1ocq n PRO 130 Cb 0.52 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.81 1ocq n PRO 130 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1ocq h ASN 131 N 0.00 0.00 -3.41 3.54 4.21 -1.89 -3.43 115.58 114.60 1ocq h ASN 131 Ca 0.00 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.96 1ocq h ASN 131 Cb 0.35 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.51 1ocq h ASN 131 CO 0.00 0.42 0.11 -0.69 -1.29 0.00 0.00 177.43 175.97 1ocq s VAL 132 N -3.79 4.61 -0.07 2.81 1.01 -1.25 -0.96 120.40 122.75 1ocq s VAL 132 Ca -0.01 1.53 0.02 0.00 0.00 0.00 0.00 61.98 63.52 1ocq s VAL 132 Cb 0.12 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.46 1ocq s VAL 132 CO 0.71 0.48 -0.13 -0.63 0.00 0.00 0.00 175.10 175.52 1ocq s ILE 133 N -0.74 1.21 -0.26 2.22 1.01 -0.07 -4.24 121.20 120.33 1ocq s ILE 133 Ca 0.34 -0.51 -0.10 0.00 0.00 0.00 0.00 60.65 60.38 1ocq s ILE 133 Cb -0.21 -1.11 -0.05 0.00 0.01 0.00 0.00 42.46 41.10 1ocq s ILE 133 CO 0.23 0.38 0.17 -0.31 0.00 0.00 0.00 174.94 175.40 1ocq s TYR 134 N 0.74 3.25 -0.43 3.97 2.02 -0.54 -1.12 117.35 125.25 1ocq s TYR 134 Ca -0.13 0.11 -0.06 0.00 -0.37 0.00 0.00 57.07 56.63 1ocq s TYR 134 Cb -0.16 -2.32 0.11 0.00 -0.40 0.00 0.00 41.96 39.19 1ocq s TYR 134 CO 0.03 -0.08 0.25 -2.00 -1.57 0.00 0.00 175.55 172.18 1ocq s GLU 135 N 1.45 2.26 0.03 -0.62 2.12 0.25 -0.35 118.70 123.84 1ocq s GLU 135 Ca 0.07 -1.73 0.27 0.00 0.36 0.00 0.00 54.97 53.93 1ocq s GLU 135 Cb -0.15 -3.71 0.82 0.00 0.26 0.00 0.00 34.13 31.34 1ocq s GLU 135 CO 0.08 -1.08 1.65 0.44 -0.54 0.00 0.00 175.26 175.80 1ocq n ILE 136 N 4.75 0.08 -3.11 -3.70 -5.35 -0.84 -1.20 119.36 109.99 1ocq n ILE 136 Ca -0.06 -0.05 0.02 0.00 -0.27 0.00 0.00 62.75 62.40 1ocq n ILE 136 Cb 0.41 -0.16 -0.00 0.00 -1.74 0.00 0.00 39.64 38.15 1ocq n ILE 136 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ocq s ALA 137 N -3.02 -2.93 0.01 -1.28 0.00 -1.25 -4.72 121.76 108.56 1ocq s ALA 137 Ca 0.12 0.77 -0.02 0.00 0.00 0.00 0.00 51.96 52.83 1ocq s ALA 137 Cb 0.17 -2.74 -0.00 0.00 0.00 0.00 0.00 23.12 20.55 1ocq s ALA 137 CO 0.62 -2.15 1.03 -0.97 0.00 0.00 0.00 175.76 174.29 1ocq h ASN 138 N 7.03 -0.10 -2.33 0.00 -1.24 -1.51 -3.17 115.58 114.27 1ocq h ASN 138 Ca 0.00 0.01 -0.59 0.00 0.71 0.00 0.00 56.30 56.44 1ocq h ASN 138 Cb 1.19 0.04 -0.38 0.00 0.73 0.00 0.00 38.32 39.90 1ocq h ASN 138 CO 0.06 -0.01 -0.99 -0.62 -1.29 0.00 0.00 177.43 174.58 1ocq n GLU 139 N -3.03 0.24 -1.61 6.67 1.02 -1.20 -4.64 120.64 118.09 1ocq n GLU 139 Ca 0.00 -3.18 -0.44 0.00 -0.02 0.00 0.00 57.16 53.52 1ocq n GLU 139 Cb 0.01 -1.63 -0.01 0.00 -0.02 0.00 0.00 31.44 29.80 1ocq n GLU 139 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1ocq n PRO 140 N 2.70 1.46 -3.70 3.49 -0.02 -1.26 -4.52 135.00 133.15 1ocq n PRO 140 Ca 0.29 0.51 -0.10 0.00 -2.02 0.00 0.00 63.50 62.19 1ocq n PRO 140 Cb 0.48 -1.94 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 1ocq n PRO 140 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ocq s ASN 141 N -0.55 -0.33 0.00 2.55 2.20 -0.63 -0.54 114.94 117.64 1ocq s ASN 141 Ca 0.59 -0.41 0.00 0.00 -0.94 0.00 0.00 52.86 52.10 1ocq s ASN 141 Cb -0.66 0.62 0.00 0.00 -2.00 0.00 0.00 41.25 39.21 1ocq s ASN 141 CO 0.60 -1.10 0.00 0.61 -2.94 0.00 0.00 177.10 174.27 1ocq n GLY 142 N -0.38 2.36 0.29 0.45 0.00 -1.26 -4.51 105.19 102.14 1ocq n GLY 142 Ca -0.10 -1.72 0.18 0.00 0.00 0.00 0.00 46.02 44.39 1ocq n GLY 142 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ocq h SER 143 N 0.00 0.00 -0.22 1.61 4.64 -2.01 -2.19 113.55 115.38 1ocq h SER 143 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ocq h SER 143 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ocq h SER 143 CO 0.00 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.06 1ocq n ASP 144 N -3.09 1.59 -4.01 4.97 5.75 -1.26 -4.68 116.55 115.82 1ocq n ASP 144 Ca -0.00 -1.82 -0.31 0.00 -0.01 0.00 0.00 54.79 52.65 1ocq n ASP 144 Cb 0.26 -0.15 -0.15 0.00 -1.03 0.00 0.00 41.12 40.05 1ocq n ASP 144 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ocq s VAL 145 N -1.71 2.06 0.26 2.12 1.01 -0.83 -4.94 120.40 118.38 1ocq s VAL 145 Ca 0.27 -1.89 0.10 0.00 0.00 0.00 0.00 61.98 60.46 1ocq s VAL 145 Cb 0.14 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 1ocq s VAL 145 CO 0.21 -0.33 -0.03 0.42 0.00 0.00 0.00 175.10 175.37 1ocq s THR 146 N 1.08 3.35 0.11 3.92 -4.23 -1.26 -4.68 115.64 113.92 1ocq s THR 146 Ca 0.01 -1.93 -0.30 0.00 -1.18 0.00 0.00 61.69 58.29 1ocq s THR 146 Cb -0.19 -2.78 -0.10 0.00 1.34 0.00 0.00 72.50 70.77 1ocq s THR 146 CO -0.08 -0.36 1.60 -0.25 -0.54 0.00 0.00 174.62 175.00 1ocq h TRP 147 N 2.00 -1.04 -0.16 3.99 2.91 -1.96 -0.42 115.95 121.28 1ocq h TRP 147 Ca -0.44 0.02 -0.13 0.00 1.13 0.00 0.00 58.89 59.47 1ocq h TRP 147 Cb 1.25 0.43 -0.01 0.00 -0.51 0.00 0.00 29.16 30.32 1ocq h TRP 147 CO 0.69 -0.49 -0.46 0.78 -1.03 0.00 0.00 178.44 177.94 1ocq h GLY 148 N -0.63 0.43 0.74 2.65 0.00 -1.96 0.14 103.07 104.44 1ocq h GLY 148 Ca 0.02 -0.44 -0.33 0.00 0.00 0.00 0.00 47.33 46.58 1ocq h GLY 148 CO -0.20 0.40 -1.89 0.70 0.00 0.00 0.00 176.54 175.55 1ocq n ASN 149 N -3.99 1.27 -0.01 0.19 3.02 -1.21 -4.55 115.26 109.99 1ocq n ASN 149 Ca -0.02 0.29 -0.03 0.00 -0.03 0.00 0.00 54.58 54.80 1ocq n ASN 149 Cb 0.53 -0.27 -0.01 0.00 -0.61 0.00 0.00 39.78 39.42 1ocq n ASN 149 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ocq n GLN 150 N -3.18 0.06 -0.06 3.52 3.00 -0.29 -4.76 117.38 115.67 1ocq n GLN 150 Ca -0.24 0.02 -0.13 0.00 -0.01 0.00 0.00 57.00 56.64 1ocq n GLN 150 Cb 1.06 -0.60 -0.12 0.00 0.00 0.00 0.00 30.24 30.59 1ocq n GLN 150 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 1ocq h ILE 151 N -0.10 1.59 -0.45 5.09 2.04 -1.04 -2.62 117.51 122.02 1ocq h ILE 151 Ca -0.06 -2.08 0.02 0.00 1.00 0.00 0.00 64.86 63.74 1ocq h ILE 151 Cb 0.89 2.95 -0.03 0.00 -0.74 0.00 0.00 36.82 39.89 1ocq h ILE 151 CO -0.03 0.52 0.27 0.50 0.00 0.00 0.00 178.15 179.40 1ocq h LYS 152 N -0.94 0.52 -0.34 2.37 3.64 -0.96 -0.59 116.57 120.29 1ocq h LYS 152 Ca -0.00 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1ocq h LYS 152 Cb 0.86 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1ocq h LYS 152 CO 0.00 0.35 -0.08 -1.35 -2.27 0.00 0.00 179.45 176.09 1ocq h PRO 153 N 0.54 0.56 -0.16 1.90 0.11 -1.77 -0.59 132.00 132.58 1ocq h PRO 153 Ca 0.18 -0.15 0.03 0.00 0.11 0.00 0.00 66.00 66.17 1ocq h PRO 153 Cb 0.01 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.03 1ocq h PRO 153 CO -0.08 0.65 -0.03 -0.92 -0.21 0.00 0.00 178.00 177.41 1ocq h TYR 154 N 0.52 -0.06 -0.77 0.65 3.20 -1.05 -2.37 116.97 117.08 1ocq h TYR 154 Ca 0.10 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.00 1ocq h TYR 154 Cb 0.46 0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 1ocq h TYR 154 CO 0.02 -0.05 0.51 0.00 -1.64 0.00 0.00 178.16 177.00 1ocq h ALA 155 N 1.15 1.47 0.00 1.82 0.00 -0.58 -1.17 119.26 121.94 1ocq h ALA 155 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ocq h ALA 155 Cb 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ocq h ALA 155 CO -0.15 0.49 0.00 0.39 0.00 0.00 0.00 179.25 179.97 1ocq n GLU 156 N -4.42 0.48 -0.09 0.00 1.02 -0.28 -0.69 120.64 116.65 1ocq n GLU 156 Ca 0.09 0.04 -0.17 0.00 -0.02 0.00 0.00 57.16 57.10 1ocq n GLU 156 Cb 0.05 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.83 1ocq n GLU 156 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ocq n GLU 157 N -1.21 0.68 0.12 3.49 1.02 -0.54 -4.52 120.64 119.68 1ocq n GLU 157 Ca 0.14 0.16 -0.24 0.00 -0.02 0.00 0.00 57.16 57.20 1ocq n GLU 157 Cb 0.17 -1.57 -0.16 0.00 -0.02 0.00 0.00 31.44 29.85 1ocq n GLU 157 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ocq h VAL 158 N 0.02 1.26 -0.76 2.62 2.07 -1.03 -3.34 116.25 117.08 1ocq h VAL 158 Ca -0.53 -2.64 0.05 0.00 0.82 0.00 0.00 66.70 64.41 1ocq h VAL 158 Cb 1.99 3.02 -0.06 0.00 -1.52 0.00 0.00 31.29 34.73 1ocq h VAL 158 CO -0.02 0.80 0.46 0.40 0.02 0.00 0.00 177.57 179.23 1ocq h ILE 159 N 0.05 1.03 -0.45 4.57 2.04 -1.16 -1.84 117.51 121.76 1ocq h ILE 159 Ca -0.25 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 1ocq h ILE 159 Cb 2.07 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 1ocq h ILE 159 CO 0.24 0.16 0.22 -0.65 0.00 0.00 0.00 178.15 178.12 1ocq h PRO 160 N 0.86 0.62 -0.15 2.37 0.11 -1.80 0.67 132.00 134.69 1ocq h PRO 160 Ca 0.33 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.37 1ocq h PRO 160 Cb 0.14 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1ocq h PRO 160 CO -0.16 0.48 0.10 0.82 -0.21 0.00 0.00 178.00 179.02 1ocq h ILE 161 N 0.62 1.05 -0.12 4.15 1.08 -1.47 -1.64 117.51 121.18 1ocq h ILE 161 Ca 0.16 -0.12 -0.00 0.00 -0.39 0.00 0.00 64.86 64.50 1ocq h ILE 161 Cb 0.05 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 34.67 1ocq h ILE 161 CO -0.02 0.05 0.06 0.40 -0.69 0.00 0.00 178.15 177.95 1ocq h ILE 162 N 0.19 1.11 0.00 -0.67 2.04 -0.89 -3.13 117.51 116.15 1ocq h ILE 162 Ca 0.05 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1ocq h ILE 162 Cb 0.00 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1ocq h ILE 162 CO -0.01 0.10 -0.11 0.03 0.00 0.00 0.00 178.15 178.16 1ocq h ARG 163 N 0.08 0.00 0.00 2.37 2.47 -0.69 0.16 114.38 118.77 1ocq h ARG 163 Ca 0.04 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.73 1ocq h ARG 163 Cb 0.10 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 1ocq h ARG 163 CO -0.01 0.11 -0.14 -0.97 0.56 0.00 0.00 179.97 179.52 1ocq h ASN 164 N 0.00 0.00 0.00 7.04 -1.24 -1.24 -3.21 115.58 116.93 1ocq h ASN 164 Ca -0.00 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 1ocq h ASN 164 Cb 0.39 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.43 1ocq h ASN 164 CO 0.01 0.14 -1.68 0.59 -1.29 0.00 0.00 177.43 175.20 1ocq n ASN 165 N -3.65 2.02 -3.36 1.15 3.02 -0.28 -4.95 115.26 109.22 1ocq n ASN 165 Ca -0.02 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.38 1ocq n ASN 165 Cb 0.26 1.32 -0.08 0.00 -0.61 0.00 0.00 39.78 40.67 1ocq n ASN 165 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ocq s ASP 166 N -3.84 1.13 0.37 6.41 -1.08 0.41 -4.71 116.67 115.36 1ocq s ASP 166 Ca -0.05 -1.28 0.27 0.00 -0.52 0.00 0.00 52.55 50.97 1ocq s ASP 166 Cb 0.07 0.64 1.12 0.00 -1.46 0.00 0.00 42.92 43.28 1ocq s ASP 166 CO 0.53 -0.29 1.82 1.55 0.52 0.00 0.00 175.17 179.29 1ocq h PRO 167 N 7.41 0.00 0.00 4.34 0.13 -1.81 -3.34 132.00 138.73 1ocq h PRO 167 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1ocq h PRO 167 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1ocq h PRO 167 CO 0.23 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.27 1ocq n ASN 168 N -2.56 0.00 -4.72 1.44 0.23 -1.26 -4.96 115.26 103.43 1ocq n ASN 168 Ca 0.02 -1.00 -0.34 0.00 -0.53 0.00 0.00 54.58 52.73 1ocq n ASN 168 Cb 0.26 0.00 0.10 0.00 -2.08 0.00 0.00 39.78 38.06 1ocq n ASN 168 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 1ocq s ASN 169 N 0.00 4.11 0.37 0.53 0.01 -1.26 -4.87 114.94 113.82 1ocq s ASN 169 Ca 0.00 2.35 -0.28 0.00 -0.71 0.00 0.00 52.86 54.22 1ocq s ASN 169 Cb 0.00 -2.59 -0.11 0.00 0.41 0.00 0.00 41.25 38.97 1ocq s ASN 169 CO 0.00 -2.32 1.42 -0.63 -1.51 0.00 0.00 177.10 174.06 1ocq s ILE 170 N -2.02 2.27 -0.13 0.60 -1.09 -1.26 -4.91 121.20 114.66 1ocq s ILE 170 Ca 0.74 0.27 0.03 0.00 -2.23 0.00 0.00 60.65 59.46 1ocq s ILE 170 Cb -0.29 -3.17 0.01 0.00 -1.58 0.00 0.00 42.46 37.43 1ocq s ILE 170 CO 0.46 0.06 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.39 1ocq s ILE 171 N -1.14 1.97 -0.22 2.92 1.01 -0.87 -1.46 121.20 123.42 1ocq s ILE 171 Ca 0.52 -0.93 -0.10 0.00 0.00 0.00 0.00 60.65 60.13 1ocq s ILE 171 Cb -0.44 -1.74 -0.05 0.00 0.01 0.00 0.00 42.46 40.24 1ocq s ILE 171 CO 0.59 0.53 0.15 -0.63 0.00 0.00 0.00 174.94 175.59 1ocq s ILE 172 N 0.76 5.38 -0.17 2.92 1.01 0.53 -0.83 121.20 130.80 1ocq s ILE 172 Ca -0.09 0.21 -0.00 0.00 0.00 0.00 0.00 60.65 60.76 1ocq s ILE 172 Cb -0.16 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1ocq s ILE 172 CO -0.00 0.40 -0.14 -0.69 0.00 0.00 0.00 174.94 174.51 1ocq s VAL 173 N 0.67 2.71 0.82 2.92 1.01 0.27 -1.98 120.40 126.82 1ocq s VAL 173 Ca 0.08 -0.74 -0.13 0.00 0.00 0.00 0.00 61.98 61.20 1ocq s VAL 173 Cb -0.12 -2.17 0.09 0.00 0.00 0.00 0.00 36.38 34.18 1ocq s VAL 173 CO 0.01 0.50 1.18 -0.83 0.00 0.00 0.00 175.10 175.96 1ocq s GLY 174 N 1.03 2.03 0.42 4.51 0.00 -1.20 -1.02 107.32 113.09 1ocq s GLY 174 Ca -0.01 0.75 0.05 0.00 0.00 0.00 0.00 44.72 45.51 1ocq s GLY 174 CO -0.03 1.16 0.02 -0.51 0.00 0.00 0.00 173.10 173.74 1ocq s THR 175 N -2.30 1.71 0.98 0.90 -4.23 -1.26 -4.80 115.64 106.63 1ocq s THR 175 Ca 0.71 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 59.10 1ocq s THR 175 Cb -0.26 -2.81 0.18 0.00 1.34 0.00 0.00 72.50 70.94 1ocq s THR 175 CO 0.52 0.00 1.08 -0.83 -0.54 0.00 0.00 174.62 174.85 1ocq s GLY 176 N -3.71 1.59 -1.22 3.99 0.00 -1.26 -1.16 107.32 105.55 1ocq s GLY 176 Ca 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 44.72 44.89 1ocq s GLY 176 CO 0.15 0.44 0.89 2.41 0.00 0.00 0.00 173.10 176.99 1ocq n THR 177 N -4.18 -5.73 -3.47 0.90 -1.04 -1.20 -1.24 114.28 98.31 1ocq n THR 177 Ca 0.06 -0.57 -0.18 0.00 -2.04 0.00 0.00 64.05 61.32 1ocq n THR 177 Cb 0.55 -4.70 0.08 0.00 -1.82 0.00 0.00 70.33 64.44 1ocq n THR 177 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1ocq n TRP 178 N -4.12 -2.25 -3.72 -1.42 8.01 0.30 -2.88 117.44 111.37 1ocq n TRP 178 Ca -0.28 0.94 -0.25 0.00 -1.31 0.00 0.00 57.50 56.61 1ocq n TRP 178 Cb 0.67 -5.02 0.05 0.00 -2.01 0.00 0.00 31.31 24.99 1ocq n TRP 178 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.69 177.11 1ocq n SER 179 N -3.11 -3.91 -0.01 -0.99 7.64 -0.31 -4.56 113.62 108.38 1ocq n SER 179 Ca -0.25 -0.71 0.03 0.00 1.01 0.00 0.00 58.87 58.95 1ocq n SER 179 Cb 0.66 -4.38 -0.07 0.00 -1.01 0.00 0.00 64.21 59.41 1ocq n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ocq n GLN 180 N -4.59 0.60 -2.10 1.43 6.02 -0.47 -1.00 117.38 117.27 1ocq n GLN 180 Ca -0.10 -0.07 -0.41 0.00 -0.01 0.00 0.00 57.00 56.41 1ocq n GLN 180 Cb 0.59 -1.20 -0.00 0.00 1.02 0.00 0.00 30.24 30.65 1ocq n GLN 180 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1ocq n ASP 181 N -1.86 6.30 0.25 1.08 -0.08 -0.37 -4.60 116.55 117.26 1ocq n ASP 181 Ca -0.03 -3.07 0.15 0.00 -1.51 0.00 0.00 54.79 50.33 1ocq n ASP 181 Cb 0.30 -1.45 0.50 0.00 2.34 0.00 0.00 41.12 42.80 1ocq n ASP 181 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 1ocq h VAL 182 N 3.30 0.06 -0.10 5.18 -1.51 -1.87 -3.21 116.25 118.11 1ocq h VAL 182 Ca 0.55 -0.75 -0.00 0.00 -1.23 0.00 0.00 66.70 65.27 1ocq h VAL 182 Cb 0.49 1.70 -0.00 0.00 -2.13 0.00 0.00 31.29 31.35 1ocq h VAL 182 CO 1.61 0.03 0.06 -0.74 -1.23 0.00 0.00 177.57 177.29 1ocq h HIS 183 N 0.00 0.13 -0.43 5.19 -0.00 -1.83 -0.11 115.15 118.10 1ocq h HIS 183 Ca -0.00 -0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 60.24 1ocq h HIS 183 Cb 0.70 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.05 1ocq h HIS 183 CO 0.00 0.14 -0.25 0.45 -0.00 0.00 0.00 177.93 178.27 1ocq h HIS 184 N 0.08 1.04 -0.56 5.26 3.86 -1.96 -2.29 115.15 120.59 1ocq h HIS 184 Ca 0.03 -0.26 -0.01 0.00 -1.16 0.00 0.00 60.37 58.97 1ocq h HIS 184 Cb 0.05 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.25 1ocq h HIS 184 CO -0.05 1.05 0.29 0.00 0.86 0.00 0.00 177.93 180.08 1ocq h ALA 185 N 0.93 0.72 0.00 2.45 0.00 -1.56 -2.82 119.26 118.98 1ocq h ALA 185 Ca 0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ocq h ALA 185 Cb 0.81 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1ocq h ALA 185 CO 0.07 0.25 -0.17 0.00 0.00 0.00 0.00 179.25 179.40 1ocq h ALA 186 N 1.12 1.30 -0.00 0.00 0.00 -0.76 -1.40 119.26 119.51 1ocq h ALA 186 Ca 0.19 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ocq h ALA 186 Cb 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ocq h ALA 186 CO -0.03 0.21 -0.10 -0.25 0.00 0.00 0.00 179.25 179.08 1ocq n ASP 187 N -3.72 0.40 -2.94 0.00 8.00 -0.88 -4.35 116.55 113.06 1ocq n ASP 187 Ca -0.02 -0.49 -0.13 0.00 0.71 0.00 0.00 54.79 54.86 1ocq n ASP 187 Cb 0.28 -0.10 0.03 0.00 -0.02 0.00 0.00 41.12 41.31 1ocq n ASP 187 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1ocq n ASN 188 N -1.02 -0.97 -4.78 -2.24 5.15 -0.55 -5.10 115.26 105.75 1ocq n ASN 188 Ca 0.14 -3.36 -0.33 0.00 -0.60 0.00 0.00 54.58 50.43 1ocq n ASN 188 Cb 0.27 0.78 0.02 0.00 -0.53 0.00 0.00 39.78 40.32 1ocq n ASN 188 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1ocq s GLN 189 N -0.88 3.13 0.76 1.20 -0.21 -1.05 -4.85 119.66 117.76 1ocq s GLN 189 Ca 0.30 1.38 -0.11 0.00 0.02 0.00 0.00 55.36 56.95 1ocq s GLN 189 Cb 0.31 -2.00 0.05 0.00 1.00 0.00 0.00 33.01 32.37 1ocq s GLN 189 CO -0.08 -0.99 1.10 -0.51 -2.12 0.00 0.00 175.29 172.70 1ocq s LEU 190 N -4.45 3.09 0.15 2.90 1.43 -1.26 -4.99 118.68 115.54 1ocq s LEU 190 Ca 0.67 1.87 0.01 0.00 -1.03 0.00 0.00 54.13 55.65 1ocq s LEU 190 Cb -0.20 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.46 1ocq s LEU 190 CO 0.36 -2.02 1.35 0.00 0.23 0.00 0.00 176.35 176.28 1ocq h ALA 191 N -0.95 0.47 -2.71 4.21 0.00 -2.02 -3.46 119.26 114.80 1ocq h ALA 191 Ca -0.44 -0.72 -0.53 0.00 0.00 0.00 0.00 54.91 53.22 1ocq h ALA 191 Cb 1.24 -0.06 0.06 0.00 0.00 0.00 0.00 17.79 19.03 1ocq h ALA 191 CO 0.51 0.89 0.87 0.34 0.00 0.00 0.00 179.25 181.87 1ocq s ASP 192 N -6.97 6.50 0.03 0.00 -1.08 -1.26 -4.87 116.67 109.02 1ocq s ASP 192 Ca -0.04 2.78 0.25 0.00 -0.52 0.00 0.00 52.55 55.02 1ocq s ASP 192 Cb 0.10 -2.61 1.03 0.00 -1.46 0.00 0.00 42.92 39.97 1ocq s ASP 192 CO 0.84 -0.85 1.78 -0.81 0.52 0.00 0.00 175.17 176.66 1ocq n PRO 193 N 3.01 0.03 -1.75 4.34 -0.04 -1.26 -3.36 135.00 135.97 1ocq n PRO 193 Ca 0.11 0.10 -0.25 0.00 -0.04 0.00 0.00 63.50 63.42 1ocq n PRO 193 Cb 0.38 -1.54 0.05 0.00 -0.04 0.00 0.00 33.50 32.35 1ocq n PRO 193 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ocq n ASN 194 N -1.59 5.40 -4.85 3.54 3.02 -1.26 -4.38 115.26 115.13 1ocq n ASN 194 Ca 0.06 -3.77 -0.32 0.00 -0.03 0.00 0.00 54.58 50.52 1ocq n ASN 194 Cb 0.30 -0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.89 1ocq n ASN 194 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ocq s VAL 195 N -4.55 5.07 0.13 2.41 1.01 -1.21 -2.04 120.40 121.22 1ocq s VAL 195 Ca 0.54 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 62.21 1ocq s VAL 195 Cb 0.43 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 1ocq s VAL 195 CO 0.02 0.27 -0.14 -0.04 0.00 0.00 0.00 175.10 175.22 1ocq s MET 196 N -2.04 1.07 -0.12 2.72 -1.94 -0.01 -4.58 119.30 114.39 1ocq s MET 196 Ca 0.28 -1.30 -0.05 0.00 -1.71 0.00 0.00 55.69 52.91 1ocq s MET 196 Cb -0.12 -0.92 -0.04 0.00 2.01 0.00 0.00 34.83 35.76 1ocq s MET 196 CO 0.19 0.17 0.05 0.71 -0.01 0.00 0.00 175.02 176.13 1ocq s TYR 197 N -2.32 3.29 0.25 -0.03 2.02 -0.02 -0.57 117.35 119.97 1ocq s TYR 197 Ca 0.11 0.23 -0.30 0.00 -0.37 0.00 0.00 57.07 56.74 1ocq s TYR 197 Cb -0.04 -1.91 -0.09 0.00 -0.40 0.00 0.00 41.96 39.52 1ocq s TYR 197 CO 0.03 0.43 1.07 0.00 -1.57 0.00 0.00 175.55 175.52 1ocq s ALA 198 N -0.54 3.39 -0.06 3.71 0.00 -0.18 -1.66 121.76 126.41 1ocq s ALA 198 Ca 0.10 0.83 0.02 0.00 0.00 0.00 0.00 51.96 52.92 1ocq s ALA 198 Cb -0.12 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.70 1ocq s ALA 198 CO 0.02 -0.11 -0.11 0.12 0.00 0.00 0.00 175.76 175.68 1ocq s PHE 199 N -0.94 1.35 -0.01 0.00 5.36 -0.90 -4.26 117.98 118.57 1ocq s PHE 199 Ca 0.45 -0.48 0.08 0.00 -0.96 0.00 0.00 56.93 56.02 1ocq s PHE 199 Cb -0.30 -1.00 -0.02 0.00 -0.34 0.00 0.00 43.02 41.36 1ocq s PHE 199 CO 0.38 -0.25 -0.25 -1.01 -1.46 0.00 0.00 175.22 172.63 1ocq s HIS 200 N 0.64 2.21 0.05 10.12 3.76 -0.17 -3.59 115.29 128.31 1ocq s HIS 200 Ca -0.13 -0.42 -0.00 0.00 -0.15 0.00 0.00 55.06 54.36 1ocq s HIS 200 Cb -0.15 -1.41 -0.04 0.00 1.11 0.00 0.00 32.58 32.09 1ocq s HIS 200 CO 0.03 -0.03 -0.04 -0.59 -0.85 0.00 0.00 174.74 173.27 1ocq s PHE 201 N -0.60 0.53 -0.06 1.40 -0.12 -1.19 -4.69 117.98 113.26 1ocq s PHE 201 Ca 0.10 -0.93 0.03 0.00 -0.05 0.00 0.00 56.93 56.07 1ocq s PHE 201 Cb -0.09 -0.37 0.01 0.00 -0.63 0.00 0.00 43.02 41.93 1ocq s PHE 201 CO -0.01 -0.31 -0.14 0.71 -0.05 0.00 0.00 175.22 175.43 1ocq s TYR 202 N -3.35 1.52 -0.34 3.49 1.51 -1.26 -1.74 117.35 117.18 1ocq s TYR 202 Ca 0.03 -0.52 0.25 0.00 -1.01 0.00 0.00 57.07 55.82 1ocq s TYR 202 Cb 0.04 -1.08 1.09 0.00 -0.11 0.00 0.00 41.96 41.90 1ocq s TYR 202 CO -0.07 -0.24 1.75 0.00 -1.11 0.00 0.00 175.55 175.87 1ocq h ALA 203 N 6.73 1.00 0.00 3.71 0.00 -0.82 -1.85 119.26 128.03 1ocq h ALA 203 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ocq h ALA 203 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1ocq h ALA 203 CO 0.48 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1ocq n GLY 204 N -0.27 -1.11 3.73 0.00 0.00 -0.19 -4.62 105.19 102.73 1ocq n GLY 204 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1ocq n GLY 204 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ocq s THR 205 N -3.12 5.29 0.07 2.61 2.01 -0.70 -4.89 115.64 116.91 1ocq s THR 205 Ca 0.06 0.58 -0.31 0.00 0.31 0.00 0.00 61.69 62.33 1ocq s THR 205 Cb 0.09 -3.65 -0.10 0.00 0.01 0.00 0.00 72.50 68.86 1ocq s THR 205 CO 0.32 0.39 1.89 1.41 -0.69 0.00 0.00 174.62 177.94 1ocq n HIS 206 N 3.53 2.55 0.09 4.92 8.25 -1.26 -4.89 115.22 128.40 1ocq n HIS 206 Ca -0.12 -0.22 0.08 0.00 -0.26 0.00 0.00 57.72 57.21 1ocq n HIS 206 Cb 0.52 -2.75 0.17 0.00 1.12 0.00 0.00 29.99 29.04 1ocq n HIS 206 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ocq n GLY 207 N 4.36 1.74 0.32 -1.41 0.00 -1.26 -4.71 105.19 104.23 1ocq n GLY 207 Ca 0.19 -0.52 -0.08 0.00 0.00 0.00 0.00 46.02 45.62 1ocq n GLY 207 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1ocq h GLN 208 N 3.05 1.13 -0.04 1.61 4.15 -2.00 -1.01 115.11 122.00 1ocq h GLN 208 Ca 0.00 -0.29 -0.18 0.00 0.77 0.00 0.00 58.65 58.95 1ocq h GLN 208 Cb 0.78 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.32 1ocq h GLN 208 CO 0.00 1.01 -0.76 -0.97 -1.93 0.00 0.00 178.83 176.19 1ocq h ASN 209 N 1.06 0.33 -0.83 -0.69 -1.24 -2.00 -2.43 115.58 109.78 1ocq h ASN 209 Ca 0.21 -0.23 -0.04 0.00 0.71 0.00 0.00 56.30 56.96 1ocq h ASN 209 Cb 0.41 -0.10 -0.04 0.00 0.73 0.00 0.00 38.32 39.33 1ocq h ASN 209 CO 0.01 0.97 0.37 -0.07 -1.29 0.00 0.00 177.43 177.41 1ocq h LEU 210 N 0.18 1.11 -0.46 0.34 3.38 -1.77 0.09 115.31 118.17 1ocq h LEU 210 Ca -0.03 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1ocq h LEU 210 Cb 1.33 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1ocq h LEU 210 CO 0.12 0.95 0.27 0.03 0.09 0.00 0.00 178.44 179.90 1ocq h ARG 211 N 1.19 0.63 -0.47 1.13 3.08 -1.10 -1.32 114.38 117.51 1ocq h ARG 211 Ca 0.28 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 1ocq h ARG 211 Cb 0.16 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1ocq h ARG 211 CO -0.03 0.47 0.24 -0.44 -1.07 0.00 0.00 179.97 179.14 1ocq h ASP 212 N 0.61 0.58 -0.04 7.04 3.32 -0.87 -1.23 116.42 125.83 1ocq h ASP 212 Ca 0.16 -0.05 -0.16 0.00 0.02 0.00 0.00 57.03 57.01 1ocq h ASP 212 Cb 0.01 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1ocq h ASP 212 CO -0.03 0.49 -0.53 1.56 -1.72 0.00 0.00 179.24 179.02 1ocq h GLN 213 N 0.66 0.61 -0.32 3.56 1.08 -0.54 -0.83 115.11 119.33 1ocq h GLN 213 Ca 0.17 -0.38 -0.00 0.00 -1.45 0.00 0.00 58.65 56.99 1ocq h GLN 213 Cb 0.06 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 1ocq h GLN 213 CO -0.02 0.99 0.19 0.28 -0.95 0.00 0.00 178.83 179.32 1ocq h VAL 214 N 0.48 1.11 -1.01 -0.54 2.07 -0.89 -1.47 116.25 115.99 1ocq h VAL 214 Ca 0.01 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.30 1ocq h VAL 214 Cb 1.08 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.50 1ocq h VAL 214 CO 0.10 0.11 0.66 0.44 0.02 0.00 0.00 177.57 178.91 1ocq h ASP 215 N 0.42 1.11 -0.37 0.57 3.32 -0.97 -0.62 116.42 119.87 1ocq h ASP 215 Ca 0.12 -0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.18 1ocq h ASP 215 Cb 0.01 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1ocq h ASP 215 CO -0.02 0.77 0.19 0.22 -1.72 0.00 0.00 179.24 178.68 1ocq h TYR 216 N 1.29 0.35 -0.49 4.55 3.20 -0.71 -0.68 116.97 124.49 1ocq h TYR 216 Ca 0.40 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.26 1ocq h TYR 216 Cb -0.02 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 1ocq h TYR 216 CO -0.00 0.19 0.22 0.00 -1.64 0.00 0.00 178.16 176.93 1ocq h ALA 217 N 1.19 0.63 -0.76 1.82 0.00 -0.63 -2.05 119.26 119.46 1ocq h ALA 217 Ca 0.16 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1ocq h ALA 217 Cb 0.06 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1ocq h ALA 217 CO -0.10 0.21 0.50 -0.07 0.00 0.00 0.00 179.25 179.79 1ocq h LEU 218 N 0.64 0.83 -0.87 0.00 3.38 -0.89 -1.49 115.31 116.90 1ocq h LEU 218 Ca 0.16 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1ocq h LEU 218 Cb 0.15 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1ocq h LEU 218 CO -0.02 0.58 0.00 0.44 0.09 0.00 0.00 178.44 179.53 1ocq h ASP 219 N 0.97 0.00 -0.14 -0.43 3.32 -0.41 -0.94 116.42 118.78 1ocq h ASP 219 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 1ocq h ASP 219 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1ocq h ASP 219 CO -0.08 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.44 1ocq n GLN 220 N -2.33 1.69 -0.81 3.56 1.13 -0.58 -4.93 117.38 115.10 1ocq n GLN 220 Ca 0.02 -1.03 0.00 0.00 -1.94 0.00 0.00 57.00 54.05 1ocq n GLN 220 Cb 0.22 -1.40 0.00 0.00 0.11 0.00 0.00 30.24 29.17 1ocq n GLN 220 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ocq n GLY 221 N 1.12 0.66 3.75 1.08 0.00 -0.36 -5.02 105.19 106.42 1ocq n GLY 221 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1ocq n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ocq s ALA 222 N -2.36 3.35 0.09 4.61 0.00 -1.11 -4.08 121.76 122.26 1ocq s ALA 222 Ca 0.00 0.70 -0.20 0.00 0.00 0.00 0.00 51.96 52.45 1ocq s ALA 222 Cb 0.00 -3.26 -0.07 0.00 0.00 0.00 0.00 23.12 19.79 1ocq s ALA 222 CO 0.00 0.06 0.61 0.00 0.00 0.00 0.00 175.76 176.43 1ocq s ALA 223 N -0.96 3.56 -0.07 0.00 0.00 -1.25 -4.22 121.76 118.81 1ocq s ALA 223 Ca 0.43 0.10 0.04 0.00 0.00 0.00 0.00 51.96 52.53 1ocq s ALA 223 Cb -0.27 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.15 1ocq s ALA 223 CO 0.34 0.38 -0.20 0.42 0.00 0.00 0.00 175.76 176.70 1ocq s ILE 224 N -1.13 1.69 -0.14 0.00 -1.09 -1.26 -0.84 121.20 118.43 1ocq s ILE 224 Ca 0.31 -0.83 0.01 0.00 -2.23 0.00 0.00 60.65 57.90 1ocq s ILE 224 Cb -0.20 -1.47 -0.00 0.00 -1.58 0.00 0.00 42.46 39.21 1ocq s ILE 224 CO 0.20 0.48 -0.17 0.12 -1.23 0.00 0.00 174.94 174.35 1ocq s PHE 225 N 0.24 2.74 -1.29 3.97 2.19 -0.67 -4.54 117.98 120.63 1ocq s PHE 225 Ca -0.11 -0.98 -0.15 0.00 0.33 0.00 0.00 56.93 56.02 1ocq s PHE 225 Cb -0.15 -1.85 0.12 0.00 -1.31 0.00 0.00 43.02 39.83 1ocq s PHE 225 CO 0.05 -0.42 1.71 0.28 1.83 0.00 0.00 175.22 178.67 1ocq n VAL 226 N 3.86 4.05 0.76 3.12 0.31 -0.18 -2.12 118.33 128.14 1ocq n VAL 226 Ca -0.19 -4.24 0.10 0.00 -0.01 0.00 0.00 64.34 60.00 1ocq n VAL 226 Cb 0.52 -2.43 0.45 0.00 -0.91 0.00 0.00 33.84 31.48 1ocq n VAL 226 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1ocq n SER 227 N 6.43 0.00 -3.67 4.52 3.41 -1.24 -1.86 113.62 121.22 1ocq n SER 227 Ca 0.44 0.41 -0.10 0.00 -0.26 0.00 0.00 58.87 59.35 1ocq n SER 227 Cb 0.42 -0.46 -0.09 0.00 -0.26 0.00 0.00 64.21 63.83 1ocq n SER 227 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1ocq s GLU 228 N -2.92 0.60 0.07 4.33 2.12 -1.24 -4.29 118.70 117.37 1ocq s GLU 228 Ca 0.12 0.97 -0.14 0.00 0.36 0.00 0.00 54.97 56.28 1ocq s GLU 228 Cb 0.14 0.14 0.02 0.00 0.26 0.00 0.00 34.13 34.69 1ocq s GLU 228 CO 0.36 -0.13 0.32 1.67 -0.54 0.00 0.00 175.26 176.94 1ocq s TRP 229 N 1.19 -0.10 0.13 5.30 1.48 -0.86 -3.17 118.94 122.91 1ocq s TRP 229 Ca -0.07 -0.12 0.02 0.00 -1.06 0.00 0.00 56.10 54.87 1ocq s TRP 229 Cb -0.06 0.12 -0.04 0.00 -1.16 0.00 0.00 33.47 32.33 1ocq s TRP 229 CO -0.12 -0.56 -0.03 0.20 -4.06 0.00 0.00 176.95 172.37 1ocq s GLY 230 N -2.37 0.95 0.03 3.67 0.00 -0.71 -0.60 107.32 108.28 1ocq s GLY 230 Ca -0.01 -1.45 0.28 0.00 0.00 0.00 0.00 44.72 43.54 1ocq s GLY 230 CO -0.07 -1.48 1.78 -1.30 0.00 0.00 0.00 173.10 172.04 1ocq n THR 231 N -0.12 0.08 -2.33 0.90 -2.24 -1.26 -1.22 114.28 108.09 1ocq n THR 231 Ca -0.10 -0.04 -0.11 0.00 -2.27 0.00 0.00 64.05 61.53 1ocq n THR 231 Cb 0.62 -0.33 0.06 0.00 -2.10 0.00 0.00 70.33 68.57 1ocq n THR 231 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ocq n SER 232 N -1.60 0.58 -4.62 3.42 3.41 -1.26 -0.72 113.62 112.82 1ocq n SER 232 Ca 0.06 -1.50 -0.28 0.00 -0.26 0.00 0.00 58.87 56.89 1ocq n SER 232 Cb 0.35 -0.31 0.20 0.00 -0.26 0.00 0.00 64.21 64.19 1ocq n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ocq s ALA 233 N -3.04 0.50 -0.59 7.33 0.00 -0.41 -1.02 121.76 124.54 1ocq s ALA 233 Ca 0.31 -0.34 0.16 0.00 0.00 0.00 0.00 51.96 52.09 1ocq s ALA 233 Cb -0.02 -3.14 0.78 0.00 0.00 0.00 0.00 23.12 20.74 1ocq s ALA 233 CO 0.21 -3.16 1.50 0.00 0.00 0.00 0.00 175.76 174.31 1ocq n ALA 234 N -4.41 1.32 1.05 0.00 0.00 -1.26 -1.02 120.51 116.18 1ocq n ALA 234 Ca 0.04 0.08 0.14 0.00 0.00 0.00 0.00 53.44 53.71 1ocq n ALA 234 Cb 0.57 -1.26 0.63 0.00 0.00 0.00 0.00 19.45 19.39 1ocq n ALA 234 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ocq n THR 235 N -1.96 0.02 -0.49 0.00 -2.24 -1.26 -4.91 114.28 103.45 1ocq n THR 235 Ca 0.01 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1ocq n THR 235 Cb 0.11 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 1ocq n THR 235 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ocq n GLY 236 N 1.43 1.08 0.00 3.38 0.00 -0.19 -5.00 105.19 105.89 1ocq n GLY 236 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1ocq n GLY 236 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ocq n ASP 237 N 0.00 0.28 -0.19 1.61 -0.08 -1.25 -1.73 116.55 115.19 1ocq n ASP 237 Ca 0.00 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.26 1ocq n ASP 237 Cb 0.00 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.45 1ocq n ASP 237 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ocq n GLY 238 N 1.85 0.43 0.00 0.27 0.00 -1.26 -1.29 105.19 105.20 1ocq n GLY 238 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1ocq n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ocq n GLY 239 N -2.03 1.46 3.51 -0.02 0.00 -1.26 -4.56 105.19 102.29 1ocq n GLY 239 Ca -0.02 -2.01 -0.31 0.00 0.00 0.00 0.00 46.02 43.68 1ocq n GLY 239 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ocq s VAL 240 N -2.02 3.07 -0.51 1.61 -7.23 -1.26 -3.78 120.40 110.28 1ocq s VAL 240 Ca 0.00 -1.11 0.07 0.00 -1.81 0.00 0.00 61.98 59.13 1ocq s VAL 240 Cb 0.00 -2.33 0.25 0.00 0.56 0.00 0.00 36.38 34.86 1ocq s VAL 240 CO 0.00 0.31 0.62 0.49 -0.31 0.00 0.00 175.10 176.21 1ocq n PHE 241 N 1.42 1.51 0.17 2.82 3.01 0.10 -4.96 117.46 121.52 1ocq n PHE 241 Ca -0.16 -3.84 0.05 0.00 1.01 0.00 0.00 57.45 54.51 1ocq n PHE 241 Cb 0.52 -0.44 0.24 0.00 -0.01 0.00 0.00 39.48 39.79 1ocq n PHE 241 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1ocq h LEU 242 N 4.13 0.00 0.20 4.37 3.38 -1.94 -1.14 115.31 124.31 1ocq h LEU 242 Ca 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1ocq h LEU 242 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1ocq h LEU 242 CO 0.63 0.43 -0.10 0.44 0.09 0.00 0.00 178.44 179.93 1ocq h ASP 243 N 0.00 -0.23 -0.18 -0.43 3.32 -1.97 -0.81 116.42 116.12 1ocq h ASP 243 Ca -0.00 -0.07 -0.11 0.00 0.02 0.00 0.00 57.03 56.87 1ocq h ASP 243 Cb 1.06 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 1ocq h ASP 243 CO 0.06 -0.08 -0.25 -0.08 -1.72 0.00 0.00 179.24 177.17 1ocq h GLU 244 N -0.36 0.65 -0.69 3.56 4.57 -1.83 -2.49 114.58 117.99 1ocq h GLU 244 Ca -0.03 -0.26 0.05 0.00 -1.18 0.00 0.00 59.36 57.94 1ocq h GLU 244 Cb 0.28 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.79 1ocq h GLU 244 CO 0.05 0.84 0.40 0.00 -1.18 0.00 0.00 179.01 179.12 1ocq h ALA 245 N 1.16 0.92 -0.71 2.92 0.00 -1.07 -1.90 119.26 120.57 1ocq h ALA 245 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1ocq h ALA 245 Cb 0.73 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1ocq h ALA 245 CO 0.06 0.10 0.25 0.37 0.00 0.00 0.00 179.25 180.03 1ocq h GLN 246 N 0.75 1.08 -0.50 0.00 5.75 -0.80 0.78 115.11 122.17 1ocq h GLN 246 Ca 0.30 -0.21 0.05 0.00 -0.15 0.00 0.00 58.65 58.64 1ocq h GLN 246 Cb 0.14 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 28.48 1ocq h GLN 246 CO -0.16 0.90 0.24 0.28 -2.65 0.00 0.00 178.83 177.44 1ocq h VAL 247 N 1.05 0.93 -0.59 2.39 2.07 -1.02 -1.14 116.25 119.94 1ocq h VAL 247 Ca 0.24 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.54 1ocq h VAL 247 Cb 0.25 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1ocq h VAL 247 CO -0.01 0.08 0.15 -0.50 0.02 0.00 0.00 177.57 177.31 1ocq h TRP 248 N 0.46 1.00 -0.46 1.57 4.06 -0.82 -1.31 115.95 120.45 1ocq h TRP 248 Ca 0.22 -0.12 0.04 0.00 2.06 0.00 0.00 58.89 61.10 1ocq h TRP 248 Cb 0.16 -0.28 -0.04 0.00 -1.00 0.00 0.00 29.16 28.00 1ocq h TRP 248 CO -0.11 0.84 0.22 0.82 -3.56 0.00 0.00 178.44 176.65 1ocq h ILE 249 N 0.86 0.95 -0.53 1.49 1.08 -0.45 -0.20 117.51 120.71 1ocq h ILE 249 Ca 0.19 -0.15 -0.11 0.00 -0.39 0.00 0.00 64.86 64.40 1ocq h ILE 249 Cb 0.35 0.47 -0.02 0.00 -3.07 0.00 0.00 36.82 34.55 1ocq h ILE 249 CO 0.00 0.08 -0.10 0.44 -0.69 0.00 0.00 178.15 177.88 1ocq h ASP 250 N 0.44 0.98 -0.41 1.72 3.32 -1.06 -1.37 116.42 120.04 1ocq h ASP 250 Ca 0.20 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.95 1ocq h ASP 250 Cb 0.12 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 1ocq h ASP 250 CO -0.15 1.09 0.25 0.15 -1.72 0.00 0.00 179.24 178.86 1ocq h PHE 251 N 0.88 0.48 -0.49 4.55 3.57 -0.89 -1.47 116.94 123.57 1ocq h PHE 251 Ca 0.14 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 1ocq h PHE 251 Cb 0.65 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 1ocq h PHE 251 CO 0.04 0.28 -0.02 0.52 -2.23 0.00 0.00 178.31 176.91 1ocq h MET 252 N 0.51 0.83 -0.62 1.11 2.86 -0.77 -1.93 114.93 116.93 1ocq h MET 252 Ca 0.16 -0.24 -0.09 0.00 -2.06 0.00 0.00 59.70 57.48 1ocq h MET 252 Cb -0.01 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 1ocq h MET 252 CO -0.06 0.85 0.05 -0.44 1.06 0.00 0.00 176.91 178.37 1ocq h ASP 253 N 0.77 1.03 0.04 1.22 3.32 -0.93 -0.72 116.42 121.15 1ocq h ASP 253 Ca 0.15 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 1ocq h ASP 253 Cb 0.49 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1ocq h ASP 253 CO 0.02 1.06 -0.17 -0.33 -1.72 0.00 0.00 179.24 178.10 1ocq h GLU 254 N 0.97 0.25 -0.65 3.56 5.08 -0.95 -2.98 114.58 119.87 1ocq h GLU 254 Ca 0.18 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1ocq h GLU 254 Cb 0.50 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1ocq h GLU 254 CO 0.02 0.43 0.00 0.54 -1.00 0.00 0.00 179.01 179.00 1ocq n ARG 255 N -4.23 2.65 -3.75 2.33 3.00 -0.76 -4.97 116.66 110.93 1ocq n ARG 255 Ca -0.01 -2.55 -0.26 0.00 -0.01 0.00 0.00 57.85 55.02 1ocq n ARG 255 Cb 0.30 -1.56 0.05 0.00 0.00 0.00 0.00 32.46 31.26 1ocq n ARG 255 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1ocq n ASN 256 N 1.60 -5.08 -4.65 0.55 5.15 -0.69 -4.95 115.26 107.20 1ocq n ASN 256 Ca 0.23 -0.68 -0.37 0.00 -0.60 0.00 0.00 54.58 53.16 1ocq n ASN 256 Cb 0.61 -4.43 -0.09 0.00 -0.53 0.00 0.00 39.78 35.34 1ocq n ASN 256 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ocq s LEU 257 N -7.21 4.10 0.59 1.20 1.43 -0.36 -4.76 118.68 113.67 1ocq s LEU 257 Ca 0.56 0.18 -0.15 0.00 -1.03 0.00 0.00 54.13 53.69 1ocq s LEU 257 Cb -0.26 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 1ocq s LEU 257 CO 0.78 0.00 1.03 -0.44 0.23 0.00 0.00 176.35 177.96 1ocq s SER 258 N 1.21 6.04 0.06 2.29 0.01 -1.26 -4.71 113.70 117.33 1ocq s SER 258 Ca 0.10 1.66 -0.21 0.00 1.31 0.00 0.00 55.95 58.81 1ocq s SER 258 Cb -0.14 -2.51 0.05 0.00 0.21 0.00 0.00 66.02 63.62 1ocq s SER 258 CO 0.07 -0.99 0.48 -1.66 0.41 0.00 0.00 173.24 171.55 1ocq s TRP 259 N -2.69 -0.37 -0.04 2.43 1.48 -0.13 -1.01 118.94 118.61 1ocq s TRP 259 Ca 0.60 0.36 0.02 0.00 -1.06 0.00 0.00 56.10 56.02 1ocq s TRP 259 Cb -0.13 0.31 0.01 0.00 -1.16 0.00 0.00 33.47 32.50 1ocq s TRP 259 CO 0.40 -0.63 -0.07 0.00 -4.06 0.00 0.00 176.95 172.58 1ocq s ALA 260 N -2.59 0.83 0.04 2.67 0.00 -0.77 -1.66 121.76 120.27 1ocq s ALA 260 Ca -0.04 -0.20 -0.16 0.00 0.00 0.00 0.00 51.96 51.55 1ocq s ALA 260 Cb -0.01 -0.41 -0.06 0.00 0.00 0.00 0.00 23.12 22.65 1ocq s ALA 260 CO -0.03 0.06 0.47 1.21 0.00 0.00 0.00 175.76 177.47 1ocq s ASN 261 N 0.63 6.89 -0.28 0.00 3.84 -0.51 -2.03 114.94 123.47 1ocq s ASN 261 Ca -0.10 1.06 -0.13 0.00 0.21 0.00 0.00 52.86 53.90 1ocq s ASN 261 Cb -0.13 -2.29 -0.04 0.00 -0.55 0.00 0.00 41.25 38.25 1ocq s ASN 261 CO 0.01 0.29 0.29 0.86 -2.79 0.00 0.00 177.10 175.76 1ocq s TRP 262 N -1.13 3.23 0.23 0.43 -0.11 0.23 -0.67 118.94 121.15 1ocq s TRP 262 Ca 0.27 0.24 -0.21 0.00 1.22 0.00 0.00 56.10 57.62 1ocq s TRP 262 Cb -0.17 -2.50 0.03 0.00 -1.50 0.00 0.00 33.47 29.33 1ocq s TRP 262 CO 0.16 -0.22 0.64 -1.54 -4.62 0.00 0.00 176.95 171.37 1ocq s SER 263 N 1.70 -0.34 -0.99 5.86 1.04 -1.03 -4.60 113.70 115.34 1ocq s SER 263 Ca 0.11 -0.43 -0.18 0.00 0.48 0.00 0.00 55.95 55.93 1ocq s SER 263 Cb -0.16 0.66 0.13 0.00 0.10 0.00 0.00 66.02 66.75 1ocq s SER 263 CO 0.11 -1.18 1.21 -0.22 0.98 0.00 0.00 173.24 174.13 1ocq s LEU 264 N -2.87 4.94 0.20 2.42 2.96 -0.01 -0.99 118.68 125.33 1ocq s LEU 264 Ca 0.08 -2.17 -0.21 0.00 -0.22 0.00 0.00 54.13 51.60 1ocq s LEU 264 Cb -0.03 -2.41 0.05 0.00 0.50 0.00 0.00 46.19 44.29 1ocq s LEU 264 CO -0.00 -1.04 0.62 0.28 -1.32 0.00 0.00 176.35 174.88 1ocq s THR 265 N 2.66 0.01 -2.40 3.68 -1.32 -1.26 -4.01 115.64 113.00 1ocq s THR 265 Ca 0.35 -0.40 0.22 0.00 -1.21 0.00 0.00 61.69 60.66 1ocq s THR 265 Cb -0.04 -1.36 0.43 0.00 -1.51 0.00 0.00 72.50 70.03 1ocq s THR 265 CO -0.08 -0.03 1.45 0.00 -2.21 0.00 0.00 174.62 173.75 1ocq n HIS 266 N -0.39 0.40 -1.53 9.09 1.44 -1.26 -1.62 115.22 121.35 1ocq n HIS 266 Ca -0.12 -0.20 -0.42 0.00 -2.01 0.00 0.00 57.72 54.97 1ocq n HIS 266 Cb 0.63 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.75 1ocq n HIS 266 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1ocq n LYS 267 N 1.07 0.94 -1.67 -1.40 4.81 -1.26 -4.32 118.16 116.33 1ocq n LYS 267 Ca 0.18 0.34 -0.42 0.00 -0.87 0.00 0.00 58.31 57.54 1ocq n LYS 267 Cb 0.50 -1.76 -0.01 0.00 0.02 0.00 0.00 35.03 33.79 1ocq n LYS 267 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1ocq n ASP 268 N 0.91 3.94 -3.91 3.14 2.03 -1.26 -4.63 116.55 116.77 1ocq n ASP 268 Ca 0.11 -2.82 -0.10 0.00 0.52 0.00 0.00 54.79 52.50 1ocq n ASP 268 Cb 0.38 -1.61 -0.10 0.00 -0.72 0.00 0.00 41.12 39.07 1ocq n ASP 268 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 1ocq s GLU 269 N 3.30 0.50 0.34 -0.67 -1.05 -1.26 -5.07 118.70 114.79 1ocq s GLU 269 Ca 0.49 -0.57 0.04 0.00 -0.15 0.00 0.00 54.97 54.77 1ocq s GLU 269 Cb 0.14 0.20 0.67 0.00 -0.44 0.00 0.00 34.13 34.70 1ocq s GLU 269 CO -0.07 -0.12 1.95 0.77 0.95 0.00 0.00 175.26 178.74 1ocq h SER 270 N 4.09 0.74 1.04 0.83 0.02 -1.85 -1.81 113.55 116.61 1ocq h SER 270 Ca -0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1ocq h SER 270 Cb 1.19 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.57 1ocq h SER 270 CO 0.44 0.48 0.00 0.77 -1.14 0.00 0.00 176.83 177.39 1ocq h SER 271 N 0.85 0.00 -3.51 3.07 4.64 -1.64 -3.40 113.55 113.55 1ocq h SER 271 Ca 0.33 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.12 1ocq h SER 271 Cb 0.20 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.35 1ocq h SER 271 CO -0.11 0.00 0.72 0.00 -0.87 0.00 0.00 176.83 176.57 1ocq s ALA 272 N -3.31 3.58 -0.37 5.18 0.00 -0.68 -2.46 121.76 123.70 1ocq s ALA 272 Ca 0.06 1.29 0.22 0.00 0.00 0.00 0.00 51.96 53.53 1ocq s ALA 272 Cb 0.10 -3.53 0.35 0.00 0.00 0.00 0.00 23.12 20.04 1ocq s ALA 272 CO 0.48 -0.70 1.61 0.00 0.00 0.00 0.00 175.76 177.15 1ocq h ALA 273 N 4.66 0.96 -3.21 0.00 0.00 -1.03 -3.39 119.26 117.24 1ocq h ALA 273 Ca -0.47 -0.06 -0.65 0.00 0.00 0.00 0.00 54.91 53.73 1ocq h ALA 273 Cb 1.22 -0.01 -0.17 0.00 0.00 0.00 0.00 17.79 18.82 1ocq h ALA 273 CO 0.75 0.09 -0.79 -0.51 0.00 0.00 0.00 179.25 178.78 1ocq s LEU 274 N -6.25 2.61 0.37 0.00 1.43 -0.64 -1.43 118.68 114.77 1ocq s LEU 274 Ca 0.06 -0.75 0.01 0.00 -1.03 0.00 0.00 54.13 52.42 1ocq s LEU 274 Cb 0.06 -1.34 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 1ocq s LEU 274 CO 0.67 0.12 0.58 -0.04 0.23 0.00 0.00 176.35 177.92 1ocq s MET 275 N -2.65 3.36 0.48 1.70 -1.94 -0.14 -4.20 119.30 115.91 1ocq s MET 275 Ca 0.21 -0.40 0.32 0.00 -1.71 0.00 0.00 55.69 54.11 1ocq s MET 275 Cb -0.08 -2.64 1.43 0.00 2.01 0.00 0.00 34.83 35.54 1ocq s MET 275 CO 0.11 0.03 1.72 -1.35 -0.01 0.00 0.00 175.02 175.52 1ocq h PRO 276 N 0.66 0.12 -0.10 2.03 0.11 -1.89 -1.81 132.00 131.13 1ocq h PRO 276 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ocq h PRO 276 Cb 1.23 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1ocq h PRO 276 CO 0.60 0.08 0.00 0.41 -0.21 0.00 0.00 178.00 178.88 1ocq n GLY 277 N -1.65 0.16 3.71 -0.55 0.00 -1.26 -4.95 105.19 100.66 1ocq n GLY 277 Ca 0.31 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1ocq n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ocq s ALA 278 N -1.88 3.78 0.20 4.61 0.00 -0.68 -4.92 121.76 122.86 1ocq s ALA 278 Ca 0.35 1.37 -0.31 0.00 0.00 0.00 0.00 51.96 53.37 1ocq s ALA 278 Cb 0.19 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 1ocq s ALA 278 CO 0.29 -0.86 1.42 1.21 0.00 0.00 0.00 175.76 177.83 1ocq s ASN 279 N 1.40 6.73 0.00 0.00 3.84 -1.26 -4.89 114.94 120.75 1ocq s ASN 279 Ca 0.71 2.53 0.13 0.00 0.21 0.00 0.00 52.86 56.45 1ocq s ASN 279 Cb -0.44 -2.61 0.57 0.00 -0.55 0.00 0.00 41.25 38.23 1ocq s ASN 279 CO 0.32 -0.68 1.40 -0.81 -2.79 0.00 0.00 177.10 174.54 1ocq n PRO 280 N 3.00 0.04 -0.47 0.43 -0.04 -1.26 -2.05 135.00 134.64 1ocq n PRO 280 Ca 0.09 0.26 0.09 0.00 -0.04 0.00 0.00 63.50 63.89 1ocq n PRO 280 Cb 0.41 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.67 1ocq n PRO 280 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1ocq n THR 281 N -1.46 1.60 -0.93 0.52 -2.24 -1.26 -4.42 114.28 106.09 1ocq n THR 281 Ca 0.04 -1.21 0.00 0.00 -2.27 0.00 0.00 64.05 60.60 1ocq n THR 281 Cb 0.14 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 1ocq n THR 281 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ocq n GLY 282 N 0.88 -1.78 1.34 3.38 0.00 -0.87 -3.21 105.19 104.93 1ocq n GLY 282 Ca 0.22 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1ocq n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ocq n GLY 283 N 0.00 0.65 3.77 -0.02 0.00 -1.26 -4.56 105.19 103.76 1ocq n GLY 283 Ca 0.00 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 1ocq n GLY 283 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ocq s TRP 284 N -2.00 2.88 0.77 1.61 0.51 -1.26 -5.03 118.94 116.42 1ocq s TRP 284 Ca 0.00 1.28 -0.10 0.00 -2.12 0.00 0.00 56.10 55.16 1ocq s TRP 284 Cb 0.00 -3.82 0.08 0.00 -0.81 0.00 0.00 33.47 28.91 1ocq s TRP 284 CO 0.00 -2.37 1.11 0.95 -0.51 0.00 0.00 176.95 176.12 1ocq s THR 285 N -1.00 2.13 0.31 2.01 -4.23 -1.26 -4.96 115.64 108.64 1ocq s THR 285 Ca 0.52 -0.13 0.01 0.00 -1.18 0.00 0.00 61.69 60.90 1ocq s THR 285 Cb -0.42 -2.99 0.27 0.00 1.34 0.00 0.00 72.50 70.69 1ocq s THR 285 CO 0.56 0.00 1.95 -0.08 -0.54 0.00 0.00 174.62 176.51 1ocq h GLU 286 N -0.87 0.98 0.00 3.99 4.22 -1.95 -1.42 114.58 119.53 1ocq h GLU 286 Ca -0.45 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 58.93 1ocq h GLU 286 Cb 1.32 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1ocq h GLU 286 CO 0.62 0.65 0.00 0.00 -2.18 0.00 0.00 179.01 178.10 1ocq h ALA 287 N 1.52 1.00 -0.01 2.92 0.00 -2.01 -2.39 119.26 120.30 1ocq h ALA 287 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1ocq h ALA 287 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1ocq h ALA 287 CO -0.10 0.00 -0.07 0.39 0.00 0.00 0.00 179.25 179.48 1ocq n GLU 288 N -2.98 1.36 -3.77 0.00 1.02 -0.54 -4.82 120.64 110.90 1ocq n GLU 288 Ca 0.01 -0.73 -0.37 0.00 -0.02 0.00 0.00 57.16 56.05 1ocq n GLU 288 Cb 0.30 -1.48 -0.06 0.00 -0.02 0.00 0.00 31.44 30.18 1ocq n GLU 288 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ocq s LEU 289 N -2.15 4.41 1.00 -4.62 1.43 -0.90 -0.97 118.68 116.88 1ocq s LEU 289 Ca 0.35 0.60 -0.15 0.00 -1.03 0.00 0.00 54.13 53.90 1ocq s LEU 289 Cb 0.21 -2.29 0.19 0.00 0.03 0.00 0.00 46.19 44.32 1ocq s LEU 289 CO 0.39 0.36 1.16 -0.94 0.23 0.00 0.00 176.35 177.55 1ocq s SER 290 N -1.16 2.73 0.36 2.29 1.04 -0.52 -4.71 113.70 113.73 1ocq s SER 290 Ca 0.19 0.79 0.04 0.00 0.48 0.00 0.00 55.95 57.45 1ocq s SER 290 Cb -0.13 -1.21 0.70 0.00 0.10 0.00 0.00 66.02 65.48 1ocq s SER 290 CO 0.08 -3.02 1.98 -0.65 0.98 0.00 0.00 173.24 172.61 1ocq h PRO 291 N -1.82 0.78 0.03 4.02 0.11 -1.88 -0.02 132.00 133.21 1ocq h PRO 291 Ca -0.49 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 1ocq h PRO 291 Cb 1.31 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1ocq h PRO 291 CO 0.51 0.51 -0.02 1.03 -0.21 0.00 0.00 178.00 179.83 1ocq h SER 292 N 0.80 -0.04 -0.79 -2.05 0.87 -1.82 -2.72 113.55 107.81 1ocq h SER 292 Ca 0.29 -0.27 0.02 0.00 -1.23 0.00 0.00 61.79 60.59 1ocq h SER 292 Cb 0.13 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.06 1ocq h SER 292 CO -0.09 0.25 0.51 1.23 -0.53 0.00 0.00 176.83 178.21 1ocq h GLY 293 N -0.33 1.12 0.76 5.77 0.00 -1.49 -0.87 103.07 108.03 1ocq h GLY 293 Ca -0.00 -0.40 0.04 0.00 0.00 0.00 0.00 47.33 46.97 1ocq h GLY 293 CO 0.01 0.37 0.29 -0.84 0.00 0.00 0.00 176.54 176.37 1ocq h THR 294 N 1.03 0.98 0.00 4.70 2.02 -1.00 -0.32 112.91 120.32 1ocq h THR 294 Ca 0.30 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.29 1ocq h THR 294 Cb -0.07 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1ocq h THR 294 CO -0.08 0.10 -0.00 0.15 0.37 0.00 0.00 175.52 176.06 1ocq h PHE 295 N 0.56 -0.00 -0.62 3.16 3.57 -1.12 -2.04 116.94 120.45 1ocq h PHE 295 Ca 0.23 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 1ocq h PHE 295 Cb 0.11 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 1ocq h PHE 295 CO -0.09 0.14 0.25 0.28 -2.23 0.00 0.00 178.31 176.66 1ocq h VAL 296 N -0.14 1.23 -0.66 1.41 2.07 -0.95 -0.69 116.25 118.53 1ocq h VAL 296 Ca -0.00 -0.72 0.03 0.00 0.82 0.00 0.00 66.70 66.83 1ocq h VAL 296 Cb 0.14 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 1ocq h VAL 296 CO 0.00 0.28 0.40 -0.09 0.02 0.00 0.00 177.57 178.19 1ocq h ARG 297 N 0.86 0.77 -0.72 1.57 2.43 -1.04 -1.06 114.38 117.19 1ocq h ARG 297 Ca 0.21 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1ocq h ARG 297 Cb 0.20 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 1ocq h ARG 297 CO -0.02 0.51 0.44 1.49 -1.51 0.00 0.00 179.97 180.88 1ocq h GLU 298 N 0.79 0.98 -0.57 0.20 4.57 -0.83 0.01 114.58 119.72 1ocq h GLU 298 Ca 0.27 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 58.35 1ocq h GLU 298 Cb 0.03 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 1ocq h GLU 298 CO -0.11 0.69 0.30 0.87 -1.18 0.00 0.00 179.01 179.58 1ocq h LYS 299 N 0.98 0.81 -0.26 1.92 1.79 -0.40 -0.83 116.57 120.58 1ocq h LYS 299 Ca 0.26 -0.10 -0.19 0.00 -2.18 0.00 0.00 60.65 58.44 1ocq h LYS 299 Cb -0.04 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.46 1ocq h LYS 299 CO -0.05 0.63 -0.58 0.82 -1.08 0.00 0.00 179.45 179.19 1ocq h ILE 300 N 0.77 1.28 -0.62 1.86 2.04 -0.90 -2.94 117.51 119.01 1ocq h ILE 300 Ca 0.20 -1.77 -0.05 0.00 1.00 0.00 0.00 64.86 64.24 1ocq h ILE 300 Cb 0.07 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 1ocq h ILE 300 CO -0.03 0.57 0.19 0.03 0.00 0.00 0.00 178.15 178.92 1ocq h ARG 301 N 0.63 0.93 -0.13 2.37 3.08 -0.83 -2.63 114.38 117.80 1ocq h ARG 301 Ca 0.01 -0.18 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 1ocq h ARG 301 Cb 1.18 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 1ocq h ARG 301 CO 0.12 0.80 -0.07 0.93 -1.07 0.00 0.00 179.97 180.68 1ocq h GLU 302 N 0.90 0.19 0.00 0.04 5.08 -1.11 -3.50 114.58 116.19 1ocq h GLU 302 Ca 0.20 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1ocq h GLU 302 Cb 0.26 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1ocq h GLU 302 CO -0.01 0.28 0.00 0.45 -1.00 0.00 0.00 179.01 178.73