#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 0.37 0.29 -1.46 1.02 -1.26 -4.31 119.74 114.40 2oxy s LYS 8 Ca 0.00 -0.50 -0.30 0.00 0.02 0.00 0.00 55.97 55.20 2oxy s LYS 8 Cb 0.00 -0.16 -0.13 0.00 -0.52 0.00 0.00 37.83 37.02 2oxy s LYS 8 CO 0.00 0.03 1.34 0.00 -0.92 0.00 0.00 175.35 175.80 2oxy n ALA 9 N 2.02 1.16 0.22 5.17 0.00 -1.26 -4.92 120.51 122.90 2oxy n ALA 9 Ca -0.20 0.39 0.07 0.00 0.00 0.00 0.00 53.44 53.70 2oxy n ALA 9 Cb 0.56 -2.26 0.50 0.00 0.00 0.00 0.00 19.45 18.26 2oxy n ALA 9 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2oxy h ARG 10 N 3.37 0.00 -4.13 0.00 2.43 -1.97 -3.41 114.38 110.67 2oxy h ARG 10 Ca -0.45 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.52 2oxy h ARG 10 Cb 1.28 0.00 -0.21 0.00 -0.42 0.00 0.00 29.97 30.62 2oxy h ARG 10 CO 0.69 0.25 -0.71 0.14 -1.51 0.00 0.00 179.97 178.84 2oxy s VAL 11 N -4.18 0.22 -1.98 0.20 -7.23 -1.26 -4.89 120.40 101.28 2oxy s VAL 11 Ca -0.03 -0.98 0.00 0.00 -1.81 0.00 0.00 61.98 59.16 2oxy s VAL 11 Cb 0.14 -0.39 0.00 0.00 0.56 0.00 0.00 36.38 36.69 2oxy s VAL 11 CO 0.67 -0.49 0.00 -1.22 -0.31 0.00 0.00 175.10 173.75 2oxy n TYR 12 N 1.51 -0.34 -0.24 2.82 4.01 -1.26 -4.87 117.16 118.78 2oxy n TYR 12 Ca -0.23 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.47 2oxy n TYR 12 Cb 0.55 -3.48 0.13 0.00 -0.31 0.00 0.00 39.34 36.22 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 0.37 1.16 -0.56 -0.72 0.00 -1.90 -3.21 119.26 114.40 2oxy h ALA 13 Ca -0.42 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2oxy h ALA 13 Cb 1.30 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2oxy h ALA 13 CO 0.58 0.61 0.00 -0.25 0.00 0.00 0.00 179.25 180.20 2oxy n ASP 14 N -4.30 3.81 -0.23 0.00 10.43 -1.26 -4.34 116.55 120.67 2oxy n ASP 14 Ca 0.07 -2.17 -0.05 0.00 2.57 0.00 0.00 54.79 55.21 2oxy n ASP 14 Cb 0.17 -0.43 0.01 0.00 1.84 0.00 0.00 41.12 42.71 2oxy n ASP 14 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 2oxy h VAL 15 N 3.35 0.15 0.00 2.53 2.07 -1.90 -2.44 116.25 120.00 2oxy h VAL 15 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2oxy h VAL 15 Cb 1.04 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2oxy h VAL 15 CO 0.07 0.00 -0.17 0.78 0.02 0.00 0.00 177.57 178.27 2oxy h ASN 16 N -0.14 0.00 -0.31 0.57 2.35 -1.82 -2.38 115.58 113.85 2oxy h ASN 16 Ca 0.25 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.97 2oxy h ASN 16 Cb 0.56 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 2oxy h ASN 16 CO -0.72 0.17 0.09 0.58 -1.65 0.00 0.00 177.43 175.90 2oxy h VAL 17 N 0.00 1.21 -0.03 2.81 2.07 -1.78 -3.29 116.25 117.24 2oxy h VAL 17 Ca -0.00 -0.68 -0.15 0.00 0.82 0.00 0.00 66.70 66.69 2oxy h VAL 17 Cb 0.81 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 2oxy h VAL 17 CO 0.02 0.23 -0.66 0.25 0.02 0.00 0.00 177.57 177.42 2oxy h LEU 18 N 0.35 0.14-10.36 2.57 5.85 -1.19 -3.45 115.31 109.21 2oxy h LEU 18 Ca 0.10 -0.09 -0.51 0.00 0.84 0.00 0.00 57.88 58.23 2oxy h LEU 18 Cb 0.26 -0.04 0.07 0.00 0.37 0.00 0.00 40.66 41.32 2oxy h LEU 18 CO -0.00 0.76 0.40 -0.13 -0.34 0.00 0.00 178.44 179.13 2oxy s ARG 19 N -3.57 3.29 0.50 1.25 0.52 -0.92 -5.01 118.95 115.02 2oxy s ARG 19 Ca -0.02 0.78 -0.23 0.00 -0.52 0.00 0.00 55.73 55.74 2oxy s ARG 19 Cb 0.12 -2.04 -0.07 0.00 0.52 0.00 0.00 34.95 33.48 2oxy s ARG 19 CO 0.79 -0.80 1.32 -2.30 0.02 0.00 0.00 175.30 174.32 2oxy n PRO 20 N -2.91 1.78 -0.23 3.54 -0.02 -1.26 -4.88 135.00 131.02 2oxy n PRO 20 Ca 0.07 0.65 0.22 0.00 -2.02 0.00 0.00 63.50 62.41 2oxy n PRO 20 Cb 0.54 -2.50 0.57 0.00 -0.02 0.00 0.00 33.50 32.09 2oxy n PRO 20 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2oxy h LYS 21 N 1.66 0.29 0.00 -0.52 3.64 -1.93 0.52 116.57 120.23 2oxy h LYS 21 Ca -0.50 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 58.85 2oxy h LYS 21 Cb 1.30 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2oxy h LYS 21 CO 0.58 0.19 -0.07 1.05 -2.27 0.00 0.00 179.45 178.93 2oxy h GLU 22 N 0.30 0.00 -0.69 1.90 4.11 -1.91 -0.34 114.58 117.96 2oxy h GLU 22 Ca 0.47 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.91 2oxy h GLU 22 Cb 1.33 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.55 2oxy h GLU 22 CO -0.14 0.07 0.45 -0.92 0.07 0.00 0.00 179.01 178.54 2oxy h TYR 23 N 0.00 0.85 0.00 2.06 3.20 -1.23 -3.32 116.97 118.53 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 0.33 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.31 2oxy h TYR 23 CO 0.00 0.52 -0.39 -2.67 -1.64 0.00 0.00 178.16 173.98 2oxy n TRP 24 N -4.63 0.00 -2.08 -3.82 4.27 -0.96 -4.74 117.44 105.49 2oxy n TRP 24 Ca 0.06 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.25 2oxy n TRP 24 Cb 0.04 -0.01 0.00 0.00 -1.36 0.00 0.00 31.31 29.99 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 -1.20 4.81 0.30 -0.67 2.03 -0.18 -4.77 116.55 116.88 2oxy n ASP 25 Ca 0.01 -3.00 0.16 0.00 0.52 0.00 0.00 54.79 52.48 2oxy n ASP 25 Cb 0.12 -1.54 0.93 0.00 -0.72 0.00 0.00 41.12 39.91 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 5.78 0.00 0.00 -0.67 -0.00 -1.85 -1.40 116.97 118.83 2oxy h TYR 26 Ca 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 59.20 2oxy h TYR 26 Cb 0.61 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.34 2oxy h TYR 26 CO 1.35 0.03 -0.02 0.93 -0.00 0.00 0.00 178.16 180.45 2oxy h GLU 27 N 0.00 0.00 -0.01 0.10 5.08 -1.91 -1.98 114.58 115.87 2oxy h GLU 27 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2oxy h GLU 27 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2oxy h GLU 27 CO 0.00 0.02 -0.15 0.00 -1.00 0.00 0.00 179.01 177.89 2oxy n ALA 28 N -2.14 2.87 -1.66 3.43 0.00 -0.53 -4.96 120.51 117.53 2oxy n ALA 28 Ca -0.02 -0.39 -0.46 0.00 0.00 0.00 0.00 53.44 52.57 2oxy n ALA 28 Cb 0.17 -1.18 -0.04 0.00 0.00 0.00 0.00 19.45 18.40 2oxy n ALA 28 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2oxy n LEU 29 N -0.46 2.84 -4.41 0.00 7.94 -0.74 -5.02 117.00 117.15 2oxy n LEU 29 Ca 0.15 1.11 -0.32 0.00 -1.11 0.00 0.00 56.01 55.84 2oxy n LEU 29 Cb 0.33 -1.39 -0.14 0.00 0.53 0.00 0.00 43.42 42.75 2oxy n LEU 29 CO 0.22 -0.52 -0.48 0.42 -1.11 0.00 0.00 177.39 175.92 2oxy s THR 30 N 0.40 2.77 -0.08 1.96 -4.23 -1.26 -5.11 115.64 110.10 2oxy s THR 30 Ca 0.75 -0.82 -0.04 0.00 -1.18 0.00 0.00 61.69 60.39 2oxy s THR 30 Cb -0.71 -2.07 -0.04 0.00 1.34 0.00 0.00 72.50 71.02 2oxy s THR 30 CO 0.44 0.58 0.10 -0.69 -0.54 0.00 0.00 174.62 174.51 2oxy s VAL 31 N -0.52 5.06 -0.73 2.29 1.01 -1.26 -5.04 120.40 121.21 2oxy s VAL 31 Ca 0.07 -0.04 -0.21 0.00 0.00 0.00 0.00 61.98 61.81 2oxy s VAL 31 Cb -0.11 -3.22 0.10 0.00 0.00 0.00 0.00 36.38 33.15 2oxy s VAL 31 CO 0.01 0.55 0.96 -1.10 0.00 0.00 0.00 175.10 175.52 2oxy s GLN 32 N -1.17 3.25 0.14 2.72 -0.21 -1.26 -5.04 119.66 118.10 2oxy s GLN 32 Ca 0.17 -1.24 -0.30 0.00 0.02 0.00 0.00 55.36 54.00 2oxy s GLN 32 Cb -0.12 -4.45 -0.07 0.00 1.00 0.00 0.00 33.01 29.37 2oxy s GLN 32 CO 0.06 -1.74 1.19 -1.58 -2.12 0.00 0.00 175.29 171.10 2oxy s TRP 33 N 3.30 3.45 0.00 0.91 0.52 -1.26 -4.88 118.94 120.99 2oxy s TRP 33 Ca 0.23 1.39 0.00 0.00 0.02 0.00 0.00 56.10 57.74 2oxy s TRP 33 Cb -0.15 -3.41 0.00 0.00 -1.15 0.00 0.00 33.47 28.76 2oxy s TRP 33 CO 0.03 -1.19 0.00 0.41 0.02 0.00 0.00 176.95 176.23 2oxy n GLY 34 N 2.58 -1.15 3.48 0.98 0.00 0.31 -4.99 105.19 106.40 2oxy n GLY 34 Ca 0.06 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 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 -2.77 3.20 0.38 1.61 0.41 -1.26 -4.68 118.70 115.59 2oxy s GLU 35 Ca 0.00 -0.60 0.13 0.00 -0.41 0.00 0.00 54.97 54.08 2oxy s GLU 35 Cb 0.00 -4.14 0.93 0.00 -1.78 0.00 0.00 34.13 29.14 2oxy s GLU 35 CO 0.00 -1.62 1.86 0.37 -0.49 0.00 0.00 175.26 175.38 2oxy h GLN 36 N 9.40 0.55 0.00 1.61 4.15 -1.94 -1.14 115.11 127.74 2oxy h GLN 36 Ca -0.28 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.11 2oxy h GLN 36 Cb 1.07 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.64 2oxy h GLN 36 CO 1.12 0.36 0.00 -0.25 -1.93 0.00 0.00 178.83 178.13 2oxy n ASP 37 N -4.56 0.48 0.07 -0.69 8.00 -1.26 -2.65 116.55 115.95 2oxy n ASP 37 Ca 0.19 0.65 0.12 0.00 0.71 0.00 0.00 54.79 56.45 2oxy n ASP 37 Cb 0.58 -0.74 0.46 0.00 -0.02 0.00 0.00 41.12 41.40 2oxy n ASP 37 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2oxy n ASP 38 N -2.07 0.47 -3.94 -2.24 9.92 -0.43 -4.80 116.55 113.46 2oxy n ASP 38 Ca 0.01 0.57 -0.22 0.00 -0.53 0.00 0.00 54.79 54.63 2oxy n ASP 38 Cb 0.16 -0.69 -0.16 0.00 -0.64 0.00 0.00 41.12 39.79 2oxy n ASP 38 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2oxy s TYR 39 N -3.12 1.01 0.16 1.24 2.02 -1.08 -0.59 117.35 116.98 2oxy s TYR 39 Ca 0.09 -0.33 0.11 0.00 -0.37 0.00 0.00 57.07 56.57 2oxy s TYR 39 Cb 0.12 -0.81 -0.04 0.00 -0.40 0.00 0.00 41.96 40.83 2oxy s TYR 39 CO 0.47 -0.22 -0.24 -1.21 -1.57 0.00 0.00 175.55 172.78 2oxy s GLU 40 N 0.82 1.52 -0.26 -0.62 2.02 -0.41 -4.97 118.70 116.79 2oxy s GLU 40 Ca -0.12 -1.41 -0.13 0.00 0.02 0.00 0.00 54.97 53.33 2oxy s GLU 40 Cb -0.15 -1.91 -0.04 0.00 0.10 0.00 0.00 34.13 32.13 2oxy s GLU 40 CO 0.01 0.43 0.26 0.08 0.02 0.00 0.00 175.26 176.07 2oxy s VAL 41 N -1.37 5.26 -0.27 2.63 1.01 -1.26 -0.88 120.40 125.52 2oxy s VAL 41 Ca 0.18 0.35 -0.14 0.00 0.00 0.00 0.00 61.98 62.36 2oxy s VAL 41 Cb -0.09 -3.60 -0.13 0.00 0.00 0.00 0.00 36.38 32.56 2oxy s VAL 41 CO 0.09 0.24 -0.30 0.52 0.00 0.00 0.00 175.10 175.64 2oxy n VAL 42 N 4.88 1.53 -3.60 2.92 0.31 0.07 -4.99 118.33 119.46 2oxy n VAL 42 Ca -0.12 -0.36 -0.16 0.00 -0.01 0.00 0.00 64.34 63.69 2oxy n VAL 42 Cb 0.51 -1.89 -0.06 0.00 -0.91 0.00 0.00 33.84 31.49 2oxy n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oxy s ARG 43 N -2.50 0.95 0.13 5.55 1.70 -1.12 -5.02 118.95 118.65 2oxy s ARG 43 Ca -0.38 0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 54.60 2oxy s ARG 43 Cb 0.14 0.44 -0.07 0.00 -0.57 0.00 0.00 34.95 34.89 2oxy s ARG 43 CO 0.50 -0.30 1.11 0.21 -1.08 0.00 0.00 175.30 175.74 2oxy s LYS 44 N -1.54 4.56 0.00 3.89 2.20 -1.26 -0.80 119.74 126.78 2oxy s LYS 44 Ca -0.10 1.70 0.07 0.00 -0.36 0.00 0.00 55.97 57.28 2oxy s LYS 44 Cb -0.02 -3.31 0.11 0.00 -1.51 0.00 0.00 37.83 33.10 2oxy s LYS 44 CO 0.06 -0.00 0.89 0.28 -0.36 0.00 0.00 175.35 176.21 2oxy n VAL 45 N 2.86 0.34 -0.98 4.02 0.31 -0.22 -4.86 118.33 119.79 2oxy n VAL 45 Ca 0.04 -0.67 0.13 0.00 -0.01 0.00 0.00 64.34 63.83 2oxy n VAL 45 Cb 0.47 0.94 -0.04 0.00 -0.91 0.00 0.00 33.84 34.29 2oxy n VAL 45 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2oxy n GLY 46 N 0.35 -2.12 3.32 2.92 0.00 -0.49 -4.88 105.19 104.29 2oxy n GLY 46 Ca 0.06 -1.25 -0.14 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.42 0.65 0.00 1.61 3.03 -1.26 -3.76 118.95 116.79 2oxy s ARG 47 Ca 0.00 0.26 0.00 0.00 2.03 0.00 0.00 55.73 58.02 2oxy s ARG 47 Cb 0.00 0.30 0.00 0.00 -1.03 0.00 0.00 34.95 34.22 2oxy s ARG 47 CO 0.00 -0.14 0.00 0.41 -1.13 0.00 0.00 175.30 174.44 2oxy n GLY 48 N 1.98 3.78 0.80 3.88 0.00 0.19 -4.91 105.19 110.92 2oxy n GLY 48 Ca -0.17 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 43.98 2oxy n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oxy n LYS 49 N 0.00 0.00 -3.23 1.61 5.02 -1.26 -4.78 118.16 115.52 2oxy n LYS 49 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2oxy n LYS 49 Cb 0.00 -0.40 -0.03 0.00 -0.02 0.00 0.00 35.03 34.58 2oxy n LYS 49 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 2oxy n TYR 50 N -2.16 3.05 -3.61 2.13 0.18 -1.26 -4.94 117.16 110.55 2oxy n TYR 50 Ca 0.00 -3.35 -0.05 0.00 1.88 0.00 0.00 57.90 56.39 2oxy n TYR 50 Cb 0.13 -1.01 -0.02 0.00 -0.38 0.00 0.00 39.34 38.07 2oxy n TYR 50 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 2oxy s SER 51 N -1.78 -0.22 0.03 9.48 1.04 -1.26 -4.08 113.70 116.90 2oxy s SER 51 Ca 0.34 -0.14 0.04 0.00 0.48 0.00 0.00 55.95 56.67 2oxy s SER 51 Cb 0.07 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 2oxy s SER 51 CO 0.04 -0.59 -0.12 -1.61 0.98 0.00 0.00 173.24 171.93 2oxy s GLU 52 N -2.95 0.86 -0.03 4.02 2.02 -1.01 0.55 118.70 122.16 2oxy s GLU 52 Ca 0.09 -0.65 0.06 0.00 0.02 0.00 0.00 54.97 54.49 2oxy s GLU 52 Cb -0.00 -0.84 -0.02 0.00 0.10 0.00 0.00 34.13 33.37 2oxy s GLU 52 CO -0.04 0.21 -0.20 0.08 0.02 0.00 0.00 175.26 175.33 2oxy s VAL 53 N -0.73 2.57 0.03 2.63 1.01 -1.25 -1.13 120.40 123.53 2oxy s VAL 53 Ca 0.01 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.08 2oxy s VAL 53 Cb -0.07 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 2oxy s VAL 53 CO 0.01 0.58 -0.06 -0.36 0.00 0.00 0.00 175.10 175.26 2oxy s PHE 54 N -0.68 0.55 0.23 5.22 0.08 -0.51 -1.06 117.98 121.81 2oxy s PHE 54 Ca 0.11 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.48 2oxy s PHE 54 Cb -0.10 -0.34 -0.09 0.00 -0.57 0.00 0.00 43.02 41.92 2oxy s PHE 54 CO -0.00 -0.08 1.20 -2.00 -0.10 0.00 0.00 175.22 174.24 2oxy s GLU 55 N -1.16 4.50 0.09 0.44 2.12 0.02 -0.84 118.70 123.87 2oxy s GLU 55 Ca -0.07 1.93 0.01 0.00 0.36 0.00 0.00 54.97 57.19 2oxy s GLU 55 Cb -0.08 -3.20 -0.01 0.00 0.26 0.00 0.00 34.13 31.11 2oxy s GLU 55 CO 0.00 -0.04 0.05 0.41 -0.54 0.00 0.00 175.26 175.14 2oxy n GLY 56 N 1.73 3.84 2.87 -1.50 0.00 0.13 -0.75 105.19 111.52 2oxy n GLY 56 Ca 0.02 -1.86 -0.13 0.00 0.00 0.00 0.00 46.02 44.06 2oxy n GLY 56 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2oxy s ILE 57 N -2.08 -0.01 -0.38 -0.61 1.10 -0.06 -1.72 121.20 117.44 2oxy s ILE 57 Ca 0.07 0.05 -0.25 0.00 -0.51 0.00 0.00 60.65 60.01 2oxy s ILE 57 Cb 0.00 -0.05 0.01 0.00 0.15 0.00 0.00 42.46 42.58 2oxy s ILE 57 CO 0.05 0.02 0.88 0.21 -2.11 0.00 0.00 174.94 173.98 2oxy s ASN 58 N 0.24 6.62 0.00 4.50 3.04 -0.11 -1.29 114.94 127.93 2oxy s ASN 58 Ca -0.02 0.46 0.22 0.00 0.04 0.00 0.00 52.86 53.56 2oxy s ASN 58 Cb -0.03 -2.44 1.22 0.00 -1.54 0.00 0.00 41.25 38.46 2oxy s ASN 58 CO -0.01 -0.83 1.68 1.33 -3.04 0.00 0.00 177.10 176.23 2oxy n VAL 59 N 5.95 0.12 -0.07 -5.21 0.24 0.24 -0.86 118.33 118.74 2oxy n VAL 59 Ca 0.06 0.03 -0.08 0.00 -2.04 0.00 0.00 64.34 62.31 2oxy n VAL 59 Cb 0.48 -0.69 -0.05 0.00 -1.47 0.00 0.00 33.84 32.11 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 -0.04 -1.34 4.21 -1.93 -3.42 115.58 113.07 2oxy h ASN 60 Ca 0.00 -0.28 0.00 0.00 1.21 0.00 0.00 56.30 57.23 2oxy h ASN 60 Cb 0.07 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.27 2oxy h ASN 60 CO 0.00 0.85 0.00 -0.46 -1.29 0.00 0.00 177.43 176.53 2oxy n ASN 61 N -4.64 2.50 -0.94 5.81 6.94 -1.19 -4.99 115.26 118.76 2oxy n ASN 61 Ca -0.10 -1.74 -0.12 0.00 -0.02 0.00 0.00 54.58 52.60 2oxy n ASN 61 Cb 0.29 -0.01 -0.05 0.00 -2.36 0.00 0.00 39.78 37.65 2oxy n ASN 61 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2oxy n ASN 62 N 1.00 -5.57 -4.79 0.53 3.02 -0.04 -4.99 115.26 104.42 2oxy n ASN 62 Ca 0.11 0.30 -0.36 0.00 -0.03 0.00 0.00 54.58 54.59 2oxy n ASN 62 Cb 0.44 -4.21 -0.05 0.00 -0.61 0.00 0.00 39.78 35.35 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 -3.00 4.33 0.48 3.52 0.41 -1.24 -4.77 118.70 118.43 2oxy s GLU 63 Ca 0.00 1.38 -0.22 0.00 -0.41 0.00 0.00 54.97 55.72 2oxy s GLU 63 Cb 0.00 -2.58 -0.07 0.00 -1.78 0.00 0.00 34.13 29.69 2oxy s GLU 63 CO 0.00 0.03 1.15 0.15 -0.49 0.00 0.00 175.26 176.11 2oxy s LYS 64 N -2.43 3.68 0.28 1.61 1.02 -1.26 -0.94 119.74 121.70 2oxy s LYS 64 Ca 0.56 1.73 0.01 0.00 0.02 0.00 0.00 55.97 58.28 2oxy s LYS 64 Cb -0.19 -2.32 -0.03 0.00 -0.52 0.00 0.00 37.83 34.78 2oxy s LYS 64 CO 0.24 -0.61 0.27 0.00 -0.92 0.00 0.00 175.35 174.34 2oxy s ILE 66 N -3.68 2.56 -0.14 0.00 -1.09 -0.37 -0.69 121.20 117.78 2oxy s ILE 66 Ca 0.37 -0.90 0.00 0.00 -2.23 0.00 0.00 60.65 57.89 2oxy s ILE 66 Cb 0.03 -1.96 0.02 0.00 -1.58 0.00 0.00 42.46 38.97 2oxy s ILE 66 CO 0.19 0.58 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.71 2oxy s ILE 67 N -0.47 1.52 -0.28 2.92 1.01 -0.02 -0.14 121.20 125.74 2oxy s ILE 67 Ca 0.06 -0.61 -0.05 0.00 0.00 0.00 0.00 60.65 60.05 2oxy s ILE 67 Cb -0.12 -1.43 0.02 0.00 0.01 0.00 0.00 42.46 40.94 2oxy s ILE 67 CO 0.01 0.45 0.04 -0.75 0.00 0.00 0.00 174.94 174.69 2oxy s LYS 68 N 1.45 2.99 -0.28 2.79 2.20 -0.02 -1.42 119.74 127.44 2oxy s LYS 68 Ca 0.04 -0.91 -0.12 0.00 -0.36 0.00 0.00 55.97 54.62 2oxy s LYS 68 Cb -0.13 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 2oxy s LYS 68 CO -0.10 -0.44 0.24 0.42 -0.36 0.00 0.00 175.35 175.11 2oxy s ILE 69 N 1.44 5.27 -0.61 5.43 1.01 -0.29 -0.76 121.20 132.69 2oxy s ILE 69 Ca 0.02 0.22 -0.22 0.00 0.00 0.00 0.00 60.65 60.66 2oxy s ILE 69 Cb -0.17 -3.59 0.06 0.00 0.01 0.00 0.00 42.46 38.77 2oxy s ILE 69 CO 0.00 0.20 0.91 -0.76 0.00 0.00 0.00 174.94 175.29 2oxy s LEU 70 N 1.83 4.43 0.38 2.97 1.43 -0.50 -2.40 118.68 126.83 2oxy s LEU 70 Ca 0.09 -0.86 -0.24 0.00 -1.03 0.00 0.00 54.13 52.09 2oxy s LEU 70 Cb -0.16 -2.51 -0.13 0.00 0.03 0.00 0.00 46.19 43.42 2oxy s LEU 70 CO 0.11 -1.32 0.75 0.29 0.23 0.00 0.00 176.35 176.41 2oxy n LYS 71 N 7.43 0.87 -2.60 1.70 5.02 -1.26 -4.55 118.16 124.77 2oxy n LYS 71 Ca -0.03 0.31 -0.36 0.00 -2.02 0.00 0.00 58.31 56.21 2oxy n LYS 71 Cb 0.46 -1.67 -0.05 0.00 -0.02 0.00 0.00 35.03 33.75 2oxy n LYS 71 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 2oxy s PRO 72 N -1.65 4.26 -0.15 1.97 0.02 -1.26 -4.79 135.00 133.40 2oxy s PRO 72 Ca 0.63 1.47 -0.30 0.00 0.02 0.00 0.00 61.00 62.82 2oxy s PRO 72 Cb -0.63 -2.59 0.11 0.00 0.02 0.00 0.00 34.50 31.41 2oxy s PRO 72 CO 0.58 -0.05 0.91 0.08 -0.33 0.00 0.00 177.00 178.19 2oxy s VAL 73 N -1.66 0.00 -0.13 3.83 1.01 -1.26 -5.05 120.40 117.14 2oxy s VAL 73 Ca 0.56 0.00 -0.26 0.00 0.00 0.00 0.00 61.98 62.28 2oxy s VAL 73 Cb -0.21 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 2oxy s VAL 73 CO 0.27 0.00 0.83 -0.75 0.00 0.00 0.00 175.10 175.45 2oxy s LYS 74 N -0.95 4.36 0.37 2.72 2.20 -1.26 -4.87 119.74 122.32 2oxy s LYS 74 Ca -0.04 1.06 0.16 0.00 -0.36 0.00 0.00 55.97 56.80 2oxy s LYS 74 Cb -0.01 -3.53 1.06 0.00 -1.51 0.00 0.00 37.83 33.83 2oxy s LYS 74 CO 0.03 -0.22 1.75 -0.22 -0.36 0.00 0.00 175.35 176.33 2oxy h LYS 75 N 7.14 0.42 -0.22 4.03 1.63 -2.00 -2.39 116.57 125.18 2oxy h LYS 75 Ca -0.33 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.44 2oxy h LYS 75 Cb 1.15 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 2oxy h LYS 75 CO 0.81 0.28 0.10 -0.22 -3.45 0.00 0.00 179.45 176.97 2oxy h LYS 76 N 0.43 0.32 -0.05 1.90 3.64 -1.99 -1.60 116.57 119.23 2oxy h LYS 76 Ca 0.63 -0.05 -0.18 0.00 -1.27 0.00 0.00 60.65 59.77 2oxy h LYS 76 Cb 1.49 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.24 2oxy h LYS 76 CO -0.37 0.35 -0.76 0.87 -2.27 0.00 0.00 179.45 177.27 2oxy h LYS 77 N 0.22 0.32 -0.07 1.90 1.57 -1.85 -1.30 116.57 117.37 2oxy h LYS 77 Ca 0.08 -0.28 0.02 0.00 -1.87 0.00 0.00 60.65 58.60 2oxy h LYS 77 Cb 0.13 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 2oxy h LYS 77 CO -0.01 0.94 -0.06 0.82 -0.57 0.00 0.00 179.45 180.57 2oxy h ILE 78 N 0.21 0.83 -0.52 1.86 2.04 -1.41 -1.74 117.51 118.79 2oxy h ILE 78 Ca -0.03 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.86 2oxy h ILE 78 Cb 1.33 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 38.21 2oxy h ILE 78 CO 0.12 0.00 0.30 0.11 0.00 0.00 0.00 178.15 178.68 2oxy h LYS 79 N -0.07 0.57 -0.12 2.37 1.57 -1.21 -0.72 116.57 118.97 2oxy h LYS 79 Ca 0.05 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2oxy h LYS 79 Cb 0.13 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 2oxy h LYS 79 CO -0.11 0.38 -0.12 -0.09 -0.57 0.00 0.00 179.45 178.94 2oxy h ARG 80 N 0.59 -0.14 -0.31 3.15 2.43 -1.07 -0.02 114.38 119.01 2oxy h ARG 80 Ca 0.21 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 2oxy h ARG 80 Cb 0.05 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2oxy h ARG 80 CO -0.11 -0.09 0.17 1.49 -1.51 0.00 0.00 179.97 179.92 2oxy h GLU 81 N -0.14 0.43 0.16 0.20 4.81 -1.04 -1.63 114.58 117.38 2oxy h GLU 81 Ca 0.08 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2oxy h GLU 81 Cb 0.27 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2oxy h GLU 81 CO -0.21 0.37 -0.08 0.82 -0.73 0.00 0.00 179.01 179.19 2oxy h ILE 82 N 0.38 0.90 -0.63 2.32 2.04 -0.94 -1.78 117.51 119.79 2oxy h ILE 82 Ca 0.11 -0.24 0.06 0.00 1.00 0.00 0.00 64.86 65.78 2oxy h ILE 82 Cb 0.06 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 2oxy h ILE 82 CO -0.02 0.06 0.35 0.50 0.00 0.00 0.00 178.15 179.04 2oxy h LYS 83 N -0.33 0.63 -0.06 2.37 1.63 -0.93 -0.51 116.57 119.38 2oxy h LYS 83 Ca -0.02 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 2oxy h LYS 83 Cb 0.26 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 31.75 2oxy h LYS 83 CO 0.04 0.41 0.03 0.82 -3.45 0.00 0.00 179.45 177.30 2oxy h ILE 84 N 0.65 1.09 -0.66 2.00 2.04 -1.25 0.05 117.51 121.41 2oxy h ILE 84 Ca 0.28 -0.25 0.09 0.00 1.00 0.00 0.00 64.86 65.99 2oxy h ILE 84 Cb 0.17 1.14 -0.07 0.00 -0.74 0.00 0.00 36.82 37.33 2oxy h ILE 84 CO -0.18 0.07 0.31 -0.07 0.00 0.00 0.00 178.15 178.28 2oxy h LEU 85 N -0.00 0.39 -0.53 1.44 3.38 -1.11 -1.16 115.31 117.72 2oxy h LEU 85 Ca 0.02 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2oxy h LEU 85 Cb 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2oxy h LEU 85 CO -0.00 0.23 0.27 1.56 0.09 0.00 0.00 178.44 180.59 2oxy h GLN 86 N 0.54 0.75 -0.24 1.13 4.20 -0.82 0.19 115.11 120.85 2oxy h GLN 86 Ca 0.33 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.90 2oxy h GLN 86 Cb 0.35 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 2oxy h GLN 86 CO -0.27 0.60 -0.01 -0.91 -0.67 0.00 0.00 178.83 177.57 2oxy h ASN 87 N 0.71 0.33 0.17 1.46 2.35 -0.60 -3.10 115.58 116.90 2oxy h ASN 87 Ca 0.18 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2oxy h ASN 87 Cb 0.08 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2oxy h ASN 87 CO -0.03 0.41 -1.18 0.18 -1.65 0.00 0.00 177.43 175.16 2oxy n LEU 88 N -4.33 0.65 -4.66 1.61 4.77 -0.47 -4.99 117.00 109.58 2oxy n LEU 88 Ca 0.00 -0.22 -0.46 0.00 -0.03 0.00 0.00 56.01 55.30 2oxy n LEU 88 Cb 0.21 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.22 2oxy n LEU 88 CO 0.37 0.13 1.11 0.00 -1.33 0.00 0.00 177.39 177.67 2oxy n GLY 90 N 3.03 3.27 3.76 0.00 0.00 -1.26 -5.06 105.19 108.92 2oxy n GLY 90 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.74 2.52 0.17 -0.02 0.00 -0.45 -4.93 107.32 101.88 2oxy s GLY 91 Ca 0.00 0.85 -0.32 0.00 0.00 0.00 0.00 44.72 45.25 2oxy s GLY 91 CO 0.00 1.23 1.61 2.56 0.00 0.00 0.00 173.10 178.50 2oxy s PRO 92 N -3.59 4.19 -1.98 2.90 0.04 -1.26 -2.90 135.00 132.40 2oxy s PRO 92 Ca 0.74 2.41 0.00 0.00 0.04 0.00 0.00 61.00 64.19 2oxy s PRO 92 Cb -0.27 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.09 2oxy s PRO 92 CO 0.36 -0.65 0.00 0.09 0.04 0.00 0.00 177.00 176.84 2oxy n ASN 93 N 4.13 -5.26 -4.71 6.66 3.02 -1.26 -3.63 115.26 114.21 2oxy n ASN 93 Ca 0.14 0.37 -0.37 0.00 -0.03 0.00 0.00 54.58 54.70 2oxy n ASN 93 Cb 0.38 -4.60 -0.07 0.00 -0.61 0.00 0.00 39.78 34.88 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 -2.73 5.27 0.26 2.41 -1.09 -1.14 -1.54 121.20 122.64 2oxy s ILE 94 Ca 0.00 0.62 -0.30 0.00 -2.23 0.00 0.00 60.65 58.74 2oxy s ILE 94 Cb 0.00 -3.67 -0.14 0.00 -1.58 0.00 0.00 42.46 37.07 2oxy s ILE 94 CO 0.00 0.34 1.23 0.55 -1.23 0.00 0.00 174.94 175.83 2oxy n VAL 95 N 3.84 1.47 -3.28 2.92 3.14 -0.98 -4.80 118.33 120.64 2oxy n VAL 95 Ca -0.10 -0.37 -0.40 0.00 -2.96 0.00 0.00 64.34 60.51 2oxy n VAL 95 Cb 0.52 -1.25 -0.08 0.00 -1.06 0.00 0.00 33.84 31.97 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 -1.05 4.04 -0.63 1.45 2.20 -1.26 -4.84 119.74 119.64 2oxy s LYS 96 Ca 0.63 0.23 -0.28 0.00 -0.36 0.00 0.00 55.97 56.20 2oxy s LYS 96 Cb -0.68 -3.66 0.02 0.00 -1.51 0.00 0.00 37.83 32.01 2oxy s LYS 96 CO 0.56 -0.34 1.29 -1.17 -0.36 0.00 0.00 175.35 175.32 2oxy s LEU 97 N 2.25 3.34 0.07 5.43 2.96 -1.26 -1.75 118.68 129.72 2oxy s LEU 97 Ca 0.19 -0.03 0.07 0.00 -0.22 0.00 0.00 54.13 54.15 2oxy s LEU 97 Cb -0.16 -2.93 -0.22 0.00 0.50 0.00 0.00 46.19 43.38 2oxy s LEU 97 CO 0.09 -1.67 1.08 -0.07 -1.32 0.00 0.00 176.35 174.46 2oxy h LEU 98 N 12.66 0.06 -7.38 -0.68 3.38 -0.42 -3.49 115.31 119.44 2oxy h LEU 98 Ca -0.26 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 57.66 2oxy h LEU 98 Cb 1.06 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.70 2oxy h LEU 98 CO 1.22 1.06 0.23 -0.62 0.09 0.00 0.00 178.44 180.42 2oxy s ASP 99 N -6.60 -0.44 -0.07 -0.43 -1.08 -1.02 -5.02 116.67 102.01 2oxy s ASP 99 Ca -0.02 -0.23 -0.03 0.00 -0.52 0.00 0.00 52.55 51.76 2oxy s ASP 99 Cb 0.09 0.64 0.04 0.00 -1.46 0.00 0.00 42.92 42.23 2oxy s ASP 99 CO 0.83 -1.10 0.07 -0.63 0.52 0.00 0.00 175.17 174.86 2oxy s ILE 100 N -3.78 -0.11 0.28 4.11 1.01 -1.26 -1.12 121.20 120.33 2oxy s ILE 100 Ca 0.05 0.28 0.02 0.00 0.00 0.00 0.00 60.65 61.00 2oxy s ILE 100 Cb -0.03 -0.25 -0.05 0.00 0.01 0.00 0.00 42.46 42.14 2oxy s ILE 100 CO -0.05 0.07 0.11 0.68 0.00 0.00 0.00 174.94 175.74 2oxy s VAL 101 N 2.16 0.55 0.09 2.92 -7.23 -0.79 -0.53 120.40 117.58 2oxy s VAL 101 Ca 0.04 -2.00 -0.23 0.00 -1.81 0.00 0.00 61.98 57.98 2oxy s VAL 101 Cb -0.13 -2.61 0.06 0.00 0.56 0.00 0.00 36.38 34.26 2oxy s VAL 101 CO -0.04 0.00 0.57 0.00 -0.31 0.00 0.00 175.10 175.31 2oxy s ARG 102 N -3.97 1.16 0.08 4.82 1.70 -1.26 -0.85 118.95 120.62 2oxy s ARG 102 Ca 0.37 -0.32 -0.31 0.00 -0.47 0.00 0.00 55.73 55.00 2oxy s ARG 102 Cb 0.07 0.53 -0.08 0.00 -0.57 0.00 0.00 34.95 34.90 2oxy s ARG 102 CO 0.15 -0.46 1.58 0.34 -1.08 0.00 0.00 175.30 175.83 2oxy s ASP 103 N -2.31 6.65 0.55 -2.89 -1.08 -0.62 -4.68 116.67 112.29 2oxy s ASP 103 Ca -0.02 2.44 0.24 0.00 -0.52 0.00 0.00 52.55 54.68 2oxy s ASP 103 Cb -0.00 -2.57 1.46 0.00 -1.46 0.00 0.00 42.92 40.35 2oxy s ASP 103 CO -0.06 -0.83 2.09 1.56 0.52 0.00 0.00 175.17 178.44 2oxy h GLN 104 N 7.88 0.00 0.00 4.34 4.20 -1.96 0.05 115.11 129.62 2oxy h GLN 104 Ca -0.42 0.00 -0.41 0.00 0.06 0.00 0.00 58.65 57.88 2oxy h GLN 104 Cb 1.20 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.91 2oxy h GLN 104 CO 0.92 0.00 -2.49 0.72 -0.67 0.00 0.00 178.83 177.31 2oxy n HIS 105 N -4.22 0.00 0.26 2.96 8.25 -1.26 -4.51 115.22 116.70 2oxy n HIS 105 Ca 0.03 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.60 2oxy n HIS 105 Cb 0.33 -0.99 0.07 0.00 1.12 0.00 0.00 29.99 30.52 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 -0.31 0.00 -2.73 0.41 4.64 -1.98 -3.48 113.55 110.09 2oxy h SER 106 Ca -0.61 -0.06 -0.07 0.00 -0.47 0.00 0.00 61.79 60.57 2oxy h SER 106 Cb 1.80 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.87 2oxy h SER 106 CO -0.20 0.03 -0.07 0.29 -0.87 0.00 0.00 176.83 176.01 2oxy n LYS 107 N -2.56 -1.62 0.00 4.77 4.76 0.01 -4.97 118.16 118.54 2oxy n LYS 107 Ca 0.01 0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 2oxy n LYS 107 Cb 0.51 -4.41 0.00 0.00 -1.84 0.00 0.00 35.03 29.29 2oxy n LYS 107 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2oxy n THR 108 N -1.72 0.00 -3.18 -0.18 -1.04 -1.26 -4.69 114.28 102.20 2oxy n THR 108 Ca -0.04 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.64 2oxy n THR 108 Cb 0.25 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.70 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 0.00 4.04 -0.10 -2.82 0.04 -1.26 -1.60 135.00 133.31 2oxy s PRO 109 Ca 0.00 0.65 0.02 0.00 0.04 0.00 0.00 61.00 61.72 2oxy s PRO 109 Cb 0.00 -2.61 0.01 0.00 0.04 0.00 0.00 34.50 31.94 2oxy s PRO 109 CO 0.00 0.26 -0.16 -1.12 0.04 0.00 0.00 177.00 176.03 2oxy s SER 110 N -2.08 2.36 -0.01 6.66 0.01 -0.03 -1.41 113.70 119.21 2oxy s SER 110 Ca 0.49 -0.41 -0.14 0.00 1.31 0.00 0.00 55.95 57.20 2oxy s SER 110 Cb -0.12 -1.07 -0.06 0.00 0.21 0.00 0.00 66.02 64.98 2oxy s SER 110 CO 0.19 0.04 0.39 -0.76 0.41 0.00 0.00 173.24 173.51 2oxy s LEU 111 N 0.80 4.47 -0.22 2.44 1.43 0.06 -1.88 118.68 125.79 2oxy s LEU 111 Ca -0.11 0.93 -0.04 0.00 -1.03 0.00 0.00 54.13 53.89 2oxy s LEU 111 Cb -0.16 -2.55 -0.01 0.00 0.03 0.00 0.00 46.19 43.51 2oxy s LEU 111 CO 0.02 0.33 -0.05 -0.63 0.23 0.00 0.00 176.35 176.25 2oxy s ILE 112 N -1.08 3.30 0.14 -0.59 -1.09 -0.27 -0.84 121.20 120.76 2oxy s ILE 112 Ca 0.23 -0.53 0.07 0.00 -2.23 0.00 0.00 60.65 58.20 2oxy s ILE 112 Cb -0.16 -2.50 -0.04 0.00 -1.58 0.00 0.00 42.46 38.17 2oxy s ILE 112 CO 0.13 0.42 -0.06 -0.36 -1.23 0.00 0.00 174.94 173.84 2oxy s PHE 113 N 1.47 2.77 0.29 3.97 0.08 0.81 0.37 117.98 127.73 2oxy s PHE 113 Ca 0.06 -0.15 -0.29 0.00 0.12 0.00 0.00 56.93 56.67 2oxy s PHE 113 Cb -0.14 -1.40 -0.14 0.00 -0.57 0.00 0.00 43.02 40.77 2oxy s PHE 113 CO -0.04 0.48 1.10 -0.85 -0.10 0.00 0.00 175.22 175.81 2oxy n GLU 114 N 0.32 1.52 -2.80 0.44 0.28 -0.72 -1.24 120.64 118.45 2oxy n GLU 114 Ca -0.12 0.54 -0.40 0.00 -0.16 0.00 0.00 57.16 57.02 2oxy n GLU 114 Cb 0.54 -1.97 -0.05 0.00 1.43 0.00 0.00 31.44 31.38 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 -0.93 3.87 -0.10 -1.84 5.04 -1.26 -4.48 117.35 117.65 2oxy s TYR 115 Ca 0.60 1.78 0.03 0.00 -2.44 0.00 0.00 57.07 57.04 2oxy s TYR 115 Cb -0.69 -2.97 0.01 0.00 0.35 0.00 0.00 41.96 38.66 2oxy s TYR 115 CO 0.59 0.33 -0.20 0.08 -1.34 0.00 0.00 175.55 175.02 2oxy s VAL 116 N -0.53 1.78 -1.07 3.14 1.01 -1.26 -5.04 120.40 118.44 2oxy s VAL 116 Ca 0.43 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 2oxy s VAL 116 Cb -0.24 -1.57 -0.07 0.00 0.00 0.00 0.00 36.38 34.50 2oxy s VAL 116 CO 0.29 0.50 2.06 -3.20 0.00 0.00 0.00 175.10 174.75 2oxy n ASN 117 N 3.78 3.14 -4.77 3.32 5.15 -1.26 -4.97 115.26 119.65 2oxy n ASN 117 Ca -0.20 -2.74 -0.38 0.00 -0.60 0.00 0.00 54.58 50.65 2oxy n ASN 117 Cb 0.52 -1.35 -0.01 0.00 -0.53 0.00 0.00 39.78 38.41 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 4.21 6.36 -0.18 1.20 2.47 -1.26 -4.13 114.94 123.61 2oxy s ASN 118 Ca 0.53 2.41 -0.04 0.00 0.42 0.00 0.00 52.86 56.18 2oxy s ASN 118 Cb 0.14 -2.62 -0.02 0.00 -1.45 0.00 0.00 41.25 37.30 2oxy s ASN 118 CO 0.03 -0.79 -0.02 -0.89 -3.72 0.00 0.00 177.10 171.70 2oxy s THR 119 N -1.41 3.83 0.43 -5.21 2.01 -1.08 -4.99 115.64 109.22 2oxy s THR 119 Ca 0.59 -0.36 -0.25 0.00 0.31 0.00 0.00 61.69 61.98 2oxy s THR 119 Cb -0.32 -2.71 -0.10 0.00 0.01 0.00 0.00 72.50 69.39 2oxy s THR 119 CO 0.40 0.46 1.19 -0.67 -0.69 0.00 0.00 174.62 175.31 2oxy n ASP 120 N 3.99 2.14 0.18 3.53 2.03 -1.26 -4.59 116.55 122.57 2oxy n ASP 120 Ca -0.17 1.07 0.07 0.00 0.52 0.00 0.00 54.79 56.28 2oxy n ASP 120 Cb 0.52 -1.46 0.57 0.00 -0.72 0.00 0.00 41.12 40.03 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 1.85 0.15 0.00 -0.67 -0.00 -1.93 -0.05 116.94 116.29 2oxy h PHE 121 Ca -0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 57.47 2oxy h PHE 121 Cb 1.31 -0.05 -0.00 0.00 -0.00 0.00 0.00 35.95 37.20 2oxy h PHE 121 CO 0.46 0.11 -0.16 0.87 -0.00 0.00 0.00 178.31 179.59 2oxy h LYS 122 N 0.16 0.00 0.07 6.09 1.57 -1.99 0.90 116.57 123.37 2oxy h LYS 122 Ca 0.04 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.51 2oxy h LYS 122 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2oxy h LYS 122 CO -0.01 0.16 -1.68 0.28 -0.57 0.00 0.00 179.45 177.63 2oxy n VAL 123 N -3.77 1.68 -0.03 0.50 0.31 -0.45 -4.58 118.33 111.99 2oxy n VAL 123 Ca -0.02 -0.38 -0.13 0.00 -0.01 0.00 0.00 64.34 63.80 2oxy n VAL 123 Cb 0.27 -1.87 -0.11 0.00 -0.91 0.00 0.00 33.84 31.22 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 -0.40 -0.00 -0.68 7.52 5.85 -0.82 -3.36 115.31 123.42 2oxy h LEU 124 Ca -0.39 -0.62 0.05 0.00 0.84 0.00 0.00 57.88 57.76 2oxy h LEU 124 Cb 1.72 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.70 2oxy h LEU 124 CO -0.04 0.62 0.39 1.88 -0.34 0.00 0.00 178.44 180.95 2oxy h TYR 125 N -0.64 0.72 -0.24 1.25 -1.99 -1.06 -0.94 116.97 114.08 2oxy h TYR 125 Ca -0.00 0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.82 2oxy h TYR 125 Cb 0.63 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 39.13 2oxy h TYR 125 CO 0.15 0.36 0.37 -1.35 -0.00 0.00 0.00 178.16 177.68 2oxy h PRO 126 N 0.72 0.00 0.00 4.88 0.11 -1.78 -2.00 132.00 133.94 2oxy h PRO 126 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 2oxy h PRO 126 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 2oxy h PRO 126 CO -0.17 0.00 -0.45 0.25 -0.21 0.00 0.00 178.00 177.42 2oxy n THR 127 N -3.45 0.38 -2.29 -1.15 -2.24 -0.36 -4.96 114.28 100.21 2oxy n THR 127 Ca 0.03 -0.25 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 2oxy n THR 127 Cb 0.49 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 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 -4.17 4.47 0.71 3.22 1.43 -0.75 -5.05 118.68 118.52 2oxy s LEU 128 Ca 0.08 2.43 -0.06 0.00 -1.03 0.00 0.00 54.13 55.54 2oxy s LEU 128 Cb 0.14 -3.63 0.07 0.00 0.03 0.00 0.00 46.19 42.80 2oxy s LEU 128 CO 0.68 -0.39 1.01 0.42 0.23 0.00 0.00 176.35 178.30 2oxy s THR 129 N -0.68 2.28 0.18 5.49 -4.23 -1.26 -4.90 115.64 112.52 2oxy s THR 129 Ca 0.50 -0.30 -0.18 0.00 -1.18 0.00 0.00 61.69 60.52 2oxy s THR 129 Cb -0.36 -2.98 0.14 0.00 1.34 0.00 0.00 72.50 70.64 2oxy s THR 129 CO 0.43 0.00 1.62 -0.78 -0.54 0.00 0.00 174.62 175.35 2oxy h ASP 130 N -0.59 -0.82 -0.69 3.99 3.58 -1.93 -2.14 116.42 117.82 2oxy h ASP 130 Ca -0.44 0.19 -0.05 0.00 0.42 0.00 0.00 57.03 57.15 2oxy h ASP 130 Cb 1.31 0.44 -0.03 0.00 1.72 0.00 0.00 39.33 42.77 2oxy h ASP 130 CO 0.58 -0.26 0.24 0.22 -2.88 0.00 0.00 179.24 177.14 2oxy h TYR 131 N -0.12 1.09 -0.73 0.28 3.20 -1.94 -2.80 116.97 115.94 2oxy h TYR 131 Ca 0.23 -0.10 0.11 0.00 3.14 0.00 0.00 58.73 62.11 2oxy h TYR 131 Cb 0.49 -0.32 -0.08 0.00 1.54 0.00 0.00 36.73 38.36 2oxy h TYR 131 CO -0.52 0.86 0.34 -0.44 -1.64 0.00 0.00 178.16 176.77 2oxy h ASP 132 N 1.00 0.41 -0.11 -2.11 3.32 -1.82 0.13 116.42 117.24 2oxy h ASP 132 Ca 0.23 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 2oxy h ASP 132 Cb 0.27 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2oxy h ASP 132 CO -0.01 0.21 0.00 0.40 -1.72 0.00 0.00 179.24 178.12 2oxy h ILE 133 N 0.55 1.24 -0.20 0.35 2.04 -1.22 -1.19 117.51 119.09 2oxy h ILE 133 Ca 0.38 -0.78 0.06 0.00 1.00 0.00 0.00 64.86 65.51 2oxy h ILE 133 Cb 0.47 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 38.03 2oxy h ILE 133 CO -0.32 0.22 -0.23 0.03 0.00 0.00 0.00 178.15 177.85 2oxy h ARG 134 N -0.07 -0.25 -0.21 2.37 3.08 -1.22 -0.89 114.38 117.19 2oxy h ARG 134 Ca 0.03 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.15 2oxy h ARG 134 Cb 0.34 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.40 2oxy h ARG 134 CO 0.00 -0.17 -0.10 -0.92 -1.07 0.00 0.00 179.97 177.71 2oxy h TYR 135 N -0.26 -0.25 -0.01 3.04 3.20 -0.83 -1.81 116.97 120.06 2oxy h TYR 135 Ca 0.12 0.02 -0.24 0.00 3.14 0.00 0.00 58.73 61.77 2oxy h TYR 135 Cb 0.45 0.14 0.01 0.00 1.54 0.00 0.00 36.73 38.87 2oxy h TYR 135 CO -0.37 -0.16 -0.98 1.88 -1.64 0.00 0.00 178.16 176.90 2oxy h TYR 136 N -0.08 0.80 -0.56 -3.82 0.05 -1.08 -1.62 116.97 110.67 2oxy h TYR 136 Ca 0.12 -0.43 -0.03 0.00 0.05 0.00 0.00 58.73 58.43 2oxy h TYR 136 Cb 0.25 -0.09 -0.03 0.00 1.01 0.00 0.00 36.73 37.87 2oxy h TYR 136 CO -0.27 1.26 0.21 0.82 -1.05 0.00 0.00 178.16 179.13 2oxy h ILE 137 N 0.31 1.21 -0.45 -2.88 1.08 -1.14 -0.75 117.51 114.88 2oxy h ILE 137 Ca -0.10 -0.66 -0.03 0.00 -0.39 0.00 0.00 64.86 63.68 2oxy h ILE 137 Cb 1.62 0.55 -0.02 0.00 -3.07 0.00 0.00 36.82 35.90 2oxy h ILE 137 CO 0.18 0.26 0.17 0.22 -0.69 0.00 0.00 178.15 178.28 2oxy h TYR 138 N 0.80 0.69 -0.61 1.37 3.20 -1.13 -0.02 116.97 121.27 2oxy h TYR 138 Ca 0.19 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 62.02 2oxy h TYR 138 Cb 0.18 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.20 2oxy h TYR 138 CO 0.01 0.61 0.38 0.93 -1.64 0.00 0.00 178.16 178.45 2oxy h GLU 139 N 0.58 0.74 -0.76 1.82 4.39 -0.87 -2.13 114.58 118.35 2oxy h GLU 139 Ca 0.15 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 2oxy h GLU 139 Cb 0.22 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.67 2oxy h GLU 139 CO -0.01 0.49 0.31 1.25 -1.16 0.00 0.00 179.01 179.89 2oxy h LEU 140 N 0.76 1.04 -1.07 1.33 5.85 -0.83 -2.72 115.31 119.67 2oxy h LEU 140 Ca 0.24 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 2oxy h LEU 140 Cb -0.01 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 2oxy h LEU 140 CO -0.09 0.92 0.10 -0.07 -0.34 0.00 0.00 178.44 178.96 2oxy h LEU 141 N 1.11 0.71 -0.58 2.25 3.38 -0.62 -2.05 115.31 119.52 2oxy h LEU 141 Ca 0.26 -0.13 0.10 0.00 0.09 0.00 0.00 57.88 58.20 2oxy h LEU 141 Cb 0.20 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.69 2oxy h LEU 141 CO -0.02 0.72 0.14 0.11 0.09 0.00 0.00 178.44 179.48 2oxy h LYS 142 N 0.74 0.28 -0.44 1.13 1.57 -1.07 0.48 116.57 119.25 2oxy h LYS 142 Ca 0.16 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2oxy h LYS 142 Cb 0.30 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2oxy h LYS 142 CO 0.00 0.19 0.19 0.00 -0.57 0.00 0.00 179.45 179.26 2oxy h ALA 143 N 1.44 0.58 -0.15 3.86 0.00 -1.35 -1.34 119.26 122.29 2oxy h ALA 143 Ca 0.30 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2oxy h ALA 143 Cb 0.41 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2oxy h ALA 143 CO -0.36 0.16 -0.13 -0.07 0.00 0.00 0.00 179.25 178.85 2oxy h LEU 144 N 0.58 0.38 -0.72 0.00 3.38 -1.15 -1.15 115.31 116.62 2oxy h LEU 144 Ca 0.15 -0.46 0.02 0.00 0.09 0.00 0.00 57.88 57.68 2oxy h LEU 144 Cb 0.16 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 2oxy h LEU 144 CO -0.02 0.76 0.46 -0.78 0.09 0.00 0.00 178.44 178.96 2oxy h ASP 145 N -0.00 0.78 0.26 -0.43 3.58 -0.89 -0.40 116.42 119.31 2oxy h ASP 145 Ca 0.03 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2oxy h ASP 145 Cb 0.65 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.50 2oxy h ASP 145 CO 0.03 0.55 -0.24 0.22 -2.88 0.00 0.00 179.24 176.93 2oxy h TYR 146 N 0.93 -0.63 -0.73 0.28 3.20 -1.13 -0.09 116.97 118.80 2oxy h TYR 146 Ca 0.28 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 2oxy h TYR 146 Cb -0.04 0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 2oxy h TYR 146 CO -0.03 -0.35 0.34 0.00 -1.64 0.00 0.00 178.16 176.47 2oxy h HIS 148 N 1.02 0.65 0.00 0.00 3.86 -0.92 -0.83 115.15 118.92 2oxy h HIS 148 Ca 0.25 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.47 2oxy h HIS 148 Cb 0.13 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 28.39 2oxy h HIS 148 CO 0.01 0.37 -0.04 0.66 0.86 0.00 0.00 177.93 179.78 2oxy h SER 149 N 0.68 0.00 -0.55 2.45 4.64 -0.39 0.47 113.55 120.85 2oxy h SER 149 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2oxy h SER 149 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2oxy h SER 149 CO -0.11 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 175.90 2oxy n GLN 150 N -3.27 2.86 -1.46 4.77 1.13 -0.51 -4.94 117.38 115.96 2oxy n GLN 150 Ca -0.01 -2.22 -0.02 0.00 -1.94 0.00 0.00 57.00 52.80 2oxy n GLN 150 Cb 0.21 -1.65 -0.01 0.00 0.11 0.00 0.00 30.24 28.90 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 1.16 0.45 3.17 1.08 0.00 0.16 -4.95 105.19 106.26 2oxy n GLY 151 Ca 0.20 -0.90 -0.26 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.10 1.51 -0.15 -0.61 1.01 -0.44 -1.30 121.20 119.13 2oxy s ILE 152 Ca 0.00 -0.78 -0.12 0.00 0.00 0.00 0.00 60.65 59.75 2oxy s ILE 152 Cb 0.00 -1.27 -0.05 0.00 0.01 0.00 0.00 42.46 41.15 2oxy s ILE 152 CO 0.00 0.43 0.24 -0.04 0.00 0.00 0.00 174.94 175.57 2oxy s MET 153 N -0.18 4.06 0.02 2.79 -1.94 -0.31 -2.87 119.30 120.89 2oxy s MET 153 Ca 0.01 0.02 -0.19 0.00 -1.71 0.00 0.00 55.69 53.81 2oxy s MET 153 Cb -0.10 -3.36 -0.20 0.00 2.01 0.00 0.00 34.83 33.18 2oxy s MET 153 CO 0.01 0.39 1.18 1.25 -0.01 0.00 0.00 175.02 177.85 2oxy h HIS 154 N 6.18 0.62 -0.56 -0.03 2.76 -1.93 -2.09 115.15 120.11 2oxy h HIS 154 Ca -0.45 -0.29 -0.24 0.00 -2.20 0.00 0.00 60.37 57.19 2oxy h HIS 154 Cb 1.18 -0.09 -0.09 0.00 1.55 0.00 0.00 27.41 29.95 2oxy h HIS 154 CO 0.63 1.07 -0.22 0.54 -1.30 0.00 0.00 177.93 178.66 2oxy n ARG 155 N -4.27 -1.52 -2.71 5.26 1.74 -1.26 -2.83 116.66 111.07 2oxy n ARG 155 Ca -0.09 0.90 -0.03 0.00 -0.77 0.00 0.00 57.85 57.86 2oxy n ARG 155 Cb 0.60 -5.23 0.10 0.00 -1.02 0.00 0.00 32.46 26.92 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 -1.02 -0.68 -4.70 0.55 2.03 -1.26 -0.51 116.55 110.96 2oxy n ASP 156 Ca -0.12 -2.24 -0.42 0.00 0.52 0.00 0.00 54.79 52.53 2oxy n ASP 156 Cb 0.56 0.40 -0.03 0.00 -0.72 0.00 0.00 41.12 41.34 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 -0.94 3.03 -0.15 5.18 1.01 -1.26 -4.78 120.40 122.50 2oxy s VAL 157 Ca 0.16 0.60 -0.33 0.00 0.00 0.00 0.00 61.98 62.41 2oxy s VAL 157 Cb 0.41 -3.39 0.13 0.00 0.00 0.00 0.00 36.38 33.54 2oxy s VAL 157 CO -0.09 0.02 1.12 -1.59 0.00 0.00 0.00 175.10 174.55 2oxy s LYS 158 N 1.98 0.45 0.44 2.72 -2.85 -1.26 -4.75 119.74 116.47 2oxy s LYS 158 Ca 0.70 -0.13 0.17 0.00 -1.00 0.00 0.00 55.97 55.72 2oxy s LYS 158 Cb -0.40 0.21 1.09 0.00 -2.06 0.00 0.00 37.83 36.67 2oxy s LYS 158 CO 0.31 -0.19 1.94 -1.35 0.10 0.00 0.00 175.35 176.16 2oxy h PRO 159 N 2.06 0.35 0.00 1.78 0.11 -1.93 -0.48 132.00 133.89 2oxy h PRO 159 Ca -0.13 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.95 2oxy h PRO 159 Cb 1.19 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2oxy h PRO 159 CO 0.26 0.23 -0.03 0.45 -0.21 0.00 0.00 178.00 178.70 2oxy h HIS 160 N 0.36 0.00 -0.41 0.65 3.86 -1.96 -2.39 115.15 115.27 2oxy h HIS 160 Ca 0.34 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.55 2oxy h HIS 160 Cb 0.82 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.29 2oxy h HIS 160 CO -0.00 0.03 0.00 0.09 0.86 0.00 0.00 177.93 178.91 2oxy n ASN 161 N -3.28 4.58 -3.89 2.45 3.02 -0.19 -4.84 115.26 113.11 2oxy n ASN 161 Ca -0.02 -2.88 -0.30 0.00 -0.03 0.00 0.00 54.58 51.35 2oxy n ASN 161 Cb 0.18 -0.58 -0.15 0.00 -0.61 0.00 0.00 39.78 38.61 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 -2.62 1.51 -0.03 2.41 1.01 -0.90 -1.30 120.40 120.48 2oxy s VAL 162 Ca 0.46 -1.62 -0.25 0.00 0.00 0.00 0.00 61.98 60.58 2oxy s VAL 162 Cb 0.36 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2oxy s VAL 162 CO 0.13 -0.46 0.75 -0.04 0.00 0.00 0.00 175.10 175.47 2oxy s MET 163 N 1.33 4.46 -0.10 2.72 -1.94 0.09 -4.93 119.30 120.93 2oxy s MET 163 Ca 0.05 0.98 0.00 0.00 -1.71 0.00 0.00 55.69 55.02 2oxy s MET 163 Cb -0.18 -3.43 0.02 0.00 2.01 0.00 0.00 34.83 33.25 2oxy s MET 163 CO -0.14 0.10 -0.09 0.42 -0.01 0.00 0.00 175.02 175.30 2oxy s ILE 164 N 0.63 1.09 -0.65 2.53 1.01 -1.26 -0.96 121.20 123.59 2oxy s ILE 164 Ca 0.39 -0.36 -0.18 0.00 0.00 0.00 0.00 60.65 60.50 2oxy s ILE 164 Cb -0.19 -1.07 0.12 0.00 0.01 0.00 0.00 42.46 41.34 2oxy s ILE 164 CO 0.20 0.37 0.74 -0.62 0.00 0.00 0.00 174.94 175.63 2oxy s ASP 165 N 1.40 6.30 0.23 3.58 -1.08 -0.02 -2.64 116.67 124.45 2oxy s ASP 165 Ca -0.01 -1.69 -0.07 0.00 -0.52 0.00 0.00 52.55 50.26 2oxy s ASP 165 Cb -0.13 -2.29 0.21 0.00 -1.46 0.00 0.00 42.92 39.25 2oxy s ASP 165 CO -0.05 -1.02 1.82 -0.74 0.52 0.00 0.00 175.17 175.70 2oxy h HIS 166 N 8.94 1.20 -0.54 -5.34 -0.00 -1.83 0.56 115.15 118.14 2oxy h HIS 166 Ca -0.20 -0.06 0.04 0.00 -0.00 0.00 0.00 60.37 60.15 2oxy h HIS 166 Cb 1.08 -0.37 -0.03 0.00 -0.00 0.00 0.00 27.41 28.09 2oxy h HIS 166 CO 0.89 0.87 0.36 1.49 -0.00 0.00 0.00 177.93 181.54 2oxy h GLU 167 N 1.18 0.56 -0.19 5.26 4.81 -1.93 -2.58 114.58 121.69 2oxy h GLU 167 Ca 0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 2oxy h GLU 167 Cb 0.13 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2oxy h GLU 167 CO -0.03 0.37 0.00 1.28 -0.73 0.00 0.00 179.01 179.90 2oxy n LEU 168 N -4.47 3.00 -3.32 1.64 4.77 -0.64 -4.96 117.00 113.01 2oxy n LEU 168 Ca 0.07 -1.27 -0.24 0.00 -0.03 0.00 0.00 56.01 54.54 2oxy n LEU 168 Cb 0.18 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2oxy n LEU 168 CO 0.35 0.59 0.00 0.54 -1.33 0.00 0.00 177.39 177.54 2oxy n ARG 169 N 1.23 -4.29 -4.37 3.23 5.12 0.10 -4.93 116.66 112.74 2oxy n ARG 169 Ca 0.15 0.65 -0.34 0.00 -1.93 0.00 0.00 57.85 56.37 2oxy n ARG 169 Cb 0.54 -5.44 -0.14 0.00 -1.16 0.00 0.00 32.46 26.26 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 -6.00 3.40 -0.03 5.56 2.20 -0.70 -5.00 119.74 119.18 2oxy s LYS 170 Ca 0.41 -0.65 0.06 0.00 -0.36 0.00 0.00 55.97 55.43 2oxy s LYS 170 Cb -0.20 -2.80 -0.01 0.00 -1.51 0.00 0.00 37.83 33.30 2oxy s LYS 170 CO 0.50 0.05 -0.21 -1.17 -0.36 0.00 0.00 175.35 174.15 2oxy s LEU 171 N 0.81 2.02 -0.04 5.43 0.20 -1.26 -0.84 118.68 125.01 2oxy s LEU 171 Ca -0.03 -0.41 0.01 0.00 0.69 0.00 0.00 54.13 54.39 2oxy s LEU 171 Cb -0.15 -1.13 0.02 0.00 -0.43 0.00 0.00 46.19 44.50 2oxy s LEU 171 CO 0.01 0.24 -0.03 -0.13 -0.29 0.00 0.00 176.35 176.15 2oxy s ARG 172 N -0.33 0.61 -0.16 1.98 1.81 -0.14 -4.56 118.95 118.17 2oxy s ARG 172 Ca 0.03 -0.04 -0.29 0.00 -1.72 0.00 0.00 55.73 53.72 2oxy s ARG 172 Cb -0.10 -0.68 -0.00 0.00 -0.45 0.00 0.00 34.95 33.71 2oxy s ARG 172 CO 0.01 -0.10 1.01 -1.17 -0.68 0.00 0.00 175.30 174.37 2oxy s LEU 173 N 0.92 4.19 0.00 2.53 2.96 -0.59 -0.73 118.68 127.95 2oxy s LEU 173 Ca -0.11 1.46 0.00 0.00 -0.22 0.00 0.00 54.13 55.26 2oxy s LEU 173 Cb -0.14 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.01 2oxy s LEU 173 CO -0.00 -0.53 0.01 2.30 -1.32 0.00 0.00 176.35 176.80 2oxy n ILE 174 N 4.86 0.00 -3.15 6.68 -5.35 -0.42 -2.32 119.36 119.67 2oxy n ILE 174 Ca 0.10 -1.86 -0.16 0.00 -0.27 0.00 0.00 62.75 60.56 2oxy n ILE 174 Cb 0.48 0.40 0.01 0.00 -1.74 0.00 0.00 39.64 38.79 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 -1.28 -7.02 -1.25 7.28 -0.08 -1.26 -4.86 116.55 108.08 2oxy n ASP 175 Ca -0.15 0.10 0.06 0.00 -1.51 0.00 0.00 54.79 53.30 2oxy n ASP 175 Cb 0.50 -4.10 0.26 0.00 2.34 0.00 0.00 41.12 40.12 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 -0.78 1.13 0.29 -0.67 7.02 -1.26 -4.42 117.44 118.75 2oxy n TRP 176 Ca 0.00 -0.44 0.18 0.00 -1.02 0.00 0.00 57.50 56.23 2oxy n TRP 176 Cb 0.55 -0.22 0.83 0.00 -2.42 0.00 0.00 31.31 30.05 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 4.56 0.00 -0.83 6.99 0.00 -1.91 -2.41 103.07 109.47 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 0.19 0.00 -0.54 1.04 0.00 0.00 0.00 176.54 177.24 2oxy n LEU 178 N -3.13 1.84 -4.75 3.11 4.77 -1.26 -4.90 117.00 112.68 2oxy n LEU 178 Ca -0.01 -0.72 -0.35 0.00 -0.03 0.00 0.00 56.01 54.90 2oxy n LEU 178 Cb 0.24 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.38 2oxy n LEU 178 CO 0.26 0.35 0.81 0.00 -1.33 0.00 0.00 177.39 177.48 2oxy s ALA 179 N -2.49 2.40 0.04 -1.18 0.00 -0.91 -4.70 121.76 114.91 2oxy s ALA 179 Ca 0.16 0.88 -0.10 0.00 0.00 0.00 0.00 51.96 52.91 2oxy s ALA 179 Cb 0.17 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2oxy s ALA 179 CO 0.60 -1.41 0.20 -1.21 0.00 0.00 0.00 175.76 173.94 2oxy s GLU 180 N -3.65 0.69 0.15 0.00 0.41 -0.78 -4.90 118.70 110.62 2oxy s GLU 180 Ca 0.75 -0.62 -0.30 0.00 -0.41 0.00 0.00 54.97 54.39 2oxy s GLU 180 Cb -0.28 0.29 -0.07 0.00 -1.78 0.00 0.00 34.13 32.29 2oxy s GLU 180 CO 0.38 -0.20 1.05 -0.06 -0.49 0.00 0.00 175.26 175.94 2oxy s PHE 181 N -2.54 3.67 -0.15 1.61 0.40 -1.26 -1.16 117.98 118.55 2oxy s PHE 181 Ca -0.05 1.67 -0.21 0.00 -0.60 0.00 0.00 56.93 57.73 2oxy s PHE 181 Cb -0.01 -3.20 -0.03 0.00 0.51 0.00 0.00 43.02 40.29 2oxy s PHE 181 CO -0.04 -0.32 0.63 -0.47 0.70 0.00 0.00 175.22 175.72 2oxy s TYR 182 N -0.14 3.44 -0.10 0.36 5.04 -0.42 -4.92 117.35 120.62 2oxy s TYR 182 Ca 0.49 1.01 -0.00 0.00 -2.44 0.00 0.00 57.07 56.12 2oxy s TYR 182 Cb -0.27 -2.77 0.02 0.00 0.35 0.00 0.00 41.96 39.29 2oxy s TYR 182 CO 0.33 -0.06 -0.08 -1.01 -1.34 0.00 0.00 175.55 173.39 2oxy s HIS 183 N 1.47 1.42 0.24 4.97 3.76 -1.26 -4.57 115.29 121.31 2oxy s HIS 183 Ca 0.31 -0.67 -0.31 0.00 -0.15 0.00 0.00 55.06 54.23 2oxy s HIS 183 Cb -0.16 -1.18 -0.14 0.00 1.11 0.00 0.00 32.58 32.21 2oxy s HIS 183 CO 0.12 -0.47 1.28 -2.30 -0.85 0.00 0.00 174.74 172.53 2oxy n PRO 184 N 4.80 1.72 -0.50 8.40 -0.02 -1.26 -1.88 135.00 146.26 2oxy n PRO 184 Ca -0.14 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2oxy n PRO 184 Cb 0.50 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 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 1.89 1.15 3.74 -1.23 0.00 -1.26 -5.00 105.19 104.49 2oxy n GLY 185 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.21 4.25 -0.47 1.61 2.20 -0.79 -4.94 119.74 121.39 2oxy s LYS 186 Ca 0.00 2.33 -0.19 0.00 -0.36 0.00 0.00 55.97 57.74 2oxy s LYS 186 Cb 0.00 -3.11 0.04 0.00 -1.51 0.00 0.00 37.83 33.25 2oxy s LYS 186 CO 0.00 -0.45 0.59 -1.21 -0.36 0.00 0.00 175.35 173.92 2oxy s GLU 187 N -0.25 3.16 0.43 4.03 2.02 -1.26 -4.24 118.70 122.60 2oxy s GLU 187 Ca 0.61 -0.70 -0.06 0.00 0.02 0.00 0.00 54.97 54.84 2oxy s GLU 187 Cb -0.42 -4.02 -0.04 0.00 0.10 0.00 0.00 34.13 29.74 2oxy s GLU 187 CO 0.43 -1.08 0.74 0.71 0.02 0.00 0.00 175.26 176.08 2oxy s TYR 188 N 2.58 3.53 0.17 1.61 2.02 0.18 -4.97 117.35 122.47 2oxy s TYR 188 Ca 0.17 0.80 -0.33 0.00 -0.37 0.00 0.00 57.07 57.34 2oxy s TYR 188 Cb -0.17 -2.27 -0.13 0.00 -0.40 0.00 0.00 41.96 38.99 2oxy s TYR 188 CO 0.14 -0.16 1.66 -1.71 -1.57 0.00 0.00 175.55 173.92 2oxy n ASN 189 N -1.87 3.51 -0.20 2.29 2.85 -1.26 -4.74 115.26 115.85 2oxy n ASN 189 Ca 0.00 1.06 0.13 0.00 -0.11 0.00 0.00 54.58 55.67 2oxy n ASN 189 Cb 0.55 -1.49 0.46 0.00 1.24 0.00 0.00 39.78 40.54 2oxy n ASN 189 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2oxy n VAL 190 N 3.78 0.00 -2.27 3.44 0.24 -1.26 -4.57 118.33 117.69 2oxy n VAL 190 Ca 0.17 -0.10 -0.43 0.00 -2.04 0.00 0.00 64.34 61.94 2oxy n VAL 190 Cb 0.32 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 2oxy n VAL 190 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2oxy n ARG 191 N -0.76 3.28 -4.20 7.34 5.12 -1.26 -4.85 116.66 121.33 2oxy n ARG 191 Ca 0.13 -3.25 -0.12 0.00 -1.93 0.00 0.00 57.85 52.68 2oxy n ARG 191 Cb 0.32 -3.13 -0.10 0.00 -1.16 0.00 0.00 32.46 28.39 2oxy n ARG 191 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2oxy s VAL 192 N 1.96 0.01 0.30 1.55 -7.23 -1.26 -5.12 120.40 110.60 2oxy s VAL 192 Ca 0.44 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 2oxy s VAL 192 Cb 0.08 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.52 2oxy s VAL 192 CO -0.02 -0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.77 2oxy n ALA 193 N -0.27 -3.27 -2.80 1.32 0.00 0.33 -4.85 120.51 110.96 2oxy n ALA 193 Ca 0.02 0.40 -0.34 0.00 0.00 0.00 0.00 53.44 53.53 2oxy n ALA 193 Cb 0.66 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.91 2oxy n ALA 193 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2oxy s SER 194 N -6.54 5.83 0.18 0.00 0.15 -1.26 -4.97 113.70 107.10 2oxy s SER 194 Ca 0.00 0.22 -0.13 0.00 0.70 0.00 0.00 55.95 56.74 2oxy s SER 194 Cb 0.00 -1.73 0.21 0.00 -1.71 0.00 0.00 66.02 62.79 2oxy s SER 194 CO 0.00 0.30 1.21 -1.14 1.20 0.00 0.00 173.24 174.81 2oxy n ARG 195 N 1.34 -0.17 0.05 5.44 0.63 -1.26 -0.65 116.66 122.04 2oxy n ARG 195 Ca -0.14 1.20 0.11 0.00 -0.92 0.00 0.00 57.85 58.09 2oxy n ARG 195 Cb 0.53 -1.78 0.43 0.00 0.45 0.00 0.00 32.46 32.09 2oxy n ARG 195 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2oxy n TYR 196 N -5.16 0.36 0.09 -0.14 4.01 -1.26 -2.42 117.16 112.63 2oxy n TYR 196 Ca 0.09 0.13 0.05 0.00 -0.16 0.00 0.00 57.90 58.00 2oxy n TYR 196 Cb 0.32 -0.71 0.09 0.00 -0.31 0.00 0.00 39.34 38.74 2oxy n TYR 196 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2oxy n PHE 197 N -1.81 0.22 -2.45 -0.72 3.72 0.18 -4.59 117.46 111.99 2oxy n PHE 197 Ca 0.04 -0.28 -0.41 0.00 -0.05 0.00 0.00 57.45 56.75 2oxy n PHE 197 Cb 0.25 -0.02 -0.04 0.00 -0.94 0.00 0.00 39.48 38.74 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 -0.90 4.52 0.64 -1.08 1.02 -0.95 -4.17 119.74 118.82 2oxy s LYS 198 Ca 0.16 1.77 -0.13 0.00 0.02 0.00 0.00 55.97 57.79 2oxy s LYS 198 Cb 0.09 -3.29 -0.02 0.00 -0.52 0.00 0.00 37.83 34.09 2oxy s LYS 198 CO 0.13 -0.07 1.05 0.20 -0.92 0.00 0.00 175.35 175.74 2oxy s GLY 199 N 0.31 1.83 0.42 -3.33 0.00 -1.26 -4.92 107.32 100.37 2oxy s GLY 199 Ca 0.53 0.17 0.22 0.00 0.00 0.00 0.00 44.72 45.64 2oxy s GLY 199 CO 0.34 0.47 1.75 -2.55 0.00 0.00 0.00 173.10 173.11 2oxy h PRO 200 N -0.21 0.30 -0.94 2.90 0.11 -1.92 -1.27 132.00 130.97 2oxy h PRO 200 Ca -0.45 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.67 2oxy h PRO 200 Cb 1.21 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 2oxy h PRO 200 CO 0.58 0.20 0.62 1.05 -0.21 0.00 0.00 178.00 180.23 2oxy h GLU 201 N 0.30 1.19 -0.02 1.05 9.09 -1.90 -1.19 114.58 123.11 2oxy h GLU 201 Ca 0.63 -0.07 -0.12 0.00 0.05 0.00 0.00 59.36 59.84 2oxy h GLU 201 Cb 1.75 -0.27 -0.02 0.00 -1.65 0.00 0.00 28.75 28.56 2oxy h GLU 201 CO -0.29 0.79 -0.55 -0.07 0.05 0.00 0.00 179.01 178.94 2oxy h LEU 202 N 1.23 0.05 0.00 3.06 3.38 -1.48 0.14 115.31 121.69 2oxy h LEU 202 Ca 0.36 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.21 2oxy h LEU 202 Cb -0.07 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2oxy h LEU 202 CO -0.09 0.59 -0.56 -0.07 0.09 0.00 0.00 178.44 178.40 2oxy h LEU 203 N 0.04 0.00 -2.29 1.67 3.38 -1.09 -3.19 115.31 113.82 2oxy h LEU 203 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2oxy h LEU 203 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2oxy h LEU 203 CO 0.07 0.41 0.00 1.33 0.09 0.00 0.00 178.44 180.34 2oxy n VAL 204 N -3.14 0.55 -3.54 1.22 0.24 -0.61 -4.99 118.33 108.06 2oxy n VAL 204 Ca 0.01 -0.77 -0.20 0.00 -2.04 0.00 0.00 64.34 61.34 2oxy n VAL 204 Cb 0.71 0.88 0.07 0.00 -1.47 0.00 0.00 33.84 34.03 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 0.94 -2.75 -4.49 -1.34 8.00 -0.97 -4.96 116.55 110.97 2oxy n ASP 205 Ca 0.13 -0.65 -0.43 0.00 0.71 0.00 0.00 54.79 54.55 2oxy n ASP 205 Cb 0.46 -4.85 -0.04 0.00 -0.02 0.00 0.00 41.12 36.67 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 -6.63 4.24 0.37 0.64 0.20 0.45 -4.93 118.68 113.02 2oxy s LEU 206 Ca 0.13 -0.67 0.20 0.00 0.69 0.00 0.00 54.13 54.48 2oxy s LEU 206 Cb -0.06 -2.61 0.22 0.00 -0.43 0.00 0.00 46.19 43.30 2oxy s LEU 206 CO 0.75 -1.32 1.53 1.56 -0.29 0.00 0.00 176.35 178.57 2oxy h GLN 207 N 9.43 0.00 -2.19 1.98 4.20 -1.85 -3.36 115.11 123.33 2oxy h GLN 207 Ca -0.27 0.00 -0.76 0.00 0.06 0.00 0.00 58.65 57.67 2oxy h GLN 207 Cb 1.07 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 28.61 2oxy h GLN 207 CO 1.13 0.21 1.15 -0.40 -0.67 0.00 0.00 178.83 180.25 2oxy n ASP 208 N -3.14 7.43 -3.75 1.46 5.75 -1.26 -0.65 116.55 122.39 2oxy n ASP 208 Ca 0.03 -3.64 -0.23 0.00 -0.01 0.00 0.00 54.79 50.95 2oxy n ASP 208 Cb 0.62 -1.16 0.15 0.00 -1.03 0.00 0.00 41.12 39.69 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 0.06 -3.69 -2.40 2.11 0.18 -1.26 -4.66 117.16 107.50 2oxy n TYR 209 Ca 0.51 -1.13 0.00 0.00 1.88 0.00 0.00 57.90 59.16 2oxy n TYR 209 Cb 0.27 -0.78 0.00 0.00 -0.38 0.00 0.00 39.34 38.46 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 -3.47 0.00 -0.16 9.48 5.68 -1.26 -4.93 116.55 121.89 2oxy n ASP 210 Ca 0.14 0.00 0.24 0.00 -0.50 0.00 0.00 54.79 54.67 2oxy n ASP 210 Cb 0.48 0.00 0.66 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 0.00 0.15 -0.02 2.11 0.05 -1.94 -1.98 116.97 115.35 2oxy h TYR 211 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2oxy h TYR 211 Cb 0.00 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 37.69 2oxy h TYR 211 CO 0.00 0.04 0.05 0.66 -1.05 0.00 0.00 178.16 177.86 2oxy h SER 212 N 0.11 0.00 -0.57 3.88 4.64 -1.95 -1.62 113.55 118.04 2oxy h SER 212 Ca 0.40 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.80 2oxy h SER 212 Cb 1.41 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.44 2oxy h SER 212 CO -0.05 0.00 0.21 0.25 -0.87 0.00 0.00 176.83 176.37 2oxy h LEU 213 N 0.00 0.22 -1.71 5.97 5.85 -1.72 -1.87 115.31 122.03 2oxy h LEU 213 Ca 0.01 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.83 2oxy h LEU 213 Cb 0.10 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2oxy h LEU 213 CO -0.00 0.14 0.25 0.44 -0.34 0.00 0.00 178.44 178.93 2oxy h ASP 214 N 0.40 0.32 0.15 1.25 3.32 -1.51 -2.29 116.42 118.05 2oxy h ASP 214 Ca 0.28 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.20 2oxy h ASP 214 Cb 0.33 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2oxy h ASP 214 CO -0.28 0.22 -0.47 0.24 -1.72 0.00 0.00 179.24 177.22 2oxy h MET 215 N 0.38 0.38 -0.19 3.56 2.86 -1.44 0.01 114.93 120.49 2oxy h MET 215 Ca 0.15 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 2oxy h MET 215 Cb 0.14 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2oxy h MET 215 CO -0.03 0.78 0.05 2.35 1.06 0.00 0.00 176.91 181.11 2oxy h TRP 216 N 0.31 0.31 -0.11 -0.22 2.91 -1.14 -1.00 115.95 117.01 2oxy h TRP 216 Ca 0.02 -0.04 0.01 0.00 1.13 0.00 0.00 58.89 60.01 2oxy h TRP 216 Cb 0.95 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 29.50 2oxy h TRP 216 CO 0.03 0.42 0.03 0.77 -1.03 0.00 0.00 178.44 178.66 2oxy h SER 217 N 0.12 0.04 -0.61 2.65 0.02 -1.32 -1.03 113.55 113.41 2oxy h SER 217 Ca 0.06 0.01 0.12 0.00 -0.84 0.00 0.00 61.79 61.14 2oxy h SER 217 Cb 0.26 0.01 -0.09 0.00 0.14 0.00 0.00 62.40 62.72 2oxy h SER 217 CO 0.00 0.04 0.14 0.25 -1.14 0.00 0.00 176.83 176.11 2oxy h LEU 218 N 0.09 0.01 -0.71 5.07 5.85 -0.95 -1.51 115.31 123.16 2oxy h LEU 218 Ca 0.05 0.11 0.09 0.00 0.84 0.00 0.00 57.88 58.98 2oxy h LEU 218 Cb 0.03 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 2oxy h LEU 218 CO -0.05 0.01 0.36 1.23 -0.34 0.00 0.00 178.44 179.64 2oxy h GLY 219 N 0.27 1.07 0.96 3.75 0.00 -0.07 0.26 103.07 109.30 2oxy h GLY 219 Ca 0.32 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 2oxy h GLY 219 CO -0.41 0.06 0.09 0.00 0.00 0.00 0.00 176.54 176.27 2oxy h MET 221 N 0.15 0.29 0.22 0.00 -1.53 -1.16 -2.11 114.93 110.79 2oxy h MET 221 Ca 0.05 -0.02 -0.01 0.00 -3.44 0.00 0.00 59.70 56.28 2oxy h MET 221 Cb 0.04 -0.07 0.00 0.00 -0.55 0.00 0.00 31.60 31.03 2oxy h MET 221 CO -0.01 0.19 -0.10 0.35 0.14 0.00 0.00 176.91 177.48 2oxy h PHE 222 N 0.30 -0.27 -0.45 1.39 3.57 -0.62 -2.03 116.94 118.82 2oxy h PHE 222 Ca 0.17 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.75 2oxy h PHE 222 Cb 0.14 0.09 -0.09 0.00 2.79 0.00 0.00 35.95 38.88 2oxy h PHE 222 CO -0.14 -0.16 -0.12 0.00 -2.23 0.00 0.00 178.31 175.66 2oxy h ALA 223 N 0.48 0.28 -0.89 2.41 0.00 -1.07 -0.65 119.26 119.82 2oxy h ALA 223 Ca -0.03 0.17 0.17 0.00 0.00 0.00 0.00 54.91 55.23 2oxy h ALA 223 Cb 0.23 0.36 -0.10 0.00 0.00 0.00 0.00 17.79 18.28 2oxy h ALA 223 CO 0.05 -0.46 0.47 0.78 0.00 0.00 0.00 179.25 180.09 2oxy h GLY 224 N -0.01 1.51 0.63 0.00 0.00 -1.17 -1.41 103.07 102.61 2oxy h GLY 224 Ca 0.22 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 2oxy h GLY 224 CO -0.47 -0.09 -0.07 -0.33 0.00 0.00 0.00 176.54 175.58 2oxy h MET 225 N 0.61 0.18 0.01 4.80 2.07 -0.58 0.77 114.93 122.79 2oxy h MET 225 Ca 0.51 -0.09 -0.20 0.00 -2.07 0.00 0.00 59.70 57.84 2oxy h MET 225 Cb 0.79 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.50 2oxy h MET 225 CO -0.40 0.61 -0.95 -0.84 1.07 0.00 0.00 176.91 176.40 2oxy h ILE 226 N -0.25 1.64 0.00 -1.22 3.07 -1.01 -3.29 117.51 116.46 2oxy h ILE 226 Ca 0.01 -3.14 0.00 0.00 1.55 0.00 0.00 64.86 63.29 2oxy h ILE 226 Cb 0.58 2.72 0.00 0.00 -0.27 0.00 0.00 36.82 39.85 2oxy h ILE 226 CO 0.02 0.90 -1.26 0.49 -1.05 0.00 0.00 178.15 177.25 2oxy n PHE 227 N -3.46 0.16 -1.68 0.16 3.72 -0.54 -4.57 117.46 111.25 2oxy n PHE 227 Ca -0.01 0.05 -0.17 0.00 -0.05 0.00 0.00 57.45 57.27 2oxy n PHE 227 Cb 0.89 -0.37 -0.06 0.00 -0.94 0.00 0.00 39.48 39.00 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 -1.95 -1.19 -3.46 -1.08 1.74 0.25 -4.82 116.66 106.16 2oxy n ARG 228 Ca 0.01 1.01 -0.43 0.00 -0.77 0.00 0.00 57.85 57.67 2oxy n ARG 228 Cb 0.45 -5.27 -0.07 0.00 -1.02 0.00 0.00 32.46 26.55 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 -3.74 2.70 -0.08 5.56 2.20 -1.17 -5.04 119.74 120.17 2oxy s LYS 229 Ca 0.00 -1.71 -0.00 0.00 -0.36 0.00 0.00 55.97 53.89 2oxy s LYS 229 Cb 0.00 -4.07 0.02 0.00 -1.51 0.00 0.00 37.83 32.27 2oxy s LYS 229 CO 0.00 -1.23 -0.04 -1.83 -0.36 0.00 0.00 175.35 171.89 2oxy s GLU 230 N 1.47 1.09 0.60 4.03 4.04 -1.26 -2.47 118.70 126.19 2oxy s GLU 230 Ca 0.04 -0.10 -0.17 0.00 0.04 0.00 0.00 54.97 54.79 2oxy s GLU 230 Cb -0.27 -1.23 -0.03 0.00 0.02 0.00 0.00 34.13 32.61 2oxy s GLU 230 CO 0.01 -0.23 1.08 -2.14 -1.84 0.00 0.00 175.26 172.14 2oxy s PRO 231 N 1.63 3.21 0.04 -4.83 0.02 -1.26 -5.10 135.00 128.70 2oxy s PRO 231 Ca 0.01 1.34 -0.19 0.00 0.02 0.00 0.00 61.00 62.18 2oxy s PRO 231 Cb -0.13 -2.01 -0.17 0.00 0.02 0.00 0.00 34.50 32.22 2oxy s PRO 231 CO -0.05 -0.92 1.26 0.35 -0.33 0.00 0.00 177.00 177.31 2oxy h PHE 232 N 0.54 0.58 -3.34 6.54 3.57 -1.74 -3.36 116.94 119.73 2oxy h PHE 232 Ca -0.48 -0.23 -0.72 0.00 3.53 0.00 0.00 57.97 60.07 2oxy h PHE 232 Cb 1.23 -0.10 -0.30 0.00 2.79 0.00 0.00 35.95 39.57 2oxy h PHE 232 CO 0.56 0.96 -0.42 -0.06 -2.23 0.00 0.00 178.31 177.12 2oxy s PHE 233 N -3.86 3.44 -0.98 0.41 0.08 -1.26 -5.03 117.98 110.78 2oxy s PHE 233 Ca -0.13 -1.93 -0.02 0.00 0.12 0.00 0.00 56.93 54.96 2oxy s PHE 233 Cb 0.05 -3.41 0.29 0.00 -0.57 0.00 0.00 43.02 39.38 2oxy s PHE 233 CO 0.79 -0.98 1.24 0.98 -0.10 0.00 0.00 175.22 177.15 2oxy n TYR 234 N 4.86 3.01 -2.89 0.36 9.36 -1.26 -4.59 117.16 126.01 2oxy n TYR 234 Ca -0.07 -3.17 -0.34 0.00 3.32 0.00 0.00 57.90 57.63 2oxy n TYR 234 Cb 0.41 -1.15 -0.07 0.00 -0.63 0.00 0.00 39.34 37.91 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 -1.48 2.52 0.03 2.98 0.00 -1.26 -4.97 107.32 105.14 2oxy s GLY 235 Ca 0.33 0.35 0.26 0.00 0.00 0.00 0.00 44.72 45.65 2oxy s GLY 235 CO 0.04 0.67 1.53 1.42 0.00 0.00 0.00 173.10 176.76 2oxy n HIS 236 N -0.11 0.13 -3.83 1.90 -0.00 -1.26 -4.80 115.22 107.25 2oxy n HIS 236 Ca 0.04 0.04 -0.05 0.00 -0.00 0.00 0.00 57.72 57.74 2oxy n HIS 236 Cb 0.52 -0.40 0.01 0.00 -0.00 0.00 0.00 29.99 30.12 2oxy n HIS 236 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 2oxy s ASP 237 N -3.27 -0.07 0.40 0.41 1.47 -1.26 -5.01 116.67 109.34 2oxy s ASP 237 Ca 0.11 -0.75 0.14 0.00 1.18 0.00 0.00 52.55 53.23 2oxy s ASP 237 Cb 0.17 0.63 0.84 0.00 -0.34 0.00 0.00 42.92 44.22 2oxy s ASP 237 CO 0.66 -1.22 1.88 0.78 0.68 0.00 0.00 175.17 177.95 2oxy h ASN 238 N 2.00 0.00 0.08 2.11 2.35 -1.97 -0.69 115.58 119.46 2oxy h ASN 238 Ca -0.27 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2oxy h ASN 238 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 2oxy h ASN 238 CO 0.34 0.31 -0.04 0.45 -1.65 0.00 0.00 177.43 176.84 2oxy h HIS 239 N 0.00 -0.10 0.00 1.19 3.86 -1.97 -3.16 115.15 114.98 2oxy h HIS 239 Ca -0.00 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 2oxy h HIS 239 Cb 0.56 0.03 -0.00 0.00 1.06 0.00 0.00 27.41 29.06 2oxy h HIS 239 CO 0.00 0.40 -0.07 0.22 0.86 0.00 0.00 177.93 179.34 2oxy h ASP 240 N -0.65 0.00 -0.26 2.45 3.58 -1.91 -2.43 116.42 117.20 2oxy h ASP 240 Ca -0.01 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.47 2oxy h ASP 240 Cb 0.54 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.56 2oxy h ASP 240 CO 0.02 0.07 0.09 -0.61 -2.88 0.00 0.00 179.24 175.92 2oxy h GLN 241 N 0.00 0.21 -0.45 0.28 5.75 -1.11 0.33 115.11 120.12 2oxy h GLN 241 Ca -0.00 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.44 2oxy h GLN 241 Cb 0.13 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 2oxy h GLN 241 CO 0.01 0.14 0.10 1.25 -2.65 0.00 0.00 178.83 177.67 2oxy h LEU 242 N 0.21 0.63 -0.03 -2.39 5.85 -1.41 -2.40 115.31 115.78 2oxy h LEU 242 Ca 0.12 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 2oxy h LEU 242 Cb 0.08 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 2oxy h LEU 242 CO -0.12 0.64 0.02 0.58 -0.34 0.00 0.00 178.44 179.22 2oxy h VAL 243 N 0.66 1.06 -0.97 1.05 2.07 -1.12 0.60 116.25 119.59 2oxy h VAL 243 Ca 0.15 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.56 2oxy h VAL 243 Cb 0.27 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 2oxy h VAL 243 CO -0.00 0.05 0.63 0.11 0.02 0.00 0.00 177.57 178.38 2oxy h LYS 244 N -0.03 1.12 0.07 1.57 1.79 -0.72 -1.09 116.57 119.29 2oxy h LYS 244 Ca 0.01 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2oxy h LYS 244 Cb 0.06 -0.25 0.00 0.00 -1.58 0.00 0.00 32.23 30.46 2oxy h LYS 244 CO -0.00 0.74 -0.03 0.82 -1.08 0.00 0.00 179.45 179.90 2oxy h ILE 245 N 1.16 1.08 -0.69 1.86 2.04 -1.24 -3.13 117.51 118.59 2oxy h ILE 245 Ca 0.41 -0.51 0.14 0.00 1.00 0.00 0.00 64.86 65.91 2oxy h ILE 245 Cb 0.14 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2oxy h ILE 245 CO -0.15 0.13 0.46 0.00 0.00 0.00 0.00 178.15 178.59 2oxy h ALA 246 N 0.59 2.20 0.00 1.87 0.00 -0.45 -0.93 119.26 122.54 2oxy h ALA 246 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2oxy h ALA 246 Cb 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2oxy h ALA 246 CO 0.02 -0.38 0.00 1.63 0.00 0.00 0.00 179.25 180.51 2oxy n LYS 247 N -4.45 0.20 -0.08 0.00 5.02 -0.45 -0.87 118.16 117.53 2oxy n LYS 247 Ca 0.13 0.37 -0.13 0.00 -2.02 0.00 0.00 58.31 56.66 2oxy n LYS 247 Cb 0.53 -1.84 -0.04 0.00 -0.02 0.00 0.00 35.03 33.66 2oxy n LYS 247 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2oxy n VAL 248 N -2.21 1.35 0.25 -0.18 0.31 -0.56 -4.46 118.33 112.83 2oxy n VAL 248 Ca 0.03 0.01 0.15 0.00 -0.01 0.00 0.00 64.34 64.52 2oxy n VAL 248 Cb 0.27 -2.04 0.43 0.00 -0.91 0.00 0.00 33.84 31.59 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 -0.78 0.00 0.00 7.52 3.38 -1.33 0.15 115.31 124.25 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 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2oxy h LEU 249 CO -0.12 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.02 2oxy n GLY 250 N 0.56 0.19 0.13 0.83 0.00 -0.05 -4.37 105.19 102.49 2oxy n GLY 250 Ca 0.02 -1.58 0.12 0.00 0.00 0.00 0.00 46.02 44.58 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 0.00 -0.16 2.61 1.35 -1.46 -3.30 112.91 111.95 2oxy h THR 251 Ca 0.00 -0.82 0.05 0.00 -0.55 0.00 0.00 66.41 65.09 2oxy h THR 251 Cb 0.00 1.55 -0.06 0.00 -1.73 0.00 0.00 68.15 67.92 2oxy h THR 251 CO 0.00 0.00 -0.19 0.44 -0.25 0.00 0.00 175.52 175.52 2oxy h ASP 252 N 0.00 -0.60 -0.01 5.36 3.32 -1.88 -0.17 116.42 122.45 2oxy h ASP 252 Ca 0.00 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.11 2oxy h ASP 252 Cb 0.91 0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2oxy h ASP 252 CO 0.00 -0.24 -0.10 1.23 -1.72 0.00 0.00 179.24 178.41 2oxy h GLY 253 N -0.23 0.27 1.15 2.75 0.00 -1.84 -2.09 103.07 103.09 2oxy h GLY 253 Ca 0.11 -0.16 -0.14 0.00 0.00 0.00 0.00 47.33 47.14 2oxy h GLY 253 CO -0.29 0.15 -0.26 -2.00 0.00 0.00 0.00 176.54 174.14 2oxy h LEU 254 N 0.24 0.99 -0.56 3.11 5.85 -1.51 -2.06 115.31 121.37 2oxy h LEU 254 Ca 0.05 -0.39 -0.14 0.00 0.84 0.00 0.00 57.88 58.24 2oxy h LEU 254 Cb 0.33 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2oxy h LEU 254 CO 0.02 1.18 -0.31 0.78 -0.34 0.00 0.00 178.44 179.77 2oxy h ASN 255 N 0.82 0.86 -0.36 1.25 2.35 -0.62 -1.52 115.58 118.36 2oxy h ASN 255 Ca 0.10 -0.35 -0.02 0.00 -0.55 0.00 0.00 56.30 55.48 2oxy h ASN 255 Cb 0.83 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 2oxy h ASN 255 CO 0.07 1.10 0.16 0.58 -1.65 0.00 0.00 177.43 177.69 2oxy h VAL 256 N 0.70 1.18 -0.25 2.81 2.07 -1.38 -1.83 116.25 119.55 2oxy h VAL 256 Ca 0.08 -0.54 0.05 0.00 0.82 0.00 0.00 66.70 67.11 2oxy h VAL 256 Cb 0.86 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 2oxy h VAL 256 CO 0.08 0.19 -0.05 0.22 0.02 0.00 0.00 177.57 178.03 2oxy h TYR 257 N 0.44 -0.10 -0.10 1.57 3.20 -1.20 -0.25 116.97 120.52 2oxy h TYR 257 Ca 0.12 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.02 2oxy h TYR 257 Cb 0.16 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2oxy h TYR 257 CO -0.01 -0.09 0.04 -0.07 -1.64 0.00 0.00 178.16 176.39 2oxy h LEU 258 N 0.02 0.05 -0.37 2.82 3.38 -1.16 -2.12 115.31 117.92 2oxy h LEU 258 Ca 0.12 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2oxy h LEU 258 Cb 0.18 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2oxy h LEU 258 CO -0.25 0.04 0.16 0.78 0.09 0.00 0.00 178.44 179.27 2oxy h ASN 259 N 0.09 0.21 0.02 -0.43 2.35 -1.18 0.67 115.58 117.31 2oxy h ASN 259 Ca 0.04 0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2oxy h ASN 259 Cb 0.02 -0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 2oxy h ASN 259 CO -0.04 0.16 -0.16 0.50 -1.65 0.00 0.00 177.43 176.23 2oxy h LYS 260 N 0.33 -0.27 -0.25 0.81 3.64 -0.80 -2.23 116.57 117.79 2oxy h LYS 260 Ca 0.16 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2oxy h LYS 260 Cb 0.11 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2oxy h LYS 260 CO -0.14 -0.18 0.00 0.66 -2.27 0.00 0.00 179.45 177.52 2oxy n TYR 261 N -5.30 0.33 -3.52 1.91 4.01 -0.82 -4.92 117.16 108.86 2oxy n TYR 261 Ca -0.05 -0.17 -0.20 0.00 -0.16 0.00 0.00 57.90 57.32 2oxy n TYR 261 Cb 0.21 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.32 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 0.27 -6.77 -4.39 -0.72 1.74 -0.31 -5.01 116.66 101.48 2oxy n ARG 262 Ca 0.11 0.81 -0.34 0.00 -0.77 0.00 0.00 57.85 57.65 2oxy n ARG 262 Cb 0.24 -5.79 -0.11 0.00 -1.02 0.00 0.00 32.46 25.79 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 -3.38 4.09 -0.14 0.55 -1.09 0.07 -5.03 121.20 116.28 2oxy s ILE 263 Ca 0.18 -0.31 0.01 0.00 -2.23 0.00 0.00 60.65 58.30 2oxy s ILE 263 Cb -0.08 -2.75 0.02 0.00 -1.58 0.00 0.00 42.46 38.06 2oxy s ILE 263 CO 0.74 0.55 -0.16 -0.70 -1.23 0.00 0.00 174.94 174.14 2oxy s GLU 264 N -0.28 2.40 0.43 2.79 2.12 -1.26 -4.42 118.70 120.48 2oxy s GLU 264 Ca 0.05 -0.61 -0.25 0.00 0.36 0.00 0.00 54.97 54.52 2oxy s GLU 264 Cb -0.12 -2.10 -0.08 0.00 0.26 0.00 0.00 34.13 32.09 2oxy s GLU 264 CO 0.02 -0.15 1.32 -0.51 -0.54 0.00 0.00 175.26 175.41 2oxy s LEU 265 N 1.22 4.14 0.07 2.70 1.43 -1.26 -4.96 118.68 122.03 2oxy s LEU 265 Ca -0.00 2.69 -0.37 0.00 -1.03 0.00 0.00 54.13 55.42 2oxy s LEU 265 Cb -0.14 -3.97 -0.17 0.00 0.03 0.00 0.00 46.19 41.94 2oxy s LEU 265 CO -0.07 -0.99 1.34 -0.67 0.23 0.00 0.00 176.35 176.19 2oxy n ASP 266 N -0.09 1.58 -0.23 2.29 2.03 -1.26 -4.71 116.55 116.16 2oxy n ASP 266 Ca 0.05 1.12 0.21 0.00 0.52 0.00 0.00 54.79 56.69 2oxy n ASP 266 Cb 0.44 -1.17 0.55 0.00 -0.72 0.00 0.00 41.12 40.22 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 4.57 0.31 -0.06 -0.67 0.11 -1.99 0.32 132.00 134.59 2oxy h PRO 267 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2oxy h PRO 267 Cb 1.34 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2oxy h PRO 267 CO 0.78 0.21 0.04 0.37 -0.21 0.00 0.00 178.00 179.18 2oxy h GLN 268 N 0.32 0.07 -0.43 1.05 5.75 -2.00 -1.30 115.11 118.58 2oxy h GLN 268 Ca 0.46 -0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.86 2oxy h GLN 268 Cb 1.27 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.79 2oxy h GLN 268 CO -0.15 0.05 -0.14 1.25 -2.65 0.00 0.00 178.83 177.19 2oxy h LEU 269 N 0.08 0.80 -0.36 -2.39 5.85 -1.33 -1.74 115.31 116.21 2oxy h LEU 269 Ca 0.02 -0.25 0.03 0.00 0.84 0.00 0.00 57.88 58.52 2oxy h LEU 269 Cb -0.00 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 2oxy h LEU 269 CO -0.01 0.95 0.16 -0.08 -0.34 0.00 0.00 178.44 179.11 2oxy h GLU 270 N 0.72 0.33 -0.76 1.25 4.81 -1.09 -1.01 114.58 118.82 2oxy h GLU 270 Ca 0.12 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.28 2oxy h GLU 270 Cb 0.63 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 2oxy h GLU 270 CO 0.04 0.22 0.27 0.00 -0.73 0.00 0.00 179.01 178.81 2oxy h ALA 271 N 1.21 1.05 -0.39 2.92 0.00 -1.07 -2.31 119.26 120.67 2oxy h ALA 271 Ca 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2oxy h ALA 271 Cb 0.10 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2oxy h ALA 271 CO -0.13 0.66 0.15 1.25 0.00 0.00 0.00 179.25 181.17 2oxy h LEU 272 N 1.11 0.54 -0.61 0.00 5.85 -0.99 -3.09 115.31 118.12 2oxy h LEU 272 Ca 0.25 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2oxy h LEU 272 Cb 0.25 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2oxy h LEU 272 CO -0.02 0.56 0.31 0.58 -0.34 0.00 0.00 178.44 179.54 2oxy h VAL 273 N 0.48 1.21 0.00 1.05 2.07 -1.00 -3.48 116.25 116.58 2oxy h VAL 273 Ca 0.13 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2oxy h VAL 273 Cb 0.20 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 2oxy h VAL 273 CO -0.01 0.24 0.00 0.61 0.02 0.00 0.00 177.57 178.43 2oxy n GLY 274 N -0.97 1.60 2.82 2.17 0.00 -0.89 -4.73 105.19 105.19 2oxy n GLY 274 Ca 0.04 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 45.22 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 0.42 -0.02 1.61 0.52 -1.26 -4.97 118.95 115.25 2oxy s ARG 275 Ca 0.00 0.05 -0.07 0.00 -0.52 0.00 0.00 55.73 55.19 2oxy s ARG 275 Cb 0.00 -0.59 0.01 0.00 0.52 0.00 0.00 34.95 34.89 2oxy s ARG 275 CO 0.00 -0.14 0.15 -1.01 0.02 0.00 0.00 175.30 174.32 2oxy s HIS 276 N 1.11 -0.03 0.44 -0.53 3.76 -1.26 -5.00 115.29 113.77 2oxy s HIS 276 Ca -0.09 0.06 -0.21 0.00 -0.15 0.00 0.00 55.06 54.67 2oxy s HIS 276 Cb -0.14 -0.01 -0.11 0.00 1.11 0.00 0.00 32.58 33.44 2oxy s HIS 276 CO -0.02 -0.23 0.96 -1.12 -0.85 0.00 0.00 174.74 173.48 2oxy s SER 277 N -0.93 6.89 0.20 1.40 0.01 -1.26 -1.70 113.70 118.31 2oxy s SER 277 Ca -0.10 1.70 -0.33 0.00 1.31 0.00 0.00 55.95 58.53 2oxy s SER 277 Cb -0.06 -2.54 -0.13 0.00 0.21 0.00 0.00 66.02 63.51 2oxy s SER 277 CO 0.01 -0.39 1.67 -1.14 0.41 0.00 0.00 173.24 173.79 2oxy n ARG 278 N -0.70 2.56 -3.46 12.44 0.63 -1.26 -4.29 116.66 122.58 2oxy n ARG 278 Ca 0.07 0.92 -0.38 0.00 -0.92 0.00 0.00 57.85 57.55 2oxy n ARG 278 Cb 0.54 -2.74 -0.08 0.00 0.45 0.00 0.00 32.46 30.62 2oxy n ARG 278 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2oxy s LYS 279 N 0.99 4.10 0.32 -0.14 2.20 0.52 -4.96 119.74 122.77 2oxy s LYS 279 Ca 0.76 0.03 -0.29 0.00 -0.36 0.00 0.00 55.97 56.11 2oxy s LYS 279 Cb -0.56 -3.57 -0.11 0.00 -1.51 0.00 0.00 37.83 32.08 2oxy s LYS 279 CO 0.35 -0.08 1.48 -2.14 -0.36 0.00 0.00 175.35 174.60 2oxy s PRO 280 N 1.44 4.18 0.30 4.03 0.02 -1.26 -4.82 135.00 138.89 2oxy s PRO 280 Ca 0.15 2.47 0.06 0.00 0.02 0.00 0.00 61.00 63.70 2oxy s PRO 280 Cb -0.15 -3.02 0.76 0.00 0.02 0.00 0.00 34.50 32.11 2oxy s PRO 280 CO 0.08 -0.49 1.74 -1.49 -0.33 0.00 0.00 177.00 176.51 2oxy h TRP 281 N 3.94 0.93 -0.15 6.54 4.06 -1.97 -1.76 115.95 127.55 2oxy h TRP 281 Ca -0.49 0.04 0.04 0.00 2.06 0.00 0.00 58.89 60.54 2oxy h TRP 281 Cb 1.23 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 29.12 2oxy h TRP 281 CO 0.56 0.11 0.27 -0.07 -3.56 0.00 0.00 178.44 175.76 2oxy h LEU 282 N 0.61 0.00 -1.30 -4.49 4.07 -1.98 -0.89 115.31 111.33 2oxy h LEU 282 Ca 0.58 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.54 2oxy h LEU 282 Cb 1.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.76 2oxy h LEU 282 CO -0.44 0.00 0.00 0.11 -1.08 0.00 0.00 178.44 177.03 2oxy h LYS 283 N 0.00 0.00 0.00 1.13 1.79 -1.69 -2.01 116.57 115.79 2oxy h LYS 283 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 2oxy h LYS 283 Cb 0.61 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 2oxy h LYS 283 CO -0.00 0.00 -0.49 1.19 -1.08 0.00 0.00 179.45 179.07 2oxy n PHE 284 N -2.37 0.20 -2.56 -1.35 3.72 -0.34 -4.90 117.46 109.86 2oxy n PHE 284 Ca -0.00 0.06 -0.39 0.00 -0.05 0.00 0.00 57.45 57.06 2oxy n PHE 284 Cb 0.12 -0.42 -0.05 0.00 -0.94 0.00 0.00 39.48 38.19 2oxy n PHE 284 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 2oxy s MET 285 N -3.06 4.58 0.37 -1.08 1.75 -0.76 -4.92 119.30 116.18 2oxy s MET 285 Ca 0.10 1.65 -0.07 0.00 -1.25 0.00 0.00 55.69 56.12 2oxy s MET 285 Cb 0.16 -3.05 0.03 0.00 2.84 0.00 0.00 34.83 34.81 2oxy s MET 285 CO 0.69 0.20 0.61 0.27 -0.65 0.00 0.00 175.02 176.14 2oxy n ASN 286 N 0.95 -1.73 0.12 1.11 0.23 -1.26 -5.01 115.26 109.66 2oxy n ASN 286 Ca 0.00 -2.79 0.02 0.00 -0.53 0.00 0.00 54.58 51.27 2oxy n ASN 286 Cb 0.47 3.06 0.36 0.00 -2.08 0.00 0.00 39.78 41.58 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 1.43 -0.38 -2.53 0.00 -2.00 -0.86 119.26 116.94 2oxy h ALA 287 Ca -0.30 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.25 2oxy h ALA 287 Cb 1.22 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2oxy h ALA 287 CO 0.39 0.40 -0.23 0.22 0.00 0.00 0.00 179.25 180.03 2oxy h ASP 288 N 0.21 0.77 -0.02 0.00 3.58 -1.99 -3.34 116.42 115.63 2oxy h ASP 288 Ca 0.04 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.21 2oxy h ASP 288 Cb 0.47 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.31 2oxy h ASP 288 CO 0.03 0.98 -0.17 -0.46 -2.88 0.00 0.00 179.24 176.75 2oxy n ASN 289 N -4.11 1.96 0.25 2.28 0.23 -1.06 -4.71 115.26 110.10 2oxy n ASN 289 Ca -0.00 -1.48 0.09 0.00 -0.53 0.00 0.00 54.58 52.66 2oxy n ASN 289 Cb 0.44 0.24 0.67 0.00 -2.08 0.00 0.00 39.78 39.05 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 2.44 0.00 0.00 -3.83 3.07 -1.29 -0.38 115.11 115.12 2oxy h GLN 290 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2oxy h GLN 290 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.16 2oxy h GLN 290 CO 0.00 0.00 0.00 -2.39 0.09 0.00 0.00 178.83 176.53 2oxy n HIS 291 N -4.47 0.64 0.92 0.06 1.44 -1.26 -2.26 115.22 110.29 2oxy n HIS 291 Ca -0.02 0.30 0.10 0.00 -2.01 0.00 0.00 57.72 56.08 2oxy n HIS 291 Cb 0.11 -0.98 -0.05 0.00 0.12 0.00 0.00 29.99 29.19 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 -2.13 1.47 -4.55 2.39 4.77 -0.16 -4.49 117.00 114.30 2oxy n LEU 292 Ca 0.00 -0.64 -0.34 0.00 -0.03 0.00 0.00 56.01 55.00 2oxy n LEU 292 Cb 0.10 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.08 2oxy n LEU 292 CO 0.12 0.30 -0.34 -0.69 -1.33 0.00 0.00 177.39 175.45 2oxy s VAL 293 N -2.55 4.03 0.15 4.08 1.01 -0.96 -4.89 120.40 121.27 2oxy s VAL 293 Ca 0.13 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 2oxy s VAL 293 Cb 0.16 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2oxy s VAL 293 CO 0.65 0.52 0.22 -0.94 0.00 0.00 0.00 175.10 175.54 2oxy s SER 294 N 0.05 0.12 0.28 3.32 1.04 -1.26 -4.97 113.70 112.27 2oxy s SER 294 Ca 0.01 -0.94 -0.03 0.00 0.48 0.00 0.00 55.95 55.46 2oxy s SER 294 Cb -0.13 0.39 0.38 0.00 0.10 0.00 0.00 66.02 66.76 2oxy s SER 294 CO 0.02 -0.84 1.94 -0.65 0.98 0.00 0.00 173.24 174.70 2oxy h PRO 295 N 2.64 1.17 -0.55 4.02 0.11 -2.00 -2.19 132.00 135.21 2oxy h PRO 295 Ca -0.33 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.64 2oxy h PRO 295 Cb 1.22 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 2oxy h PRO 295 CO 0.52 0.78 0.06 1.05 -0.21 0.00 0.00 178.00 180.19 2oxy h GLU 296 N 1.21 0.89 0.09 1.05 9.09 -1.98 -1.37 114.58 123.57 2oxy h GLU 296 Ca 0.34 -0.22 -0.00 0.00 0.05 0.00 0.00 59.36 59.52 2oxy h GLU 296 Cb -0.09 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 26.90 2oxy h GLU 296 CO -0.08 0.85 -0.04 0.00 0.05 0.00 0.00 179.01 179.78 2oxy h ALA 297 N 1.23 -0.12 -0.31 1.06 0.00 -1.87 -1.23 119.26 118.02 2oxy h ALA 297 Ca 0.17 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.09 2oxy h ALA 297 Cb 0.41 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2oxy h ALA 297 CO 0.01 -0.55 0.03 0.82 0.00 0.00 0.00 179.25 179.56 2oxy h ILE 298 N -0.16 0.81 -0.64 0.00 1.08 -1.38 0.06 117.51 117.29 2oxy h ILE 298 Ca -0.01 -0.05 -0.03 0.00 -0.39 0.00 0.00 64.86 64.38 2oxy h ILE 298 Cb 0.13 0.67 -0.03 0.00 -3.07 0.00 0.00 36.82 34.51 2oxy h ILE 298 CO 0.02 0.02 0.26 -0.78 -0.69 0.00 0.00 178.15 176.99 2oxy h ASP 299 N 0.13 0.86 -0.04 1.72 3.58 -1.15 0.26 116.42 121.78 2oxy h ASP 299 Ca 0.15 -0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 2oxy h ASP 299 Cb 0.18 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2oxy h ASP 299 CO -0.22 0.76 0.01 0.15 -2.88 0.00 0.00 179.24 177.07 2oxy h PHE 300 N 0.93 0.06 -0.51 0.28 3.57 -0.93 -2.49 116.94 117.85 2oxy h PHE 300 Ca 0.22 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.77 2oxy h PHE 300 Cb 0.17 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.84 2oxy h PHE 300 CO 0.01 0.23 0.22 1.25 -2.23 0.00 0.00 178.31 177.79 2oxy h LEU 301 N -0.12 0.27 -1.80 0.59 5.85 -0.56 -2.25 115.31 117.29 2oxy h LEU 301 Ca 0.01 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2oxy h LEU 301 Cb 0.20 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 2oxy h LEU 301 CO -0.00 0.19 -0.04 -0.78 -0.34 0.00 0.00 178.44 177.47 2oxy h ASP 302 N 0.43 0.07 0.74 1.25 3.58 -0.85 -0.88 116.42 120.74 2oxy h ASP 302 Ca 0.24 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2oxy h ASP 302 Cb 0.21 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.24 2oxy h ASP 302 CO -0.21 0.12 -0.31 0.29 -2.88 0.00 0.00 179.24 176.26 2oxy n LYS 303 N -4.45 0.03 -0.09 0.28 5.02 -0.87 -3.88 118.16 114.20 2oxy n LYS 303 Ca -0.02 0.01 -0.21 0.00 -2.02 0.00 0.00 58.31 56.07 2oxy n LYS 303 Cb 0.15 -1.52 -0.12 0.00 -0.02 0.00 0.00 35.03 33.52 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 -1.56 2.61 -4.05 -0.35 4.77 -0.59 -1.81 117.00 116.03 2oxy n LEU 304 Ca 0.06 0.08 -0.43 0.00 -0.03 0.00 0.00 56.01 55.69 2oxy n LEU 304 Cb 0.35 -0.95 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 2oxy n LEU 304 CO 0.32 0.80 1.87 0.18 -1.33 0.00 0.00 177.39 179.23 2oxy n LEU 305 N -3.60 6.21 -4.48 2.23 4.77 -0.44 -4.50 117.00 117.20 2oxy n LEU 305 Ca -0.43 -4.52 -0.33 0.00 -0.03 0.00 0.00 56.01 50.71 2oxy n LEU 305 Cb 0.96 -1.55 -0.13 0.00 -2.33 0.00 0.00 43.42 40.37 2oxy n LEU 305 CO 0.26 1.12 -0.44 -0.13 -1.33 0.00 0.00 177.39 176.86 2oxy s ARG 306 N 1.13 2.62 0.15 3.23 1.81 -1.26 -4.91 118.95 121.72 2oxy s ARG 306 Ca 0.42 -0.68 -0.20 0.00 -1.72 0.00 0.00 55.73 53.55 2oxy s ARG 306 Cb 0.06 -2.43 0.04 0.00 -0.45 0.00 0.00 34.95 32.18 2oxy s ARG 306 CO -0.00 0.58 1.66 1.88 -0.68 0.00 0.00 175.30 178.74 2oxy h TYR 307 N 5.48 -0.38 -3.12 -0.53 0.05 -1.91 -3.40 116.97 113.16 2oxy h TYR 307 Ca -0.44 0.03 -0.56 0.00 0.05 0.00 0.00 58.73 57.81 2oxy h TYR 307 Cb 1.16 0.21 -0.06 0.00 1.01 0.00 0.00 36.73 39.05 2oxy h TYR 307 CO 0.51 -0.22 1.07 0.34 -1.05 0.00 0.00 178.16 178.80 2oxy s ASP 308 N -5.12 6.27 0.53 3.88 -1.08 -1.26 -4.72 116.67 115.17 2oxy s ASP 308 Ca -0.14 0.55 0.21 0.00 -0.52 0.00 0.00 52.55 52.65 2oxy s ASP 308 Cb 0.12 -2.54 1.38 0.00 -1.46 0.00 0.00 42.92 40.42 2oxy s ASP 308 CO 0.69 -1.54 2.10 1.12 0.52 0.00 0.00 175.17 178.05 2oxy h HIS 309 N 10.75 0.00 0.00 -5.34 2.07 -1.96 -0.01 115.15 120.66 2oxy h HIS 309 Ca -0.27 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.25 2oxy h HIS 309 Cb 1.10 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.08 2oxy h HIS 309 CO 1.00 0.00 -0.01 1.96 -3.07 0.00 0.00 177.93 177.81 2oxy h GLN 310 N 0.00 0.00 0.00 5.12 1.08 -1.95 -2.91 115.11 116.46 2oxy h GLN 310 Ca 0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2oxy h GLN 310 Cb 0.40 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 2oxy h GLN 310 CO -0.00 0.01 -0.85 0.93 -0.95 0.00 0.00 178.83 177.97 2oxy h GLU 311 N 0.00 0.00 -7.08 1.46 5.08 -1.38 -3.48 114.58 109.18 2oxy h GLU 311 Ca -0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 2oxy h GLU 311 Cb 0.34 0.00 0.10 0.00 0.50 0.00 0.00 28.75 29.69 2oxy h GLU 311 CO 0.00 0.00 0.47 1.03 -1.00 0.00 0.00 179.01 179.51 2oxy s ARG 312 N -3.32 3.19 0.27 2.33 0.52 -1.10 -4.97 118.95 115.87 2oxy s ARG 312 Ca 0.01 1.78 -0.30 0.00 -0.52 0.00 0.00 55.73 56.71 2oxy s ARG 312 Cb 0.10 -2.03 -0.13 0.00 0.52 0.00 0.00 34.95 33.41 2oxy s ARG 312 CO 0.77 -1.02 1.26 1.28 0.02 0.00 0.00 175.30 177.61 2oxy n LEU 313 N -1.34 2.78 -4.79 2.53 4.77 -0.75 -5.01 117.00 115.19 2oxy n LEU 313 Ca 0.12 1.17 -0.31 0.00 -0.03 0.00 0.00 56.01 56.97 2oxy n LEU 313 Cb 0.50 -1.39 0.08 0.00 -2.33 0.00 0.00 43.42 40.27 2oxy n LEU 313 CO 0.45 -0.78 0.70 0.42 -1.33 0.00 0.00 177.39 176.85 2oxy s THR 314 N -0.61 3.46 0.23 -5.08 -4.23 -1.26 -4.87 115.64 103.28 2oxy s THR 314 Ca 0.63 0.48 -0.08 0.00 -1.18 0.00 0.00 61.69 61.53 2oxy s THR 314 Cb -0.66 -3.12 0.20 0.00 1.34 0.00 0.00 72.50 70.26 2oxy s THR 314 CO 0.56 -0.62 1.89 0.00 -0.54 0.00 0.00 174.62 175.91 2oxy h ALA 315 N -1.01 1.09 0.01 3.99 0.00 -1.94 -0.24 119.26 121.16 2oxy h ALA 315 Ca -0.45 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2oxy h ALA 315 Cb 1.24 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2oxy h ALA 315 CO 0.56 0.52 -0.00 1.25 0.00 0.00 0.00 179.25 181.57 2oxy h LEU 316 N 1.17 -0.01 -0.84 0.00 5.85 -1.93 -2.43 115.31 117.11 2oxy h LEU 316 Ca 0.31 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 59.04 2oxy h LEU 316 Cb -0.11 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.87 2oxy h LEU 316 CO -0.06 0.03 0.53 -0.33 -0.34 0.00 0.00 178.44 178.27 2oxy h GLU 317 N -0.05 0.95 -0.96 1.25 5.08 -1.89 -2.69 114.58 116.27 2oxy h GLU 317 Ca -0.00 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2oxy h GLU 317 Cb 0.05 -0.22 -0.06 0.00 0.50 0.00 0.00 28.75 29.03 2oxy h GLU 317 CO 0.00 0.63 0.63 0.00 -1.00 0.00 0.00 179.01 179.27 2oxy h ALA 318 N 1.38 1.29 0.00 3.43 0.00 -0.82 -1.64 119.26 122.90 2oxy h ALA 318 Ca 0.36 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2oxy h ALA 318 Cb 0.12 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2oxy h ALA 318 CO -0.15 0.48 0.00 0.52 0.00 0.00 0.00 179.25 180.10 2oxy h MET 319 N 1.19 0.00 -0.00 0.00 2.86 -1.09 -1.33 114.93 116.56 2oxy h MET 319 Ca 0.39 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.03 2oxy h MET 319 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 2oxy h MET 319 CO -0.14 0.00 -0.15 0.25 1.06 0.00 0.00 176.91 177.94 2oxy n THR 320 N -3.03 0.00 -2.11 2.22 -2.24 -0.62 -4.85 114.28 103.65 2oxy n THR 320 Ca -0.01 -0.07 -0.39 0.00 -2.27 0.00 0.00 64.05 61.31 2oxy n THR 320 Cb 0.20 -0.01 -0.01 0.00 -2.10 0.00 0.00 70.33 68.41 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 -2.53 2.90 0.60 4.78 2.46 -0.50 -4.91 115.29 118.09 2oxy s HIS 321 Ca 0.27 1.44 0.29 0.00 0.47 0.00 0.00 55.06 57.53 2oxy s HIS 321 Cb 0.20 -3.62 1.66 0.00 -0.13 0.00 0.00 32.58 30.69 2oxy s HIS 321 CO 0.50 -1.91 2.08 -1.00 -2.47 0.00 0.00 174.74 171.93 2oxy h PRO 322 N 2.76 0.00 -0.81 2.88 0.13 -1.92 -1.60 132.00 133.43 2oxy h PRO 322 Ca -0.49 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.86 2oxy h PRO 322 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 2oxy h PRO 322 CO 0.63 0.00 0.57 -0.92 -0.23 0.00 0.00 178.00 178.05 2oxy h TYR 323 N 0.00 0.12 -0.32 1.56 3.20 -1.91 -0.81 116.97 118.81 2oxy h TYR 323 Ca 0.09 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 2oxy h TYR 323 Cb 0.56 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.80 2oxy h TYR 323 CO 0.00 0.03 0.00 1.19 -1.64 0.00 0.00 178.16 177.74 2oxy n PHE 324 N -4.35 0.42 -0.31 -3.82 3.72 -0.60 -4.63 117.46 107.88 2oxy n PHE 324 Ca 0.17 -0.21 -0.04 0.00 -0.05 0.00 0.00 57.45 57.32 2oxy n PHE 324 Cb 0.82 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.44 2oxy n PHE 324 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 2oxy h GLN 325 N 2.55 1.15 -0.30 -1.08 -0.00 -1.27 -1.07 115.11 115.10 2oxy h GLN 325 Ca 0.00 -0.11 -0.13 0.00 -0.00 0.00 0.00 58.65 58.41 2oxy h GLN 325 Cb 0.57 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.48 27.80 2oxy h GLN 325 CO 0.00 0.81 -0.36 0.37 -0.00 0.00 0.00 178.83 179.65 2oxy h GLN 326 N 1.16 0.67 0.08 0.06 4.15 -1.82 -1.23 115.11 118.18 2oxy h GLN 326 Ca 0.30 -0.33 -0.00 0.00 0.77 0.00 0.00 58.65 59.39 2oxy h GLN 326 Cb -0.04 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.65 2oxy h GLN 326 CO -0.06 0.93 -0.04 0.28 -1.93 0.00 0.00 178.83 178.02 2oxy h VAL 327 N 0.56 0.95 -0.85 2.39 2.07 -1.75 -2.00 116.25 117.62 2oxy h VAL 327 Ca 0.05 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.55 2oxy h VAL 327 Cb 0.88 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 31.61 2oxy h VAL 327 CO 0.08 0.02 0.55 0.03 0.02 0.00 0.00 177.57 178.28 2oxy h ARG 328 N -0.15 0.90 -0.95 1.57 3.08 -1.15 -2.64 114.38 115.04 2oxy h ARG 328 Ca -0.01 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.99 2oxy h ARG 328 Cb 0.12 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 29.92 2oxy h ARG 328 CO 0.02 0.60 0.62 0.00 -1.07 0.00 0.00 179.97 180.13 2oxy h ALA 329 N 1.54 1.21 0.00 0.04 0.00 -0.75 -2.85 119.26 118.45 2oxy h ALA 329 Ca 0.37 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 2oxy h ALA 329 Cb 0.24 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2oxy h ALA 329 CO -0.14 0.62 -0.46 0.00 0.00 0.00 0.00 179.25 179.27 2oxy h ALA 330 N 1.34 1.05 0.00 0.00 0.00 -1.03 -3.25 119.26 117.37 2oxy h ALA 330 Ca 0.35 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2oxy h ALA 330 Cb -0.13 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2oxy h ALA 330 CO -0.07 0.57 0.00 0.39 0.00 0.00 0.00 179.25 180.14 2oxy n GLU 331 N -3.71 0.88 -4.42 0.00 1.02 -1.04 -4.82 120.64 108.55 2oxy n GLU 331 Ca -0.01 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.87 2oxy n GLU 331 Cb 0.53 -1.06 -0.11 0.00 -0.02 0.00 0.00 31.44 30.78 2oxy n GLU 331 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2oxy s ASN 332 N 1.80 3.58 0.00 1.62 2.47 -1.23 -5.05 114.94 118.13 2oxy s ASN 332 Ca 0.00 -0.87 0.09 0.00 0.42 0.00 0.00 52.86 52.50 2oxy s ASN 332 Cb 0.00 -0.33 0.54 0.00 -1.45 0.00 0.00 41.25 40.02 2oxy s ASN 332 CO 0.00 0.10 0.99 -0.24 -3.72 0.00 0.00 177.10 174.23