#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1owd s ILE 2 N 0.00 4.94 0.00 1.39 -1.09 -0.08 -4.01 121.20 122.36 1owd s ILE 2 Ca 0.00 1.44 0.00 0.00 -2.23 0.00 0.00 60.65 59.86 1owd s ILE 2 Cb 0.00 -4.03 0.00 0.00 -1.58 0.00 0.00 42.46 36.85 1owd s ILE 2 CO 0.00 0.32 0.00 0.61 -1.23 0.00 0.00 174.94 174.64 1owd n GLY 3 N 2.79 1.40 7.00 6.18 0.00 -1.26 -3.05 105.19 118.26 1owd n GLY 3 Ca -0.03 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1owd n GLY 3 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1owd n GLY 4 N 0.00 -0.63 2.99 -0.02 0.00 -1.26 -4.90 105.19 101.37 1owd n GLY 4 Ca 0.00 -1.13 -0.09 0.00 0.00 0.00 0.00 46.02 44.80 1owd n GLY 4 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1owd s GLU 5 N 0.00 0.34 0.84 1.61 2.02 -0.74 -5.01 118.70 117.77 1owd s GLU 5 Ca 0.00 -0.66 -0.12 0.00 0.02 0.00 0.00 54.97 54.21 1owd s GLU 5 Cb 0.00 0.12 0.10 0.00 0.10 0.00 0.00 34.13 34.45 1owd s GLU 5 CO 0.00 -0.06 1.10 -0.06 0.02 0.00 0.00 175.26 176.26 1owd s PHE 6 N -1.70 2.63 0.27 1.61 0.40 -1.26 -1.69 117.98 118.24 1owd s PHE 6 Ca -0.14 1.14 -0.12 0.00 -0.60 0.00 0.00 56.93 57.21 1owd s PHE 6 Cb -0.08 -3.17 0.05 0.00 0.51 0.00 0.00 43.02 40.33 1owd s PHE 6 CO -0.02 -2.04 0.64 -2.37 0.70 0.00 0.00 175.22 172.13 1owd n THR 7 N -3.62 0.00 -4.30 0.64 5.66 -0.64 -4.79 114.28 107.23 1owd n THR 7 Ca 0.07 -0.69 -0.18 0.00 -3.05 0.00 0.00 64.05 60.20 1owd n THR 7 Cb 0.56 0.72 -0.10 0.00 -1.55 0.00 0.00 70.33 69.96 1owd n THR 7 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1owd s THR 8 N -2.29 1.55 0.56 1.09 -4.23 -1.26 -4.24 115.64 106.81 1owd s THR 8 Ca 0.13 -2.06 0.26 0.00 -1.18 0.00 0.00 61.69 58.84 1owd s THR 8 Cb -0.03 -1.88 0.36 0.00 1.34 0.00 0.00 72.50 72.29 1owd s THR 8 CO 0.08 -0.57 2.05 -0.29 -0.54 0.00 0.00 174.62 175.36 1owd h ILE 9 N 2.86 0.63 -0.01 2.99 6.09 -1.85 -1.03 117.51 127.19 1owd h ILE 9 Ca -0.38 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.11 1owd h ILE 9 Cb 1.21 0.80 -0.00 0.00 0.47 0.00 0.00 36.82 39.30 1owd h ILE 9 CO 0.59 0.00 0.03 1.05 -3.07 0.00 0.00 178.15 176.75 1owd h GLU 10 N 0.00 0.00 0.00 2.19 4.11 -1.90 0.39 114.58 119.37 1owd h GLU 10 Ca 0.15 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.44 1owd h GLU 10 Cb 0.67 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1owd h GLU 10 CO -0.00 0.00 -1.17 -0.91 0.07 0.00 0.00 179.01 177.00 1owd h ASN 11 N 0.00 0.00 -2.19 3.06 -0.26 -1.56 -3.39 115.58 111.24 1owd h ASN 11 Ca 0.00 0.00 -0.56 0.00 -0.56 0.00 0.00 56.30 55.18 1owd h ASN 11 Cb 0.07 0.00 -0.41 0.00 -1.06 0.00 0.00 38.32 36.92 1owd h ASN 11 CO -0.00 0.49 -0.80 0.00 -1.06 0.00 0.00 177.43 176.06 1owd n GLN 12 N -2.93 2.47 0.31 0.81 1.13 0.07 -4.96 117.38 114.28 1owd n GLN 12 Ca -0.06 -4.39 0.14 0.00 -1.94 0.00 0.00 57.00 50.75 1owd n GLN 12 Cb 0.78 -2.06 0.76 0.00 0.11 0.00 0.00 30.24 29.83 1owd n GLN 12 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1owd h PRO 13 N 3.17 0.00 -0.07 -1.09 0.13 -1.60 -2.02 132.00 130.53 1owd h PRO 13 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1owd h PRO 13 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1owd h PRO 13 CO 0.72 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.82 1owd n TRP 14 N -2.78 0.05 -2.41 1.56 2.14 -1.15 -1.11 117.44 113.74 1owd n TRP 14 Ca -0.02 -0.03 -0.41 0.00 2.07 0.00 0.00 57.50 59.12 1owd n TRP 14 Cb 0.37 -0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.84 1owd n TRP 14 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 1owd s PHE 15 N -1.94 3.48 -0.11 -2.67 5.36 -0.76 -1.43 117.98 119.91 1owd s PHE 15 Ca 0.29 1.55 0.04 0.00 -0.96 0.00 0.00 56.93 57.84 1owd s PHE 15 Cb 0.20 -3.37 0.00 0.00 -0.34 0.00 0.00 43.02 39.51 1owd s PHE 15 CO 0.30 -0.93 -0.23 0.00 -1.46 0.00 0.00 175.22 172.90 1owd s ALA 16 N -0.54 2.14 -0.37 11.12 0.00 0.91 -4.48 121.76 130.54 1owd s ALA 16 Ca 0.49 -0.97 -0.16 0.00 0.00 0.00 0.00 51.96 51.32 1owd s ALA 16 Cb -0.32 -0.84 -0.00 0.00 0.00 0.00 0.00 23.12 21.95 1owd s ALA 16 CO 0.39 0.21 0.39 0.00 0.00 0.00 0.00 175.76 176.75 1owd s ALA 17 N 0.47 3.47 -0.33 0.00 0.00 -0.58 -1.38 121.76 123.40 1owd s ALA 17 Ca -0.16 -1.32 -0.11 0.00 0.00 0.00 0.00 51.96 50.37 1owd s ALA 17 Cb -0.17 -2.90 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 1owd s ALA 17 CO 0.06 -1.25 0.20 0.42 0.00 0.00 0.00 175.76 175.20 1owd s ILE 18 N 2.05 4.95 0.45 0.00 1.01 -0.58 -0.93 121.20 128.15 1owd s ILE 18 Ca 0.12 -0.37 0.07 0.00 0.00 0.00 0.00 60.65 60.46 1owd s ILE 18 Cb -0.17 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.73 1owd s ILE 18 CO 0.12 -0.01 0.31 -0.31 0.00 0.00 0.00 174.94 175.05 1owd s TYR 19 N 1.66 2.34 -0.07 3.97 1.51 0.12 -0.74 117.35 126.14 1owd s TYR 19 Ca 0.05 -0.64 -0.03 0.00 -1.01 0.00 0.00 57.07 55.45 1owd s TYR 19 Cb -0.17 -2.01 0.04 0.00 -0.11 0.00 0.00 41.96 39.70 1owd s TYR 19 CO 0.08 -0.11 0.14 0.50 -1.11 0.00 0.00 175.55 175.06 1owd s ARG 20 N -4.09 0.08 0.15 -0.62 3.52 -0.93 -0.51 118.95 116.56 1owd s ARG 20 Ca 0.41 0.38 -0.30 0.00 -0.13 0.00 0.00 55.73 56.08 1owd s ARG 20 Cb -0.00 -0.19 -0.07 0.00 -1.56 0.00 0.00 34.95 33.13 1owd s ARG 20 CO 0.24 -0.18 1.08 1.03 -0.81 0.00 0.00 175.30 176.66 1owd s ARG 21 N 1.25 4.60 0.49 5.12 0.52 0.82 -2.83 118.95 128.92 1owd s ARG 21 Ca -0.08 1.66 0.08 0.00 -0.52 0.00 0.00 55.73 56.87 1owd s ARG 21 Cb -0.12 -3.31 0.03 0.00 0.52 0.00 0.00 34.95 32.07 1owd s ARG 21 CO -0.06 0.08 0.54 -1.01 0.02 0.00 0.00 175.30 174.86 1owd s HIS 22 N -0.07 2.15 0.24 -0.53 3.76 0.38 -4.90 115.29 116.32 1owd s HIS 22 Ca 0.50 -0.61 -0.30 0.00 -0.15 0.00 0.00 55.06 54.50 1owd s HIS 22 Cb -0.28 -2.17 -0.09 0.00 1.11 0.00 0.00 32.58 31.14 1owd s HIS 22 CO 0.33 -0.54 1.36 1.03 -0.85 0.00 0.00 174.74 176.07 1owd s ARG 23 N -4.35 4.34 0.00 1.40 3.00 -1.26 -1.85 118.95 120.23 1owd s ARG 23 Ca 0.50 2.17 0.00 0.00 0.00 0.00 0.00 55.73 58.41 1owd s ARG 23 Cb -0.05 -3.14 0.00 0.00 0.00 0.00 0.00 34.95 31.76 1owd s ARG 23 CO 0.31 -0.31 0.00 0.41 0.00 0.00 0.00 175.30 175.71 1owd n GLY 23 N 2.09 3.15 0.00 -3.53 0.00 -1.26 -4.38 105.19 101.26 1owd n GLY 23 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1owd n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1owd n GLY 24 N -0.90 1.51 3.76 -0.02 0.00 -0.77 -5.10 105.19 103.68 1owd n GLY 24 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1owd n GLY 24 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1owd s SER 25 N -1.91 5.89 -0.07 1.61 1.04 -1.26 -4.67 113.70 114.34 1owd s SER 25 Ca 0.00 2.63 0.03 0.00 0.48 0.00 0.00 55.95 59.09 1owd s SER 25 Cb 0.00 -2.63 0.01 0.00 0.10 0.00 0.00 66.02 63.50 1owd s SER 25 CO 0.00 -1.14 -0.15 -0.69 0.98 0.00 0.00 173.24 172.24 1owd s VAL 26 N -1.34 1.35 0.03 5.02 1.01 -1.26 -0.47 120.40 124.75 1owd s VAL 26 Ca 0.64 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 62.06 1owd s VAL 26 Cb -0.37 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 1owd s VAL 26 CO 0.46 0.40 -0.18 0.42 0.00 0.00 0.00 175.10 176.20 1owd s THR 27 N 0.46 1.46 0.39 3.92 -4.23 -1.13 -4.97 115.64 111.54 1owd s THR 27 Ca -0.13 -1.07 -0.27 0.00 -1.18 0.00 0.00 61.69 59.05 1owd s THR 27 Cb -0.15 -1.27 -0.09 0.00 1.34 0.00 0.00 72.50 72.32 1owd s THR 27 CO 0.04 0.18 1.34 -0.47 -0.54 0.00 0.00 174.62 175.17 1owd s TYR 28 N -0.75 2.81 0.00 3.99 6.14 -1.26 -2.18 117.35 126.10 1owd s TYR 28 Ca 0.06 1.36 0.00 0.00 0.64 0.00 0.00 57.07 59.13 1owd s TYR 28 Cb -0.08 -3.75 0.00 0.00 0.42 0.00 0.00 41.96 38.55 1owd s TYR 28 CO 0.01 -2.24 0.00 0.28 0.64 0.00 0.00 175.55 174.24 1owd n VAL 29 N 0.32 0.00 -4.14 3.14 0.31 0.08 -4.89 118.33 113.15 1owd n VAL 29 Ca 0.02 0.09 -0.12 0.00 -0.01 0.00 0.00 64.34 64.32 1owd n VAL 29 Cb 0.42 -0.94 -0.08 0.00 -0.91 0.00 0.00 33.84 32.34 1owd n VAL 29 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1owd s GLY 31 N -3.16 1.79 0.15 0.00 0.00 -0.68 -1.52 107.32 103.90 1owd s GLY 31 Ca 0.33 -1.58 -0.25 0.00 0.00 0.00 0.00 44.72 43.23 1owd s GLY 31 CO 0.14 -1.15 0.85 -0.32 0.00 0.00 0.00 173.10 172.62 1owd s GLY 32 N -4.59 -0.29 -0.03 0.20 0.00 -0.48 -3.76 107.32 98.38 1owd s GLY 32 Ca 0.62 0.24 0.04 0.00 0.00 0.00 0.00 44.72 45.62 1owd s GLY 32 CO 0.41 0.06 -0.15 -0.56 0.00 0.00 0.00 173.10 172.86 1owd s SER 33 N -2.83 1.91 -0.35 1.64 0.01 -0.92 -0.06 113.70 113.09 1owd s SER 33 Ca 0.09 -0.30 -0.28 0.00 1.31 0.00 0.00 55.95 56.77 1owd s SER 33 Cb -0.02 -0.40 0.02 0.00 0.21 0.00 0.00 66.02 65.83 1owd s SER 33 CO -0.01 0.16 1.06 -0.22 0.41 0.00 0.00 173.24 174.64 1owd s LEU 34 N -0.11 3.89 -0.16 2.44 2.96 -0.51 -1.05 118.68 126.14 1owd s LEU 34 Ca 0.00 0.88 -0.25 0.00 -0.22 0.00 0.00 54.13 54.55 1owd s LEU 34 Cb -0.09 -3.50 -0.23 0.00 0.50 0.00 0.00 46.19 42.87 1owd s LEU 34 CO 0.01 -0.94 0.53 0.24 -1.32 0.00 0.00 176.35 174.87 1owd h MET 35 N 8.34 0.03 -3.99 1.98 2.86 -1.28 -2.09 114.93 120.78 1owd h MET 35 Ca -0.21 -0.05 -0.12 0.00 -2.06 0.00 0.00 59.70 57.25 1owd h MET 35 Cb 1.06 0.02 -0.12 0.00 0.06 0.00 0.00 31.60 32.62 1owd h MET 35 CO 1.04 1.02 -0.35 -1.54 1.06 0.00 0.00 176.91 178.15 1owd s SER 36 N -6.57 0.05 0.36 1.22 1.04 -1.15 -4.59 113.70 104.05 1owd s SER 36 Ca -0.23 -1.00 0.17 0.00 0.48 0.00 0.00 55.95 55.37 1owd s SER 36 Cb 0.01 0.45 1.12 0.00 0.10 0.00 0.00 66.02 67.70 1owd s SER 36 CO 0.66 -0.93 1.67 -0.65 0.98 0.00 0.00 173.24 174.98 1owd h PRO 37 N 2.51 0.31 -0.01 4.02 0.11 -1.95 -0.17 132.00 136.83 1owd h PRO 37 Ca -0.31 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1owd h PRO 37 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1owd h PRO 37 CO 0.47 0.21 -0.41 0.00 -0.21 0.00 0.00 178.00 178.06 1owd s TRP 39 N -2.46 1.48 -0.07 0.00 0.52 -0.08 -1.21 118.94 117.12 1owd s TRP 39 Ca 0.20 -0.40 0.05 0.00 0.02 0.00 0.00 56.10 55.97 1owd s TRP 39 Cb 0.18 -1.00 -0.00 0.00 -1.15 0.00 0.00 33.47 31.50 1owd s TRP 39 CO 0.55 -0.13 -0.22 0.08 0.02 0.00 0.00 176.95 177.24 1owd s VAL 40 N 0.04 1.89 -0.14 4.03 1.01 -0.48 -0.88 120.40 125.86 1owd s VAL 40 Ca -0.03 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 1owd s VAL 40 Cb -0.10 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 1owd s VAL 40 CO 0.01 0.53 -0.08 -0.51 0.00 0.00 0.00 175.10 175.04 1owd s ILE 41 N 0.11 3.47 0.00 2.22 2.07 -0.22 -0.99 121.20 127.85 1owd s ILE 41 Ca -0.10 -0.51 0.00 0.00 -1.41 0.00 0.00 60.65 58.63 1owd s ILE 41 Cb -0.15 -2.49 0.00 0.00 0.13 0.00 0.00 42.46 39.95 1owd s ILE 41 CO 0.05 0.51 0.00 -0.24 -1.91 0.00 0.00 174.94 173.36 1owd n SER 42 N 3.48 0.04 -4.51 4.50 2.88 -0.52 -2.17 113.62 117.32 1owd n SER 42 Ca -0.18 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.03 1owd n SER 42 Cb 0.53 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.86 1owd n SER 42 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1owd s ALA 43 N -2.00 2.91 0.42 -1.46 0.00 -1.26 -1.19 121.76 119.18 1owd s ALA 43 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 51.96 51.17 1owd s ALA 43 Cb 0.00 -1.33 0.90 0.00 0.00 0.00 0.00 23.12 22.69 1owd s ALA 43 CO 0.00 0.39 2.05 1.15 0.00 0.00 0.00 175.76 179.35 1owd h THR 44 N 4.77 1.10 0.00 0.00 2.02 -1.74 -2.62 112.91 116.44 1owd h THR 44 Ca -0.38 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1owd h THR 44 Cb 1.19 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 1owd h THR 44 CO 0.56 0.11 0.00 0.00 0.37 0.00 0.00 175.52 176.56 1owd n HIS 45 N -4.46 0.72 0.54 3.16 1.44 -1.26 -1.38 115.22 113.97 1owd n HIS 45 Ca 0.02 0.34 0.13 0.00 -2.01 0.00 0.00 57.72 56.19 1owd n HIS 45 Cb 0.09 -1.04 0.43 0.00 0.12 0.00 0.00 29.99 29.59 1owd n HIS 45 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1owd n PHE 47 N -2.30 0.00 -0.28 0.00 3.72 -0.48 -4.85 117.46 113.27 1owd n PHE 47 Ca 0.04 0.00 0.26 0.00 -0.05 0.00 0.00 57.45 57.70 1owd n PHE 47 Cb 0.37 0.00 0.60 0.00 -0.94 0.00 0.00 39.48 39.51 1owd n PHE 47 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1owd h ILE 48 N 0.00 0.53 0.00 4.37 6.09 -1.53 -0.77 117.51 126.21 1owd h ILE 48 Ca 0.00 -0.08 -0.09 0.00 -1.37 0.00 0.00 64.86 63.32 1owd h ILE 48 Cb 0.00 0.28 -0.01 0.00 0.47 0.00 0.00 36.82 37.56 1owd h ILE 48 CO 0.00 0.04 -0.43 0.44 -3.07 0.00 0.00 178.15 175.13 1owd h ASP 49 N 0.23 0.00 -2.20 2.19 3.32 -1.88 -3.37 116.42 114.71 1owd h ASP 49 Ca 0.53 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 57.00 1owd h ASP 49 Cb 1.64 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.80 1owd h ASP 49 CO -0.15 0.43 -0.98 -1.22 -1.72 0.00 0.00 179.24 175.60 1owd n TYR 50 N -3.24 0.14 0.52 4.55 4.02 -0.34 -5.01 117.16 117.80 1owd n TYR 50 Ca 0.02 -3.60 0.00 0.00 -0.01 0.00 0.00 57.90 54.31 1owd n TYR 50 Cb 0.68 -0.20 0.00 0.00 -0.02 0.00 0.00 39.34 39.80 1owd n TYR 50 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1owd n PRO 51 N 1.81 0.52 -3.47 -0.72 -0.04 -0.91 -4.79 135.00 127.40 1owd n PRO 51 Ca 0.25 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.28 1owd n PRO 51 Cb 0.49 -1.24 -0.10 0.00 -0.04 0.00 0.00 33.50 32.61 1owd n PRO 51 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1owd s LYS 52 N 0.29 2.93 0.62 0.54 1.02 -1.26 -4.96 119.74 118.91 1owd s LYS 52 Ca 0.00 -1.14 0.31 0.00 0.02 0.00 0.00 55.97 55.16 1owd s LYS 52 Cb 0.00 -3.97 1.71 0.00 -0.52 0.00 0.00 37.83 35.05 1owd s LYS 52 CO 0.00 -0.83 2.03 1.57 -0.92 0.00 0.00 175.35 177.21 1owd h LYS 53 N 8.62 0.00 0.00 1.68 2.10 -1.90 -2.37 116.57 124.70 1owd h LYS 53 Ca -0.27 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.29 1owd h LYS 53 Cb 1.11 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.43 1owd h LYS 53 CO 0.76 0.00 -0.41 1.49 -2.00 0.00 0.00 179.45 179.29 1owd h GLU 54 N 0.00 0.00 0.00 0.07 4.57 -1.93 -3.15 114.58 114.14 1owd h GLU 54 Ca 0.07 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1owd h GLU 54 Cb 0.62 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1owd h GLU 54 CO -0.00 0.41 0.00 -0.25 -1.18 0.00 0.00 179.01 177.99 1owd n ASP 55 N -3.91 0.00 -4.85 1.04 8.00 -0.89 -4.88 116.55 111.05 1owd n ASP 55 Ca -0.01 0.17 -0.37 0.00 0.71 0.00 0.00 54.79 55.29 1owd n ASP 55 Cb 0.46 -0.38 -0.06 0.00 -0.02 0.00 0.00 41.12 41.12 1owd n ASP 55 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1owd s TYR 56 N -2.76 3.66 -0.03 1.24 2.02 -1.19 -0.12 117.35 120.17 1owd s TYR 56 Ca 0.19 0.85 0.06 0.00 -0.37 0.00 0.00 57.07 57.80 1owd s TYR 56 Cb 0.17 -2.19 -0.01 0.00 -0.40 0.00 0.00 41.96 39.52 1owd s TYR 56 CO 0.42 0.61 -0.22 0.42 -1.57 0.00 0.00 175.55 175.20 1owd s ILE 57 N -1.20 1.78 -0.08 2.71 1.01 0.33 -4.16 121.20 121.60 1owd s ILE 57 Ca 0.26 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.99 1owd s ILE 57 Cb -0.15 -1.49 0.01 0.00 0.01 0.00 0.00 42.46 40.84 1owd s ILE 57 CO 0.14 0.50 -0.14 -0.69 0.00 0.00 0.00 174.94 174.76 1owd s VAL 58 N -0.36 1.29 0.09 2.92 1.01 -0.72 0.11 120.40 124.74 1owd s VAL 58 Ca 0.04 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 61.55 1owd s VAL 58 Cb -0.10 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 1owd s VAL 58 CO 0.01 0.39 -0.17 -0.31 0.00 0.00 0.00 175.10 175.02 1owd s TYR 59 N 0.80 2.57 -0.01 5.22 1.51 -0.11 -0.57 117.35 126.76 1owd s TYR 59 Ca -0.11 -0.24 0.02 0.00 -1.01 0.00 0.00 57.07 55.72 1owd s TYR 59 Cb -0.16 -1.40 -0.00 0.00 -0.11 0.00 0.00 41.96 40.30 1owd s TYR 59 CO 0.02 0.35 -0.07 -0.51 -1.11 0.00 0.00 175.55 174.23 1owd s LEU 60 N -1.90 1.89 -0.47 -1.29 1.43 -1.07 -1.53 118.68 115.73 1owd s LEU 60 Ca 0.17 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1owd s LEU 60 Cb -0.11 -0.39 0.00 0.00 0.03 0.00 0.00 46.19 45.72 1owd s LEU 60 CO 0.09 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.34 1owd n GLY 61 N 3.11 0.26 3.29 -3.19 0.00 -1.25 -1.73 105.19 105.67 1owd n GLY 61 Ca -0.15 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 1owd n GLY 61 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1owd s ARG 62 N -3.96 2.88 0.07 1.61 3.52 -1.26 -3.70 118.95 118.09 1owd s ARG 62 Ca 0.00 -0.99 0.25 0.00 -0.13 0.00 0.00 55.73 54.86 1owd s ARG 62 Cb 0.00 -3.30 0.42 0.00 -1.56 0.00 0.00 34.95 30.50 1owd s ARG 62 CO 0.00 -0.50 1.36 0.43 -0.81 0.00 0.00 175.30 175.78 1owd n SER 63 N 4.80 0.59 -4.18 -2.12 7.64 -1.26 -4.75 113.62 114.34 1owd n SER 63 Ca -0.14 -0.03 -0.14 0.00 1.01 0.00 0.00 58.87 59.57 1owd n SER 63 Cb 0.47 0.21 -0.11 0.00 -1.01 0.00 0.00 64.21 63.77 1owd n SER 63 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1owd s ARG 64 N -3.10 0.86 0.13 1.43 0.52 -1.26 -2.88 118.95 114.65 1owd s ARG 64 Ca 0.08 -1.20 -0.16 0.00 -0.52 0.00 0.00 55.73 53.93 1owd s ARG 64 Cb 0.15 -0.51 -0.01 0.00 0.52 0.00 0.00 34.95 35.10 1owd s ARG 64 CO 0.71 0.07 1.67 1.25 0.02 0.00 0.00 175.30 179.02 1owd h LEU 65 N 3.43 0.54 -4.73 2.53 5.85 -1.41 -3.34 115.31 118.18 1owd h LEU 65 Ca -0.37 -0.18 -0.51 0.00 0.84 0.00 0.00 57.88 57.66 1owd h LEU 65 Cb 1.19 -0.14 -0.41 0.00 0.37 0.00 0.00 40.66 41.66 1owd h LEU 65 CO 0.55 0.57 -0.89 0.59 -0.34 0.00 0.00 178.44 178.92 1owd n ASN 66 N -4.64 3.53 -3.74 1.25 4.13 -1.26 -5.04 115.26 109.49 1owd n ASN 66 Ca -0.00 -3.36 -0.13 0.00 1.68 0.00 0.00 54.58 52.76 1owd n ASN 66 Cb 0.15 -0.49 -0.10 0.00 -1.54 0.00 0.00 39.78 37.80 1owd n ASN 66 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1owd s SER 67 N -3.38 -0.40 -0.33 6.41 0.01 -1.26 -5.11 113.70 109.64 1owd s SER 67 Ca 0.41 0.77 -0.28 0.00 1.31 0.00 0.00 55.95 58.16 1owd s SER 67 Cb 0.42 0.77 0.02 0.00 0.21 0.00 0.00 66.02 67.43 1owd s SER 67 CO -0.11 -0.14 1.01 0.20 0.41 0.00 0.00 173.24 174.62 1owd s ASN 68 N 0.31 6.84 -0.13 2.44 -0.87 -1.26 -4.52 114.94 117.75 1owd s ASN 68 Ca -0.01 0.89 -0.22 0.00 -1.57 0.00 0.00 52.86 51.96 1owd s ASN 68 Cb -0.03 -2.51 -0.03 0.00 -0.02 0.00 0.00 41.25 38.65 1owd s ASN 68 CO -0.01 -0.86 0.65 -0.89 -2.57 0.00 0.00 177.10 173.43 1owd s THR 69 N 3.56 5.05 -0.28 1.60 2.01 -1.26 -4.99 115.64 121.34 1owd s THR 69 Ca 0.43 1.29 -0.42 0.00 0.31 0.00 0.00 61.69 63.29 1owd s THR 69 Cb -0.12 -3.98 -0.18 0.00 0.01 0.00 0.00 72.50 68.23 1owd s THR 69 CO 0.16 0.20 1.55 0.00 -0.69 0.00 0.00 174.62 175.85 1owd n GLN 70 N 4.28 0.59 -0.00 4.92 -0.00 -1.26 -1.54 117.38 124.36 1owd n GLN 70 Ca -0.02 0.21 0.00 0.00 -0.00 0.00 0.00 57.00 57.20 1owd n GLN 70 Cb 0.51 -1.80 0.00 0.00 -0.00 0.00 0.00 30.24 28.94 1owd n GLN 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1owd n GLY 71 N 3.57 0.10 3.65 2.61 0.00 -1.26 -5.01 105.19 108.85 1owd n GLY 71 Ca 0.26 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 1owd n GLY 71 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1owd s GLU 72 N -0.98 0.46 -0.03 1.61 -1.05 -0.59 -4.86 118.70 113.27 1owd s GLU 72 Ca 0.00 0.72 -0.00 0.00 -0.15 0.00 0.00 54.97 55.54 1owd s GLU 72 Cb 0.00 -1.72 0.03 0.00 -0.44 0.00 0.00 34.13 31.99 1owd s GLU 72 CO 0.00 -2.76 0.03 -1.64 0.95 0.00 0.00 175.26 171.84 1owd s MET 73 N -4.85 0.07 -0.01 -4.83 -1.94 -0.70 -5.00 119.30 102.03 1owd s MET 73 Ca 0.65 0.19 -0.15 0.00 -1.71 0.00 0.00 55.69 54.67 1owd s MET 73 Cb -0.20 -0.38 -0.06 0.00 2.01 0.00 0.00 34.83 36.21 1owd s MET 73 CO 0.59 -0.19 0.41 0.21 -0.01 0.00 0.00 175.02 176.03 1owd s LYS 74 N 1.27 3.96 0.16 2.03 2.20 -1.26 -2.61 119.74 125.49 1owd s LYS 74 Ca -0.06 0.41 0.01 0.00 -0.36 0.00 0.00 55.97 55.96 1owd s LYS 74 Cb -0.13 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 1owd s LYS 74 CO -0.03 0.65 0.03 -0.06 -0.36 0.00 0.00 175.35 175.58 1owd s PHE 75 N -0.93 1.10 0.41 4.03 0.40 0.26 -4.64 117.98 118.62 1owd s PHE 75 Ca 0.24 -1.12 0.06 0.00 -0.60 0.00 0.00 56.93 55.50 1owd s PHE 75 Cb -0.17 -0.63 -0.07 0.00 0.51 0.00 0.00 43.02 42.67 1owd s PHE 75 CO 0.13 -0.35 0.02 -1.21 0.70 0.00 0.00 175.22 174.51 1owd s GLU 76 N -3.98 1.96 -0.43 0.44 2.02 -0.21 -1.75 118.70 116.74 1owd s GLU 76 Ca 0.25 -2.13 -0.12 0.00 0.02 0.00 0.00 54.97 52.99 1owd s GLU 76 Cb 0.07 -1.53 0.07 0.00 0.10 0.00 0.00 34.13 32.84 1owd s GLU 76 CO 0.04 -0.11 0.31 0.08 0.02 0.00 0.00 175.26 175.60 1owd s VAL 77 N -2.80 4.72 0.39 2.63 1.01 -1.26 -1.64 120.40 123.45 1owd s VAL 77 Ca 0.31 -1.17 0.11 0.00 0.00 0.00 0.00 61.98 61.24 1owd s VAL 77 Cb 0.09 -3.82 0.14 0.00 0.00 0.00 0.00 36.38 32.79 1owd s VAL 77 CO 0.16 -0.49 1.89 -0.08 0.00 0.00 0.00 175.10 176.58 1owd h GLU 78 N 8.56 0.11 -2.11 2.72 4.81 -0.44 -3.44 114.58 124.79 1owd h GLU 78 Ca -0.26 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 58.96 1owd h GLU 78 Cb 1.10 -0.01 -0.22 0.00 0.63 0.00 0.00 28.75 30.25 1owd h GLU 78 CO 0.79 0.34 -0.09 1.21 -0.73 0.00 0.00 179.01 180.54 1owd s ASN 79 N -6.93 -0.91 -0.38 1.04 2.47 -0.99 -4.95 114.94 104.29 1owd s ASN 79 Ca -0.04 1.43 -0.06 0.00 0.42 0.00 0.00 52.86 54.61 1owd s ASN 79 Cb 0.15 1.59 0.07 0.00 -1.45 0.00 0.00 41.25 41.60 1owd s ASN 79 CO 0.72 -0.23 0.17 -0.22 -3.72 0.00 0.00 177.10 173.83 1owd s LEU 80 N 2.05 4.76 -0.19 3.21 2.96 -1.26 -0.60 118.68 129.60 1owd s LEU 80 Ca -0.08 -1.46 -0.05 0.00 -0.22 0.00 0.00 54.13 52.32 1owd s LEU 80 Cb -0.08 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1owd s LEU 80 CO -0.18 -0.44 -0.01 -0.63 -1.32 0.00 0.00 176.35 173.77 1owd s ILE 81 N 1.34 3.92 0.06 6.68 1.01 -0.29 -5.01 121.20 128.92 1owd s ILE 81 Ca 0.02 -0.33 0.05 0.00 0.00 0.00 0.00 60.65 60.38 1owd s ILE 81 Cb -0.21 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 1owd s ILE 81 CO 0.01 0.44 -0.05 -0.76 0.00 0.00 0.00 174.94 174.58 1owd s LEU 82 N 0.89 3.27 -0.15 2.97 1.43 -1.26 -1.78 118.68 124.04 1owd s LEU 82 Ca 0.01 -0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 52.61 1owd s LEU 82 Cb -0.14 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 1owd s LEU 82 CO 0.02 0.22 1.70 -2.28 0.23 0.00 0.00 176.35 176.23 1owd s HIS 83 N -1.17 1.94 0.63 0.29 5.65 -1.23 -4.87 115.29 116.53 1owd s HIS 83 Ca 0.21 0.38 0.32 0.00 0.25 0.00 0.00 55.06 56.23 1owd s HIS 83 Cb -0.11 -3.97 1.79 0.00 -1.18 0.00 0.00 32.58 29.11 1owd s HIS 83 CO 0.13 -3.46 2.08 1.57 -0.65 0.00 0.00 174.74 174.41 1owd h LYS 84 N 10.71 0.00 -0.66 2.88 -0.00 -1.95 -2.26 116.57 125.29 1owd h LYS 84 Ca -0.37 0.00 -0.21 0.00 -0.00 0.00 0.00 60.65 60.07 1owd h LYS 84 Cb 1.17 0.00 -0.13 0.00 -0.00 0.00 0.00 32.23 33.28 1owd h LYS 84 CO 0.98 0.00 0.23 -0.25 -0.00 0.00 0.00 179.45 180.41 1owd n ASP 85 N -3.35 4.40 -4.78 7.07 10.43 -1.26 -5.01 116.55 124.05 1owd n ASP 85 Ca 0.00 -3.30 -0.37 0.00 2.57 0.00 0.00 54.79 53.70 1owd n ASP 85 Cb 0.32 -0.72 -0.03 0.00 1.84 0.00 0.00 41.12 42.53 1owd n ASP 85 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 1owd s TYR 86 N -3.03 3.17 0.24 1.24 6.14 -0.85 -4.76 117.35 119.49 1owd s TYR 86 Ca 0.53 1.61 -0.18 0.00 0.64 0.00 0.00 57.07 59.67 1owd s TYR 86 Cb 0.43 -3.20 0.02 0.00 0.42 0.00 0.00 41.96 39.63 1owd s TYR 86 CO 0.11 -0.86 0.60 -1.54 0.64 0.00 0.00 175.55 174.51 1owd s SER 87 N -1.50 -0.23 -0.13 4.32 1.04 -1.19 -5.02 113.70 110.99 1owd s SER 87 Ca 0.59 -0.63 -0.04 0.00 0.48 0.00 0.00 55.95 56.35 1owd s SER 87 Cb -0.24 0.65 0.06 0.00 0.10 0.00 0.00 66.02 66.59 1owd s SER 87 CO 0.30 -1.20 0.15 0.00 0.98 0.00 0.00 173.24 173.46 1owd s ALA 88 N -3.93 -0.03 0.72 5.32 0.00 -1.26 -1.37 121.76 121.21 1owd s ALA 88 Ca 0.13 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.37 1owd s ALA 88 Cb -0.03 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.13 1owd s ALA 88 CO 0.04 -0.83 0.00 -0.25 0.00 0.00 0.00 175.76 174.72 1owd n ASP 89 N 5.31 0.00 -0.32 0.00 10.43 0.01 -4.96 116.55 127.02 1owd n ASP 89 Ca -0.05 -0.84 0.08 0.00 2.57 0.00 0.00 54.79 56.55 1owd n ASP 89 Cb 0.50 0.00 0.25 0.00 1.84 0.00 0.00 41.12 43.70 1owd n ASP 89 CO 0.00 0.00 0.00 0.74 -1.07 0.00 0.00 177.20 176.87 1owd h THR 90 N -0.61 0.76 0.00 -3.53 2.02 -2.04 -3.37 112.91 106.14 1owd h THR 90 Ca 0.00 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1owd h THR 90 Cb 0.00 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.39 1owd h THR 90 CO 0.00 0.13 -0.70 0.18 0.37 0.00 0.00 175.52 175.50 1owd n LEU 91 N -4.81 0.64 -4.80 2.58 4.77 -1.26 -5.09 117.00 109.02 1owd n LEU 91 Ca 0.19 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.83 1owd n LEU 91 Cb 0.45 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 1owd n LEU 91 CO 0.22 0.00 0.68 0.00 -1.33 0.00 0.00 177.39 176.97 1owd s ALA 92 N -1.91 3.00 -0.00 -1.18 0.00 -1.26 -4.65 121.76 115.75 1owd s ALA 92 Ca 0.00 0.52 0.07 0.00 0.00 0.00 0.00 51.96 52.55 1owd s ALA 92 Cb 0.00 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 1owd s ALA 92 CO 0.00 -0.07 -0.23 -1.01 0.00 0.00 0.00 175.76 174.46 1owd s HIS 93 N -2.00 2.02 -0.06 0.00 3.76 -1.26 -0.81 115.29 116.94 1owd s HIS 93 Ca 0.63 -0.38 0.03 0.00 -0.15 0.00 0.00 55.06 55.19 1owd s HIS 93 Cb -0.14 -1.28 -0.02 0.00 1.11 0.00 0.00 32.58 32.25 1owd s HIS 93 CO 0.18 0.00 -0.15 -1.01 -0.85 0.00 0.00 174.74 172.91 1owd s HIS 94 N -0.60 2.70 -1.42 1.40 3.76 -0.47 -4.61 115.29 116.05 1owd s HIS 94 Ca 0.09 -0.21 -0.04 0.00 -0.15 0.00 0.00 55.06 54.75 1owd s HIS 94 Cb -0.09 -1.64 0.03 0.00 1.11 0.00 0.00 32.58 31.99 1owd s HIS 94 CO -0.00 0.14 0.64 0.09 -0.85 0.00 0.00 174.74 174.76 1owd n ASN 95 N 2.42 -1.61 -4.16 1.40 3.02 -1.26 -3.16 115.26 111.91 1owd n ASN 95 Ca -0.17 -0.90 -0.43 0.00 -0.03 0.00 0.00 54.58 53.05 1owd n ASN 95 Cb 0.52 -3.52 0.00 0.00 -0.61 0.00 0.00 39.78 36.18 1owd n ASN 95 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1owd n ASP 96 N -2.96 4.66 -3.83 6.41 4.64 -1.26 -4.63 116.55 119.57 1owd n ASP 96 Ca -0.21 -2.94 -0.12 0.00 -1.38 0.00 0.00 54.79 50.14 1owd n ASP 96 Cb 0.64 -1.65 -0.11 0.00 -1.04 0.00 0.00 41.12 38.96 1owd n ASP 96 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 1owd s ILE 97 N 2.81 0.04 0.04 5.18 2.07 -1.26 -4.25 121.20 125.83 1owd s ILE 97 Ca 0.47 -0.33 -0.11 0.00 -1.41 0.00 0.00 60.65 59.27 1owd s ILE 97 Cb 0.07 -0.36 0.01 0.00 0.13 0.00 0.00 42.46 42.31 1owd s ILE 97 CO -0.00 -0.18 0.25 0.00 -1.91 0.00 0.00 174.94 173.09 1owd s ALA 98 N -0.63 -0.51 -0.08 1.50 0.00 -0.33 -3.46 121.76 118.25 1owd s ALA 98 Ca -0.07 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 51.76 1owd s ALA 98 Cb -0.04 0.31 -0.00 0.00 0.00 0.00 0.00 23.12 23.39 1owd s ALA 98 CO 0.01 -0.40 -0.21 -0.51 0.00 0.00 0.00 175.76 174.65 1owd s LEU 99 N -2.12 1.98 -0.21 0.00 1.43 -0.74 -1.43 118.68 117.60 1owd s LEU 99 Ca -0.04 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.59 1owd s LEU 99 Cb -0.01 -1.24 0.05 0.00 0.03 0.00 0.00 46.19 45.02 1owd s LEU 99 CO -0.04 0.15 -0.09 -0.76 0.23 0.00 0.00 176.35 175.84 1owd s LEU 100 N 0.25 2.36 -0.34 1.79 1.02 -0.17 -1.14 118.68 122.45 1owd s LEU 100 Ca -0.13 -0.96 -0.24 0.00 0.02 0.00 0.00 54.13 52.82 1owd s LEU 100 Cb -0.16 -1.22 0.01 0.00 0.02 0.00 0.00 46.19 44.84 1owd s LEU 100 CO 0.06 -0.17 0.81 -0.75 0.02 0.00 0.00 176.35 176.32 1owd s LYS 101 N 1.40 3.87 0.42 1.70 2.20 0.23 -1.39 119.74 128.16 1owd s LYS 101 Ca -0.02 0.49 -0.01 0.00 -0.36 0.00 0.00 55.97 56.06 1owd s LYS 101 Cb -0.17 -3.77 -0.02 0.00 -1.51 0.00 0.00 37.83 32.36 1owd s LYS 101 CO -0.08 -0.78 0.65 0.96 -0.36 0.00 0.00 175.35 175.74 1owd s ILE 102 N 3.09 4.72 -0.28 5.43 -4.36 -0.35 0.30 121.20 129.75 1owd s ILE 102 Ca 0.33 -0.29 -0.22 0.00 -0.26 0.00 0.00 60.65 60.22 1owd s ILE 102 Cb -0.13 -3.75 0.08 0.00 1.25 0.00 0.00 42.46 39.91 1owd s ILE 102 CO 0.15 -0.57 0.75 -0.60 0.24 0.00 0.00 174.94 174.91 1owd s ARG 103 N -4.51 0.75 0.73 0.37 3.52 -0.65 -4.66 118.95 114.49 1owd s ARG 103 Ca 0.44 1.03 -0.07 0.00 -0.13 0.00 0.00 55.73 57.00 1owd s ARG 103 Cb -0.10 0.29 0.07 0.00 -1.56 0.00 0.00 34.95 33.66 1owd s ARG 103 CO 0.39 -0.11 1.04 -1.54 -0.81 0.00 0.00 175.30 174.27 1owd s SER 104 N 0.82 4.67 0.56 -2.12 1.04 -0.05 -1.05 113.70 117.57 1owd s SER 104 Ca -0.03 0.44 0.24 0.00 0.48 0.00 0.00 55.95 57.07 1owd s SER 104 Cb -0.05 -1.03 1.52 0.00 0.10 0.00 0.00 66.02 66.56 1owd s SER 104 CO -0.07 -1.70 2.14 0.11 0.98 0.00 0.00 173.24 174.70 1owd h LYS 105 N -0.69 0.00 -0.00 4.02 1.57 -1.90 0.20 116.57 119.77 1owd h LYS 105 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1owd h LYS 105 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1owd h LYS 105 CO 0.59 0.00 -0.05 0.39 -0.57 0.00 0.00 179.45 179.81 1owd n GLU 106 N -4.17 0.66 -0.64 3.15 4.71 -1.26 -4.91 120.64 118.18 1owd n GLU 106 Ca 0.00 -0.13 0.00 0.00 -0.01 0.00 0.00 57.16 57.03 1owd n GLU 106 Cb 0.23 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.16 1owd n GLU 106 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1owd n GLY 107 N 1.24 0.61 3.76 0.62 0.00 0.71 -5.08 105.19 107.05 1owd n GLY 107 Ca 0.16 -0.64 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 1owd n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1owd s ARG 108 N -1.20 2.78 0.00 1.61 0.52 -1.26 -4.77 118.95 116.64 1owd s ARG 108 Ca 0.00 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.36 1owd s ARG 108 Cb 0.00 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.86 1owd s ARG 108 CO 0.00 0.51 0.00 0.00 0.02 0.00 0.00 175.30 175.83 1owd s ALA 110 N -3.49 3.20 -0.36 0.00 0.00 0.29 -4.85 121.76 116.55 1owd s ALA 110 Ca 0.00 0.92 -0.06 0.00 0.00 0.00 0.00 51.96 52.82 1owd s ALA 110 Cb 0.00 -3.35 0.06 0.00 0.00 0.00 0.00 23.12 19.83 1owd s ALA 110 CO 0.00 -0.41 0.14 -1.14 0.00 0.00 0.00 175.76 174.35 1owd s GLN 111 N -2.15 2.47 0.27 0.00 2.00 -1.26 -4.73 119.66 116.25 1owd s GLN 111 Ca 0.54 -1.38 -0.30 0.00 -2.00 0.00 0.00 55.36 52.23 1owd s GLN 111 Cb -0.30 -3.50 -0.14 0.00 0.80 0.00 0.00 33.01 29.87 1owd s GLN 111 CO 0.38 -0.80 1.23 -2.30 -0.50 0.00 0.00 175.29 173.30 1owd n PRO 112 N 4.76 1.73 -2.46 1.67 -0.02 -1.26 -4.88 135.00 134.55 1owd n PRO 112 Ca -0.10 0.61 -0.05 0.00 -2.02 0.00 0.00 63.50 61.94 1owd n PRO 112 Cb 0.43 -2.14 -0.01 0.00 -0.02 0.00 0.00 33.50 31.76 1owd n PRO 112 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1owd n SER 113 N 1.52 -0.67 0.17 2.55 3.41 -0.44 -4.96 113.62 115.19 1owd n SER 113 Ca 0.10 -1.76 0.08 0.00 -0.26 0.00 0.00 58.87 57.03 1owd n SER 113 Cb 0.32 1.21 0.58 0.00 -0.26 0.00 0.00 64.21 66.06 1owd n SER 113 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1owd h ARG 114 N 0.00 0.15 -0.37 4.33 2.43 -1.99 -2.63 114.38 116.30 1owd h ARG 114 Ca -0.12 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 1owd h ARG 114 Cb 0.50 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1owd h ARG 114 CO 0.16 0.10 0.00 0.25 -1.51 0.00 0.00 179.97 178.97 1owd n THR 115 N -4.51 0.75 -3.63 0.20 -2.24 -1.26 -4.85 114.28 98.73 1owd n THR 115 Ca -0.00 -0.87 -0.28 0.00 -2.27 0.00 0.00 64.05 60.62 1owd n THR 115 Cb 0.11 0.71 -0.16 0.00 -2.10 0.00 0.00 70.33 68.90 1owd n THR 115 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1owd s ILE 116 N -1.08 0.25 0.07 2.28 1.01 -0.99 -3.89 121.20 118.84 1owd s ILE 116 Ca 0.29 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 60.18 1owd s ILE 116 Cb 0.16 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 1owd s ILE 116 CO 0.22 -0.55 -0.05 -1.10 0.00 0.00 0.00 174.94 173.46 1owd s GLN 117 N 1.95 0.67 0.20 2.79 -1.52 -0.26 -1.33 119.66 122.16 1owd s GLN 117 Ca 0.06 -1.18 -0.02 0.00 -1.95 0.00 0.00 55.36 52.27 1owd s GLN 117 Cb -0.16 0.00 -0.05 0.00 -0.22 0.00 0.00 33.01 32.58 1owd s GLN 117 CO -0.24 -0.06 0.41 0.95 -0.25 0.00 0.00 175.29 176.10 1owd s THR 118 N -3.42 5.18 -0.01 -0.19 -4.23 -1.26 -2.93 115.64 108.77 1owd s THR 118 Ca 0.06 -0.26 0.04 0.00 -1.18 0.00 0.00 61.69 60.35 1owd s THR 118 Cb 0.04 -3.72 -0.03 0.00 1.34 0.00 0.00 72.50 70.13 1owd s THR 118 CO -0.06 -0.16 -0.12 0.27 -0.54 0.00 0.00 174.62 174.00 1owd s ILE 119 N -1.87 3.25 0.36 2.99 -5.25 -0.79 -4.93 121.20 114.97 1owd s ILE 119 Ca 0.39 -0.84 -0.26 0.00 -0.99 0.00 0.00 60.65 58.95 1owd s ILE 119 Cb -0.11 -2.36 -0.09 0.00 2.95 0.00 0.00 42.46 42.85 1owd s ILE 119 CO 0.29 0.45 1.06 0.00 -1.79 0.00 0.00 174.94 174.95 1owd s LEU 121 N -2.30 3.38 0.85 0.00 2.01 -1.26 -1.83 118.68 119.53 1owd s LEU 121 Ca 0.54 1.23 -0.12 0.00 0.01 0.00 0.00 54.13 55.79 1owd s LEU 121 Cb -0.25 -4.24 0.10 0.00 0.01 0.00 0.00 46.19 41.81 1owd s LEU 121 CO 0.31 -0.76 1.16 -2.16 1.01 0.00 0.00 176.35 175.91 1owd s PRO 122 N -5.02 1.64 0.23 1.29 0.04 -1.26 -4.85 135.00 127.07 1owd s PRO 122 Ca 0.52 0.18 0.07 0.00 0.04 0.00 0.00 61.00 61.81 1owd s PRO 122 Cb -0.11 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 1owd s PRO 122 CO 0.51 -1.83 0.15 -1.54 0.04 0.00 0.00 177.00 174.33 1owd s SER 123 N -4.36 5.40 -0.13 6.66 1.04 -1.26 -4.87 113.70 116.17 1owd s SER 123 Ca 0.63 -0.26 -0.40 0.00 0.48 0.00 0.00 55.95 56.40 1owd s SER 123 Cb -0.12 -1.35 -0.17 0.00 0.10 0.00 0.00 66.02 64.48 1owd s SER 123 CO 0.51 0.00 1.49 0.23 0.98 0.00 0.00 173.24 176.45 1owd n MET 124 N -0.88 0.87 -1.48 4.02 2.81 -1.26 -2.20 117.12 119.01 1owd n MET 124 Ca -0.08 0.32 -0.17 0.00 -1.81 0.00 0.00 57.70 55.96 1owd n MET 124 Cb 0.57 -1.94 -0.07 0.00 -0.71 0.00 0.00 33.22 31.07 1owd n MET 124 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1owd n TYR 125 N 3.66 -0.18 -3.84 2.03 4.02 -1.26 -4.93 117.16 116.66 1owd n TYR 125 Ca 0.23 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.83 1owd n TYR 125 Cb 0.12 -3.00 -0.11 0.00 -0.02 0.00 0.00 39.34 36.34 1owd n TYR 125 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1owd n ASN 126 N -0.93 3.23 -4.88 7.72 2.85 -0.93 -5.07 115.26 117.25 1owd n ASN 126 Ca -0.17 -3.23 -0.24 0.00 -0.11 0.00 0.00 54.58 50.84 1owd n ASN 126 Cb 0.56 -0.79 -0.04 0.00 1.24 0.00 0.00 39.78 40.75 1owd n ASN 126 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 1owd s ASP 127 N -1.41 5.88 0.49 1.20 -0.00 -1.26 -4.59 116.67 116.97 1owd s ASP 127 Ca 0.26 -0.06 -0.21 0.00 -0.00 0.00 0.00 52.55 52.55 1owd s ASP 127 Cb -0.03 -1.63 -0.07 0.00 -0.00 0.00 0.00 42.92 41.19 1owd s ASP 127 CO -0.15 -0.00 1.11 -2.16 -0.00 0.00 0.00 175.17 173.96 1owd s PRO 128 N -3.57 3.65 0.82 8.23 0.04 -1.26 -5.02 135.00 137.90 1owd s PRO 128 Ca 0.33 1.59 -0.11 0.00 0.04 0.00 0.00 61.00 62.85 1owd s PRO 128 Cb -0.09 -2.19 0.09 0.00 0.04 0.00 0.00 34.50 32.35 1owd s PRO 128 CO 0.26 -0.60 1.12 1.14 0.04 0.00 0.00 177.00 178.97 1owd s GLN 129 N -3.03 1.75 0.65 4.56 -2.07 -1.26 -4.97 119.66 115.30 1owd s GLN 129 Ca 0.68 1.37 -0.17 0.00 -1.82 0.00 0.00 55.36 55.41 1owd s GLN 129 Cb -0.23 -1.82 -0.00 0.00 -1.09 0.00 0.00 33.01 29.86 1owd s GLN 129 CO 0.27 -2.05 1.23 -0.59 -1.32 0.00 0.00 175.29 172.82 1owd s PHE 130 N -2.72 2.21 0.00 9.60 -0.12 -1.26 -3.09 117.98 122.60 1owd s PHE 130 Ca 0.64 1.54 0.00 0.00 -0.05 0.00 0.00 56.93 59.06 1owd s PHE 130 Cb -0.20 -3.52 0.00 0.00 -0.63 0.00 0.00 43.02 38.67 1owd s PHE 130 CO 0.56 -2.51 0.00 0.41 -0.05 0.00 0.00 175.22 173.63 1owd n GLY 131 N 0.53 0.96 3.76 1.99 0.00 -0.33 -4.97 105.19 107.12 1owd n GLY 131 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1owd n GLY 131 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1owd s THR 132 N -2.64 3.76 -0.01 2.61 2.01 -1.18 -4.71 115.64 115.48 1owd s THR 132 Ca 0.00 1.73 -0.20 0.00 0.31 0.00 0.00 61.69 63.53 1owd s THR 132 Cb 0.00 -4.08 -0.05 0.00 0.01 0.00 0.00 72.50 68.37 1owd s THR 132 CO 0.00 0.38 0.58 -0.44 -0.69 0.00 0.00 174.62 174.45 1owd s SER 133 N -1.07 6.95 0.09 3.53 0.01 -1.26 -1.23 113.70 120.71 1owd s SER 133 Ca 0.44 1.13 0.00 0.00 1.31 0.00 0.00 55.95 58.83 1owd s SER 133 Cb -0.28 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 1owd s SER 133 CO 0.36 0.10 -0.03 0.00 0.41 0.00 0.00 173.24 174.09 1owd s GLU 135 N -3.91 2.35 0.06 0.00 -1.05 -0.85 -0.73 118.70 114.58 1owd s GLU 135 Ca 0.12 -1.30 0.02 0.00 -0.15 0.00 0.00 54.97 53.66 1owd s GLU 135 Cb 0.07 -2.24 -0.03 0.00 -0.44 0.00 0.00 34.13 31.49 1owd s GLU 135 CO -0.06 0.40 -0.07 0.96 0.95 0.00 0.00 175.26 177.44 1owd s ILE 136 N -2.11 0.54 0.04 1.83 -4.36 -0.47 -2.14 121.20 114.53 1owd s ILE 136 Ca 0.30 -1.32 0.00 0.00 -0.26 0.00 0.00 60.65 59.37 1owd s ILE 136 Cb -0.07 -0.90 -0.03 0.00 1.25 0.00 0.00 42.46 42.70 1owd s ILE 136 CO 0.20 -0.54 -0.04 -0.89 0.24 0.00 0.00 174.94 173.91 1owd s THR 137 N -2.07 0.25 0.00 8.37 2.01 -1.26 -1.88 115.64 121.06 1owd s THR 137 Ca -0.04 -1.27 0.00 0.00 0.31 0.00 0.00 61.69 60.69 1owd s THR 137 Cb -0.05 -0.78 0.00 0.00 0.01 0.00 0.00 72.50 71.67 1owd s THR 137 CO -0.01 -0.66 0.00 0.61 -0.69 0.00 0.00 174.62 173.87 1owd n GLY 138 N 1.02 0.12 0.88 4.40 0.00 -0.80 -4.65 105.19 106.17 1owd n GLY 138 Ca -0.20 -1.00 0.06 0.00 0.00 0.00 0.00 46.02 44.88 1owd n GLY 138 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1owd n PHE 139 N -0.33 0.90 -1.50 1.61 3.72 -1.26 -2.55 117.46 118.05 1owd n PHE 139 Ca 0.00 -1.05 -0.29 0.00 -0.05 0.00 0.00 57.45 56.06 1owd n PHE 139 Cb 0.00 -0.34 0.15 0.00 -0.94 0.00 0.00 39.48 38.34 1owd n PHE 139 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1owd s GLY 140 N -2.15 1.58 0.39 1.37 0.00 -1.25 -4.12 107.32 103.14 1owd s GLY 140 Ca 0.42 -0.55 -0.24 0.00 0.00 0.00 0.00 44.72 44.35 1owd s GLY 140 CO 0.06 0.03 0.81 0.28 0.00 0.00 0.00 173.10 174.29 1owd n LYS 141 N -3.84 0.98 0.11 2.90 5.02 -1.02 -2.55 118.16 119.76 1owd n LYS 141 Ca 0.07 0.35 0.10 0.00 -2.02 0.00 0.00 58.31 56.82 1owd n LYS 141 Cb 0.59 -1.76 0.01 0.00 -0.02 0.00 0.00 35.03 33.85 1owd n LYS 141 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1owd h GLU 142 N 1.30 0.00 -3.30 1.97 5.08 -1.85 -1.33 114.58 116.45 1owd h GLU 142 Ca -0.41 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 57.82 1owd h GLU 142 Cb 1.37 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.41 1owd h GLU 142 CO 0.55 0.03 -0.39 -0.80 -1.00 0.00 0.00 179.01 177.41 1owd s ASN 143 N -5.50 -0.07 0.48 1.42 -0.87 -1.26 -4.08 114.94 105.05 1owd s ASN 143 Ca 0.00 -0.08 0.15 0.00 -1.57 0.00 0.00 52.86 51.35 1owd s ASN 143 Cb 0.09 0.25 1.11 0.00 -0.02 0.00 0.00 41.25 42.69 1owd s ASN 143 CO 0.78 -0.41 2.06 0.28 -2.57 0.00 0.00 177.10 177.24 1owd h SER 144 N 4.05 0.02 1.24 -1.22 0.02 -1.91 -2.48 113.55 113.27 1owd h SER 144 Ca -0.30 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1owd h SER 144 Cb 1.19 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1owd h SER 144 CO 0.41 0.11 0.00 0.35 -1.14 0.00 0.00 176.83 176.56 1owd n THR 145 N -4.42 0.46 -2.30 -2.27 -2.24 -1.26 -4.85 114.28 97.39 1owd n THR 145 Ca -0.03 -0.14 -0.35 0.00 -2.27 0.00 0.00 64.05 61.27 1owd n THR 145 Cb 0.17 -0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 67.77 1owd n THR 145 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1owd s ASP 146 N -4.02 5.86 -0.01 3.42 -0.00 -0.94 -4.94 116.67 116.05 1owd s ASP 146 Ca 0.11 2.09 0.08 0.00 -0.00 0.00 0.00 52.55 54.83 1owd s ASP 146 Cb 0.14 -2.57 -0.12 0.00 -0.00 0.00 0.00 42.92 40.37 1owd s ASP 146 CO 0.55 -1.12 0.22 0.00 -0.00 0.00 0.00 175.17 174.82 1owd n TYR 147 N -1.29 0.00 -3.96 4.23 4.11 -1.26 -4.97 117.16 114.01 1owd n TYR 147 Ca 0.11 0.00 -0.25 0.00 -0.00 0.00 0.00 57.90 57.76 1owd n TYR 147 Cb 0.51 -0.14 -0.03 0.00 -0.00 0.00 0.00 39.34 39.69 1owd n TYR 147 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1owd s LEU 148 N -3.24 4.29 0.10 -3.48 1.43 -1.26 -5.10 118.68 111.43 1owd s LEU 148 Ca -0.01 0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.20 1owd s LEU 148 Cb 0.05 -2.86 -0.04 0.00 0.03 0.00 0.00 46.19 43.37 1owd s LEU 148 CO 0.34 0.02 0.27 -0.31 0.23 0.00 0.00 176.35 176.90 1owd s TYR 149 N -1.82 3.50 0.31 0.29 4.12 -1.26 -4.73 117.35 117.77 1owd s TYR 149 Ca 0.34 0.30 -0.29 0.00 0.02 0.00 0.00 57.07 57.44 1owd s TYR 149 Cb -0.10 -1.81 -0.11 0.00 -1.52 0.00 0.00 41.96 38.42 1owd s TYR 149 CO 0.28 0.53 1.49 -1.25 0.02 0.00 0.00 175.55 176.61 1owd s PRO 150 N -2.73 4.19 0.37 -1.71 0.04 -1.26 -4.91 135.00 129.00 1owd s PRO 150 Ca 0.37 2.46 0.10 0.00 0.04 0.00 0.00 61.00 63.97 1owd s PRO 150 Cb -0.12 -3.04 0.74 0.00 0.04 0.00 0.00 34.50 32.12 1owd s PRO 150 CO 0.27 -0.49 1.86 1.49 0.04 0.00 0.00 177.00 180.18 1owd h GLU 151 N 4.17 0.14 -6.09 4.56 4.57 -1.97 -3.44 114.58 116.52 1owd h GLU 151 Ca -0.48 -0.04 -0.65 0.00 -1.18 0.00 0.00 59.36 57.01 1owd h GLU 151 Cb 1.23 -0.01 -0.10 0.00 -0.16 0.00 0.00 28.75 29.70 1owd h GLU 151 CO 0.73 0.39 -0.59 -1.14 -1.18 0.00 0.00 179.01 177.22 1owd s GLN 152 N -4.47 2.97 0.49 1.92 0.74 -1.26 -1.13 119.66 118.92 1owd s GLN 152 Ca -0.04 -0.58 -0.23 0.00 0.05 0.00 0.00 55.36 54.56 1owd s GLN 152 Cb 0.15 -2.79 -0.06 0.00 1.10 0.00 0.00 33.01 31.40 1owd s GLN 152 CO 0.73 0.61 1.34 -1.17 -0.55 0.00 0.00 175.29 176.25 1owd s LEU 153 N -1.99 3.98 0.15 3.68 2.96 -1.14 -4.92 118.68 121.40 1owd s LEU 153 Ca 0.25 2.72 0.02 0.00 -0.22 0.00 0.00 54.13 56.90 1owd s LEU 153 Cb -0.12 -4.14 -0.04 0.00 0.50 0.00 0.00 46.19 42.38 1owd s LEU 153 CO 0.17 -1.29 -0.04 -0.54 -1.32 0.00 0.00 176.35 173.34 1owd s LYS 154 N -2.68 1.04 0.16 1.98 1.02 -1.06 -1.62 119.74 118.57 1owd s LYS 154 Ca 0.66 -1.47 -0.13 0.00 0.02 0.00 0.00 55.97 55.05 1owd s LYS 154 Cb -0.39 -0.34 0.01 0.00 -0.52 0.00 0.00 37.83 36.59 1owd s LYS 154 CO 0.48 -0.06 0.37 0.00 -0.92 0.00 0.00 175.35 175.22 1owd s MET 155 N -3.86 1.17 0.27 1.68 0.23 -0.68 -1.91 119.30 116.19 1owd s MET 155 Ca 0.19 -0.96 -0.19 0.00 -1.03 0.00 0.00 55.69 53.71 1owd s MET 155 Cb 0.05 0.43 0.01 0.00 -1.53 0.00 0.00 34.83 33.80 1owd s MET 155 CO 0.01 -0.45 0.65 -0.08 -2.03 0.00 0.00 175.02 173.12 1owd s THR 156 N -3.89 0.00 -0.06 3.16 -1.32 -0.79 -1.79 115.64 110.96 1owd s THR 156 Ca 0.10 -1.11 0.06 0.00 -1.21 0.00 0.00 61.69 59.52 1owd s THR 156 Cb 0.02 -2.06 -0.01 0.00 -1.51 0.00 0.00 72.50 68.95 1owd s THR 156 CO -0.05 -0.00 -0.23 -0.69 -2.21 0.00 0.00 174.62 171.44 1owd s VAL 157 N -3.95 1.91 0.31 5.08 1.01 -1.26 -1.37 120.40 122.13 1owd s VAL 157 Ca 0.14 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.17 1owd s VAL 157 Cb -0.04 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1owd s VAL 157 CO 0.08 0.53 0.11 0.68 0.00 0.00 0.00 175.10 176.50 1owd s VAL 158 N -0.09 0.62 -0.07 2.92 -7.23 0.10 -4.86 120.40 111.79 1owd s VAL 158 Ca -0.05 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.16 1owd s VAL 158 Cb -0.13 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.20 1owd s VAL 158 CO 0.04 0.00 -0.17 -0.54 -0.31 0.00 0.00 175.10 174.12 1owd s LYS 159 N -3.89 2.66 0.43 4.82 -0.14 -0.09 -0.61 119.74 122.92 1owd s LYS 159 Ca 0.35 -0.75 -0.25 0.00 -1.36 0.00 0.00 55.97 53.95 1owd s LYS 159 Cb 0.06 -2.36 -0.08 0.00 -1.68 0.00 0.00 37.83 33.77 1owd s LYS 159 CO 0.15 0.48 1.33 -0.51 -0.76 0.00 0.00 175.35 176.05 1owd s LEU 160 N -0.38 4.16 -0.04 3.17 1.43 -0.36 -0.63 118.68 126.02 1owd s LEU 160 Ca 0.04 2.71 0.06 0.00 -1.03 0.00 0.00 54.13 55.91 1owd s LEU 160 Cb -0.12 -3.95 -0.02 0.00 0.03 0.00 0.00 46.19 42.13 1owd s LEU 160 CO 0.02 -0.97 -0.24 -0.63 0.23 0.00 0.00 176.35 174.76 1owd s ILE 161 N -1.26 2.19 0.70 -0.59 1.01 0.51 -1.19 121.20 122.56 1owd s ILE 161 Ca 0.59 -1.04 -0.16 0.00 0.00 0.00 0.00 60.65 60.04 1owd s ILE 161 Cb -0.39 -1.79 0.02 0.00 0.01 0.00 0.00 42.46 40.31 1owd s ILE 161 CO 0.50 0.57 1.27 -0.94 0.00 0.00 0.00 174.94 176.34 1owd s SER 162 N -0.38 4.26 0.14 3.58 1.04 -1.26 -4.10 113.70 116.99 1owd s SER 162 Ca 0.03 2.55 -0.14 0.00 0.48 0.00 0.00 55.95 58.86 1owd s SER 162 Cb -0.12 -2.61 0.02 0.00 0.10 0.00 0.00 66.02 63.41 1owd s SER 162 CO 0.02 -2.23 1.68 -0.74 0.98 0.00 0.00 173.24 172.94 1owd h HIS 163 N 0.07 0.73 -0.17 5.02 2.76 -1.97 -0.83 115.15 120.77 1owd h HIS 163 Ca -0.49 -0.07 -0.04 0.00 -2.20 0.00 0.00 60.37 57.57 1owd h HIS 163 Cb 1.33 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 30.06 1owd h HIS 163 CO 0.43 0.64 -0.07 0.07 -1.30 0.00 0.00 177.93 177.70 1owd h ARG 164 N 0.61 0.26 -0.05 5.26 0.11 -1.98 -1.90 114.38 116.69 1owd h ARG 164 Ca 0.15 -0.05 -0.21 0.00 0.10 0.00 0.00 59.98 59.97 1owd h ARG 164 Cb 0.24 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.28 1owd h ARG 164 CO -0.01 0.35 -0.84 1.49 0.10 0.00 0.00 179.97 181.06 1owd h GLU 165 N 0.25 0.45 0.00 0.08 4.81 -1.87 -3.15 114.58 115.16 1owd h GLU 165 Ca 0.06 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1owd h GLU 165 Cb 0.29 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1owd h GLU 165 CO 0.01 1.07 0.00 0.00 -0.73 0.00 0.00 179.01 179.36 1owd n GLN 167 N -2.80 1.81 -1.15 0.00 6.02 -0.76 -1.63 117.38 118.87 1owd n GLN 167 Ca 0.02 -1.18 -0.33 0.00 -0.01 0.00 0.00 57.00 55.51 1owd n GLN 167 Cb 0.34 -1.48 0.12 0.00 1.02 0.00 0.00 30.24 30.25 1owd n GLN 167 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1owd s GLN 168 N -2.00 1.74 0.15 -1.09 -1.52 -1.08 -2.79 119.66 113.07 1owd s GLN 168 Ca 0.36 1.63 -0.25 0.00 -1.95 0.00 0.00 55.36 55.14 1owd s GLN 168 Cb 0.21 -1.80 0.01 0.00 -0.22 0.00 0.00 33.01 31.21 1owd s GLN 168 CO 0.33 -2.11 1.59 -1.00 -0.25 0.00 0.00 175.29 173.85 1owd h PRO 169 N -0.95 -0.32 0.00 2.91 0.13 -1.93 -1.60 132.00 130.24 1owd h PRO 169 Ca -0.46 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1owd h PRO 169 Cb 1.28 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.48 1owd h PRO 169 CO 0.47 -0.22 0.00 0.72 -0.23 0.00 0.00 178.00 178.74 1owd n HIS 170 N -5.42 0.00 0.00 1.56 8.25 -1.26 -4.47 115.22 113.88 1owd n HIS 170 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1owd n HIS 170 Cb 0.34 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.44 1owd n HIS 170 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1owd n TYR 171 N -1.01 0.00 0.09 4.41 4.02 -0.63 -4.79 117.16 119.25 1owd n TYR 171 Ca 0.13 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 58.04 1owd n TYR 171 Cb 0.06 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.42 1owd n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1owd n TYR 172 N 0.00 0.07 -2.77 -0.72 4.01 -0.65 -4.98 117.16 112.12 1owd n TYR 172 Ca 0.00 -0.18 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 1owd n TYR 172 Cb 0.00 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.02 1owd n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1owd n GLY 173 N 0.12 2.48 0.14 2.72 0.00 -1.02 -1.15 105.19 108.48 1owd n GLY 173 Ca 0.03 -0.30 0.05 0.00 0.00 0.00 0.00 46.02 45.81 1owd n GLY 173 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1owd n SER 174 N 0.41 0.40 0.18 1.61 7.64 -1.26 -3.83 113.62 118.78 1owd n SER 174 Ca 0.00 -1.76 0.06 0.00 1.01 0.00 0.00 58.87 58.17 1owd n SER 174 Cb 0.00 -0.04 0.31 0.00 -1.01 0.00 0.00 64.21 63.47 1owd n SER 174 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1owd h GLU 175 N 0.48 0.00 -5.22 1.43 5.08 -1.52 -3.41 114.58 111.42 1owd h GLU 175 Ca 0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.75 1owd h GLU 175 Cb 0.11 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.22 1owd h GLU 175 CO 0.00 0.38 -0.34 0.54 -1.00 0.00 0.00 179.01 178.59 1owd s VAL 176 N -3.54 5.26 0.62 3.13 0.11 -1.25 -4.86 120.40 119.87 1owd s VAL 176 Ca 0.00 0.46 0.08 0.00 -2.93 0.00 0.00 61.98 59.59 1owd s VAL 176 Cb 0.11 -3.63 0.11 0.00 -1.53 0.00 0.00 36.38 31.43 1owd s VAL 176 CO 0.69 0.27 0.86 0.42 -3.33 0.00 0.00 175.10 174.01 1owd s THR 177 N 1.36 2.03 -1.27 5.04 -4.23 -1.26 -4.91 115.64 112.40 1owd s THR 177 Ca 0.13 -0.93 0.21 0.00 -1.18 0.00 0.00 61.69 59.92 1owd s THR 177 Cb -0.15 -2.10 0.29 0.00 1.34 0.00 0.00 72.50 71.89 1owd s THR 177 CO 0.07 0.00 1.66 0.35 -0.54 0.00 0.00 174.62 176.16 1owd n THR 178 N -2.41 0.45 0.45 3.99 -2.24 -1.26 -2.35 114.28 110.91 1owd n THR 178 Ca 0.17 0.11 0.08 0.00 -2.27 0.00 0.00 64.05 62.14 1owd n THR 178 Cb 0.62 -0.76 0.22 0.00 -2.10 0.00 0.00 70.33 68.30 1owd n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1owd n LYS 179 N -1.37 2.13 -4.35 -0.78 5.02 -1.26 -4.91 118.16 112.64 1owd n LYS 179 Ca 0.08 -1.75 -0.20 0.00 -2.02 0.00 0.00 58.31 54.41 1owd n LYS 179 Cb 0.19 -1.38 -0.10 0.00 -0.02 0.00 0.00 35.03 33.72 1owd n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1owd s MET 180 N -1.35 1.34 -0.02 1.97 -1.94 -0.99 -2.00 119.30 116.30 1owd s MET 180 Ca 0.33 -1.53 0.03 0.00 -1.71 0.00 0.00 55.69 52.81 1owd s MET 180 Cb 0.17 -1.26 -0.00 0.00 2.01 0.00 0.00 34.83 35.74 1owd s MET 180 CO 0.22 0.23 -0.12 -0.51 -0.01 0.00 0.00 175.02 174.84 1owd s LEU 181 N -3.07 1.93 0.10 -0.03 1.43 -0.48 -4.82 118.68 113.73 1owd s LEU 181 Ca 0.20 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 53.11 1owd s LEU 181 Cb -0.03 -0.65 -0.04 0.00 0.03 0.00 0.00 46.19 45.50 1owd s LEU 181 CO 0.08 0.12 0.09 0.00 0.23 0.00 0.00 176.35 176.86 1owd s ALA 183 N -1.45 -1.46 0.13 0.00 0.00 -0.86 -0.36 121.76 117.75 1owd s ALA 183 Ca 0.29 1.30 -0.25 0.00 0.00 0.00 0.00 51.96 53.31 1owd s ALA 183 Cb -0.12 -0.41 0.08 0.00 0.00 0.00 0.00 23.12 22.67 1owd s ALA 183 CO 0.22 -0.31 1.07 0.00 0.00 0.00 0.00 175.76 176.74 1owd s ALA 184 N -0.56 -1.76 -0.19 0.00 0.00 0.20 -1.33 121.76 118.11 1owd s ALA 184 Ca -0.07 -0.03 -0.20 0.00 0.00 0.00 0.00 51.96 51.67 1owd s ALA 184 Cb -0.03 0.68 -0.03 0.00 0.00 0.00 0.00 23.12 23.74 1owd s ALA 184 CO 0.05 -1.06 0.57 0.34 0.00 0.00 0.00 175.76 175.65 1owd s ASP 185 N -3.24 6.64 0.42 0.00 3.68 -1.26 -0.91 116.67 122.01 1owd s ASP 185 Ca 0.18 0.78 0.17 0.00 2.13 0.00 0.00 52.55 55.81 1owd s ASP 185 Cb -0.01 -2.32 1.07 0.00 -1.45 0.00 0.00 42.92 40.21 1owd s ASP 185 CO 0.03 -0.20 1.89 -0.65 0.13 0.00 0.00 175.17 176.37 1owd h PRO 186 N 7.37 0.40 -0.12 4.34 0.11 -1.95 0.27 132.00 142.43 1owd h PRO 186 Ca -0.34 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1owd h PRO 186 Cb 1.15 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1owd h PRO 186 CO 0.76 0.26 0.00 1.04 -0.21 0.00 0.00 178.00 179.85 1owd n GLN 187 N -4.49 2.03 -3.25 1.05 1.13 -1.26 -4.97 117.38 107.61 1owd n GLN 187 Ca 0.17 -1.52 -0.23 0.00 -1.94 0.00 0.00 57.00 53.47 1owd n GLN 187 Cb 0.61 -1.46 0.02 0.00 0.11 0.00 0.00 30.24 29.52 1owd n GLN 187 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 1owd n TRP 188 N 0.79 -2.01 -0.06 1.08 7.02 0.08 -4.90 117.44 119.45 1owd n TRP 188 Ca 0.17 0.57 -0.04 0.00 -1.02 0.00 0.00 57.50 57.19 1owd n TRP 188 Cb 0.47 -3.97 -0.15 0.00 -2.42 0.00 0.00 31.31 25.24 1owd n TRP 188 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1owd n LYS 189 N -4.06 0.67 -4.29 -0.99 4.76 -1.26 -4.63 118.16 108.37 1owd n LYS 189 Ca -0.06 -0.02 -0.24 0.00 -2.87 0.00 0.00 58.31 55.12 1owd n LYS 189 Cb 0.58 -1.56 -0.12 0.00 -1.84 0.00 0.00 35.03 32.09 1owd n LYS 189 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1owd s THR 190 N -2.80 1.73 -0.06 -0.18 -1.32 -1.26 -4.43 115.64 107.31 1owd s THR 190 Ca -0.09 -1.56 -0.31 0.00 -1.21 0.00 0.00 61.69 58.52 1owd s THR 190 Cb 0.08 -1.58 0.13 0.00 -1.51 0.00 0.00 72.50 69.63 1owd s THR 190 CO 0.85 -0.06 1.36 -0.62 -2.21 0.00 0.00 174.62 173.94 1owd s ASP 191 N -1.93 -0.02 0.71 8.08 2.15 -1.17 -4.08 116.67 120.41 1owd s ASP 191 Ca 0.07 -0.07 -0.07 0.00 0.43 0.00 0.00 52.55 52.91 1owd s ASP 191 Cb -0.10 0.08 0.07 0.00 -0.30 0.00 0.00 42.92 42.67 1owd s ASP 191 CO 0.04 -0.15 1.02 -0.94 -0.17 0.00 0.00 175.17 174.97 1owd s SER 192 N -3.14 4.76 0.29 -0.34 1.04 -1.26 -0.91 113.70 114.15 1owd s SER 192 Ca 0.17 0.42 -0.18 0.00 0.48 0.00 0.00 55.95 56.84 1owd s SER 192 Cb 0.05 -1.05 0.02 0.00 0.10 0.00 0.00 66.02 65.14 1owd s SER 192 CO -0.05 -1.63 0.67 0.00 0.98 0.00 0.00 173.24 173.21 1owd n GLN 194 N -0.45 0.70 0.00 0.00 7.27 -1.26 -0.78 117.38 122.85 1owd n GLN 194 Ca -0.04 0.25 0.00 0.00 0.07 0.00 0.00 57.00 57.29 1owd n GLN 194 Cb 0.60 -1.85 0.00 0.00 2.41 0.00 0.00 30.24 31.39 1owd n GLN 194 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1owd n GLY 195 N 3.05 2.06 0.02 1.69 0.00 -1.26 -2.43 105.19 108.31 1owd n GLY 195 Ca 0.23 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1owd n GLY 195 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1owd n ASP 196 N 0.00 0.63 -4.44 1.61 8.00 0.04 -3.78 116.55 118.60 1owd n ASP 196 Ca 0.00 -0.39 -0.43 0.00 0.71 0.00 0.00 54.79 54.67 1owd n ASP 196 Cb 0.00 0.97 -0.00 0.00 -0.02 0.00 0.00 41.12 42.06 1owd n ASP 196 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1owd n SER 197 N -1.85 -0.88 0.00 -2.24 7.64 -1.26 -1.62 113.62 113.42 1owd n SER 197 Ca 0.02 0.98 0.00 0.00 1.01 0.00 0.00 58.87 60.88 1owd n SER 197 Cb 0.42 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 1owd n SER 197 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1owd n GLY 198 N 1.81 2.23 3.85 0.23 0.00 -0.22 -1.69 105.19 111.40 1owd n GLY 198 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1owd n GLY 198 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1owd s GLY 199 N -1.94 1.64 0.20 -0.02 0.00 -0.64 -3.50 107.32 103.06 1owd s GLY 199 Ca 0.00 -0.21 -0.30 0.00 0.00 0.00 0.00 44.72 44.21 1owd s GLY 199 CO 0.00 0.16 1.17 2.56 0.00 0.00 0.00 173.10 176.99 1owd s PRO 200 N -5.23 4.52 -0.46 2.90 0.04 -1.26 -0.62 135.00 134.89 1owd s PRO 200 Ca 0.59 1.85 -0.01 0.00 0.04 0.00 0.00 61.00 63.47 1owd s PRO 200 Cb -0.13 -3.24 0.12 0.00 0.04 0.00 0.00 34.50 31.30 1owd s PRO 200 CO 0.53 -0.03 0.24 -1.17 0.04 0.00 0.00 177.00 176.62 1owd s LEU 201 N -0.44 5.07 -0.11 -3.56 2.96 0.71 -4.12 118.68 119.19 1owd s LEU 201 Ca 0.51 -2.37 -0.11 0.00 -0.22 0.00 0.00 54.13 51.94 1owd s LEU 201 Cb -0.32 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 1owd s LEU 201 CO 0.37 -0.44 0.24 -0.69 -1.32 0.00 0.00 176.35 174.52 1owd s VAL 202 N 0.64 5.33 -0.03 1.68 1.01 -0.91 -1.23 120.40 126.88 1owd s VAL 202 Ca 0.12 0.45 0.03 0.00 0.00 0.00 0.00 61.98 62.58 1owd s VAL 202 Cb -0.22 -3.54 -0.00 0.00 0.00 0.00 0.00 36.38 32.62 1owd s VAL 202 CO -0.04 0.53 -0.12 0.00 0.00 0.00 0.00 175.10 175.47 1owd s SER 204 N 0.09 6.22 -0.28 0.00 0.15 -1.26 -0.89 113.70 117.72 1owd s SER 204 Ca -0.02 0.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.76 1owd s SER 204 Cb -0.09 -2.55 0.04 0.00 -1.71 0.00 0.00 66.02 61.71 1owd s SER 204 CO 0.01 -1.67 -0.03 -0.22 1.20 0.00 0.00 173.24 172.53 1owd s LEU 205 N 5.73 3.61 -1.39 3.45 2.96 -0.41 -4.67 118.68 127.95 1owd s LEU 205 Ca 0.48 -1.15 -0.08 0.00 -0.22 0.00 0.00 54.13 53.15 1owd s LEU 205 Cb -0.09 -1.68 0.03 0.00 0.50 0.00 0.00 46.19 44.95 1owd s LEU 205 CO 0.24 -0.21 1.04 0.00 -1.32 0.00 0.00 176.35 176.10 1owd n GLN 206 N 4.62 -6.64 -0.95 1.98 6.02 -1.26 -2.08 117.38 119.07 1owd n GLN 206 Ca -0.14 0.73 0.00 0.00 -0.01 0.00 0.00 57.00 57.58 1owd n GLN 206 Cb 0.44 -5.67 0.00 0.00 1.02 0.00 0.00 30.24 26.03 1owd n GLN 206 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1owd n GLY 207 N -1.75 0.68 2.98 1.08 0.00 -1.26 -5.03 105.19 101.89 1owd n GLY 207 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 1owd n GLY 207 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1owd s ARG 208 N -0.05 1.58 0.08 1.61 6.06 -0.88 -5.10 118.95 122.24 1owd s ARG 208 Ca 0.00 -0.35 -0.31 0.00 -2.50 0.00 0.00 55.73 52.58 1owd s ARG 208 Cb 0.00 -1.39 -0.09 0.00 0.06 0.00 0.00 34.95 33.53 1owd s ARG 208 CO 0.00 -0.05 1.74 -1.64 -2.50 0.00 0.00 175.30 172.85 1owd s MET 209 N 0.92 4.17 -0.04 5.12 -1.94 -1.26 -1.29 119.30 124.98 1owd s MET 209 Ca -0.10 2.45 0.02 0.00 -1.71 0.00 0.00 55.69 56.35 1owd s MET 209 Cb -0.15 -3.66 0.01 0.00 2.01 0.00 0.00 34.83 33.04 1owd s MET 209 CO 0.01 -0.80 -0.10 0.99 -0.01 0.00 0.00 175.02 175.11 1owd s THR 210 N 2.89 0.87 -0.99 2.05 2.01 -0.07 -4.14 115.64 118.26 1owd s THR 210 Ca 0.78 -0.38 -0.23 0.00 0.31 0.00 0.00 61.69 62.16 1owd s THR 210 Cb -0.42 -0.79 0.01 0.00 0.01 0.00 0.00 72.50 71.31 1owd s THR 210 CO 0.34 0.28 1.66 -0.22 -0.69 0.00 0.00 174.62 175.99 1owd s LEU 211 N 0.36 3.38 0.06 4.42 2.96 -0.76 -0.91 118.68 128.19 1owd s LEU 211 Ca -0.06 -1.22 -0.02 0.00 -0.22 0.00 0.00 54.13 52.61 1owd s LEU 211 Cb -0.11 -2.57 -0.27 0.00 0.50 0.00 0.00 46.19 43.74 1owd s LEU 211 CO 0.01 -1.99 1.09 0.74 -1.32 0.00 0.00 176.35 174.89 1owd h THR 212 N 6.90 1.45 -4.51 3.68 2.02 -1.52 -3.39 112.91 117.53 1owd h THR 212 Ca 0.17 -3.05 -0.22 0.00 0.77 0.00 0.00 66.41 64.09 1owd h THR 212 Cb 1.00 2.89 -0.15 0.00 -1.74 0.00 0.00 68.15 70.15 1owd h THR 212 CO 1.35 0.88 -0.62 -0.83 0.37 0.00 0.00 175.52 176.67 1owd s GLY 213 N -4.73 1.26 -0.06 2.16 0.00 -0.37 -2.86 107.32 102.73 1owd s GLY 213 Ca -0.04 -1.60 0.02 0.00 0.00 0.00 0.00 44.72 43.10 1owd s GLY 213 CO 0.87 -1.37 -0.11 -0.42 0.00 0.00 0.00 173.10 172.07 1owd s ILE 214 N -4.12 1.01 0.10 0.90 1.01 -1.19 -0.21 121.20 118.70 1owd s ILE 214 Ca 0.34 -0.41 -0.31 0.00 0.00 0.00 0.00 60.65 60.27 1owd s ILE 214 Cb 0.07 -0.93 -0.10 0.00 0.01 0.00 0.00 42.46 41.51 1owd s ILE 214 CO 0.08 0.32 1.83 -0.69 0.00 0.00 0.00 174.94 176.49 1owd s VAL 215 N 0.64 2.66 0.05 2.92 1.01 0.21 -1.26 120.40 126.64 1owd s VAL 215 Ca -0.13 0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1owd s VAL 215 Cb -0.15 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1owd s VAL 215 CO 0.03 -0.00 0.00 -0.24 0.00 0.00 0.00 175.10 174.89 1owd n SER 216 N 5.96 0.43 -3.19 3.32 2.88 -0.93 -1.06 113.62 121.03 1owd n SER 216 Ca 0.18 0.08 -0.12 0.00 -1.33 0.00 0.00 58.87 57.67 1owd n SER 216 Cb 0.39 -0.11 -0.02 0.00 -0.75 0.00 0.00 64.21 63.71 1owd n SER 216 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1owd s TRP 217 N -1.44 0.69 0.00 0.66 1.48 -0.94 -4.93 118.94 114.47 1owd s TRP 217 Ca 0.00 -1.08 0.00 0.00 -1.06 0.00 0.00 56.10 53.96 1owd s TRP 217 Cb 0.00 0.25 0.00 0.00 -1.16 0.00 0.00 33.47 32.56 1owd s TRP 217 CO 0.00 -1.27 0.00 0.41 -4.06 0.00 0.00 176.95 172.03 1owd n GLY 218 N -0.54 1.97 3.55 3.67 0.00 -1.26 -0.18 105.19 112.41 1owd n GLY 218 Ca -0.02 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 1owd n GLY 218 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1owd s ARG 219 N -2.00 3.47 2.55 1.61 6.06 -1.26 -4.89 118.95 124.50 1owd s ARG 219 Ca 0.00 0.05 0.00 0.00 -2.50 0.00 0.00 55.73 53.28 1owd s ARG 219 Cb 0.00 -3.97 0.00 0.00 0.06 0.00 0.00 34.95 31.04 1owd s ARG 219 CO 0.00 -1.33 0.00 0.41 -2.50 0.00 0.00 175.30 171.88 1owd n GLY 220 N 5.00 -0.15 2.76 8.12 0.00 -1.26 -4.61 105.19 115.05 1owd n GLY 220 Ca 0.05 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.81 1owd n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1owd n ALA 222 N 5.01 -0.96 -2.50 0.00 0.00 -1.26 -4.92 120.51 115.87 1owd n ALA 222 Ca -0.09 0.28 -0.33 0.00 0.00 0.00 0.00 53.44 53.30 1owd n ALA 222 Cb 0.50 -3.84 -0.05 0.00 0.00 0.00 0.00 19.45 16.06 1owd n ALA 222 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1owd s LEU 223 N -6.67 4.26 0.21 0.00 1.43 -1.26 -4.65 118.68 112.00 1owd s LEU 223 Ca 0.29 0.84 -0.32 0.00 -1.03 0.00 0.00 54.13 53.91 1owd s LEU 223 Cb -0.13 -3.36 -0.13 0.00 0.03 0.00 0.00 46.19 42.60 1owd s LEU 223 CO 0.36 0.04 1.50 1.17 0.23 0.00 0.00 176.35 179.66 1owd n LYS 224 N 0.33 2.16 -2.44 1.70 4.81 -1.26 -1.99 118.16 121.45 1owd n LYS 224 Ca -0.03 0.77 -0.17 0.00 -0.87 0.00 0.00 58.31 58.01 1owd n LYS 224 Cb 0.52 -2.49 -0.01 0.00 0.02 0.00 0.00 35.03 33.07 1owd n LYS 224 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1owd n ASP 225 N 2.69 -4.93 -3.44 3.14 8.00 -1.26 -4.92 116.55 115.83 1owd n ASP 225 Ca 0.14 0.08 -0.26 0.00 0.71 0.00 0.00 54.79 55.45 1owd n ASP 225 Cb 0.31 -4.13 -0.09 0.00 -0.02 0.00 0.00 41.12 37.18 1owd n ASP 225 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1owd n LYS 226 N -2.94 0.90 -0.71 -1.24 4.76 -0.84 -4.33 118.16 113.76 1owd n LYS 226 Ca -0.19 -3.61 -0.29 0.00 -2.87 0.00 0.00 58.31 51.34 1owd n LYS 226 Cb 0.65 -1.74 0.21 0.00 -1.84 0.00 0.00 35.03 32.31 1owd n LYS 226 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 1owd s PRO 227 N -0.85 0.00 0.20 1.97 0.02 -1.26 -4.43 135.00 130.65 1owd s PRO 227 Ca 0.33 1.04 -0.19 0.00 0.02 0.00 0.00 61.00 62.19 1owd s PRO 227 Cb 0.07 -1.65 -0.08 0.00 0.02 0.00 0.00 34.50 32.86 1owd s PRO 227 CO -0.15 -3.16 0.70 0.20 -0.33 0.00 0.00 177.00 174.26 1owd s GLY 228 N -2.72 2.62 -0.11 0.52 0.00 -0.44 -4.52 107.32 102.66 1owd s GLY 228 Ca 0.67 0.13 -0.01 0.00 0.00 0.00 0.00 44.72 45.51 1owd s GLY 228 CO 0.61 0.49 -0.07 0.14 0.00 0.00 0.00 173.10 174.27 1owd s VAL 229 N -1.47 3.60 0.09 1.40 1.01 0.75 -2.02 120.40 123.76 1owd s VAL 229 Ca 0.41 -0.49 0.07 0.00 0.00 0.00 0.00 61.98 61.97 1owd s VAL 229 Cb -0.17 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.66 1owd s VAL 229 CO 0.21 0.54 -0.18 -0.31 0.00 0.00 0.00 175.10 175.37 1owd s TYR 230 N -0.09 1.51 -0.01 5.22 2.02 0.25 -2.19 117.35 124.06 1owd s TYR 230 Ca 0.01 -0.44 -0.30 0.00 -0.37 0.00 0.00 57.07 55.96 1owd s TYR 230 Cb -0.13 -0.83 -0.05 0.00 -0.40 0.00 0.00 41.96 40.54 1owd s TYR 230 CO 0.03 0.14 1.43 0.99 -1.57 0.00 0.00 175.55 176.57 1owd s THR 231 N -1.25 3.71 -0.64 -0.71 2.01 -0.39 -1.38 115.64 116.98 1owd s THR 231 Ca 0.03 1.06 -0.27 0.00 0.31 0.00 0.00 61.69 62.81 1owd s THR 231 Cb -0.10 -3.68 0.00 0.00 0.01 0.00 0.00 72.50 68.73 1owd s THR 231 CO 0.03 -0.02 1.59 -0.60 -0.69 0.00 0.00 174.62 174.94 1owd s ARG 232 N 2.67 2.94 0.18 4.92 3.52 -0.85 -3.19 118.95 129.13 1owd s ARG 232 Ca 0.65 0.31 -0.14 0.00 -0.13 0.00 0.00 55.73 56.42 1owd s ARG 232 Cb -0.31 -4.27 0.12 0.00 -1.56 0.00 0.00 34.95 28.92 1owd s ARG 232 CO 0.26 -2.39 1.79 0.28 -0.81 0.00 0.00 175.30 174.43 1owd h VAL 233 N 6.51 0.98 -1.01 7.11 2.07 -1.83 -2.89 116.25 127.19 1owd h VAL 233 Ca -0.27 -0.17 0.24 0.00 0.82 0.00 0.00 66.70 67.32 1owd h VAL 233 Cb 1.11 0.43 -0.11 0.00 -1.52 0.00 0.00 31.29 31.20 1owd h VAL 233 CO 1.23 0.09 0.62 0.77 0.02 0.00 0.00 177.57 180.30 1owd h SER 234 N 0.50 0.65 -0.30 0.57 4.64 -1.89 0.94 113.55 118.66 1owd h SER 234 Ca 0.21 0.11 -0.02 0.00 -0.47 0.00 0.00 61.79 61.63 1owd h SER 234 Cb 0.10 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 1owd h SER 234 CO -0.14 0.14 0.14 -0.74 -0.87 0.00 0.00 176.83 175.36 1owd h HIS 235 N 0.58 0.48 -0.48 4.77 6.17 -1.89 -3.04 115.15 121.75 1owd h HIS 235 Ca 0.62 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.68 1owd h HIS 235 Cb 1.21 -0.15 0.00 0.00 2.52 0.00 0.00 27.41 30.99 1owd h HIS 235 CO -0.00 0.38 0.00 1.19 0.71 0.00 0.00 177.93 180.21 1owd n PHE 236 N -4.40 0.66 -0.23 5.26 3.01 0.32 -4.57 117.46 117.51 1owd n PHE 236 Ca 0.02 -0.33 0.04 0.00 1.01 0.00 0.00 57.45 58.19 1owd n PHE 236 Cb 0.14 -0.01 0.15 0.00 -0.01 0.00 0.00 39.48 39.75 1owd n PHE 236 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1owd h LEU 237 N 2.81 -0.03 -1.01 4.37 3.38 -1.44 -1.07 115.31 122.31 1owd h LEU 237 Ca 0.00 0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.15 1owd h LEU 237 Cb 0.67 0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.55 1owd h LEU 237 CO 0.01 -0.03 0.66 -0.65 0.09 0.00 0.00 178.44 178.51 1owd h PRO 238 N 0.25 1.21 -0.37 1.13 0.11 -1.87 -0.26 132.00 132.20 1owd h PRO 238 Ca 0.38 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.35 1owd h PRO 238 Cb 0.62 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1owd h PRO 238 CO -0.49 0.80 -0.03 2.35 -0.21 0.00 0.00 178.00 180.43 1owd h TRP 239 N 1.24 0.74 -0.38 0.65 7.01 -1.68 -1.99 115.95 121.55 1owd h TRP 239 Ca 0.41 -0.14 -0.02 0.00 2.11 0.00 0.00 58.89 61.25 1owd h TRP 239 Cb 0.05 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 26.91 1owd h TRP 239 CO -0.00 0.78 0.15 0.82 -2.79 0.00 0.00 178.44 177.40 1owd h ILE 240 N 0.48 1.19 0.28 2.65 2.04 -0.70 -2.17 117.51 121.29 1owd h ILE 240 Ca 0.10 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.35 1owd h ILE 240 Cb 0.51 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1owd h ILE 240 CO 0.02 0.21 -0.14 -0.09 0.00 0.00 0.00 178.15 178.16 1owd h ARG 241 N 0.46 -0.36 -0.18 2.37 2.43 -1.04 -2.85 114.38 115.20 1owd h ARG 241 Ca 0.12 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1owd h ARG 241 Cb 0.19 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1owd h ARG 241 CO -0.01 -0.22 -0.05 0.66 -1.51 0.00 0.00 179.97 178.85 1owd h SER 242 N -0.41 0.25 0.06 -3.80 4.64 -1.34 -2.83 113.55 110.13 1owd h SER 242 Ca -0.04 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1owd h SER 242 Cb 0.31 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1owd h SER 242 CO 0.06 0.34 -0.06 1.41 -0.87 0.00 0.00 176.83 177.72 1owd n HIS 243 N -4.34 0.00 0.48 4.77 8.25 -0.82 -5.11 115.22 118.46 1owd n HIS 243 Ca -0.00 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.51 1owd n HIS 243 Cb 0.21 -0.03 0.05 0.00 1.12 0.00 0.00 29.99 31.34 1owd n HIS 243 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23