#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oxy s LYS 8 N 0.00 0.60 0.21 -1.46 -0.14 -1.26 -4.27 119.74 113.42 2oxy s LYS 8 Ca 0.00 -0.75 -0.32 0.00 -1.36 0.00 0.00 55.97 53.53 2oxy s LYS 8 Cb 0.00 -0.44 -0.13 0.00 -1.68 0.00 0.00 37.83 35.58 2oxy s LYS 8 CO 0.00 0.09 1.51 0.00 -0.76 0.00 0.00 175.35 176.19 2oxy n ALA 9 N 1.56 1.40 1.29 5.17 0.00 -1.26 -4.91 120.51 123.76 2oxy n ALA 9 Ca -0.21 0.42 0.14 0.00 0.00 0.00 0.00 53.44 53.79 2oxy n ALA 9 Cb 0.55 -2.33 0.58 0.00 0.00 0.00 0.00 19.45 18.25 2oxy n ALA 9 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2oxy n ARG 10 N 2.75 0.46 -4.06 0.00 1.85 -1.26 -4.49 116.66 111.91 2oxy n ARG 10 Ca 0.14 -0.14 -0.11 0.00 -1.00 0.00 0.00 57.85 56.73 2oxy n ARG 10 Cb 0.31 -1.50 -0.11 0.00 -1.05 0.00 0.00 32.46 30.11 2oxy n ARG 10 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2oxy s VAL 11 N -2.64 0.45 -1.88 8.89 -7.23 -1.26 -4.92 120.40 111.81 2oxy s VAL 11 Ca 0.24 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 59.20 2oxy s VAL 11 Cb 0.20 -0.75 0.00 0.00 0.56 0.00 0.00 36.38 36.38 2oxy s VAL 11 CO 0.51 -0.52 0.00 -1.22 -0.31 0.00 0.00 175.10 173.56 2oxy n TYR 12 N 1.18 -0.50 -0.27 2.82 4.01 -1.26 -4.84 117.16 118.30 2oxy n TYR 12 Ca -0.21 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.46 2oxy n TYR 12 Cb 0.56 -3.49 0.05 0.00 -0.31 0.00 0.00 39.34 36.15 2oxy n TYR 12 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2oxy h ALA 13 N 0.51 0.98 -0.69 -0.72 0.00 -1.92 -3.15 119.26 114.28 2oxy h ALA 13 Ca -0.42 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2oxy h ALA 13 Cb 1.29 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2oxy h ALA 13 CO 0.56 0.66 0.00 -0.25 0.00 0.00 0.00 179.25 180.22 2oxy n ASP 14 N -4.26 3.96 -0.13 0.00 8.00 -1.26 -4.36 116.55 118.50 2oxy n ASP 14 Ca 0.06 -2.06 -0.04 0.00 0.71 0.00 0.00 54.79 53.46 2oxy n ASP 14 Cb 0.23 -0.48 0.02 0.00 -0.02 0.00 0.00 41.12 40.87 2oxy n ASP 14 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2oxy h VAL 15 N 4.04 0.56 -0.14 2.53 2.07 -1.90 -2.82 116.25 120.59 2oxy h VAL 15 Ca 0.00 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.37 2oxy h VAL 15 Cb 1.02 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2oxy h VAL 15 CO 0.03 0.00 -0.55 0.78 0.02 0.00 0.00 177.57 177.85 2oxy h ASN 16 N -0.01 0.47 -0.82 0.57 2.35 -1.82 -2.75 115.58 113.57 2oxy h ASN 16 Ca 0.20 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2oxy h ASN 16 Cb 0.32 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.52 2oxy h ASN 16 CO -0.44 0.93 0.48 0.58 -1.65 0.00 0.00 177.43 177.32 2oxy h VAL 17 N 0.32 1.23 0.00 2.81 2.07 -1.86 -3.03 116.25 117.80 2oxy h VAL 17 Ca 0.00 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2oxy h VAL 17 Cb 1.07 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2oxy h VAL 17 CO 0.10 0.25 0.00 0.25 0.02 0.00 0.00 177.57 178.19 2oxy h LEU 18 N 1.13 0.00-10.44 2.57 5.85 -1.40 -3.45 115.31 109.57 2oxy h LEU 18 Ca 0.29 0.00 -0.50 0.00 0.84 0.00 0.00 57.88 58.52 2oxy h LEU 18 Cb -0.01 0.00 0.08 0.00 0.37 0.00 0.00 40.66 41.09 2oxy h LEU 18 CO -0.05 0.00 0.40 -0.13 -0.34 0.00 0.00 178.44 178.32 2oxy s ARG 19 N -3.27 2.92 0.44 1.25 1.81 -1.05 -5.01 118.95 116.05 2oxy s ARG 19 Ca 0.07 0.57 -0.24 0.00 -1.72 0.00 0.00 55.73 54.40 2oxy s ARG 19 Cb 0.08 -2.02 -0.08 0.00 -0.45 0.00 0.00 34.95 32.48 2oxy s ARG 19 CO 0.61 -1.01 1.28 -2.14 -0.68 0.00 0.00 175.30 173.36 2oxy s PRO 20 N -5.28 3.77 0.33 3.54 0.02 -1.26 -4.89 135.00 131.23 2oxy s PRO 20 Ca 0.58 2.08 0.11 0.00 0.02 0.00 0.00 61.00 63.79 2oxy s PRO 20 Cb -0.12 -2.58 1.01 0.00 0.02 0.00 0.00 34.50 32.83 2oxy s PRO 20 CO 0.53 -0.63 1.63 -0.22 -0.33 0.00 0.00 177.00 177.97 2oxy h LYS 21 N 2.30 0.16 0.00 5.54 3.64 -1.92 0.22 116.57 126.52 2oxy h LYS 21 Ca -0.50 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2oxy h LYS 21 Cb 1.26 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2oxy h LYS 21 CO 0.61 0.11 0.00 1.05 -2.27 0.00 0.00 179.45 178.95 2oxy h GLU 22 N 0.17 0.00 -0.51 1.90 4.11 -1.90 0.01 114.58 118.36 2oxy h GLU 22 Ca 0.70 0.00 0.03 0.00 0.07 0.00 0.00 59.36 60.15 2oxy h GLU 22 Cb 1.61 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.82 2oxy h GLU 22 CO -0.71 0.00 0.30 -0.92 0.07 0.00 0.00 179.01 177.75 2oxy h TYR 23 N 0.00 0.56 0.00 2.06 3.20 -0.92 -3.33 116.97 118.55 2oxy h TYR 23 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2oxy h TYR 23 Cb 0.31 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.40 2oxy h TYR 23 CO 0.00 0.31 -0.85 -2.67 -1.64 0.00 0.00 178.16 173.32 2oxy n TRP 24 N -4.81 0.00 -2.11 -3.82 4.27 -0.84 -4.74 117.44 105.39 2oxy n TRP 24 Ca 0.04 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.22 2oxy n TRP 24 Cb 0.08 -0.09 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 2oxy n TRP 24 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 2oxy n ASP 25 N -1.47 4.49 0.25 -0.67 2.03 -0.07 -4.80 116.55 116.31 2oxy n ASP 25 Ca 0.00 -2.95 0.14 0.00 0.52 0.00 0.00 54.79 52.51 2oxy n ASP 25 Cb 0.19 -1.60 0.81 0.00 -0.72 0.00 0.00 41.12 39.80 2oxy n ASP 25 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 2oxy h TYR 26 N 6.18 0.00 -0.04 -0.67 -0.00 -1.85 -2.44 116.97 118.15 2oxy h TYR 26 Ca 0.48 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 59.21 2oxy h TYR 26 Cb 0.68 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.41 2oxy h TYR 26 CO 1.36 0.00 0.00 0.93 -0.00 0.00 0.00 178.16 180.46 2oxy h GLU 27 N 0.00 0.06 -0.00 0.10 5.08 -1.92 -1.62 114.58 116.28 2oxy h GLU 27 Ca 0.04 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2oxy h GLU 27 Cb 0.18 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2oxy h GLU 27 CO -0.00 0.06 -0.02 0.00 -1.00 0.00 0.00 179.01 178.05 2oxy n ALA 28 N -2.53 2.46 -1.90 3.43 0.00 -0.92 -4.88 120.51 116.17 2oxy n ALA 28 Ca -0.02 -0.14 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 2oxy n ALA 28 Cb 0.11 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.06 2oxy n ALA 28 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2oxy s LEU 29 N -2.78 4.37 -0.27 0.00 2.96 -0.61 -4.99 118.68 117.36 2oxy s LEU 29 Ca 0.21 2.64 -0.08 0.00 -0.22 0.00 0.00 54.13 56.68 2oxy s LEU 29 Cb 0.20 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 43.28 2oxy s LEU 29 CO 0.50 -0.86 0.09 -0.89 -1.32 0.00 0.00 176.35 173.88 2oxy s THR 30 N 1.41 4.36 0.24 3.68 2.01 -1.26 -5.08 115.64 121.00 2oxy s THR 30 Ca 0.72 -0.30 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 2oxy s THR 30 Cb -0.44 -3.11 -0.10 0.00 0.01 0.00 0.00 72.50 68.86 2oxy s THR 30 CO 0.32 0.23 1.48 -0.69 -0.69 0.00 0.00 174.62 175.27 2oxy s VAL 31 N 1.60 2.58 -0.46 3.82 1.01 -1.26 -4.98 120.40 122.71 2oxy s VAL 31 Ca 0.05 0.48 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 2oxy s VAL 31 Cb -0.16 -3.30 0.11 0.00 0.00 0.00 0.00 36.38 33.03 2oxy s VAL 31 CO 0.04 0.07 0.32 -1.10 0.00 0.00 0.00 175.10 174.43 2oxy s GLN 32 N -0.19 2.43 0.07 2.72 -1.52 -1.26 -5.06 119.66 116.85 2oxy s GLN 32 Ca 0.61 -1.74 -0.30 0.00 -1.95 0.00 0.00 55.36 51.98 2oxy s GLN 32 Cb -0.43 -3.87 -0.05 0.00 -0.22 0.00 0.00 33.01 28.44 2oxy s GLN 32 CO 0.42 -1.16 1.08 -1.58 -0.25 0.00 0.00 175.29 173.81 2oxy s TRP 33 N 1.34 3.58 0.00 0.91 0.52 -1.26 -4.76 118.94 119.28 2oxy s TRP 33 Ca 0.06 1.54 0.00 0.00 0.02 0.00 0.00 56.10 57.72 2oxy s TRP 33 Cb -0.25 -3.25 0.00 0.00 -1.15 0.00 0.00 33.47 28.81 2oxy s TRP 33 CO -0.01 -0.57 0.00 0.41 0.02 0.00 0.00 176.95 176.80 2oxy n GLY 34 N 2.78 -0.61 3.48 0.98 0.00 0.34 -5.00 105.19 107.15 2oxy n GLY 34 Ca 0.06 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.95 2oxy n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oxy s GLU 35 N -1.09 3.20 0.37 1.61 0.41 -1.26 -4.73 118.70 117.21 2oxy s GLU 35 Ca 0.00 -0.64 0.07 0.00 -0.41 0.00 0.00 54.97 53.99 2oxy s GLU 35 Cb 0.00 -4.07 0.78 0.00 -1.78 0.00 0.00 34.13 29.06 2oxy s GLU 35 CO 0.00 -1.29 1.96 -0.56 -0.49 0.00 0.00 175.26 174.88 2oxy h GLN 36 N 9.09 0.69 0.00 1.61 -0.00 -1.94 -1.67 115.11 122.89 2oxy h GLN 36 Ca -0.27 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.34 2oxy h GLN 36 Cb 1.09 -0.15 0.00 0.00 -0.00 0.00 0.00 27.48 28.41 2oxy h GLN 36 CO 1.00 0.45 0.00 -0.25 -0.00 0.00 0.00 178.83 180.03 2oxy n ASP 37 N -4.48 0.11 0.25 0.06 8.00 -1.26 -2.71 116.55 116.53 2oxy n ASP 37 Ca 0.10 0.53 0.17 0.00 0.71 0.00 0.00 54.79 56.30 2oxy n ASP 37 Cb 0.24 -0.55 0.70 0.00 -0.02 0.00 0.00 41.12 41.48 2oxy n ASP 37 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2oxy h ASP 38 N 0.00 0.00 -4.01 -2.24 5.19 -1.71 -3.45 116.42 110.21 2oxy h ASP 38 Ca 0.00 0.00 -0.40 0.00 -0.62 0.00 0.00 57.03 56.01 2oxy h ASP 38 Cb 0.26 0.00 -0.29 0.00 0.18 0.00 0.00 39.33 39.48 2oxy h ASP 38 CO 0.00 0.00 -0.78 -0.31 -3.12 0.00 0.00 179.24 175.03 2oxy s TYR 39 N -3.64 0.86 -0.02 4.55 2.02 -1.10 -0.65 117.35 119.36 2oxy s TYR 39 Ca 0.01 -0.17 0.04 0.00 -0.37 0.00 0.00 57.07 56.58 2oxy s TYR 39 Cb 0.09 -0.56 -0.00 0.00 -0.40 0.00 0.00 41.96 41.09 2oxy s TYR 39 CO 0.49 -0.03 -0.13 -1.21 -1.57 0.00 0.00 175.55 173.10 2oxy s GLU 40 N -0.14 1.25 0.17 -0.62 2.02 -0.27 -4.96 118.70 116.16 2oxy s GLU 40 Ca 0.02 -0.47 -0.30 0.00 0.02 0.00 0.00 54.97 54.24 2oxy s GLU 40 Cb -0.04 -1.16 -0.08 0.00 0.10 0.00 0.00 34.13 32.95 2oxy s GLU 40 CO -0.00 0.23 1.22 0.08 0.02 0.00 0.00 175.26 176.81 2oxy s VAL 41 N -0.08 3.56 -0.10 2.63 1.01 -1.26 -1.02 120.40 125.13 2oxy s VAL 41 Ca 0.00 1.28 -0.11 0.00 0.00 0.00 0.00 61.98 63.15 2oxy s VAL 41 Cb -0.08 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 2oxy s VAL 41 CO 0.00 0.19 -0.22 0.52 0.00 0.00 0.00 175.10 175.59 2oxy n VAL 42 N 2.73 1.29 -3.74 2.92 0.31 -0.06 -4.92 118.33 116.86 2oxy n VAL 42 Ca 0.05 0.11 -0.13 0.00 -0.01 0.00 0.00 64.34 64.36 2oxy n VAL 42 Cb 0.44 -1.98 -0.08 0.00 -0.91 0.00 0.00 33.84 31.31 2oxy n VAL 42 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2oxy s ARG 43 N -2.51 0.74 0.14 5.55 0.52 -1.12 -5.02 118.95 117.26 2oxy s ARG 43 Ca -0.20 -0.26 -0.31 0.00 -0.52 0.00 0.00 55.73 54.45 2oxy s ARG 43 Cb 0.04 0.33 -0.08 0.00 0.52 0.00 0.00 34.95 35.77 2oxy s ARG 43 CO 0.28 -0.22 1.30 0.15 0.02 0.00 0.00 175.30 176.83 2oxy s LYS 44 N -1.70 4.39 -0.10 3.54 1.02 -1.26 -1.40 119.74 124.22 2oxy s LYS 44 Ca -0.11 1.97 0.14 0.00 0.02 0.00 0.00 55.97 58.00 2oxy s LYS 44 Cb -0.04 -3.25 0.26 0.00 -0.52 0.00 0.00 37.83 34.28 2oxy s LYS 44 CO 0.02 -0.29 1.15 1.33 -0.92 0.00 0.00 175.35 176.64 2oxy n VAL 45 N 3.36 1.70 0.00 3.17 0.24 0.37 -4.85 118.33 122.33 2oxy n VAL 45 Ca 0.08 -1.89 0.00 0.00 -2.04 0.00 0.00 64.34 60.50 2oxy n VAL 45 Cb 0.44 -0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.76 2oxy n VAL 45 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oxy n GLY 46 N -1.04 0.00 3.31 7.63 0.00 -0.00 -4.75 105.19 110.34 2oxy n GLY 46 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 2oxy n GLY 46 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2oxy s ARG 47 N 0.00 1.04 0.00 1.61 3.03 -1.26 -4.18 118.95 119.20 2oxy s ARG 47 Ca 0.00 -0.86 0.00 0.00 2.03 0.00 0.00 55.73 56.90 2oxy s ARG 47 Cb 0.00 0.42 0.00 0.00 -1.03 0.00 0.00 34.95 34.34 2oxy s ARG 47 CO 0.00 -0.39 0.00 0.41 -1.13 0.00 0.00 175.30 174.19 2oxy n GLY 48 N -0.19 1.14 0.74 3.88 0.00 -0.20 -4.87 105.19 105.69 2oxy n GLY 48 Ca -0.14 -1.48 0.06 0.00 0.00 0.00 0.00 46.02 44.45 2oxy n GLY 48 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2oxy n LYS 49 N 0.00 1.17 -0.33 1.61 2.85 -1.26 -4.81 118.16 117.38 2oxy n LYS 49 Ca 0.00 -2.88 0.08 0.00 -1.05 0.00 0.00 58.31 54.46 2oxy n LYS 49 Cb 0.00 -1.22 0.24 0.00 -0.65 0.00 0.00 35.03 33.39 2oxy n LYS 49 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 2oxy n TYR 50 N -0.77 0.81 -4.02 5.58 4.11 -1.26 -4.82 117.16 116.79 2oxy n TYR 50 Ca 0.15 -0.58 -0.09 0.00 -0.00 0.00 0.00 57.90 57.38 2oxy n TYR 50 Cb 0.78 -0.11 -0.08 0.00 -0.00 0.00 0.00 39.34 39.94 2oxy n TYR 50 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 2oxy s SER 51 N -1.13 0.20 0.17 9.48 0.15 -1.26 -3.93 113.70 117.38 2oxy s SER 51 Ca 0.36 -0.95 0.06 0.00 0.70 0.00 0.00 55.95 56.12 2oxy s SER 51 Cb 0.21 0.34 -0.04 0.00 -1.71 0.00 0.00 66.02 64.83 2oxy s SER 51 CO 0.19 -0.77 0.06 -1.61 1.20 0.00 0.00 173.24 172.31 2oxy s GLU 52 N -3.97 2.64 -0.09 5.44 2.02 -0.82 -1.03 118.70 122.89 2oxy s GLU 52 Ca 0.16 -1.00 0.01 0.00 0.02 0.00 0.00 54.97 54.16 2oxy s GLU 52 Cb 0.05 -2.49 -0.02 0.00 0.10 0.00 0.00 34.13 31.77 2oxy s GLU 52 CO -0.03 0.47 -0.13 0.08 0.02 0.00 0.00 175.26 175.67 2oxy s VAL 53 N -1.75 3.16 0.01 2.63 1.01 -1.26 -1.15 120.40 123.05 2oxy s VAL 53 Ca 0.29 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.65 2oxy s VAL 53 Cb -0.10 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.98 2oxy s VAL 53 CO 0.21 0.56 -0.09 -0.36 0.00 0.00 0.00 175.10 175.41 2oxy s PHE 54 N -0.20 0.84 0.33 5.22 0.08 -0.68 0.14 117.98 123.71 2oxy s PHE 54 Ca 0.01 -0.22 -0.29 0.00 0.12 0.00 0.00 56.93 56.54 2oxy s PHE 54 Cb -0.13 -0.52 -0.10 0.00 -0.57 0.00 0.00 43.02 41.69 2oxy s PHE 54 CO 0.03 -0.01 1.33 -2.00 -0.10 0.00 0.00 175.22 174.47 2oxy s GLU 55 N -0.54 4.33 0.35 0.44 2.12 -0.50 -0.96 118.70 123.95 2oxy s GLU 55 Ca 0.01 2.25 0.04 0.00 0.36 0.00 0.00 54.97 57.63 2oxy s GLU 55 Cb -0.05 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.24 2oxy s GLU 55 CO 0.00 -0.23 0.18 0.20 -0.54 0.00 0.00 175.26 174.87 2oxy s GLY 56 N -0.38 2.32 0.02 -1.50 0.00 -0.21 -0.88 107.32 106.69 2oxy s GLY 56 Ca 0.50 -1.66 0.05 0.00 0.00 0.00 0.00 44.72 43.61 2oxy s GLY 56 CO 0.53 -1.64 -0.14 -1.50 0.00 0.00 0.00 173.10 170.35 2oxy s ILE 57 N -3.43 1.08 -0.38 0.90 1.10 -0.19 -1.71 121.20 118.57 2oxy s ILE 57 Ca 0.33 -0.86 -0.26 0.00 -0.51 0.00 0.00 60.65 59.35 2oxy s ILE 57 Cb 0.03 -0.96 0.02 0.00 0.15 0.00 0.00 42.46 41.70 2oxy s ILE 57 CO 0.19 0.09 0.93 0.21 -2.11 0.00 0.00 174.94 174.25 2oxy s ASN 58 N -0.88 6.65 0.01 4.50 3.84 0.24 -1.11 114.94 128.20 2oxy s ASN 58 Ca 0.03 0.51 0.16 0.00 0.21 0.00 0.00 52.86 53.77 2oxy s ASN 58 Cb -0.07 -2.46 0.69 0.00 -0.55 0.00 0.00 41.25 38.85 2oxy s ASN 58 CO 0.01 -0.89 1.51 1.33 -2.79 0.00 0.00 177.10 176.27 2oxy n VAL 59 N 6.05 0.92 -0.08 -5.21 0.24 0.18 -0.17 118.33 120.26 2oxy n VAL 59 Ca 0.07 0.23 -0.14 0.00 -2.04 0.00 0.00 64.34 62.45 2oxy n VAL 59 Cb 0.48 -0.97 -0.11 0.00 -1.47 0.00 0.00 33.84 31.77 2oxy n VAL 59 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 2oxy h ASN 60 N 0.00 0.00 -0.09 -1.34 2.35 -1.93 -3.41 115.58 111.16 2oxy h ASN 60 Ca 0.00 -0.78 0.00 0.00 -0.55 0.00 0.00 56.30 54.97 2oxy h ASN 60 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2oxy h ASN 60 CO 0.00 1.06 0.00 -0.46 -1.65 0.00 0.00 177.43 176.38 2oxy n ASN 61 N -4.58 2.02 -0.81 5.81 0.23 -1.17 -4.99 115.26 111.77 2oxy n ASN 61 Ca -0.14 -1.55 -0.11 0.00 -0.53 0.00 0.00 54.58 52.25 2oxy n ASN 61 Cb 0.48 -0.05 -0.05 0.00 -2.08 0.00 0.00 39.78 38.08 2oxy n ASN 61 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2oxy n ASN 62 N 0.42 -5.07 -4.75 0.53 3.02 0.76 -4.97 115.26 105.20 2oxy n ASN 62 Ca 0.06 0.26 -0.40 0.00 -0.03 0.00 0.00 54.58 54.47 2oxy n ASN 62 Cb 0.27 -3.51 -0.05 0.00 -0.61 0.00 0.00 39.78 35.88 2oxy n ASN 62 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2oxy s GLU 63 N -2.74 4.76 0.47 3.52 2.02 -1.24 -4.79 118.70 120.70 2oxy s GLU 63 Ca 0.00 1.61 -0.23 0.00 0.02 0.00 0.00 54.97 56.37 2oxy s GLU 63 Cb 0.00 -3.25 -0.07 0.00 0.10 0.00 0.00 34.13 30.91 2oxy s GLU 63 CO 0.00 0.37 1.23 0.15 0.02 0.00 0.00 175.26 177.03 2oxy s LYS 64 N -1.18 3.64 0.31 1.61 1.02 -1.26 -0.59 119.74 123.30 2oxy s LYS 64 Ca 0.43 1.93 0.02 0.00 0.02 0.00 0.00 55.97 58.36 2oxy s LYS 64 Cb -0.28 -2.42 -0.02 0.00 -0.52 0.00 0.00 37.83 34.59 2oxy s LYS 64 CO 0.35 -0.69 0.34 0.00 -0.92 0.00 0.00 175.35 174.43 2oxy s ILE 66 N -3.43 3.26 -0.21 0.00 -1.09 -0.25 -1.05 121.20 118.44 2oxy s ILE 66 Ca 0.36 -0.61 -0.01 0.00 -2.23 0.00 0.00 60.65 58.16 2oxy s ILE 66 Cb 0.02 -2.35 0.02 0.00 -1.58 0.00 0.00 42.46 38.57 2oxy s ILE 66 CO 0.22 0.55 -0.12 -0.63 -1.23 0.00 0.00 174.94 173.73 2oxy s ILE 67 N -0.15 2.60 -0.32 2.92 1.01 -0.13 -0.79 121.20 126.34 2oxy s ILE 67 Ca 0.00 -0.88 -0.08 0.00 0.00 0.00 0.00 60.65 59.69 2oxy s ILE 67 Cb -0.13 -2.20 0.01 0.00 0.01 0.00 0.00 42.46 40.15 2oxy s ILE 67 CO 0.03 0.40 0.12 -0.75 0.00 0.00 0.00 174.94 174.74 2oxy s LYS 68 N 1.34 3.04 -0.37 2.79 2.20 0.18 -1.68 119.74 127.24 2oxy s LYS 68 Ca 0.03 -0.90 -0.22 0.00 -0.36 0.00 0.00 55.97 54.52 2oxy s LYS 68 Cb -0.15 -3.49 0.01 0.00 -1.51 0.00 0.00 37.83 32.69 2oxy s LYS 68 CO -0.08 -0.51 0.70 0.42 -0.36 0.00 0.00 175.35 175.52 2oxy s ILE 69 N 1.52 4.81 -0.61 5.43 1.01 -0.30 -0.42 121.20 132.65 2oxy s ILE 69 Ca 0.02 0.67 -0.21 0.00 0.00 0.00 0.00 60.65 61.13 2oxy s ILE 69 Cb -0.18 -4.15 0.07 0.00 0.01 0.00 0.00 42.46 38.21 2oxy s ILE 69 CO 0.04 -0.40 0.85 -0.76 0.00 0.00 0.00 174.94 174.67 2oxy s LEU 70 N 2.90 4.66 0.18 2.97 1.43 -0.20 -1.94 118.68 128.69 2oxy s LEU 70 Ca 0.27 -0.99 -0.21 0.00 -1.03 0.00 0.00 54.13 52.17 2oxy s LEU 70 Cb -0.14 -2.46 -0.13 0.00 0.03 0.00 0.00 46.19 43.50 2oxy s LEU 70 CO 0.16 -1.25 0.35 0.29 0.23 0.00 0.00 176.35 176.13 2oxy n LYS 71 N 7.13 0.00 -2.61 1.70 4.76 -1.25 -4.29 118.16 123.60 2oxy n LYS 71 Ca -0.05 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.02 2oxy n LYS 71 Cb 0.45 -0.78 -0.05 0.00 -1.84 0.00 0.00 35.03 32.81 2oxy n LYS 71 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2oxy s PRO 72 N -0.78 4.43 0.00 1.97 0.04 -1.26 -4.81 135.00 134.59 2oxy s PRO 72 Ca 0.49 1.52 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2oxy s PRO 72 Cb -0.69 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.05 2oxy s PRO 72 CO 0.44 0.10 0.00 1.55 0.04 0.00 0.00 177.00 179.13 2oxy n VAL 73 N 0.47 0.00 -3.97 -0.36 3.14 -1.26 -5.08 118.33 111.27 2oxy n VAL 73 Ca 0.02 0.00 -0.34 0.00 -2.96 0.00 0.00 64.34 61.06 2oxy n VAL 73 Cb 0.49 0.00 -0.15 0.00 -1.06 0.00 0.00 33.84 33.12 2oxy n VAL 73 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2oxy s LYS 74 N -2.00 3.04 0.48 1.45 2.47 -1.26 -4.88 119.74 119.04 2oxy s LYS 74 Ca 0.00 -0.84 0.23 0.00 -1.56 0.00 0.00 55.97 53.80 2oxy s LYS 74 Cb 0.00 -2.91 1.26 0.00 -1.46 0.00 0.00 37.83 34.72 2oxy s LYS 74 CO 0.00 -0.30 1.91 -0.22 0.16 0.00 0.00 175.35 176.91 2oxy h LYS 75 N 8.03 0.20 -0.29 4.03 3.64 -2.00 -2.13 116.57 128.04 2oxy h LYS 75 Ca -0.38 -0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 58.82 2oxy h LYS 75 Cb 1.13 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2oxy h LYS 75 CO 0.60 0.13 -0.48 -0.22 -2.27 0.00 0.00 179.45 177.21 2oxy h LYS 76 N 0.20 0.79 -0.36 1.90 3.64 -1.99 -2.57 116.57 118.18 2oxy h LYS 76 Ca 0.38 -0.46 -0.14 0.00 -1.27 0.00 0.00 60.65 59.16 2oxy h LYS 76 Cb 1.19 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 2oxy h LYS 76 CO -0.08 1.09 -0.32 -0.22 -2.27 0.00 0.00 179.45 177.66 2oxy h LYS 77 N 0.62 0.85 -0.62 1.90 3.64 -1.79 -2.17 116.57 119.00 2oxy h LYS 77 Ca 0.03 -0.43 -0.03 0.00 -1.27 0.00 0.00 60.65 58.95 2oxy h LYS 77 Cb 1.06 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.86 2oxy h LYS 77 CO 0.10 1.07 0.26 0.82 -2.27 0.00 0.00 179.45 179.43 2oxy h ILE 78 N 0.64 1.23 -0.47 2.00 2.04 -1.50 -2.18 117.51 119.27 2oxy h ILE 78 Ca 0.06 -0.71 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 2oxy h ILE 78 Cb 0.90 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2oxy h ILE 78 CO 0.08 0.28 -0.06 0.11 0.00 0.00 0.00 178.15 178.56 2oxy h LYS 79 N 0.86 0.81 0.46 2.37 1.57 -1.42 -1.44 116.57 119.78 2oxy h LYS 79 Ca 0.21 -0.25 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2oxy h LYS 79 Cb 0.19 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2oxy h LYS 79 CO -0.02 0.85 -0.24 -0.09 -0.57 0.00 0.00 179.45 179.38 2oxy h ARG 80 N 0.74 -0.62 -0.31 3.15 2.43 -1.20 0.69 114.38 119.26 2oxy h ARG 80 Ca 0.13 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.40 2oxy h ARG 80 Cb 0.53 0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.18 2oxy h ARG 80 CO 0.03 -0.42 0.01 1.49 -1.51 0.00 0.00 179.97 179.58 2oxy h GLU 81 N -0.65 0.10 -0.17 0.20 4.81 -1.34 -1.33 114.58 116.21 2oxy h GLU 81 Ca -0.06 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 2oxy h GLU 81 Cb 0.51 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2oxy h GLU 81 CO 0.08 0.07 0.08 0.82 -0.73 0.00 0.00 179.01 179.34 2oxy h ILE 82 N 0.11 1.12 -0.81 2.32 2.04 -1.18 -0.37 117.51 120.73 2oxy h ILE 82 Ca 0.15 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.71 2oxy h ILE 82 Cb 0.19 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 2oxy h ILE 82 CO -0.24 0.11 0.51 0.50 0.00 0.00 0.00 178.15 179.03 2oxy h LYS 83 N 0.15 0.94 0.06 2.37 1.63 -0.56 0.08 116.57 121.24 2oxy h LYS 83 Ca 0.06 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2oxy h LYS 83 Cb 0.10 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.52 2oxy h LYS 83 CO -0.01 0.62 -0.03 0.82 -3.45 0.00 0.00 179.45 177.41 2oxy h ILE 84 N 0.97 1.10 -0.26 2.00 2.04 -1.11 0.11 117.51 122.35 2oxy h ILE 84 Ca 0.34 -0.52 0.05 0.00 1.00 0.00 0.00 64.86 65.72 2oxy h ILE 84 Cb 0.07 1.44 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 2oxy h ILE 84 CO -0.14 0.13 -0.07 -0.07 0.00 0.00 0.00 178.15 178.00 2oxy h LEU 85 N -0.31 -0.26 -0.58 1.44 3.38 -0.77 -1.34 115.31 116.85 2oxy h LEU 85 Ca -0.01 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.12 2oxy h LEU 85 Cb 0.28 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 2oxy h LEU 85 CO 0.01 -0.10 0.24 1.56 0.09 0.00 0.00 178.44 180.25 2oxy h GLN 86 N -0.01 0.44 0.00 1.13 4.20 -0.91 -1.47 115.11 118.48 2oxy h GLN 86 Ca 0.13 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 2oxy h GLN 86 Cb 0.20 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 2oxy h GLN 86 CO -0.27 0.29 -0.22 -0.91 -0.67 0.00 0.00 178.83 177.04 2oxy h ASN 87 N 0.45 0.00 -0.00 1.46 2.35 -0.16 -2.94 115.58 116.73 2oxy h ASN 87 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 2oxy h ASN 87 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2oxy h ASN 87 CO -0.26 0.22 -0.21 0.18 -1.65 0.00 0.00 177.43 175.72 2oxy n LEU 88 N -4.09 2.35 -4.76 1.61 4.77 -0.56 -5.00 117.00 111.31 2oxy n LEU 88 Ca -0.02 -0.81 -0.41 0.00 -0.03 0.00 0.00 56.01 54.74 2oxy n LEU 88 Cb 0.29 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2oxy n LEU 88 CO 0.36 0.41 1.09 0.00 -1.33 0.00 0.00 177.39 177.92 2oxy n GLY 90 N 0.51 2.71 3.76 0.00 0.00 -1.26 -5.04 105.19 105.87 2oxy n GLY 90 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 2oxy n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oxy s GLY 91 N -2.00 2.24 0.18 -0.02 0.00 -0.24 -4.92 107.32 102.55 2oxy s GLY 91 Ca 0.00 0.63 -0.32 0.00 0.00 0.00 0.00 44.72 45.04 2oxy s GLY 91 CO 0.00 0.99 1.59 2.56 0.00 0.00 0.00 173.10 178.25 2oxy s PRO 92 N -3.97 4.20 -1.97 2.90 0.04 -1.26 -2.94 135.00 132.00 2oxy s PRO 92 Ca 0.69 2.41 0.00 0.00 0.04 0.00 0.00 61.00 64.14 2oxy s PRO 92 Cb -0.22 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.18 2oxy s PRO 92 CO 0.40 -0.63 0.00 0.09 0.04 0.00 0.00 177.00 176.90 2oxy n ASN 93 N 3.93 -5.36 -4.70 6.66 3.02 -1.26 -3.63 115.26 113.92 2oxy n ASN 93 Ca 0.14 0.33 -0.37 0.00 -0.03 0.00 0.00 54.58 54.65 2oxy n ASN 93 Cb 0.38 -4.66 -0.08 0.00 -0.61 0.00 0.00 39.78 34.81 2oxy n ASN 93 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2oxy s ILE 94 N -2.78 5.27 0.30 2.41 -1.09 -1.15 -1.45 121.20 122.71 2oxy s ILE 94 Ca 0.00 0.57 -0.29 0.00 -2.23 0.00 0.00 60.65 58.70 2oxy s ILE 94 Cb 0.00 -3.66 -0.13 0.00 -1.58 0.00 0.00 42.46 37.09 2oxy s ILE 94 CO 0.00 0.33 1.25 0.55 -1.23 0.00 0.00 174.94 175.84 2oxy n VAL 95 N 3.98 1.71 -3.20 2.92 3.14 -0.98 -4.81 118.33 121.09 2oxy n VAL 95 Ca -0.11 -0.43 -0.40 0.00 -2.96 0.00 0.00 64.34 60.44 2oxy n VAL 95 Cb 0.52 -1.39 -0.07 0.00 -1.06 0.00 0.00 33.84 31.83 2oxy n VAL 95 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2oxy s LYS 96 N -1.40 4.05 -0.48 1.45 2.20 -1.26 -4.90 119.74 119.40 2oxy s LYS 96 Ca 0.60 0.34 -0.27 0.00 -0.36 0.00 0.00 55.97 56.29 2oxy s LYS 96 Cb -0.63 -3.66 0.03 0.00 -1.51 0.00 0.00 37.83 32.06 2oxy s LYS 96 CO 0.58 -0.39 1.00 -1.17 -0.36 0.00 0.00 175.35 175.02 2oxy s LEU 97 N 2.37 3.87 0.01 5.43 2.96 -1.26 -1.98 118.68 130.08 2oxy s LEU 97 Ca 0.22 0.21 -0.12 0.00 -0.22 0.00 0.00 54.13 54.22 2oxy s LEU 97 Cb -0.16 -3.30 -0.33 0.00 0.50 0.00 0.00 46.19 42.91 2oxy s LEU 97 CO 0.09 -1.14 0.89 -0.07 -1.32 0.00 0.00 176.35 174.80 2oxy h LEU 98 N 10.85 0.71 -7.47 -0.68 3.38 -0.58 -3.49 115.31 118.03 2oxy h LEU 98 Ca -0.24 -0.86 0.03 0.00 0.09 0.00 0.00 57.88 56.91 2oxy h LEU 98 Cb 1.07 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.50 2oxy h LEU 98 CO 1.07 1.69 0.24 -0.62 0.09 0.00 0.00 178.44 180.91 2oxy s ASP 99 N -7.41 -0.41 -0.12 -0.43 -1.08 -1.05 -5.02 116.67 101.16 2oxy s ASP 99 Ca -0.11 -0.29 -0.01 0.00 -0.52 0.00 0.00 52.55 51.63 2oxy s ASP 99 Cb 0.05 0.64 0.03 0.00 -1.46 0.00 0.00 42.92 42.18 2oxy s ASP 99 CO 0.91 -1.12 -0.04 -0.63 0.52 0.00 0.00 175.17 174.81 2oxy s ILE 100 N -3.78 0.82 0.22 4.11 1.01 -1.26 -1.24 121.20 121.08 2oxy s ILE 100 Ca 0.06 -0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.47 2oxy s ILE 100 Cb -0.03 -0.94 -0.05 0.00 0.01 0.00 0.00 42.46 41.45 2oxy s ILE 100 CO -0.03 0.26 0.07 0.68 0.00 0.00 0.00 174.94 175.91 2oxy s VAL 101 N 1.78 0.50 0.04 2.92 -7.23 -0.56 -0.51 120.40 117.35 2oxy s VAL 101 Ca 0.04 -1.99 -0.19 0.00 -1.81 0.00 0.00 61.98 58.03 2oxy s VAL 101 Cb -0.13 -2.42 0.04 0.00 0.56 0.00 0.00 36.38 34.43 2oxy s VAL 101 CO -0.07 -0.18 0.44 0.00 -0.31 0.00 0.00 175.10 174.97 2oxy s ARG 102 N -4.01 0.94 0.05 4.82 1.70 -1.26 0.16 118.95 121.34 2oxy s ARG 102 Ca 0.33 -0.33 -0.30 0.00 -0.47 0.00 0.00 55.73 54.95 2oxy s ARG 102 Cb 0.07 0.42 -0.09 0.00 -0.57 0.00 0.00 34.95 34.79 2oxy s ARG 102 CO 0.10 -0.33 1.85 0.34 -1.08 0.00 0.00 175.30 176.18 2oxy s ASP 103 N -1.99 6.49 0.55 -2.89 -1.08 -0.92 -4.65 116.67 112.18 2oxy s ASP 103 Ca -0.05 2.60 0.27 0.00 -0.52 0.00 0.00 52.55 54.85 2oxy s ASP 103 Cb -0.01 -2.54 1.46 0.00 -1.46 0.00 0.00 42.92 40.37 2oxy s ASP 103 CO -0.02 -1.01 1.98 -0.61 0.52 0.00 0.00 175.17 176.04 2oxy h GLN 104 N 9.74 0.00 0.00 4.34 5.75 -1.97 0.18 115.11 133.15 2oxy h GLN 104 Ca -0.46 0.00 -0.42 0.00 -0.15 0.00 0.00 58.65 57.61 2oxy h GLN 104 Cb 1.22 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.70 2oxy h GLN 104 CO 0.94 0.00 -2.49 0.72 -2.65 0.00 0.00 178.83 175.36 2oxy n HIS 105 N -4.14 0.00 0.02 3.99 8.25 -1.26 -4.61 115.22 117.48 2oxy n HIS 105 Ca 0.09 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.48 2oxy n HIS 105 Cb 0.60 -0.98 -0.12 0.00 1.12 0.00 0.00 29.99 30.61 2oxy n HIS 105 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2oxy h SER 106 N -0.52 0.00 0.00 0.41 4.64 -1.97 -3.48 113.55 112.63 2oxy h SER 106 Ca -0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.69 2oxy h SER 106 Cb 1.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.82 2oxy h SER 106 CO -0.26 0.97 0.00 0.29 -0.87 0.00 0.00 176.83 176.96 2oxy n LYS 107 N -3.19 -0.39 -1.65 4.77 5.02 0.63 -4.98 118.16 118.37 2oxy n LYS 107 Ca -0.08 0.10 -0.43 0.00 -2.02 0.00 0.00 58.31 55.87 2oxy n LYS 107 Cb 0.98 -3.43 -0.03 0.00 -0.02 0.00 0.00 35.03 32.53 2oxy n LYS 107 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2oxy n THR 108 N -2.44 0.69 -3.00 -0.18 -1.04 -1.26 -4.71 114.28 102.35 2oxy n THR 108 Ca 0.00 -0.17 -0.37 0.00 -2.04 0.00 0.00 64.05 61.47 2oxy n THR 108 Cb 0.10 -2.27 -0.06 0.00 -1.82 0.00 0.00 70.33 66.28 2oxy n THR 108 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2oxy s PRO 109 N 4.64 4.39 -0.07 -2.82 0.04 -1.26 -2.16 135.00 137.76 2oxy s PRO 109 Ca 0.91 1.03 0.03 0.00 0.04 0.00 0.00 61.00 63.02 2oxy s PRO 109 Cb -0.47 -2.92 0.01 0.00 0.04 0.00 0.00 34.50 31.16 2oxy s PRO 109 CO 0.43 0.39 -0.17 -1.12 0.04 0.00 0.00 177.00 176.57 2oxy s SER 110 N -1.57 2.28 -0.07 6.66 0.01 0.12 -1.03 113.70 120.10 2oxy s SER 110 Ca 0.44 -0.39 -0.21 0.00 1.31 0.00 0.00 55.95 57.10 2oxy s SER 110 Cb -0.18 -0.96 -0.04 0.00 0.21 0.00 0.00 66.02 65.05 2oxy s SER 110 CO 0.22 0.10 0.58 -0.76 0.41 0.00 0.00 173.24 173.80 2oxy s LEU 111 N 0.42 4.32 -0.20 2.44 1.43 0.44 -1.50 118.68 126.03 2oxy s LEU 111 Ca -0.14 1.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.95 2oxy s LEU 111 Cb -0.16 -2.88 -0.02 0.00 0.03 0.00 0.00 46.19 43.17 2oxy s LEU 111 CO 0.05 -0.02 -0.03 -0.63 0.23 0.00 0.00 176.35 175.95 2oxy s ILE 112 N 0.50 3.60 0.16 -0.59 -1.09 -0.37 -0.65 121.20 122.76 2oxy s ILE 112 Ca 0.31 -0.43 0.10 0.00 -2.23 0.00 0.00 60.65 58.40 2oxy s ILE 112 Cb -0.17 -2.63 -0.04 0.00 -1.58 0.00 0.00 42.46 38.05 2oxy s ILE 112 CO 0.15 0.43 -0.22 -0.36 -1.23 0.00 0.00 174.94 173.71 2oxy s PHE 113 N 1.18 2.06 0.31 3.97 0.08 0.03 0.20 117.98 125.82 2oxy s PHE 113 Ca 0.02 -0.41 -0.27 0.00 0.12 0.00 0.00 56.93 56.40 2oxy s PHE 113 Cb -0.14 -1.05 -0.14 0.00 -0.57 0.00 0.00 43.02 41.12 2oxy s PHE 113 CO -0.00 0.38 0.85 -0.85 -0.10 0.00 0.00 175.22 175.50 2oxy n GLU 114 N 0.48 1.01 -2.63 0.44 0.28 -0.84 -1.09 120.64 118.30 2oxy n GLU 114 Ca -0.14 0.36 -0.41 0.00 -0.16 0.00 0.00 57.16 56.80 2oxy n GLU 114 Cb 0.56 -1.68 -0.04 0.00 1.43 0.00 0.00 31.44 31.71 2oxy n GLU 114 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 2oxy s TYR 115 N -1.15 3.69 -0.09 -1.84 5.04 -1.26 -4.33 117.35 117.42 2oxy s TYR 115 Ca 0.61 1.67 0.04 0.00 -2.44 0.00 0.00 57.07 56.95 2oxy s TYR 115 Cb -0.70 -3.17 -0.00 0.00 0.35 0.00 0.00 41.96 38.44 2oxy s TYR 115 CO 0.59 -0.23 -0.23 0.08 -1.34 0.00 0.00 175.55 174.42 2oxy s VAL 116 N 0.16 1.95 -1.46 3.14 1.01 -1.26 -5.02 120.40 118.92 2oxy s VAL 116 Ca 0.50 -0.97 -0.13 0.00 0.00 0.00 0.00 61.98 61.38 2oxy s VAL 116 Cb -0.26 -1.68 0.04 0.00 0.00 0.00 0.00 36.38 34.48 2oxy s VAL 116 CO 0.31 0.54 2.27 -3.20 0.00 0.00 0.00 175.10 175.02 2oxy n ASN 117 N 3.41 4.55 -4.77 3.32 5.15 -1.26 -4.97 115.26 120.69 2oxy n ASN 117 Ca -0.19 -2.84 -0.37 0.00 -0.60 0.00 0.00 54.58 50.57 2oxy n ASN 117 Cb 0.53 -1.63 -0.01 0.00 -0.53 0.00 0.00 39.78 38.14 2oxy n ASN 117 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2oxy s ASN 118 N 2.82 6.15 -0.16 1.20 3.84 -1.26 -4.10 114.94 123.43 2oxy s ASN 118 Ca 0.49 2.37 -0.00 0.00 0.21 0.00 0.00 52.86 55.93 2oxy s ASN 118 Cb 0.14 -2.61 -0.00 0.00 -0.55 0.00 0.00 41.25 38.23 2oxy s ASN 118 CO -0.08 -0.93 -0.14 -0.89 -2.79 0.00 0.00 177.10 172.27 2oxy s THR 119 N -1.49 2.78 -0.06 -5.21 2.01 -1.13 -5.00 115.64 107.55 2oxy s THR 119 Ca 0.63 -0.73 -0.40 0.00 0.31 0.00 0.00 61.69 61.50 2oxy s THR 119 Cb -0.30 -2.18 -0.20 0.00 0.01 0.00 0.00 72.50 69.82 2oxy s THR 119 CO 0.37 0.51 1.11 -0.67 -0.69 0.00 0.00 174.62 175.25 2oxy n ASP 120 N 4.10 0.13 0.12 3.53 2.03 -1.26 -4.53 116.55 120.67 2oxy n ASP 120 Ca -0.19 1.14 0.15 0.00 0.52 0.00 0.00 54.79 56.41 2oxy n ASP 120 Cb 0.52 -0.90 0.68 0.00 -0.72 0.00 0.00 41.12 40.70 2oxy n ASP 120 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 2oxy h PHE 121 N 3.18 0.00 0.00 -0.67 -0.00 -1.94 -0.12 116.94 117.39 2oxy h PHE 121 Ca -0.49 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 57.47 2oxy h PHE 121 Cb 1.39 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 37.34 2oxy h PHE 121 CO 0.57 0.00 -0.02 0.87 -0.00 0.00 0.00 178.31 179.73 2oxy h LYS 122 N 0.00 0.00 0.05 6.09 1.57 -2.00 -1.06 116.57 121.23 2oxy h LYS 122 Ca 0.14 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.56 2oxy h LYS 122 Cb 0.58 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 2oxy h LYS 122 CO -0.00 0.02 -2.10 0.28 -0.57 0.00 0.00 179.45 177.08 2oxy n VAL 123 N -4.36 1.62 0.11 0.50 0.31 -0.44 -4.62 118.33 111.45 2oxy n VAL 123 Ca -0.03 -0.49 -0.13 0.00 -0.01 0.00 0.00 64.34 63.68 2oxy n VAL 123 Cb 0.11 -1.71 -0.08 0.00 -0.91 0.00 0.00 33.84 31.24 2oxy n VAL 123 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2oxy h LEU 124 N -0.28 -0.26 -0.78 7.52 5.85 -0.96 -3.35 115.31 123.06 2oxy h LEU 124 Ca -0.50 -0.24 0.09 0.00 0.84 0.00 0.00 57.88 58.07 2oxy h LEU 124 Cb 1.82 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 42.84 2oxy h LEU 124 CO -0.09 0.13 0.44 1.88 -0.34 0.00 0.00 178.44 180.46 2oxy h TYR 125 N -0.68 0.79 -0.23 1.25 -1.99 -1.44 -0.98 116.97 113.70 2oxy h TYR 125 Ca -0.03 0.03 0.07 0.00 2.00 0.00 0.00 58.73 60.79 2oxy h TYR 125 Cb 0.47 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 38.96 2oxy h TYR 125 CO 0.04 0.33 0.30 -1.35 -0.00 0.00 0.00 178.16 177.47 2oxy h PRO 126 N 0.75 0.00 0.00 4.88 0.11 -1.79 -0.68 132.00 135.27 2oxy h PRO 126 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2oxy h PRO 126 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2oxy h PRO 126 CO -0.24 0.00 -0.43 0.25 -0.21 0.00 0.00 178.00 177.37 2oxy n THR 127 N -3.61 0.22 -2.43 -1.15 -2.24 -0.38 -4.93 114.28 99.76 2oxy n THR 127 Ca 0.03 -0.15 -0.41 0.00 -2.27 0.00 0.00 64.05 61.25 2oxy n THR 127 Cb 0.42 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.51 2oxy n THR 127 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2oxy s LEU 128 N -3.70 4.44 0.78 3.22 1.43 -0.26 -5.05 118.68 119.54 2oxy s LEU 128 Ca 0.09 2.14 -0.10 0.00 -1.03 0.00 0.00 54.13 55.23 2oxy s LEU 128 Cb 0.15 -3.60 0.09 0.00 0.03 0.00 0.00 46.19 42.86 2oxy s LEU 128 CO 0.67 -0.36 1.12 0.42 0.23 0.00 0.00 176.35 178.44 2oxy s THR 129 N 0.18 2.13 0.18 5.49 -4.23 -1.26 -4.90 115.64 113.23 2oxy s THR 129 Ca 0.53 -0.15 -0.15 0.00 -1.18 0.00 0.00 61.69 60.75 2oxy s THR 129 Cb -0.31 -2.98 0.14 0.00 1.34 0.00 0.00 72.50 70.69 2oxy s THR 129 CO 0.34 0.00 1.66 -0.78 -0.54 0.00 0.00 174.62 175.30 2oxy h ASP 130 N -0.91 -0.38 -0.72 3.99 3.58 -1.93 -2.35 116.42 117.71 2oxy h ASP 130 Ca -0.45 0.14 0.03 0.00 0.42 0.00 0.00 57.03 57.17 2oxy h ASP 130 Cb 1.31 0.27 -0.05 0.00 1.72 0.00 0.00 39.33 42.58 2oxy h ASP 130 CO 0.59 -0.13 0.44 0.22 -2.88 0.00 0.00 179.24 177.48 2oxy h TYR 131 N 0.03 0.83 -0.38 0.28 3.20 -1.94 -2.78 116.97 116.21 2oxy h TYR 131 Ca 0.23 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.18 2oxy h TYR 131 Cb 0.36 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 2oxy h TYR 131 CO -0.38 0.47 0.11 -0.44 -1.64 0.00 0.00 178.16 176.28 2oxy h ASP 132 N 0.86 0.10 0.11 -2.11 3.32 -1.82 -0.16 116.42 116.72 2oxy h ASP 132 Ca 0.29 0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.40 2oxy h ASP 132 Cb 0.04 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2oxy h ASP 132 CO -0.12 0.09 -0.14 0.40 -1.72 0.00 0.00 179.24 177.75 2oxy h ILE 133 N 0.26 0.68 -0.53 0.35 2.04 -1.26 -0.80 117.51 118.24 2oxy h ILE 133 Ca 0.18 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.14 2oxy h ILE 133 Cb 0.17 0.68 -0.10 0.00 -0.74 0.00 0.00 36.82 36.83 2oxy h ILE 133 CO -0.20 0.00 -0.11 0.03 0.00 0.00 0.00 178.15 177.87 2oxy h ARG 134 N -0.29 0.02 0.23 2.37 3.08 -1.23 -0.36 114.38 118.19 2oxy h ARG 134 Ca 0.01 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2oxy h ARG 134 Cb 0.30 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2oxy h ARG 134 CO -0.06 0.01 -0.11 -0.92 -1.07 0.00 0.00 179.97 177.82 2oxy h TYR 135 N 0.02 -0.29 -0.33 3.04 3.20 -0.87 -1.52 116.97 120.22 2oxy h TYR 135 Ca 0.26 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 62.00 2oxy h TYR 135 Cb 0.40 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 2oxy h TYR 135 CO -0.43 -0.12 -0.30 1.88 -1.64 0.00 0.00 178.16 177.55 2oxy h TYR 136 N -0.39 0.81 -0.38 -3.82 0.05 -0.95 -1.28 116.97 111.00 2oxy h TYR 136 Ca -0.03 -0.21 -0.12 0.00 0.05 0.00 0.00 58.73 58.42 2oxy h TYR 136 Cb 0.30 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.84 2oxy h TYR 136 CO -0.04 0.92 -0.24 0.82 -1.05 0.00 0.00 178.16 178.57 2oxy h ILE 137 N 0.60 1.27 -0.60 -2.88 1.08 -1.06 -0.94 117.51 114.98 2oxy h ILE 137 Ca 0.07 -1.36 0.04 0.00 -0.39 0.00 0.00 64.86 63.22 2oxy h ILE 137 Cb 0.81 1.23 -0.04 0.00 -3.07 0.00 0.00 36.82 35.75 2oxy h ILE 137 CO 0.07 0.45 0.35 0.22 -0.69 0.00 0.00 178.15 178.55 2oxy h TYR 138 N 0.67 0.65 -0.35 1.37 3.20 -1.05 -0.24 116.97 121.22 2oxy h TYR 138 Ca 0.09 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.88 2oxy h TYR 138 Cb 0.75 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 2oxy h TYR 138 CO 0.04 0.35 -0.19 0.93 -1.64 0.00 0.00 178.16 177.65 2oxy h GLU 139 N 0.67 0.65 -0.39 1.82 4.39 -0.82 -2.31 114.58 118.59 2oxy h GLU 139 Ca 0.25 -0.24 -0.13 0.00 0.34 0.00 0.00 59.36 59.59 2oxy h GLU 139 Cb 0.08 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 2oxy h GLU 139 CO -0.13 0.80 -0.26 1.25 -1.16 0.00 0.00 179.01 179.51 2oxy h LEU 140 N 0.58 0.91 -1.34 1.33 5.85 -0.89 -2.96 115.31 118.80 2oxy h LEU 140 Ca 0.09 -0.43 0.07 0.00 0.84 0.00 0.00 57.88 58.45 2oxy h LEU 140 Cb 0.65 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.37 2oxy h LEU 140 CO 0.05 1.15 0.50 -0.07 -0.34 0.00 0.00 178.44 179.72 2oxy h LEU 141 N 0.69 0.70 -0.44 2.25 3.38 -0.68 -1.91 115.31 119.30 2oxy h LEU 141 Ca 0.08 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.14 2oxy h LEU 141 Cb 0.84 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 2oxy h LEU 141 CO 0.07 0.45 -0.01 0.11 0.09 0.00 0.00 178.44 179.15 2oxy h LYS 142 N 0.80 0.10 -0.54 1.13 1.57 -1.26 0.53 116.57 118.88 2oxy h LYS 142 Ca 0.33 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 59.03 2oxy h LYS 142 Cb 0.26 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2oxy h LYS 142 CO -0.11 0.06 0.07 0.00 -0.57 0.00 0.00 179.45 178.90 2oxy h ALA 143 N 1.39 0.73 -0.14 3.86 0.00 -1.33 -1.47 119.26 122.30 2oxy h ALA 143 Ca 0.22 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2oxy h ALA 143 Cb 0.32 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2oxy h ALA 143 CO -0.37 0.48 -0.13 -0.07 0.00 0.00 0.00 179.25 179.16 2oxy h LEU 144 N 0.80 0.35 -0.84 0.00 3.38 -1.03 -0.19 115.31 117.78 2oxy h LEU 144 Ca 0.16 -0.47 0.04 0.00 0.09 0.00 0.00 57.88 57.70 2oxy h LEU 144 Cb 0.43 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 2oxy h LEU 144 CO 0.01 0.75 0.53 -0.78 0.09 0.00 0.00 178.44 179.05 2oxy h ASP 145 N -0.04 0.87 0.36 -0.43 3.58 -0.93 -0.26 116.42 119.57 2oxy h ASP 145 Ca 0.02 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 2oxy h ASP 145 Cb 0.65 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.52 2oxy h ASP 145 CO 0.03 0.58 -0.18 0.22 -2.88 0.00 0.00 179.24 177.01 2oxy h TYR 146 N 1.01 -0.47 -0.60 0.28 3.20 -1.02 -0.82 116.97 118.55 2oxy h TYR 146 Ca 0.35 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.18 2oxy h TYR 146 Cb 0.07 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2oxy h TYR 146 CO -0.03 -0.29 0.27 0.00 -1.64 0.00 0.00 178.16 176.47 2oxy h HIS 148 N 0.83 0.83 0.00 0.00 3.86 -0.88 -0.84 115.15 118.94 2oxy h HIS 148 Ca 0.21 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.42 2oxy h HIS 148 Cb 0.15 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 28.37 2oxy h HIS 148 CO 0.00 0.33 -0.14 0.66 0.86 0.00 0.00 177.93 179.64 2oxy h SER 149 N 0.76 0.00 -0.40 2.45 4.64 -0.54 0.20 113.55 120.67 2oxy h SER 149 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2oxy h SER 149 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2oxy h SER 149 CO -0.25 0.14 0.00 0.00 -0.87 0.00 0.00 176.83 175.85 2oxy n GLN 150 N -3.37 1.92 -1.16 4.77 1.13 -0.79 -4.94 117.38 114.95 2oxy n GLN 150 Ca -0.00 -1.43 -0.01 0.00 -1.94 0.00 0.00 57.00 53.61 2oxy n GLN 150 Cb 0.34 -1.31 -0.00 0.00 0.11 0.00 0.00 30.24 29.38 2oxy n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2oxy n GLY 151 N 1.14 0.45 3.41 1.08 0.00 0.06 -4.91 105.19 106.42 2oxy n GLY 151 Ca 0.13 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 2oxy n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oxy s ILE 152 N -2.05 2.79 -0.15 -0.61 1.01 -0.38 -0.92 121.20 120.90 2oxy s ILE 152 Ca 0.00 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 2oxy s ILE 152 Cb 0.00 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.34 2oxy s ILE 152 CO 0.00 0.58 0.21 -0.04 0.00 0.00 0.00 174.94 175.69 2oxy s MET 153 N -0.51 3.96 -0.04 2.79 -1.94 0.02 -2.82 119.30 120.76 2oxy s MET 153 Ca 0.07 -0.04 -0.25 0.00 -1.71 0.00 0.00 55.69 53.76 2oxy s MET 153 Cb -0.12 -3.33 -0.20 0.00 2.01 0.00 0.00 34.83 33.19 2oxy s MET 153 CO 0.01 0.46 1.10 1.25 -0.01 0.00 0.00 175.02 177.84 2oxy h HIS 154 N 5.98 -0.08 0.00 -0.03 2.76 -1.92 -1.97 115.15 119.89 2oxy h HIS 154 Ca -0.46 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 2oxy h HIS 154 Cb 1.18 0.03 0.00 0.00 1.55 0.00 0.00 27.41 30.17 2oxy h HIS 154 CO 0.65 0.45 0.00 0.54 -1.30 0.00 0.00 177.93 178.27 2oxy n ARG 155 N -4.86 -0.87 -2.74 5.26 1.74 -1.26 -2.59 116.66 111.34 2oxy n ARG 155 Ca -0.09 0.22 -0.04 0.00 -0.77 0.00 0.00 57.85 57.18 2oxy n ARG 155 Cb 0.28 -3.88 0.08 0.00 -1.02 0.00 0.00 32.46 27.92 2oxy n ARG 155 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2oxy n ASP 156 N -0.44 0.23 -4.71 0.55 2.03 -1.26 -0.38 116.55 112.58 2oxy n ASP 156 Ca 0.00 -2.29 -0.42 0.00 0.52 0.00 0.00 54.79 52.60 2oxy n ASP 156 Cb 0.22 0.04 -0.03 0.00 -0.72 0.00 0.00 41.12 40.63 2oxy n ASP 156 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2oxy s VAL 157 N -2.04 3.23 -0.21 5.18 1.01 -1.26 -4.78 120.40 121.54 2oxy s VAL 157 Ca 0.22 0.81 -0.35 0.00 0.00 0.00 0.00 61.98 62.65 2oxy s VAL 157 Cb 0.40 -3.52 0.14 0.00 0.00 0.00 0.00 36.38 33.40 2oxy s VAL 157 CO -0.05 0.04 1.24 -1.59 0.00 0.00 0.00 175.10 174.73 2oxy s LYS 158 N 1.67 0.26 0.48 2.72 -2.85 -1.26 -4.74 119.74 116.02 2oxy s LYS 158 Ca 0.67 -0.08 0.19 0.00 -1.00 0.00 0.00 55.97 55.75 2oxy s LYS 158 Cb -0.37 0.12 1.22 0.00 -2.06 0.00 0.00 37.83 36.73 2oxy s LYS 158 CO 0.30 -0.11 2.00 -1.35 0.10 0.00 0.00 175.35 176.29 2oxy h PRO 159 N 2.02 0.18 0.00 1.78 0.11 -1.93 0.01 132.00 134.17 2oxy h PRO 159 Ca -0.08 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 2oxy h PRO 159 Cb 1.16 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2oxy h PRO 159 CO 0.22 0.12 -0.08 0.45 -0.21 0.00 0.00 178.00 178.50 2oxy h HIS 160 N 0.19 0.00 -0.55 0.65 3.86 -1.96 -2.31 115.15 115.02 2oxy h HIS 160 Ca 0.24 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2oxy h HIS 160 Cb 0.71 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.18 2oxy h HIS 160 CO -0.00 0.08 0.00 0.09 0.86 0.00 0.00 177.93 178.96 2oxy n ASN 161 N -3.39 5.01 -3.96 2.45 3.02 -0.01 -4.83 115.26 113.55 2oxy n ASN 161 Ca -0.01 -2.73 -0.31 0.00 -0.03 0.00 0.00 54.58 51.50 2oxy n ASN 161 Cb 0.24 -0.61 -0.15 0.00 -0.61 0.00 0.00 39.78 38.65 2oxy n ASN 161 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2oxy s VAL 162 N -2.37 1.63 -0.14 2.41 1.01 -0.87 -1.41 120.40 120.67 2oxy s VAL 162 Ca 0.50 -1.31 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 2oxy s VAL 162 Cb 0.36 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 2oxy s VAL 162 CO 0.18 -0.11 0.49 -0.04 0.00 0.00 0.00 175.10 175.62 2oxy s MET 163 N 1.34 4.30 -0.10 2.72 -1.94 0.18 -4.94 119.30 120.86 2oxy s MET 163 Ca -0.06 0.44 0.00 0.00 -1.71 0.00 0.00 55.69 54.37 2oxy s MET 163 Cb -0.19 -3.47 0.02 0.00 2.01 0.00 0.00 34.83 33.20 2oxy s MET 163 CO -0.06 0.07 -0.09 0.42 -0.01 0.00 0.00 175.02 175.34 2oxy s ILE 164 N 0.91 1.07 -0.70 2.53 1.01 -1.26 -0.98 121.20 123.79 2oxy s ILE 164 Ca 0.25 -0.36 -0.18 0.00 0.00 0.00 0.00 60.65 60.37 2oxy s ILE 164 Cb -0.15 -1.05 0.13 0.00 0.01 0.00 0.00 42.46 41.40 2oxy s ILE 164 CO 0.10 0.37 0.78 -0.62 0.00 0.00 0.00 174.94 175.57 2oxy s ASP 165 N 1.36 6.38 0.26 3.58 -1.08 -0.35 -2.84 116.67 123.98 2oxy s ASP 165 Ca -0.01 -1.82 -0.05 0.00 -0.52 0.00 0.00 52.55 50.15 2oxy s ASP 165 Cb -0.14 -2.29 0.31 0.00 -1.46 0.00 0.00 42.92 39.34 2oxy s ASP 165 CO -0.05 -0.98 1.89 -0.74 0.52 0.00 0.00 175.17 175.82 2oxy h HIS 166 N 8.82 1.14 -0.64 -5.34 -0.00 -1.82 -0.29 115.15 117.02 2oxy h HIS 166 Ca -0.14 -0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.24 2oxy h HIS 166 Cb 1.07 -0.37 -0.03 0.00 -0.00 0.00 0.00 27.41 28.07 2oxy h HIS 166 CO 0.93 0.77 0.42 1.49 -0.00 0.00 0.00 177.93 181.54 2oxy h GLU 167 N 1.18 0.79 -0.16 5.26 4.81 -1.93 -2.55 114.58 121.98 2oxy h GLU 167 Ca 0.30 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 2oxy h GLU 167 Cb -0.01 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.20 2oxy h GLU 167 CO -0.05 0.52 0.00 1.28 -0.73 0.00 0.00 179.01 180.03 2oxy n LEU 168 N -4.45 3.16 -3.77 1.64 4.77 -0.97 -4.96 117.00 112.42 2oxy n LEU 168 Ca 0.07 -1.17 -0.29 0.00 -0.03 0.00 0.00 56.01 54.59 2oxy n LEU 168 Cb 0.08 -0.09 0.02 0.00 -2.33 0.00 0.00 43.42 41.10 2oxy n LEU 168 CO 0.35 0.59 0.07 0.54 -1.33 0.00 0.00 177.39 177.61 2oxy n ARG 169 N 1.39 -4.94 -4.53 3.23 5.12 -0.17 -4.95 116.66 111.81 2oxy n ARG 169 Ca 0.16 0.58 -0.33 0.00 -1.93 0.00 0.00 57.85 56.33 2oxy n ARG 169 Cb 0.60 -5.43 -0.13 0.00 -1.16 0.00 0.00 32.46 26.33 2oxy n ARG 169 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2oxy s LYS 170 N -6.46 3.52 -0.02 5.56 2.20 -0.89 -5.01 119.74 118.63 2oxy s LYS 170 Ca 0.60 -0.60 0.04 0.00 -0.36 0.00 0.00 55.97 55.65 2oxy s LYS 170 Cb -0.30 -2.80 -0.01 0.00 -1.51 0.00 0.00 37.83 33.21 2oxy s LYS 170 CO 0.74 0.19 -0.15 -1.17 -0.36 0.00 0.00 175.35 174.60 2oxy s LEU 171 N 0.46 1.97 -0.02 5.43 0.20 -1.26 -1.21 118.68 124.24 2oxy s LEU 171 Ca -0.06 -0.28 0.00 0.00 0.69 0.00 0.00 54.13 54.47 2oxy s LEU 171 Cb -0.15 -0.81 0.03 0.00 -0.43 0.00 0.00 46.19 44.83 2oxy s LEU 171 CO 0.04 0.17 0.02 -0.13 -0.29 0.00 0.00 176.35 176.15 2oxy s ARG 172 N -0.20 0.09 -0.19 1.98 1.81 -0.16 -4.55 118.95 117.74 2oxy s ARG 172 Ca 0.03 0.16 -0.24 0.00 -1.72 0.00 0.00 55.73 53.95 2oxy s ARG 172 Cb -0.08 -0.35 -0.01 0.00 -0.45 0.00 0.00 34.95 34.06 2oxy s ARG 172 CO 0.00 -0.16 0.80 -1.17 -0.68 0.00 0.00 175.30 174.09 2oxy s LEU 173 N 1.11 4.15 0.00 2.53 2.96 -0.53 -0.65 118.68 128.26 2oxy s LEU 173 Ca -0.09 1.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.92 2oxy s LEU 173 Cb -0.13 -3.17 0.00 0.00 0.50 0.00 0.00 46.19 43.39 2oxy s LEU 173 CO -0.03 -0.40 0.00 2.30 -1.32 0.00 0.00 176.35 176.91 2oxy n ILE 174 N 4.82 0.00 -3.43 6.68 -5.35 -0.50 -2.31 119.36 119.27 2oxy n ILE 174 Ca 0.04 -0.08 -0.32 0.00 -0.27 0.00 0.00 62.75 62.11 2oxy n ILE 174 Cb 0.49 -0.09 0.03 0.00 -1.74 0.00 0.00 39.64 38.33 2oxy n ILE 174 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2oxy n ASP 175 N -1.22 -5.84 -0.91 7.28 -0.08 -1.26 -4.89 116.55 109.63 2oxy n ASP 175 Ca -0.01 -0.15 0.06 0.00 -1.51 0.00 0.00 54.79 53.19 2oxy n ASP 175 Cb 0.02 -2.29 0.19 0.00 2.34 0.00 0.00 41.12 41.38 2oxy n ASP 175 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11 2oxy n TRP 176 N -0.52 0.73 0.28 -0.67 7.02 -1.26 -4.41 117.44 118.61 2oxy n TRP 176 Ca -0.08 -0.31 0.16 0.00 -1.02 0.00 0.00 57.50 56.25 2oxy n TRP 176 Cb 0.65 -0.10 0.77 0.00 -2.42 0.00 0.00 31.31 30.21 2oxy n TRP 176 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 2oxy h GLY 177 N 4.92 0.00 -1.20 6.99 0.00 -1.91 -1.97 103.07 109.89 2oxy h GLY 177 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2oxy h GLY 177 CO 0.08 0.00 -0.33 1.04 0.00 0.00 0.00 176.54 177.33 2oxy n LEU 178 N -3.29 2.23 -4.76 3.11 4.77 -1.26 -4.91 117.00 112.89 2oxy n LEU 178 Ca -0.01 -0.83 -0.34 0.00 -0.03 0.00 0.00 56.01 54.80 2oxy n LEU 178 Cb 0.26 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.38 2oxy n LEU 178 CO 0.27 0.40 0.78 0.00 -1.33 0.00 0.00 177.39 177.52 2oxy s ALA 179 N -2.25 2.51 -0.04 -1.18 0.00 -0.74 -4.68 121.76 115.39 2oxy s ALA 179 Ca 0.20 0.77 -0.20 0.00 0.00 0.00 0.00 51.96 52.73 2oxy s ALA 179 Cb 0.18 -3.38 0.04 0.00 0.00 0.00 0.00 23.12 19.96 2oxy s ALA 179 CO 0.47 -1.17 0.44 -2.00 0.00 0.00 0.00 175.76 173.50 2oxy s GLU 180 N -3.66 0.78 0.08 0.00 2.56 -0.74 -4.88 118.70 112.84 2oxy s GLU 180 Ca 0.72 0.01 -0.31 0.00 0.00 0.00 0.00 54.97 55.39 2oxy s GLU 180 Cb -0.25 0.36 -0.07 0.00 2.00 0.00 0.00 34.13 36.18 2oxy s GLU 180 CO 0.36 -0.22 1.30 -0.06 -0.56 0.00 0.00 175.26 176.07 2oxy s PHE 181 N -1.18 3.30 -0.11 5.30 0.40 -1.26 -0.80 117.98 123.63 2oxy s PHE 181 Ca -0.12 1.10 -0.30 0.00 -0.60 0.00 0.00 56.93 57.02 2oxy s PHE 181 Cb -0.03 -3.56 -0.01 0.00 0.51 0.00 0.00 43.02 39.93 2oxy s PHE 181 CO 0.06 -1.86 1.03 -0.47 0.70 0.00 0.00 175.22 174.68 2oxy s TYR 182 N 1.23 3.47 -0.08 0.36 5.04 -0.10 -4.92 117.35 122.35 2oxy s TYR 182 Ca 0.62 1.55 0.01 0.00 -2.44 0.00 0.00 57.07 56.80 2oxy s TYR 182 Cb -0.33 -3.22 0.02 0.00 0.35 0.00 0.00 41.96 38.79 2oxy s TYR 182 CO 0.29 -0.35 -0.08 -1.01 -1.34 0.00 0.00 175.55 173.06 2oxy s HIS 183 N 2.11 1.31 0.19 4.97 3.76 -1.26 -4.57 115.29 121.81 2oxy s HIS 183 Ca 0.49 -0.55 -0.33 0.00 -0.15 0.00 0.00 55.06 54.52 2oxy s HIS 183 Cb -0.19 -1.07 -0.14 0.00 1.11 0.00 0.00 32.58 32.29 2oxy s HIS 183 CO 0.18 -0.37 1.36 -2.30 -0.85 0.00 0.00 174.74 172.75 2oxy n PRO 184 N 4.44 1.72 -0.74 8.40 -0.02 -1.26 -1.72 135.00 145.82 2oxy n PRO 184 Ca -0.17 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2oxy n PRO 184 Cb 0.51 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2oxy n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oxy n GLY 185 N 2.36 0.69 3.74 -1.23 0.00 -1.26 -5.00 105.19 104.49 2oxy n GLY 185 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2oxy n GLY 185 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2oxy s LYS 186 N -0.37 4.23 -0.47 1.61 2.20 -0.70 -4.95 119.74 121.29 2oxy s LYS 186 Ca 0.00 2.36 -0.21 0.00 -0.36 0.00 0.00 55.97 57.77 2oxy s LYS 186 Cb 0.00 -3.10 0.03 0.00 -1.51 0.00 0.00 37.83 33.26 2oxy s LYS 186 CO 0.00 -0.48 0.67 -1.21 -0.36 0.00 0.00 175.35 173.96 2oxy s GLU 187 N -0.24 3.24 0.44 4.03 2.02 -1.26 -4.23 118.70 122.70 2oxy s GLU 187 Ca 0.61 -0.50 -0.11 0.00 0.02 0.00 0.00 54.97 54.99 2oxy s GLU 187 Cb -0.43 -4.00 -0.06 0.00 0.10 0.00 0.00 34.13 29.73 2oxy s GLU 187 CO 0.43 -1.11 0.82 0.71 0.02 0.00 0.00 175.26 176.13 2oxy s TYR 188 N 2.88 3.48 0.23 1.61 2.02 -0.15 -4.96 117.35 122.46 2oxy s TYR 188 Ca 0.21 1.12 -0.32 0.00 -0.37 0.00 0.00 57.07 57.72 2oxy s TYR 188 Cb -0.15 -2.51 -0.12 0.00 -0.40 0.00 0.00 41.96 38.77 2oxy s TYR 188 CO 0.17 -0.18 1.60 -1.71 -1.57 0.00 0.00 175.55 173.86 2oxy n ASN 189 N -1.45 3.58 -0.18 2.29 5.15 -1.26 -4.72 115.26 118.66 2oxy n ASN 189 Ca 0.03 1.11 0.13 0.00 -0.60 0.00 0.00 54.58 55.24 2oxy n ASN 189 Cb 0.54 -1.53 0.32 0.00 -0.53 0.00 0.00 39.78 38.58 2oxy n ASN 189 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2oxy n VAL 190 N 2.92 0.00 -2.12 3.44 0.24 -1.26 -4.48 118.33 117.06 2oxy n VAL 190 Ca 0.13 -0.10 -0.42 0.00 -2.04 0.00 0.00 64.34 61.91 2oxy n VAL 190 Cb 0.34 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.11 2oxy n VAL 190 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2oxy n ARG 191 N -0.87 3.46 -4.41 7.34 0.63 -1.26 -4.86 116.66 116.69 2oxy n ARG 191 Ca 0.10 -3.23 -0.22 0.00 -0.92 0.00 0.00 57.85 53.58 2oxy n ARG 191 Cb 0.35 -3.01 -0.09 0.00 0.45 0.00 0.00 32.46 30.17 2oxy n ARG 191 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2oxy s VAL 192 N 1.12 0.47 0.03 5.15 -7.23 -1.26 -5.10 120.40 113.57 2oxy s VAL 192 Ca 0.43 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2oxy s VAL 192 Cb 0.12 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.59 2oxy s VAL 192 CO -0.03 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.76 2oxy n ALA 193 N -0.72 -0.38 -2.54 1.32 0.00 0.48 -4.84 120.51 113.82 2oxy n ALA 193 Ca -0.01 0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.14 2oxy n ALA 193 Cb 0.65 -0.13 -0.12 0.00 0.00 0.00 0.00 19.45 19.86 2oxy n ALA 193 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2oxy s SER 194 N -4.15 4.36 0.17 0.00 0.01 -1.26 -4.98 113.70 107.85 2oxy s SER 194 Ca 0.00 -0.15 -0.14 0.00 1.31 0.00 0.00 55.95 56.97 2oxy s SER 194 Cb 0.00 -0.98 0.17 0.00 0.21 0.00 0.00 66.02 65.42 2oxy s SER 194 CO 0.00 0.32 1.18 -1.14 0.41 0.00 0.00 173.24 174.02 2oxy n ARG 195 N 1.98 -0.19 0.18 12.44 0.63 -1.26 -0.59 116.66 129.86 2oxy n ARG 195 Ca -0.17 1.17 0.14 0.00 -0.92 0.00 0.00 57.85 58.07 2oxy n ARG 195 Cb 0.52 -1.74 0.62 0.00 0.45 0.00 0.00 32.46 32.32 2oxy n ARG 195 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 2oxy h TYR 196 N 0.00 0.00 -0.13 -0.14 0.05 -1.92 -2.68 116.97 112.15 2oxy h TYR 196 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.04 2oxy h TYR 196 Cb 0.45 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.19 2oxy h TYR 196 CO -0.67 0.00 0.00 1.19 -1.05 0.00 0.00 178.16 177.63 2oxy n PHE 197 N -2.47 0.16 -2.22 4.88 3.72 0.24 -4.61 117.46 117.17 2oxy n PHE 197 Ca 0.00 -0.18 -0.42 0.00 -0.05 0.00 0.00 57.45 56.80 2oxy n PHE 197 Cb 0.18 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.68 2oxy n PHE 197 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2oxy s LYS 198 N -0.93 4.33 0.74 -1.08 1.02 -1.01 -4.13 119.74 118.68 2oxy s LYS 198 Ca 0.16 2.01 -0.11 0.00 0.02 0.00 0.00 55.97 58.05 2oxy s LYS 198 Cb 0.10 -3.30 0.03 0.00 -0.52 0.00 0.00 37.83 34.14 2oxy s LYS 198 CO 0.14 -0.42 1.07 0.20 -0.92 0.00 0.00 175.35 175.42 2oxy s GLY 199 N 1.19 1.66 0.41 -3.33 0.00 -1.26 -4.92 107.32 101.07 2oxy s GLY 199 Ca 0.64 0.11 0.13 0.00 0.00 0.00 0.00 44.72 45.60 2oxy s GLY 199 CO 0.30 0.45 1.92 -2.55 0.00 0.00 0.00 173.10 173.21 2oxy h PRO 200 N -0.91 0.49 -0.97 2.90 0.11 -1.92 -1.40 132.00 130.30 2oxy h PRO 200 Ca -0.44 -0.03 0.14 0.00 0.11 0.00 0.00 66.00 65.78 2oxy h PRO 200 Cb 1.22 -0.11 -0.08 0.00 0.11 0.00 0.00 31.00 32.14 2oxy h PRO 200 CO 0.55 0.32 0.61 1.05 -0.21 0.00 0.00 178.00 180.32 2oxy h GLU 201 N 0.50 0.84 0.00 1.05 9.09 -1.89 -0.51 114.58 123.66 2oxy h GLU 201 Ca 0.37 -0.05 -0.06 0.00 0.05 0.00 0.00 59.36 59.67 2oxy h GLU 201 Cb 0.74 -0.19 -0.01 0.00 -1.65 0.00 0.00 28.75 27.65 2oxy h GLU 201 CO -0.13 0.56 -0.29 -0.07 0.05 0.00 0.00 179.01 179.12 2oxy h LEU 202 N 0.86 0.00 0.00 3.06 3.38 -1.50 0.22 115.31 121.33 2oxy h LEU 202 Ca 0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.46 2oxy h LEU 202 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2oxy h LEU 202 CO -0.26 0.29 -0.79 -0.07 0.09 0.00 0.00 178.44 177.70 2oxy h LEU 203 N 0.00 0.00 -2.36 1.67 3.38 -1.04 -3.32 115.31 113.64 2oxy h LEU 203 Ca -0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2oxy h LEU 203 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2oxy h LEU 203 CO 0.04 0.08 0.00 1.33 0.09 0.00 0.00 178.44 179.97 2oxy n VAL 204 N -2.32 0.66 -3.43 1.22 0.24 -0.69 -4.97 118.33 109.04 2oxy n VAL 204 Ca 0.02 -0.83 -0.20 0.00 -2.04 0.00 0.00 64.34 61.28 2oxy n VAL 204 Cb 0.48 0.70 0.07 0.00 -1.47 0.00 0.00 33.84 33.62 2oxy n VAL 204 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2oxy n ASP 205 N 0.03 -5.68 -4.49 -1.34 8.00 -1.00 -4.99 116.55 107.09 2oxy n ASP 205 Ca 0.04 -0.46 -0.43 0.00 0.71 0.00 0.00 54.79 54.65 2oxy n ASP 205 Cb 0.25 -4.38 -0.04 0.00 -0.02 0.00 0.00 41.12 36.93 2oxy n ASP 205 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2oxy s LEU 206 N -6.38 4.19 0.18 0.64 0.20 0.75 -4.91 118.68 113.35 2oxy s LEU 206 Ca 0.49 -0.71 0.14 0.00 0.69 0.00 0.00 54.13 54.73 2oxy s LEU 206 Cb -0.22 -2.58 -0.05 0.00 -0.43 0.00 0.00 46.19 42.91 2oxy s LEU 206 CO 0.62 -1.39 1.23 1.56 -0.29 0.00 0.00 176.35 178.09 2oxy h GLN 207 N 9.50 0.00 -2.43 1.98 4.20 -1.84 -3.37 115.11 123.15 2oxy h GLN 207 Ca -0.28 0.00 -0.69 0.00 0.06 0.00 0.00 58.65 57.74 2oxy h GLN 207 Cb 1.07 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.70 2oxy h GLN 207 CO 1.15 0.56 1.82 -0.40 -0.67 0.00 0.00 178.83 181.28 2oxy n ASP 208 N -3.17 7.63 -3.73 1.46 5.75 -1.26 -0.98 116.55 122.26 2oxy n ASP 208 Ca -0.02 -3.22 -0.20 0.00 -0.01 0.00 0.00 54.79 51.34 2oxy n ASP 208 Cb 0.82 -1.31 0.12 0.00 -1.03 0.00 0.00 41.12 39.72 2oxy n ASP 208 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2oxy n TYR 209 N 1.33 -3.48 -3.15 2.11 0.18 -1.26 -4.66 117.16 108.23 2oxy n TYR 209 Ca 0.58 -1.15 0.00 0.00 1.88 0.00 0.00 57.90 59.21 2oxy n TYR 209 Cb 0.32 -0.66 0.00 0.00 -0.38 0.00 0.00 39.34 38.61 2oxy n TYR 209 CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 2oxy n ASP 210 N -3.26 0.00 -0.42 9.48 5.68 -1.26 -4.93 116.55 121.84 2oxy n ASP 210 Ca 0.13 -0.64 0.36 0.00 -0.50 0.00 0.00 54.79 54.14 2oxy n ASP 210 Cb 0.45 0.00 0.70 0.00 -1.14 0.00 0.00 41.12 41.12 2oxy n ASP 210 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 2oxy h TYR 211 N 0.64 0.24 -0.10 2.11 0.05 -1.94 -1.64 116.97 116.32 2oxy h TYR 211 Ca 0.00 0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.82 2oxy h TYR 211 Cb 0.00 -0.06 -0.00 0.00 1.01 0.00 0.00 36.73 37.67 2oxy h TYR 211 CO 0.00 -0.03 0.15 0.66 -1.05 0.00 0.00 178.16 177.89 2oxy h SER 212 N 0.10 0.00 -0.75 3.88 4.64 -1.95 -1.08 113.55 118.39 2oxy h SER 212 Ca 0.69 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 62.17 2oxy h SER 212 Cb 2.45 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 64.43 2oxy h SER 212 CO -0.15 0.00 0.21 0.25 -0.87 0.00 0.00 176.83 176.27 2oxy h LEU 213 N 0.00 0.07 -1.60 5.97 5.85 -1.67 -1.73 115.31 122.20 2oxy h LEU 213 Ca 0.05 0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.93 2oxy h LEU 213 Cb 0.35 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2oxy h LEU 213 CO -0.00 -0.01 0.29 0.44 -0.34 0.00 0.00 178.44 178.82 2oxy h ASP 214 N 0.30 0.46 0.47 1.25 3.32 -1.41 -2.59 116.42 118.22 2oxy h ASP 214 Ca 0.42 -0.01 -0.18 0.00 0.02 0.00 0.00 57.03 57.28 2oxy h ASP 214 Cb 0.71 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 2oxy h ASP 214 CO -0.49 0.33 -0.78 0.24 -1.72 0.00 0.00 179.24 176.81 2oxy h MET 215 N 0.54 0.24 -0.22 3.56 2.86 -1.44 -0.54 114.93 119.93 2oxy h MET 215 Ca 0.17 -0.22 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2oxy h MET 215 Cb 0.02 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2oxy h MET 215 CO -0.04 0.90 0.13 2.35 1.06 0.00 0.00 176.91 181.32 2oxy h TRP 216 N 0.15 0.29 -0.29 -0.22 2.91 -1.17 -1.65 115.95 115.97 2oxy h TRP 216 Ca -0.03 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.98 2oxy h TRP 216 Cb 1.36 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.90 2oxy h TRP 216 CO 0.03 0.23 0.16 0.77 -1.03 0.00 0.00 178.44 178.60 2oxy h SER 217 N 0.27 0.37 -0.40 2.65 0.02 -1.27 -1.25 113.55 113.93 2oxy h SER 217 Ca 0.08 -0.09 0.08 0.00 -0.84 0.00 0.00 61.79 61.03 2oxy h SER 217 Cb 0.03 -0.09 -0.08 0.00 0.14 0.00 0.00 62.40 62.39 2oxy h SER 217 CO -0.01 0.35 -0.17 0.25 -1.14 0.00 0.00 176.83 176.10 2oxy h LEU 218 N 0.35 -0.60 -0.74 5.07 5.85 -1.12 -2.02 115.31 122.09 2oxy h LEU 218 Ca 0.10 0.15 0.15 0.00 0.84 0.00 0.00 57.88 59.12 2oxy h LEU 218 Cb 0.07 0.34 -0.10 0.00 0.37 0.00 0.00 40.66 41.33 2oxy h LEU 218 CO -0.02 -0.21 0.26 1.23 -0.34 0.00 0.00 178.44 179.36 2oxy h GLY 219 N -0.10 1.10 0.93 3.75 0.00 -0.61 0.44 103.07 108.59 2oxy h GLY 219 Ca 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 2oxy h GLY 219 CO -0.47 -0.14 0.10 0.00 0.00 0.00 0.00 176.54 176.04 2oxy h MET 221 N 0.21 0.41 -0.16 0.00 -1.53 -1.08 -1.58 114.93 111.21 2oxy h MET 221 Ca 0.07 -0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.28 2oxy h MET 221 Cb 0.11 -0.09 -0.01 0.00 -0.55 0.00 0.00 31.60 31.06 2oxy h MET 221 CO -0.01 0.27 -0.02 0.35 0.14 0.00 0.00 176.91 177.65 2oxy h PHE 222 N 0.42 0.32 -0.29 1.39 3.57 -0.69 -2.42 116.94 119.24 2oxy h PHE 222 Ca 0.22 -0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.71 2oxy h PHE 222 Cb 0.16 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.77 2oxy h PHE 222 CO -0.12 0.53 -0.06 0.00 -2.23 0.00 0.00 178.31 176.43 2oxy h ALA 223 N 0.74 0.21 -0.88 2.41 0.00 -0.96 -1.38 119.26 119.41 2oxy h ALA 223 Ca 0.04 0.11 0.14 0.00 0.00 0.00 0.00 54.91 55.20 2oxy h ALA 223 Cb 0.41 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.34 2oxy h ALA 223 CO 0.01 -0.45 0.57 0.78 0.00 0.00 0.00 179.25 180.16 2oxy h GLY 224 N 0.02 1.18 0.23 0.00 0.00 -1.15 -1.46 103.07 101.89 2oxy h GLY 224 Ca 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 2oxy h GLY 224 CO -0.28 0.10 -0.03 -0.33 0.00 0.00 0.00 176.54 175.99 2oxy h MET 225 N 0.69 0.02 -0.01 4.80 2.07 -0.89 -1.28 114.93 120.32 2oxy h MET 225 Ca 0.44 -0.02 -0.15 0.00 -2.07 0.00 0.00 59.70 57.90 2oxy h MET 225 Cb 0.70 0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 30.41 2oxy h MET 225 CO -0.20 0.81 -0.70 -0.84 1.07 0.00 0.00 176.91 177.06 2oxy h ILE 226 N -0.76 1.48 -0.01 -1.22 3.07 -1.19 -3.19 117.51 115.68 2oxy h ILE 226 Ca -0.00 -2.33 0.00 0.00 1.55 0.00 0.00 64.86 64.07 2oxy h ILE 226 Cb 0.82 2.26 0.00 0.00 -0.27 0.00 0.00 36.82 39.63 2oxy h ILE 226 CO 0.01 0.67 -0.42 0.49 -1.05 0.00 0.00 178.15 177.84 2oxy n PHE 227 N -3.74 0.00 -3.83 0.16 3.72 -0.56 -4.55 117.46 108.66 2oxy n PHE 227 Ca -0.01 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.12 2oxy n PHE 227 Cb 0.68 -0.03 0.03 0.00 -0.94 0.00 0.00 39.48 39.21 2oxy n PHE 227 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2oxy n ARG 228 N -0.21 -5.24 -3.80 -1.08 1.74 -0.56 -4.81 116.66 102.70 2oxy n ARG 228 Ca 0.10 0.60 -0.30 0.00 -0.77 0.00 0.00 57.85 57.48 2oxy n ARG 228 Cb 0.43 -5.34 -0.14 0.00 -1.02 0.00 0.00 32.46 26.39 2oxy n ARG 228 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2oxy s LYS 229 N -6.36 1.09 -0.10 5.56 2.20 -0.77 -5.05 119.74 116.31 2oxy s LYS 229 Ca 0.38 -1.57 0.02 0.00 -0.36 0.00 0.00 55.97 54.43 2oxy s LYS 229 Cb -0.19 -2.41 0.02 0.00 -1.51 0.00 0.00 37.83 33.74 2oxy s LYS 229 CO 0.82 -1.03 -0.14 -1.21 -0.36 0.00 0.00 175.35 173.43 2oxy s GLU 230 N 1.03 2.06 0.56 4.03 2.02 -1.26 -2.28 118.70 124.85 2oxy s GLU 230 Ca 0.13 -0.50 -0.17 0.00 0.02 0.00 0.00 54.97 54.44 2oxy s GLU 230 Cb -0.20 -1.77 -0.05 0.00 0.10 0.00 0.00 34.13 32.20 2oxy s GLU 230 CO -0.13 -0.06 1.04 -2.14 0.02 0.00 0.00 175.26 173.98 2oxy s PRO 231 N 0.99 3.53 0.08 0.39 0.02 -1.26 -5.10 135.00 133.65 2oxy s PRO 231 Ca -0.07 1.21 -0.18 0.00 0.02 0.00 0.00 61.00 61.97 2oxy s PRO 231 Cb -0.15 -2.06 -0.09 0.00 0.02 0.00 0.00 34.50 32.22 2oxy s PRO 231 CO -0.01 -0.64 1.48 0.35 -0.33 0.00 0.00 177.00 177.85 2oxy h PHE 232 N 0.78 0.52 -3.39 6.54 3.57 -1.70 -3.36 116.94 119.89 2oxy h PHE 232 Ca -0.47 -0.11 -0.71 0.00 3.53 0.00 0.00 57.97 60.21 2oxy h PHE 232 Cb 1.21 -0.13 -0.31 0.00 2.79 0.00 0.00 35.95 39.51 2oxy h PHE 232 CO 0.59 0.67 -0.47 -0.06 -2.23 0.00 0.00 178.31 176.82 2oxy s PHE 233 N -4.80 3.48 -1.00 0.41 0.08 -1.26 -5.03 117.98 109.85 2oxy s PHE 233 Ca -0.14 -2.06 -0.03 0.00 0.12 0.00 0.00 56.93 54.82 2oxy s PHE 233 Cb 0.07 -3.32 0.29 0.00 -0.57 0.00 0.00 43.02 39.49 2oxy s PHE 233 CO 0.76 -0.97 1.26 0.98 -0.10 0.00 0.00 175.22 177.15 2oxy n TYR 234 N 4.78 3.06 -2.82 0.36 9.36 -1.26 -4.59 117.16 126.04 2oxy n TYR 234 Ca -0.06 -3.14 -0.33 0.00 3.32 0.00 0.00 57.90 57.69 2oxy n TYR 234 Cb 0.41 -1.20 -0.07 0.00 -0.63 0.00 0.00 39.34 37.85 2oxy n TYR 234 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 2oxy s GLY 235 N -1.33 2.36 0.12 2.98 0.00 -1.26 -4.97 107.32 105.22 2oxy s GLY 235 Ca 0.32 0.35 0.24 0.00 0.00 0.00 0.00 44.72 45.63 2oxy s GLY 235 CO 0.04 0.63 1.21 0.45 0.00 0.00 0.00 173.10 175.43 2oxy h HIS 236 N 1.87 0.00 -2.40 1.90 3.86 -1.96 -3.45 115.15 114.97 2oxy h HIS 236 Ca -0.49 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 58.69 2oxy h HIS 236 Cb 1.18 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.65 2oxy h HIS 236 CO 0.62 0.00 0.06 -0.40 0.86 0.00 0.00 177.93 179.07 2oxy n ASP 237 N -2.18 -0.71 -0.03 2.45 5.68 -1.26 -5.01 116.55 115.50 2oxy n ASP 237 Ca 0.02 -1.55 -0.03 0.00 -0.50 0.00 0.00 54.79 52.72 2oxy n ASP 237 Cb 0.46 1.19 0.20 0.00 -1.14 0.00 0.00 41.12 41.83 2oxy n ASP 237 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 2oxy h ASN 238 N 0.66 0.58 0.01 -1.12 2.35 -1.97 0.34 115.58 116.44 2oxy h ASN 238 Ca -0.11 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2oxy h ASN 238 Cb 0.41 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.62 2oxy h ASN 238 CO 0.14 0.75 -0.00 0.45 -1.65 0.00 0.00 177.43 177.11 2oxy h HIS 239 N 0.54 -0.01 -0.15 1.19 3.86 -1.97 -3.08 115.15 115.53 2oxy h HIS 239 Ca 0.09 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 2oxy h HIS 239 Cb 0.56 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 2oxy h HIS 239 CO 0.02 0.35 0.10 0.22 0.86 0.00 0.00 177.93 179.49 2oxy h ASP 240 N -0.38 0.17 -0.24 2.45 3.58 -1.91 -2.55 116.42 117.54 2oxy h ASP 240 Ca -0.00 -0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.48 2oxy h ASP 240 Cb 0.37 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.34 2oxy h ASP 240 CO 0.00 0.12 0.03 -0.61 -2.88 0.00 0.00 179.24 175.91 2oxy h GLN 241 N 0.20 0.11 -0.71 0.28 5.75 -0.89 0.28 115.11 120.14 2oxy h GLN 241 Ca 0.06 -0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.50 2oxy h GLN 241 Cb -0.02 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.47 2oxy h GLN 241 CO -0.01 0.07 0.26 1.25 -2.65 0.00 0.00 178.83 177.76 2oxy h LEU 242 N 0.12 0.99 -0.15 -2.39 5.85 -1.38 -2.36 115.31 115.98 2oxy h LEU 242 Ca 0.11 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.69 2oxy h LEU 242 Cb 0.12 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 2oxy h LEU 242 CO -0.16 0.89 0.06 0.58 -0.34 0.00 0.00 178.44 179.47 2oxy h VAL 243 N 1.04 0.99 -0.93 1.05 2.07 -1.14 0.90 116.25 120.23 2oxy h VAL 243 Ca 0.24 -0.05 0.04 0.00 0.82 0.00 0.00 66.70 67.74 2oxy h VAL 243 Cb 0.23 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 2oxy h VAL 243 CO -0.02 0.03 0.61 0.11 0.02 0.00 0.00 177.57 178.32 2oxy h LYS 244 N 0.15 1.13 0.12 1.57 1.79 -0.74 -0.27 116.57 120.32 2oxy h LYS 244 Ca 0.06 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2oxy h LYS 244 Cb 0.02 -0.26 0.00 0.00 -1.58 0.00 0.00 32.23 30.42 2oxy h LYS 244 CO -0.05 0.75 -0.06 0.82 -1.08 0.00 0.00 179.45 179.83 2oxy h ILE 245 N 1.17 1.00 -0.67 1.86 2.04 -1.11 -3.22 117.51 118.58 2oxy h ILE 245 Ca 0.37 -0.52 0.09 0.00 1.00 0.00 0.00 64.86 65.81 2oxy h ILE 245 Cb 0.03 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 2oxy h ILE 245 CO -0.12 0.12 0.44 0.00 0.00 0.00 0.00 178.15 178.60 2oxy h ALA 246 N 0.43 1.89 0.00 1.87 0.00 -0.29 -0.63 119.26 122.54 2oxy h ALA 246 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2oxy h ALA 246 Cb 0.33 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2oxy h ALA 246 CO 0.03 -0.03 0.00 0.87 0.00 0.00 0.00 179.25 180.12 2oxy h LYS 247 N 0.55 0.00 0.00 0.00 1.57 -1.07 -0.92 116.57 116.70 2oxy h LYS 247 Ca 0.31 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.95 2oxy h LYS 247 Cb 0.47 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 2oxy h LYS 247 CO -0.10 0.00 -1.35 0.28 -0.57 0.00 0.00 179.45 177.71 2oxy n VAL 248 N -2.80 1.43 0.23 0.50 0.31 -0.55 -4.46 118.33 112.98 2oxy n VAL 248 Ca -0.00 0.01 0.12 0.00 -0.01 0.00 0.00 64.34 64.46 2oxy n VAL 248 Cb 0.21 -2.12 0.39 0.00 -0.91 0.00 0.00 33.84 31.40 2oxy n VAL 248 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2oxy h LEU 249 N -0.87 0.00 0.00 7.52 3.38 -1.28 0.20 115.31 124.26 2oxy h LEU 249 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2oxy h LEU 249 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2oxy h LEU 249 CO -0.12 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2oxy n GLY 250 N 0.55 0.57 0.21 0.83 0.00 -0.35 -4.44 105.19 102.55 2oxy n GLY 250 Ca 0.02 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.51 2oxy n GLY 250 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2oxy h THR 251 N 0.00 0.12 0.01 2.61 1.35 -1.47 -3.31 112.91 112.21 2oxy h THR 251 Ca 0.00 -1.16 0.03 0.00 -0.55 0.00 0.00 66.41 64.72 2oxy h THR 251 Cb 0.00 2.05 -0.04 0.00 -1.73 0.00 0.00 68.15 68.44 2oxy h THR 251 CO 0.00 0.07 -0.21 0.44 -0.25 0.00 0.00 175.52 175.57 2oxy h ASP 252 N 0.00 -0.61 0.37 5.36 5.19 -1.89 -0.64 116.42 124.21 2oxy h ASP 252 Ca -0.00 0.08 -0.07 0.00 -0.62 0.00 0.00 57.03 56.42 2oxy h ASP 252 Cb 1.05 0.25 -0.01 0.00 0.18 0.00 0.00 39.33 40.80 2oxy h ASP 252 CO 0.01 -0.28 -0.34 1.23 -3.12 0.00 0.00 179.24 176.74 2oxy h GLY 253 N -0.34 0.00 0.73 2.75 0.00 -1.85 -2.45 103.07 101.91 2oxy h GLY 253 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2oxy h GLY 253 CO -0.18 0.00 -0.00 -2.00 0.00 0.00 0.00 176.54 174.35 2oxy h LEU 254 N 0.00 0.12 -1.27 3.11 5.85 -1.55 -1.22 115.31 120.35 2oxy h LEU 254 Ca -0.00 -0.32 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 2oxy h LEU 254 Cb 0.62 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 2oxy h LEU 254 CO 0.04 0.40 -0.16 0.78 -0.34 0.00 0.00 178.44 179.17 2oxy h ASN 255 N -0.17 0.29 -0.19 1.25 2.35 -0.94 -0.23 115.58 117.93 2oxy h ASN 255 Ca 0.02 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.64 2oxy h ASN 255 Cb 0.35 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.63 2oxy h ASN 255 CO 0.00 0.47 -0.12 0.58 -1.65 0.00 0.00 177.43 176.71 2oxy h VAL 256 N 0.28 1.32 -0.23 2.81 2.07 -1.41 -1.87 116.25 119.22 2oxy h VAL 256 Ca 0.05 -1.22 0.06 0.00 0.82 0.00 0.00 66.70 66.41 2oxy h VAL 256 Cb 0.45 1.70 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 2oxy h VAL 256 CO 0.03 0.37 -0.23 0.22 0.02 0.00 0.00 177.57 177.98 2oxy h TYR 257 N 0.11 -0.60 -0.73 1.57 3.20 -0.95 -0.67 116.97 118.90 2oxy h TYR 257 Ca 0.04 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 2oxy h TYR 257 Cb 0.63 0.30 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 2oxy h TYR 257 CO 0.07 -0.30 0.35 -0.07 -1.64 0.00 0.00 178.16 176.56 2oxy h LEU 258 N -0.24 0.95 -0.11 2.82 3.38 -1.03 -2.44 115.31 118.65 2oxy h LEU 258 Ca 0.13 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2oxy h LEU 258 Cb 0.44 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2oxy h LEU 258 CO -0.37 0.82 -0.05 -1.13 0.09 0.00 0.00 178.44 177.80 2oxy h ASN 259 N 1.02 -0.17 -0.42 -0.43 -1.24 -1.11 0.17 115.58 113.40 2oxy h ASN 259 Ca 0.25 0.04 0.09 0.00 0.71 0.00 0.00 56.30 57.39 2oxy h ASN 259 Cb 0.12 0.10 -0.09 0.00 0.73 0.00 0.00 38.32 39.18 2oxy h ASN 259 CO -0.03 -0.07 -0.24 0.50 -1.29 0.00 0.00 177.43 176.30 2oxy h LYS 260 N -0.04 -0.15 -0.09 6.67 3.64 -0.81 -2.37 116.57 123.42 2oxy h LYS 260 Ca 0.06 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2oxy h LYS 260 Cb 0.13 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2oxy h LYS 260 CO -0.14 -0.10 0.00 0.66 -2.27 0.00 0.00 179.45 177.60 2oxy n TYR 261 N -5.40 0.11 -3.50 1.91 4.01 -0.95 -4.94 117.16 108.41 2oxy n TYR 261 Ca 0.02 -0.06 -0.20 0.00 -0.16 0.00 0.00 57.90 57.51 2oxy n TYR 261 Cb 0.31 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.43 2oxy n TYR 261 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2oxy n ARG 262 N 0.13 -7.18 -4.52 -0.72 1.74 -0.36 -5.00 116.66 100.75 2oxy n ARG 262 Ca 0.17 0.84 -0.33 0.00 -0.77 0.00 0.00 57.85 57.76 2oxy n ARG 262 Cb 0.31 -5.88 -0.13 0.00 -1.02 0.00 0.00 32.46 25.74 2oxy n ARG 262 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2oxy s ILE 263 N -3.34 3.45 -0.21 0.55 1.01 -0.10 -5.03 121.20 117.53 2oxy s ILE 263 Ca 0.24 -0.51 -0.05 0.00 0.00 0.00 0.00 60.65 60.33 2oxy s ILE 263 Cb -0.10 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.85 2oxy s ILE 263 CO 0.73 0.50 0.00 -1.61 0.00 0.00 0.00 174.94 174.56 2oxy s GLU 264 N 0.48 3.55 0.42 2.79 2.02 -1.26 -4.58 118.70 122.12 2oxy s GLU 264 Ca -0.06 -0.54 -0.26 0.00 0.02 0.00 0.00 54.97 54.13 2oxy s GLU 264 Cb -0.15 -3.10 -0.08 0.00 0.10 0.00 0.00 34.13 30.89 2oxy s GLU 264 CO 0.04 -0.08 1.33 -0.51 0.02 0.00 0.00 175.26 176.05 2oxy s LEU 265 N 1.25 4.18 0.15 1.80 1.43 -1.26 -4.95 118.68 121.28 2oxy s LEU 265 Ca 0.04 2.71 -0.34 0.00 -1.03 0.00 0.00 54.13 55.50 2oxy s LEU 265 Cb -0.15 -3.92 -0.15 0.00 0.03 0.00 0.00 46.19 42.00 2oxy s LEU 265 CO 0.01 -0.94 1.34 -0.67 0.23 0.00 0.00 176.35 176.31 2oxy n ASP 266 N 0.02 1.96 -0.34 2.29 2.03 -1.26 -4.72 116.55 116.52 2oxy n ASP 266 Ca 0.04 1.12 0.20 0.00 0.52 0.00 0.00 54.79 56.68 2oxy n ASP 266 Cb 0.43 -1.27 0.45 0.00 -0.72 0.00 0.00 41.12 40.01 2oxy n ASP 266 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2oxy h PRO 267 N 4.39 0.47 -0.39 -0.67 0.11 -1.99 -0.21 132.00 133.70 2oxy h PRO 267 Ca -0.45 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 2oxy h PRO 267 Cb 1.32 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2oxy h PRO 267 CO 0.77 0.31 -0.27 1.96 -0.21 0.00 0.00 178.00 180.56 2oxy h GLN 268 N 0.48 0.82 -0.50 1.05 4.20 -2.00 -2.13 115.11 117.02 2oxy h GLN 268 Ca 0.64 -0.36 -0.10 0.00 0.06 0.00 0.00 58.65 58.89 2oxy h GLN 268 Cb 1.40 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.14 2oxy h GLN 268 CO -0.41 0.99 -0.08 1.25 -0.67 0.00 0.00 178.83 179.91 2oxy h LEU 269 N 0.70 0.90 -0.11 1.46 5.85 -1.43 -2.05 115.31 120.62 2oxy h LEU 269 Ca 0.09 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.56 2oxy h LEU 269 Cb 0.81 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 2oxy h LEU 269 CO 0.07 1.00 -0.08 -0.08 -0.34 0.00 0.00 178.44 179.01 2oxy h GLU 270 N 0.82 -0.08 -0.95 1.25 4.81 -1.14 -0.58 114.58 118.70 2oxy h GLU 270 Ca 0.14 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2oxy h GLU 270 Cb 0.60 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.95 2oxy h GLU 270 CO 0.04 -0.05 0.63 0.00 -0.73 0.00 0.00 179.01 178.90 2oxy h ALA 271 N 1.01 1.32 -0.58 2.92 0.00 -1.31 -2.27 119.26 120.34 2oxy h ALA 271 Ca 0.07 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2oxy h ALA 271 Cb 0.18 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2oxy h ALA 271 CO -0.16 0.63 -0.02 -0.07 0.00 0.00 0.00 179.25 179.63 2oxy h LEU 272 N 1.29 1.03 -0.72 0.00 3.38 -1.04 -3.13 115.31 116.12 2oxy h LEU 272 Ca 0.35 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2oxy h LEU 272 Cb -0.15 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.29 2oxy h LEU 272 CO -0.08 1.10 0.28 0.58 0.09 0.00 0.00 178.44 180.42 2oxy h VAL 273 N 0.94 1.25 0.00 1.22 2.07 -0.90 -3.48 116.25 117.35 2oxy h VAL 273 Ca 0.16 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2oxy h VAL 273 Cb 0.58 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2oxy h VAL 273 CO 0.03 0.32 0.00 0.61 0.02 0.00 0.00 177.57 178.55 2oxy n GLY 274 N -0.85 1.96 2.98 2.17 0.00 -0.87 -4.74 105.19 105.84 2oxy n GLY 274 Ca 0.06 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 2oxy n GLY 274 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oxy s ARG 275 N 0.00 1.43 -0.03 1.61 0.52 -1.26 -4.94 118.95 116.28 2oxy s ARG 275 Ca 0.00 -0.32 -0.06 0.00 -0.52 0.00 0.00 55.73 54.83 2oxy s ARG 275 Cb 0.00 -1.24 0.01 0.00 0.52 0.00 0.00 34.95 34.24 2oxy s ARG 275 CO 0.00 -0.02 0.15 -1.01 0.02 0.00 0.00 175.30 174.44 2oxy s HIS 276 N 0.78 -0.07 0.44 -0.53 3.76 -1.26 -5.00 115.29 113.41 2oxy s HIS 276 Ca -0.13 0.16 -0.23 0.00 -0.15 0.00 0.00 55.06 54.71 2oxy s HIS 276 Cb -0.15 0.01 -0.08 0.00 1.11 0.00 0.00 32.58 33.46 2oxy s HIS 276 CO 0.02 -0.18 1.08 -1.12 -0.85 0.00 0.00 174.74 173.69 2oxy s SER 277 N -0.62 6.46 0.21 1.40 0.01 -1.26 -1.89 113.70 118.01 2oxy s SER 277 Ca -0.07 2.08 -0.31 0.00 1.31 0.00 0.00 55.95 58.96 2oxy s SER 277 Cb -0.04 -2.58 -0.11 0.00 0.21 0.00 0.00 66.02 63.50 2oxy s SER 277 CO 0.01 -0.70 1.60 -0.60 0.41 0.00 0.00 173.24 173.96 2oxy s ARG 278 N -2.77 4.18 -0.27 12.44 3.52 -1.26 -4.34 118.95 130.45 2oxy s ARG 278 Ca 0.62 2.46 -0.18 0.00 -0.13 0.00 0.00 55.73 58.51 2oxy s ARG 278 Cb -0.22 -3.10 -0.03 0.00 -1.56 0.00 0.00 34.95 30.04 2oxy s ARG 278 CO 0.27 -0.63 0.51 0.21 -0.81 0.00 0.00 175.30 174.85 2oxy s LYS 279 N 0.69 4.03 0.37 5.12 2.20 0.72 -4.95 119.74 127.92 2oxy s LYS 279 Ca 0.69 0.28 -0.28 0.00 -0.36 0.00 0.00 55.97 56.30 2oxy s LYS 279 Cb -0.46 -3.66 -0.11 0.00 -1.51 0.00 0.00 37.83 32.09 2oxy s LYS 279 CO 0.36 -0.37 1.45 -1.25 -0.36 0.00 0.00 175.35 175.18 2oxy s PRO 280 N 2.31 4.14 0.31 4.03 0.04 -1.26 -4.81 135.00 139.76 2oxy s PRO 280 Ca 0.21 2.51 0.02 0.00 0.04 0.00 0.00 61.00 63.77 2oxy s PRO 280 Cb -0.16 -2.97 0.57 0.00 0.04 0.00 0.00 34.50 31.98 2oxy s PRO 280 CO 0.10 -0.48 1.89 -1.49 0.04 0.00 0.00 177.00 177.05 2oxy h TRP 281 N 3.04 1.03 -0.97 0.56 4.06 -1.96 -1.86 115.95 119.85 2oxy h TRP 281 Ca -0.51 0.03 0.25 0.00 2.06 0.00 0.00 58.89 60.72 2oxy h TRP 281 Cb 1.24 -0.34 -0.06 0.00 -1.00 0.00 0.00 29.16 29.00 2oxy h TRP 281 CO 0.54 0.50 0.66 -0.07 -3.56 0.00 0.00 178.44 176.50 2oxy h LEU 282 N 0.98 0.26 -1.78 -4.49 3.38 -1.99 -0.25 115.31 111.41 2oxy h LEU 282 Ca 0.42 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.42 2oxy h LEU 282 Cb 0.32 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2oxy h LEU 282 CO -0.17 0.08 0.03 0.11 0.09 0.00 0.00 178.44 178.58 2oxy h LYS 283 N 0.24 0.00 0.00 1.13 1.57 -1.71 -1.29 116.57 116.51 2oxy h LYS 283 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 2oxy h LYS 283 Cb 1.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.84 2oxy h LYS 283 CO -0.14 0.00 -0.57 0.74 -0.57 0.00 0.00 179.45 178.91 2oxy h PHE 284 N 0.00 0.00 -3.76 -1.35 0.04 -1.21 -3.47 116.94 107.19 2oxy h PHE 284 Ca 0.00 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.26 2oxy h PHE 284 Cb 0.07 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.24 2oxy h PHE 284 CO 0.00 0.00 0.51 1.41 -0.60 0.00 0.00 178.31 179.63 2oxy s MET 285 N -3.20 4.57 0.37 1.51 1.75 -0.49 -4.95 119.30 118.86 2oxy s MET 285 Ca 0.05 1.88 -0.05 0.00 -1.25 0.00 0.00 55.69 56.32 2oxy s MET 285 Cb 0.12 -3.18 0.02 0.00 2.84 0.00 0.00 34.83 34.63 2oxy s MET 285 CO 0.72 0.10 0.58 0.27 -0.65 0.00 0.00 175.02 176.03 2oxy n ASN 286 N 1.36 -1.63 -0.03 1.11 0.23 -1.26 -5.01 115.26 110.02 2oxy n ASN 286 Ca -0.00 -2.84 0.02 0.00 -0.53 0.00 0.00 54.58 51.22 2oxy n ASN 286 Cb 0.44 2.92 0.35 0.00 -2.08 0.00 0.00 39.78 41.42 2oxy n ASN 286 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2oxy h ALA 287 N 2.03 1.55 -0.36 -2.53 0.00 -2.00 0.18 119.26 118.14 2oxy h ALA 287 Ca -0.29 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 2oxy h ALA 287 Cb 1.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2oxy h ALA 287 CO 0.39 0.36 -0.19 0.22 0.00 0.00 0.00 179.25 180.03 2oxy h ASP 288 N 0.60 0.68 -0.01 0.00 3.58 -1.98 -3.33 116.42 115.96 2oxy h ASP 288 Ca 0.15 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.38 2oxy h ASP 288 Cb 0.07 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.94 2oxy h ASP 288 CO -0.02 0.87 -0.07 -0.46 -2.88 0.00 0.00 179.24 176.68 2oxy n ASN 289 N -4.13 1.18 -0.29 2.28 0.23 -0.96 -4.76 115.26 108.81 2oxy n ASN 289 Ca 0.00 -1.09 0.27 0.00 -0.53 0.00 0.00 54.58 53.23 2oxy n ASN 289 Cb 0.40 0.27 0.61 0.00 -2.08 0.00 0.00 39.78 38.98 2oxy n ASN 289 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 2oxy h GLN 290 N 0.89 0.21 0.00 -3.83 3.07 -1.09 -0.54 115.11 113.83 2oxy h GLN 290 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.73 2oxy h GLN 290 Cb 0.23 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 27.74 2oxy h GLN 290 CO 0.00 0.14 0.00 -2.39 0.09 0.00 0.00 178.83 176.67 2oxy n HIS 291 N -4.43 0.87 0.98 0.06 1.44 -1.26 -2.95 115.22 109.93 2oxy n HIS 291 Ca 0.23 0.30 0.10 0.00 -2.01 0.00 0.00 57.72 56.35 2oxy n HIS 291 Cb 0.97 -0.99 -0.07 0.00 0.12 0.00 0.00 29.99 30.01 2oxy n HIS 291 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2oxy n LEU 292 N -2.26 1.37 -4.54 2.39 4.77 -0.22 -4.49 117.00 114.02 2oxy n LEU 292 Ca 0.04 -0.60 -0.34 0.00 -0.03 0.00 0.00 56.01 55.08 2oxy n LEU 292 Cb 0.32 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.30 2oxy n LEU 292 CO 0.25 0.29 -0.32 -0.69 -1.33 0.00 0.00 177.39 175.59 2oxy s VAL 293 N -2.76 4.19 0.10 4.08 1.01 -1.15 -4.89 120.40 120.98 2oxy s VAL 293 Ca 0.12 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.76 2oxy s VAL 293 Cb 0.16 -2.86 -0.00 0.00 0.00 0.00 0.00 36.38 33.68 2oxy s VAL 293 CO 0.74 0.48 0.20 -0.94 0.00 0.00 0.00 175.10 175.58 2oxy s SER 294 N 0.38 0.12 0.37 3.32 1.04 -1.26 -4.99 113.70 112.67 2oxy s SER 294 Ca -0.02 -0.68 0.07 0.00 0.48 0.00 0.00 55.95 55.80 2oxy s SER 294 Cb -0.14 0.35 0.79 0.00 0.10 0.00 0.00 66.02 67.12 2oxy s SER 294 CO 0.02 -0.75 1.94 -0.65 0.98 0.00 0.00 173.24 174.78 2oxy h PRO 295 N 2.73 0.69 -0.42 4.02 0.11 -1.99 -1.43 132.00 135.70 2oxy h PRO 295 Ca -0.34 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.61 2oxy h PRO 295 Cb 1.20 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2oxy h PRO 295 CO 0.55 0.45 -0.19 1.05 -0.21 0.00 0.00 178.00 179.66 2oxy h GLU 296 N 0.71 0.87 -0.36 1.05 9.09 -1.97 -0.69 114.58 123.27 2oxy h GLU 296 Ca 0.34 -0.38 0.05 0.00 0.05 0.00 0.00 59.36 59.43 2oxy h GLU 296 Cb 0.40 -0.03 -0.05 0.00 -1.65 0.00 0.00 28.75 27.43 2oxy h GLU 296 CO -0.12 1.02 0.08 0.00 0.05 0.00 0.00 179.01 180.04 2oxy h ALA 297 N 0.83 0.39 -0.05 1.06 0.00 -1.82 -1.25 119.26 118.42 2oxy h ALA 297 Ca 0.09 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2oxy h ALA 297 Cb 0.75 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2oxy h ALA 297 CO 0.06 -0.32 0.03 0.82 0.00 0.00 0.00 179.25 179.85 2oxy h ILE 298 N 0.21 1.01 -0.57 0.00 2.04 -1.17 0.05 117.51 119.09 2oxy h ILE 298 Ca 0.17 -0.03 0.07 0.00 1.00 0.00 0.00 64.86 66.07 2oxy h ILE 298 Cb 0.18 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 2oxy h ILE 298 CO -0.21 0.01 0.26 -0.78 0.00 0.00 0.00 178.15 177.43 2oxy h ASP 299 N 0.07 0.32 0.17 1.72 3.58 -1.04 0.44 116.42 121.68 2oxy h ASP 299 Ca 0.02 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 2oxy h ASP 299 Cb -0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.04 2oxy h ASP 299 CO -0.00 0.21 -0.08 0.15 -2.88 0.00 0.00 179.24 176.64 2oxy h PHE 300 N 0.48 -0.21 -0.73 0.28 3.57 -1.06 -2.31 116.94 116.96 2oxy h PHE 300 Ca 0.27 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.81 2oxy h PHE 300 Cb 0.25 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 2oxy h PHE 300 CO -0.13 -0.13 0.45 1.25 -2.23 0.00 0.00 178.31 177.52 2oxy h LEU 301 N -0.22 0.72 -1.64 0.59 5.85 -0.70 -2.13 115.31 117.77 2oxy h LEU 301 Ca -0.02 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2oxy h LEU 301 Cb 0.17 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2oxy h LEU 301 CO 0.04 0.48 0.04 -0.78 -0.34 0.00 0.00 178.44 177.88 2oxy h ASP 302 N 0.85 0.24 0.52 1.25 3.58 -0.70 -0.93 116.42 121.23 2oxy h ASP 302 Ca 0.31 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.74 2oxy h ASP 302 Cb 0.09 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2oxy h ASP 302 CO -0.14 0.26 -0.19 0.29 -2.88 0.00 0.00 179.24 176.58 2oxy n LYS 303 N -4.42 0.39 -0.08 0.28 5.02 -0.82 -3.78 118.16 114.75 2oxy n LYS 303 Ca -0.00 -0.15 -0.23 0.00 -2.02 0.00 0.00 58.31 55.92 2oxy n LYS 303 Cb 0.15 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.54 2oxy n LYS 303 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2oxy n LEU 304 N -1.18 2.34 -4.08 -0.35 4.77 -0.43 -2.06 117.00 116.01 2oxy n LEU 304 Ca 0.11 0.23 -0.43 0.00 -0.03 0.00 0.00 56.01 55.89 2oxy n LEU 304 Cb 0.31 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 2oxy n LEU 304 CO 0.27 0.65 1.65 0.18 -1.33 0.00 0.00 177.39 178.81 2oxy n LEU 305 N -3.87 6.14 -4.52 2.23 4.77 -0.75 -4.43 117.00 116.57 2oxy n LEU 305 Ca -0.39 -4.67 -0.33 0.00 -0.03 0.00 0.00 56.01 50.59 2oxy n LEU 305 Cb 0.90 -1.50 -0.12 0.00 -2.33 0.00 0.00 43.42 40.37 2oxy n LEU 305 CO 0.25 1.21 -0.41 -0.13 -1.33 0.00 0.00 177.39 176.98 2oxy s ARG 306 N 0.33 2.69 0.11 3.23 1.81 -1.26 -4.93 118.95 120.93 2oxy s ARG 306 Ca 0.39 -0.62 -0.31 0.00 -1.72 0.00 0.00 55.73 53.47 2oxy s ARG 306 Cb 0.04 -2.51 -0.10 0.00 -0.45 0.00 0.00 34.95 31.94 2oxy s ARG 306 CO 0.01 0.61 1.58 1.88 -0.68 0.00 0.00 175.30 178.71 2oxy h TYR 307 N 5.40 -1.22 -2.99 -0.53 0.05 -1.92 -3.40 116.97 112.37 2oxy h TYR 307 Ca -0.46 0.03 -0.57 0.00 0.05 0.00 0.00 58.73 57.78 2oxy h TYR 307 Cb 1.17 0.52 -0.04 0.00 1.01 0.00 0.00 36.73 39.39 2oxy h TYR 307 CO 0.53 -0.52 1.11 0.34 -1.05 0.00 0.00 178.16 178.57 2oxy s ASP 308 N -4.72 6.33 0.46 3.88 -1.08 -1.26 -4.72 116.67 115.56 2oxy s ASP 308 Ca -0.16 1.23 0.15 0.00 -0.52 0.00 0.00 52.55 53.25 2oxy s ASP 308 Cb 0.07 -2.53 1.10 0.00 -1.46 0.00 0.00 42.92 40.10 2oxy s ASP 308 CO 0.63 -1.36 2.01 1.12 0.52 0.00 0.00 175.17 178.09 2oxy h HIS 309 N 10.83 0.32 0.00 -5.34 2.07 -1.96 -1.55 115.15 119.52 2oxy h HIS 309 Ca -0.30 0.01 -0.02 0.00 -2.85 0.00 0.00 60.37 57.21 2oxy h HIS 309 Cb 1.13 -0.11 -0.00 0.00 2.57 0.00 0.00 27.41 31.00 2oxy h HIS 309 CO 0.93 0.16 -0.10 1.96 -3.07 0.00 0.00 177.93 177.82 2oxy h GLN 310 N 0.31 0.00 0.00 5.12 1.08 -1.95 -2.70 115.11 116.97 2oxy h GLN 310 Ca 0.23 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 2oxy h GLN 310 Cb 0.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 2oxy h GLN 310 CO -0.05 0.10 -0.14 0.93 -0.95 0.00 0.00 178.83 178.72 2oxy h GLU 311 N 0.00 0.00 -6.93 1.46 5.08 -1.67 -3.48 114.58 109.05 2oxy h GLU 311 Ca -0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 2oxy h GLU 311 Cb 0.30 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.60 2oxy h GLU 311 CO 0.01 0.00 0.51 1.03 -1.00 0.00 0.00 179.01 179.56 2oxy s ARG 312 N -3.19 4.11 0.28 2.33 0.52 -1.02 -4.97 118.95 117.00 2oxy s ARG 312 Ca 0.07 1.86 -0.28 0.00 -0.52 0.00 0.00 55.73 56.86 2oxy s ARG 312 Cb 0.08 -2.73 -0.14 0.00 0.52 0.00 0.00 34.95 32.68 2oxy s ARG 312 CO 0.66 -0.28 0.97 1.28 0.02 0.00 0.00 175.30 177.96 2oxy n LEU 313 N 0.18 1.54 -4.79 2.53 4.77 -0.88 -5.00 117.00 115.35 2oxy n LEU 313 Ca 0.04 1.17 -0.31 0.00 -0.03 0.00 0.00 56.01 56.88 2oxy n LEU 313 Cb 0.46 -1.26 0.07 0.00 -2.33 0.00 0.00 43.42 40.36 2oxy n LEU 313 CO 0.51 -1.53 0.70 0.42 -1.33 0.00 0.00 177.39 176.17 2oxy s THR 314 N -1.02 3.65 0.27 -5.08 -4.23 -1.26 -4.87 115.64 103.09 2oxy s THR 314 Ca 0.59 0.53 -0.03 0.00 -1.18 0.00 0.00 61.69 61.61 2oxy s THR 314 Cb -0.72 -3.14 0.27 0.00 1.34 0.00 0.00 72.50 70.24 2oxy s THR 314 CO 0.59 -0.70 1.92 0.00 -0.54 0.00 0.00 174.62 175.89 2oxy h ALA 315 N -0.94 1.39 -0.14 3.99 0.00 -1.94 -0.29 119.26 121.33 2oxy h ALA 315 Ca -0.44 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2oxy h ALA 315 Cb 1.22 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2oxy h ALA 315 CO 0.54 0.52 -0.01 1.25 0.00 0.00 0.00 179.25 181.55 2oxy h LEU 316 N 1.20 0.26 -0.47 0.00 5.85 -1.93 -2.71 115.31 117.51 2oxy h LEU 316 Ca 0.38 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2oxy h LEU 316 Cb 0.02 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 2oxy h LEU 316 CO -0.12 0.52 0.25 -0.33 -0.34 0.00 0.00 178.44 178.41 2oxy h GLU 317 N -0.01 0.48 -0.77 1.25 5.08 -1.86 -2.62 114.58 116.14 2oxy h GLU 317 Ca 0.04 -0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.51 2oxy h GLU 317 Cb 0.39 -0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.44 2oxy h GLU 317 CO 0.01 0.32 0.34 0.00 -1.00 0.00 0.00 179.01 178.68 2oxy h ALA 318 N 1.24 1.10 0.00 3.43 0.00 -1.00 -1.87 119.26 122.16 2oxy h ALA 318 Ca 0.20 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2oxy h ALA 318 Cb 0.09 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2oxy h ALA 318 CO -0.13 -0.16 -0.01 0.52 0.00 0.00 0.00 179.25 179.47 2oxy h MET 319 N 0.51 0.00 -0.00 0.00 2.86 -1.13 -1.58 114.93 115.58 2oxy h MET 319 Ca 0.42 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.06 2oxy h MET 319 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 2oxy h MET 319 CO -0.37 0.01 -0.11 0.25 1.06 0.00 0.00 176.91 177.75 2oxy n THR 320 N -3.72 0.00 -1.90 2.22 -2.24 -0.70 -4.83 114.28 103.11 2oxy n THR 320 Ca -0.03 -0.06 -0.41 0.00 -2.27 0.00 0.00 64.05 61.28 2oxy n THR 320 Cb 0.10 -0.11 -0.01 0.00 -2.10 0.00 0.00 70.33 68.21 2oxy n THR 320 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2oxy s HIS 321 N -2.49 2.77 0.62 4.78 2.46 -0.60 -4.88 115.29 117.95 2oxy s HIS 321 Ca 0.28 1.17 0.25 0.00 0.47 0.00 0.00 55.06 57.24 2oxy s HIS 321 Cb 0.20 -3.92 1.19 0.00 -0.13 0.00 0.00 32.58 29.92 2oxy s HIS 321 CO 0.48 -2.74 1.65 -1.35 -2.47 0.00 0.00 174.74 170.31 2oxy h PRO 322 N 3.52 0.00 -0.71 2.88 0.11 -1.92 -0.59 132.00 135.29 2oxy h PRO 322 Ca -0.49 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.74 2oxy h PRO 322 Cb 1.23 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.30 2oxy h PRO 322 CO 0.68 0.00 0.47 -0.92 -0.21 0.00 0.00 178.00 178.02 2oxy h TYR 323 N 0.00 0.50 -0.41 0.65 3.20 -1.90 -1.83 116.97 117.18 2oxy h TYR 323 Ca 0.20 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.09 2oxy h TYR 323 Cb 1.58 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.69 2oxy h TYR 323 CO 0.00 0.21 0.00 1.19 -1.64 0.00 0.00 178.16 177.92 2oxy n PHE 324 N -4.48 0.55 -0.21 -3.82 3.72 -0.23 -4.61 117.46 108.38 2oxy n PHE 324 Ca 0.13 -0.27 0.01 0.00 -0.05 0.00 0.00 57.45 57.26 2oxy n PHE 324 Cb 0.45 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 39.11 2oxy n PHE 324 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2oxy h GLN 325 N 3.01 0.36 -0.07 -1.08 4.15 -1.43 -1.04 115.11 119.01 2oxy h GLN 325 Ca 0.00 -0.02 -0.21 0.00 0.77 0.00 0.00 58.65 59.19 2oxy h GLN 325 Cb 0.68 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.29 2oxy h GLN 325 CO 0.00 0.24 -0.82 1.96 -1.93 0.00 0.00 178.83 178.28 2oxy h GLN 326 N 0.38 0.52 -0.03 1.69 7.50 -1.83 -1.77 115.11 121.57 2oxy h GLN 326 Ca 0.33 -0.47 0.03 0.00 0.50 0.00 0.00 58.65 59.04 2oxy h GLN 326 Cb 0.44 0.11 -0.04 0.00 0.05 0.00 0.00 27.48 28.04 2oxy h GLN 326 CO -0.35 1.10 -0.21 0.28 -1.50 0.00 0.00 178.83 178.16 2oxy h VAL 327 N 0.34 0.51 -0.57 -0.54 2.07 -1.74 -1.77 116.25 114.54 2oxy h VAL 327 Ca -0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 2oxy h VAL 327 Cb 1.43 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 2oxy h VAL 327 CO 0.15 0.00 0.35 0.03 0.02 0.00 0.00 177.57 178.12 2oxy h ARG 328 N -0.31 0.77 -0.75 1.57 3.08 -1.20 -2.72 114.38 114.81 2oxy h ARG 328 Ca 0.07 -0.06 0.12 0.00 0.07 0.00 0.00 59.98 60.18 2oxy h ARG 328 Cb 0.41 -0.16 -0.09 0.00 0.08 0.00 0.00 29.97 30.21 2oxy h ARG 328 CO -0.21 0.54 0.34 0.00 -1.07 0.00 0.00 179.97 179.57 2oxy h ALA 329 N 1.18 1.06 0.00 0.04 0.00 -1.20 -1.55 119.26 118.79 2oxy h ALA 329 Ca 0.21 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2oxy h ALA 329 Cb -0.03 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2oxy h ALA 329 CO -0.04 -0.14 -0.16 0.00 0.00 0.00 0.00 179.25 178.91 2oxy h ALA 330 N 1.51 1.49 -0.62 0.00 0.00 -1.01 -2.78 119.26 117.84 2oxy h ALA 330 Ca 0.40 -0.14 -0.24 0.00 0.00 0.00 0.00 54.91 54.92 2oxy h ALA 330 Cb 0.54 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.16 2oxy h ALA 330 CO -0.35 0.20 0.31 -0.85 0.00 0.00 0.00 179.25 178.56 2oxy n GLU 331 N -3.98 2.62 -3.79 0.00 0.28 -0.59 -4.91 120.64 110.27 2oxy n GLU 331 Ca -0.02 -2.23 -0.30 0.00 -0.16 0.00 0.00 57.16 54.45 2oxy n GLU 331 Cb 0.24 -1.93 -0.04 0.00 1.43 0.00 0.00 31.44 31.14 2oxy n GLU 331 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2oxy s ASN 332 N -0.64 6.40 0.00 -1.84 0.02 -1.05 -5.07 114.94 112.77 2oxy s ASN 332 Ca 0.41 0.39 0.11 0.00 -1.02 0.00 0.00 52.86 52.75 2oxy s ASN 332 Cb 0.33 -2.01 0.68 0.00 0.02 0.00 0.00 41.25 40.28 2oxy s ASN 332 CO 0.09 0.06 1.12 -1.54 0.02 0.00 0.00 177.10 176.85