#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wro s ARG 3 N 0.00 2.36 -0.09 -0.52 3.52 -1.26 -4.79 118.95 118.18 2wro s ARG 3 Ca 0.00 0.13 -0.02 0.00 -0.13 0.00 0.00 55.73 55.70 2wro s ARG 3 Cb 0.00 -4.86 -0.05 0.00 -1.56 0.00 0.00 34.95 28.49 2wro s ARG 3 CO 0.00 -3.45 2.59 0.00 -0.81 0.00 0.00 175.30 173.62 2wro n ALA 4 N 14.75 5.14 -0.81 6.12 0.00 -1.26 -4.97 120.51 139.49 2wro n ALA 4 Ca 0.37 -1.10 -0.31 0.00 0.00 0.00 0.00 53.44 52.40 2wro n ALA 4 Cb 0.48 -1.58 0.02 0.00 0.00 0.00 0.00 19.45 18.37 2wro n ALA 4 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2wro n LYS 5 N 1.59 0.00 0.40 0.00 2.85 -1.26 -4.90 118.16 116.84 2wro n LYS 5 Ca 0.23 0.00 -0.16 0.00 -1.05 0.00 0.00 58.31 57.33 2wro n LYS 5 Cb 0.65 -0.81 -0.07 0.00 -0.65 0.00 0.00 35.03 34.15 2wro n LYS 5 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 2wro h THR 6 N -0.81 0.00 -0.98 0.58 2.02 -2.04 -3.48 112.91 108.20 2wro h THR 6 Ca -0.32 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 66.79 2wro h THR 6 Cb 1.13 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 2wro h THR 6 CO 0.17 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.67 2wro n GLY 7 N -1.27 0.17 0.33 2.16 0.00 -1.26 -3.86 105.19 101.46 2wro n GLY 7 Ca -0.13 -0.95 0.22 0.00 0.00 0.00 0.00 46.02 45.16 2wro n GLY 7 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2wro h VAL 8 N 0.00 0.35 0.00 1.61 3.04 -2.03 -3.35 116.25 115.86 2wro h VAL 8 Ca 0.00 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.57 2wro h VAL 8 Cb 0.00 -0.05 0.00 0.00 -2.01 0.00 0.00 31.29 29.23 2wro h VAL 8 CO 0.00 0.07 0.00 1.33 -1.01 0.00 0.00 177.57 177.96 2wro n VAL 9 N -5.04 0.00 -0.15 1.51 0.24 -1.25 -2.00 118.33 111.63 2wro n VAL 9 Ca 0.30 0.55 -0.05 0.00 -2.04 0.00 0.00 64.34 63.09 2wro n VAL 9 Cb 0.91 -0.75 0.01 0.00 -1.47 0.00 0.00 33.84 32.54 2wro n VAL 9 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2wro h ARG 10 N 0.00 -0.15 -0.83 7.34 2.43 -1.84 0.28 114.38 121.61 2wro h ARG 10 Ca 0.00 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.36 2wro h ARG 10 Cb 0.00 0.03 -0.15 0.00 -0.42 0.00 0.00 29.97 29.43 2wro h ARG 10 CO 0.00 -0.10 -0.11 -0.09 -1.51 0.00 0.00 179.97 178.16 2wro h ARG 11 N -0.16 0.03 0.00 0.20 2.43 -1.65 1.96 114.38 117.19 2wro h ARG 11 Ca 0.21 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.37 2wro h ARG 11 Cb 0.50 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2wro h ARG 11 CO -0.57 0.02 -0.08 0.00 -1.51 0.00 0.00 179.97 177.82 2wro h ARG 12 N 0.03 0.00 0.00 0.20 3.08 -0.28 -2.18 114.38 115.23 2wro h ARG 12 Ca 0.43 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.48 2wro h ARG 12 Cb 0.73 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.78 2wro h ARG 12 CO -0.81 0.08 -0.42 0.87 -1.07 0.00 0.00 179.97 178.62 2wro h LYS 13 N 0.00 0.00 0.00 0.04 1.79 0.44 -3.33 116.57 115.51 2wro h LYS 13 Ca -0.00 0.00 -0.35 0.00 -2.18 0.00 0.00 60.65 58.12 2wro h LYS 13 Cb 0.24 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.84 2wro h LYS 13 CO 0.01 0.01 -2.14 0.72 -1.08 0.00 0.00 179.45 176.97 2wro n HIS 14 N -2.93 0.01 0.17 -1.35 8.25 -0.03 -4.19 115.22 115.15 2wro n HIS 14 Ca 0.02 0.01 0.09 0.00 -0.26 0.00 0.00 57.72 57.57 2wro n HIS 14 Cb 0.54 -0.87 0.46 0.00 1.12 0.00 0.00 29.99 31.24 2wro n HIS 14 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 2wro h LYS 15 N -1.00 0.00 -0.29 -0.41 2.10 -1.63 0.95 116.57 116.29 2wro h LYS 15 Ca -0.52 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.13 2wro h LYS 15 Cb 1.46 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.79 2wro h LYS 15 CO -0.32 0.00 0.00 1.63 -2.00 0.00 0.00 179.45 178.76 2wro n LYS 16 N -2.16 0.80 0.05 0.07 5.02 -1.25 -3.54 118.16 117.15 2wro n LYS 16 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2wro n LYS 16 Cb 0.21 -1.15 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 2wro n LYS 16 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2wro n ILE 17 N -0.28 0.31 -0.29 -0.18 -0.00 0.33 -4.74 119.36 114.51 2wro n ILE 17 Ca 0.00 0.10 0.03 0.00 -0.00 0.00 0.00 62.75 62.88 2wro n ILE 17 Cb 0.07 -1.04 0.08 0.00 -0.00 0.00 0.00 39.64 38.75 2wro n ILE 17 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2wro n LEU 18 N -3.12 -0.37 -0.03 1.39 7.99 -1.16 0.17 117.00 121.87 2wro n LEU 18 Ca 0.00 1.35 -0.09 0.00 -0.01 0.00 0.00 56.01 57.26 2wro n LEU 18 Cb 0.13 -0.37 -0.03 0.00 -0.11 0.00 0.00 43.42 43.04 2wro n LEU 18 CO 0.00 -1.27 0.85 0.11 -1.51 0.00 0.00 177.39 175.58 2wro h LYS 19 N 0.00 0.04 -0.94 3.23 1.57 -1.87 -1.55 116.57 117.05 2wro h LYS 19 Ca 0.34 -0.00 0.25 0.00 -1.87 0.00 0.00 60.65 59.37 2wro h LYS 19 Cb 0.53 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 2wro h LYS 19 CO -0.80 0.02 0.65 -0.07 -0.57 0.00 0.00 179.45 178.69 2wro h LEU 20 N 0.04 0.17 -6.69 2.94 -0.00 -0.57 -2.87 115.31 108.34 2wro h LEU 20 Ca 0.08 0.02 -0.79 0.00 -0.00 0.00 0.00 57.88 57.20 2wro h LEU 20 Cb 0.11 -0.01 -0.29 0.00 -0.00 0.00 0.00 40.66 40.47 2wro h LEU 20 CO -0.15 0.06 0.70 0.00 -0.00 0.00 0.00 178.44 179.04 2wro n ALA 21 N -2.63 5.27 -2.60 1.53 0.00 -0.58 -5.01 120.51 116.48 2wro n ALA 21 Ca 0.20 -4.77 -0.33 0.00 0.00 0.00 0.00 53.44 48.55 2wro n ALA 21 Cb 0.90 -2.17 -0.10 0.00 0.00 0.00 0.00 19.45 18.07 2wro n ALA 21 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wro s LYS 22 N -3.10 2.65 0.00 0.00 -0.14 -1.09 -4.31 119.74 113.75 2wro s LYS 22 Ca 0.34 -0.65 0.00 0.00 -1.36 0.00 0.00 55.97 54.30 2wro s LYS 22 Cb 0.09 -2.55 0.00 0.00 -1.68 0.00 0.00 37.83 33.69 2wro s LYS 22 CO 0.05 0.63 0.00 0.41 -0.76 0.00 0.00 175.35 175.68 2wro n GLY 23 N 1.76 0.76 3.77 -3.33 0.00 -1.26 -5.04 105.19 101.85 2wro n GLY 23 Ca -0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 2wro n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wro s TYR 24 N -2.79 3.91 0.16 1.61 4.12 -1.26 -5.05 117.35 118.06 2wro s TYR 24 Ca 0.00 1.69 -0.30 0.00 0.02 0.00 0.00 57.07 58.48 2wro s TYR 24 Cb 0.00 -2.81 -0.07 0.00 -1.52 0.00 0.00 41.96 37.56 2wro s TYR 24 CO 0.00 0.49 1.08 -0.46 0.02 0.00 0.00 175.55 176.68 2wro s TRP 25 N -1.18 3.63 0.00 2.71 -0.11 -1.26 -4.43 118.94 118.31 2wro s TRP 25 Ca 0.37 1.63 0.00 0.00 1.22 0.00 0.00 56.10 59.32 2wro s TRP 25 Cb -0.23 -3.23 0.00 0.00 -1.50 0.00 0.00 33.47 28.50 2wro s TRP 25 CO 0.27 -0.46 0.00 0.41 -4.62 0.00 0.00 176.95 172.55 2wro n GLY 26 N 2.12 -0.16 0.47 5.86 0.00 -1.26 -3.56 105.19 108.66 2wro n GLY 26 Ca 0.03 -1.03 0.03 0.00 0.00 0.00 0.00 46.02 45.04 2wro n GLY 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wro n LEU 27 N 0.00 1.30 -0.05 0.99 4.32 -1.26 -3.12 117.00 119.18 2wro n LEU 27 Ca 0.00 -0.65 0.16 0.00 -0.02 0.00 0.00 56.01 55.49 2wro n LEU 27 Cb 0.00 -0.22 0.87 0.00 -1.62 0.00 0.00 43.42 42.45 2wro n LEU 27 CO 0.00 0.28 1.06 0.54 -1.22 0.00 0.00 177.39 178.05 2wro n ARG 28 N 0.09 0.98 -0.03 3.23 1.74 -1.23 -1.11 116.66 120.32 2wro n ARG 28 Ca 0.07 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2wro n ARG 28 Cb 0.24 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.18 2wro n ARG 28 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2wro n SER 29 N -0.92 0.79 0.00 0.55 3.41 -1.18 -3.62 113.62 112.64 2wro n SER 29 Ca 0.22 -1.49 0.00 0.00 -0.26 0.00 0.00 58.87 57.34 2wro n SER 29 Cb 0.16 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2wro n SER 29 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wro n LYS 30 N -0.23 2.05 -3.22 4.33 4.76 -1.18 -4.92 118.16 119.75 2wro n LYS 30 Ca 0.01 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.04 2wro n LYS 30 Cb 0.43 -0.61 -0.08 0.00 -1.84 0.00 0.00 35.03 32.94 2wro n LYS 30 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2wro s SER 31 N -1.13 6.38 0.21 4.39 0.15 -0.27 -4.97 113.70 118.46 2wro s SER 31 Ca 0.00 0.21 -0.17 0.00 0.70 0.00 0.00 55.95 56.70 2wro s SER 31 Cb 0.00 -2.28 0.20 0.00 -1.71 0.00 0.00 66.02 62.23 2wro s SER 31 CO 0.00 -0.42 1.60 2.19 1.20 0.00 0.00 173.24 177.81 2wro h PHE 32 N 8.29 -0.67 0.00 3.44 -0.00 -1.93 0.90 116.94 126.97 2wro h PHE 32 Ca -0.28 0.07 0.00 0.00 -0.00 0.00 0.00 57.97 57.76 2wro h PHE 32 Cb 1.13 0.39 0.00 0.00 -0.00 0.00 0.00 35.95 37.47 2wro h PHE 32 CO 0.74 -0.35 0.00 0.54 -0.00 0.00 0.00 178.31 179.24 2wro n ARG 33 N -5.45 0.00 -0.32 6.09 1.74 -1.26 -1.61 116.66 115.85 2wro n ARG 33 Ca 0.07 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.07 2wro n ARG 33 Cb 0.36 -0.68 -0.08 0.00 -1.02 0.00 0.00 32.46 31.04 2wro n ARG 33 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2wro n LYS 34 N -0.18 -0.33 -0.11 5.56 4.76 -1.14 -0.09 118.16 126.63 2wro n LYS 34 Ca 0.00 1.20 -0.11 0.00 -2.87 0.00 0.00 58.31 56.54 2wro n LYS 34 Cb 0.00 -1.77 -0.08 0.00 -1.84 0.00 0.00 35.03 31.34 2wro n LYS 34 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wro h ALA 35 N 0.31 -0.67 -0.84 7.82 0.00 0.86 1.31 119.26 128.06 2wro h ALA 35 Ca 0.12 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.11 2wro h ALA 35 Cb 0.31 1.04 -0.11 0.00 0.00 0.00 0.00 17.79 19.03 2wro h ALA 35 CO -0.71 -0.87 -0.56 -0.09 0.00 0.00 0.00 179.25 177.02 2wro h ARG 36 N -0.30 -0.08 -0.96 0.00 2.43 0.16 0.58 114.38 116.21 2wro h ARG 36 Ca 0.06 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.41 2wro h ARG 36 Cb 0.45 0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 29.92 2wro h ARG 36 CO -0.46 -0.05 0.56 0.93 -1.51 0.00 0.00 179.97 179.44 2wro h GLU 37 N -0.08 0.70 -0.50 0.20 5.08 0.18 0.21 114.58 120.37 2wro h GLU 37 Ca 0.14 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2wro h GLU 37 Cb 0.43 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2wro h GLU 37 CO -0.83 0.46 0.28 1.15 -1.00 0.00 0.00 179.01 179.07 2wro h THR 38 N 0.72 1.16 0.00 1.13 2.02 0.69 -2.60 112.91 116.03 2wro h THR 38 Ca 0.55 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 67.33 2wro h THR 38 Cb 0.83 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2wro h THR 38 CO -0.38 0.17 0.00 -0.07 0.37 0.00 0.00 175.52 175.61 2wro h LEU 39 N 0.70 0.00 -0.80 2.58 3.38 0.11 -1.75 115.31 119.53 2wro h LEU 39 Ca 0.18 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 2wro h LEU 39 Cb 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2wro h LEU 39 CO -0.03 0.00 -0.59 -0.26 0.09 0.00 0.00 178.44 177.65 2wro h PHE 40 N 0.00 0.03 0.01 1.13 -1.00 -1.35 -1.49 116.94 114.27 2wro h PHE 40 Ca 0.00 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.77 2wro h PHE 40 Cb 0.49 -0.01 -0.00 0.00 3.61 0.00 0.00 35.95 40.05 2wro h PHE 40 CO 0.00 0.61 -0.01 0.00 -1.61 0.00 0.00 178.31 177.30 2wro h ALA 41 N 1.39 -0.67 -0.74 2.45 0.00 -1.37 -2.75 119.26 117.57 2wro h ALA 41 Ca -0.01 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.01 2wro h ALA 41 Cb 1.05 0.35 -0.08 0.00 0.00 0.00 0.00 17.79 19.11 2wro h ALA 41 CO 0.08 -0.67 0.36 0.00 0.00 0.00 0.00 179.25 179.02 2wro h ALA 42 N -1.65 1.04 -0.65 0.00 0.00 -1.57 0.12 119.26 116.55 2wro h ALA 42 Ca -0.00 0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.13 2wro h ALA 42 Cb 0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.66 2wro h ALA 42 CO -0.00 -0.07 -0.06 0.41 0.00 0.00 0.00 179.25 179.53 2wro n GLY 43 N -1.31 -0.96 0.10 0.00 0.00 -0.56 0.11 105.19 102.57 2wro n GLY 43 Ca 0.12 0.66 -0.22 0.00 0.00 0.00 0.00 46.02 46.58 2wro n GLY 43 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2wro h ASN 44 N 0.00 0.00 -0.88 1.61 2.35 -1.19 -3.29 115.58 114.18 2wro h ASN 44 Ca 0.36 -0.51 0.23 0.00 -0.55 0.00 0.00 56.30 55.84 2wro h ASN 44 Cb 0.67 -0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.90 2wro h ASN 44 CO -0.63 1.50 0.23 1.88 -1.65 0.00 0.00 177.43 178.75 2wro h TYR 45 N -0.99 0.34 0.04 1.19 0.99 0.22 1.79 116.97 120.54 2wro h TYR 45 Ca -0.35 0.05 -0.00 0.00 2.00 0.00 0.00 58.73 60.43 2wro h TYR 45 Cb 1.31 -0.01 0.00 0.00 1.00 0.00 0.00 36.73 39.03 2wro h TYR 45 CO 0.10 -0.22 -0.02 0.00 -0.00 0.00 0.00 178.16 178.02 2wro h ALA 46 N 1.78 -0.75 -0.98 3.88 0.00 0.58 -2.42 119.26 121.35 2wro h ALA 46 Ca 0.55 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 55.70 2wro h ALA 46 Cb 1.11 0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.74 2wro h ALA 46 CO -0.66 -0.74 -0.05 0.98 0.00 0.00 0.00 179.25 178.78 2wro n TYR 47 N -2.19 0.56 0.00 0.00 9.36 -0.54 0.10 117.16 124.45 2wro n TYR 47 Ca -0.01 1.19 -0.00 0.00 3.32 0.00 0.00 57.90 62.40 2wro n TYR 47 Cb 0.02 -1.20 -0.00 0.00 -0.63 0.00 0.00 39.34 37.53 2wro n TYR 47 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2wro h ALA 48 N 1.97 -0.57 0.00 2.98 0.00 0.27 0.49 119.26 124.40 2wro h ALA 48 Ca 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2wro h ALA 48 Cb 1.10 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2wro h ALA 48 CO -0.95 -0.57 0.06 0.45 0.00 0.00 0.00 179.25 178.24 2wro h HIS 49 N -0.02 0.00 0.15 0.00 3.86 -0.38 -2.37 115.15 116.38 2wro h HIS 49 Ca -0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2wro h HIS 49 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 2wro h HIS 49 CO -0.30 0.00 -0.07 0.00 0.86 0.00 0.00 177.93 178.42 2wro h ARG 50 N 0.00 -0.19 -0.13 2.45 3.08 0.29 4.06 114.38 123.94 2wro h ARG 50 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2wro h ARG 50 Cb 0.11 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2wro h ARG 50 CO 0.00 0.14 0.00 1.63 -1.07 0.00 0.00 179.97 180.67 2wro n LYS 51 N -5.03 1.33 -0.05 0.04 5.02 -0.65 -3.54 118.16 115.27 2wro n LYS 51 Ca -0.09 -0.50 -0.07 0.00 -2.02 0.00 0.00 58.31 55.62 2wro n LYS 51 Cb 0.22 -1.14 -0.05 0.00 -0.02 0.00 0.00 35.03 34.04 2wro n LYS 51 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2wro n ARG 52 N -0.11 0.44 -0.38 1.97 1.74 -0.70 -4.53 116.66 115.08 2wro n ARG 52 Ca 0.06 0.06 0.31 0.00 -0.77 0.00 0.00 57.85 57.51 2wro n ARG 52 Cb 0.13 -1.22 0.61 0.00 -1.02 0.00 0.00 32.46 30.95 2wro n ARG 52 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2wro h ARG 53 N 0.00 0.20 0.25 5.56 2.43 0.78 0.86 114.38 124.45 2wro h ARG 53 Ca -0.25 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.91 2wro h ARG 53 Cb 1.39 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.88 2wro h ARG 53 CO -0.03 0.13 -0.32 0.87 -1.51 0.00 0.00 179.97 179.11 2wro h LYS 54 N 0.21 -0.56 0.00 0.20 1.57 -1.78 -1.48 116.57 114.73 2wro h LYS 54 Ca 0.69 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.51 2wro h LYS 54 Cb 2.11 0.13 0.00 0.00 0.08 0.00 0.00 32.23 34.55 2wro h LYS 54 CO -0.30 -0.37 0.00 0.54 -0.57 0.00 0.00 179.45 178.75 2wro n ARG 55 N -4.27 0.16 -0.10 3.15 1.74 0.15 -1.83 116.66 115.66 2wro n ARG 55 Ca -0.07 0.52 0.01 0.00 -0.77 0.00 0.00 57.85 57.54 2wro n ARG 55 Cb 0.28 -1.89 0.30 0.00 -1.02 0.00 0.00 32.46 30.13 2wro n ARG 55 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2wro h ASP 56 N 0.00 0.66 0.22 0.55 5.19 -0.04 -2.78 116.42 120.22 2wro h ASP 56 Ca 0.00 -0.05 -0.34 0.00 -0.62 0.00 0.00 57.03 56.02 2wro h ASP 56 Cb 0.19 -0.17 -0.06 0.00 0.18 0.00 0.00 39.33 39.48 2wro h ASP 56 CO 0.00 0.55 -2.07 0.49 -3.12 0.00 0.00 179.24 175.09 2wro n PHE 57 N -4.39 0.57 -0.25 4.55 0.99 -0.76 -3.35 117.46 114.82 2wro n PHE 57 Ca 0.05 0.18 0.32 0.00 -0.00 0.00 0.00 57.45 58.00 2wro n PHE 57 Cb 0.11 -1.10 0.63 0.00 -1.00 0.00 0.00 39.48 38.12 2wro n PHE 57 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2wro h ARG 58 N 0.01 0.00 0.00 -1.08 3.08 -1.15 -2.52 114.38 112.73 2wro h ARG 58 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.62 2wro h ARG 58 Cb 2.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.14 2wro h ARG 58 CO 0.04 0.00 -0.40 0.54 -1.07 0.00 0.00 179.97 179.09 2wro n ARG 59 N -3.62 0.26 -0.25 0.04 1.74 -1.11 -4.04 116.66 109.69 2wro n ARG 59 Ca 0.24 0.27 0.23 0.00 -0.77 0.00 0.00 57.85 57.82 2wro n ARG 59 Cb 1.38 -1.15 0.42 0.00 -1.02 0.00 0.00 32.46 32.09 2wro n ARG 59 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2wro n LEU 60 N -3.55 0.21 -0.16 0.55 4.77 -1.00 0.38 117.00 118.21 2wro n LEU 60 Ca -0.06 1.08 -0.11 0.00 -0.03 0.00 0.00 56.01 56.89 2wro n LEU 60 Cb 0.21 -0.53 -0.00 0.00 -2.33 0.00 0.00 43.42 40.77 2wro n LEU 60 CO 0.08 -1.20 0.69 -0.50 -1.33 0.00 0.00 177.39 175.14 2wro h TRP 61 N 0.00 1.08 -0.23 -1.77 6.55 -1.68 -3.01 115.95 116.90 2wro h TRP 61 Ca 0.58 -0.25 -0.02 0.00 0.95 0.00 0.00 58.89 60.15 2wro h TRP 61 Cb 1.65 -0.26 -0.01 0.00 -0.86 0.00 0.00 29.16 29.68 2wro h TRP 61 CO -0.01 1.05 0.03 0.82 -1.05 0.00 0.00 178.44 179.29 2wro h ILE 62 N 0.80 1.13 -0.72 1.49 2.04 0.70 0.23 117.51 123.18 2wro h ILE 62 Ca 0.11 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 2wro h ILE 62 Cb 0.74 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 2wro h ILE 62 CO 0.06 0.16 0.31 0.58 0.00 0.00 0.00 178.15 179.26 2wro h VAL 63 N 0.33 1.24 0.13 1.67 2.07 -1.30 -2.67 116.25 117.71 2wro h VAL 63 Ca 0.08 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 2wro h VAL 63 Cb 0.17 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2wro h VAL 63 CO -0.00 0.30 -0.06 0.03 0.02 0.00 0.00 177.57 177.85 2wro h ARG 64 N 1.01 -0.17 -0.78 1.57 3.08 -1.38 -2.61 114.38 115.10 2wro h ARG 64 Ca 0.24 0.01 0.28 0.00 0.07 0.00 0.00 59.98 60.59 2wro h ARG 64 Cb 0.17 0.04 -0.14 0.00 0.08 0.00 0.00 29.97 30.12 2wro h ARG 64 CO -0.02 -0.11 0.25 -0.89 -1.07 0.00 0.00 179.97 178.13 2wro n ILE 65 N -3.65 -0.33 -0.06 2.04 -0.00 0.75 0.17 119.36 118.28 2wro n ILE 65 Ca -0.02 1.64 -0.13 0.00 -0.00 0.00 0.00 62.75 64.24 2wro n ILE 65 Cb 0.07 -2.56 -0.12 0.00 -0.00 0.00 0.00 39.64 37.03 2wro n ILE 65 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.55 175.42 2wro h ASN 66 N 0.00 -0.00 0.00 4.38 -0.00 -1.61 -3.15 115.58 115.19 2wro h ASN 66 Ca 0.59 -0.89 0.00 0.00 -0.00 0.00 0.00 56.30 56.00 2wro h ASN 66 Cb 1.44 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.76 2wro h ASN 66 CO -0.66 0.91 0.38 0.00 -0.00 0.00 0.00 177.43 178.07 2wro h ALA 67 N -0.01 1.31 0.01 1.57 0.00 0.13 1.27 119.26 123.55 2wro h ALA 67 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 2wro h ALA 67 Cb 0.89 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 2wro h ALA 67 CO 0.00 -0.31 -1.94 0.00 0.00 0.00 0.00 179.25 177.00 2wro n ALA 68 N -1.64 1.01 0.20 0.00 0.00 -0.26 -3.73 120.51 116.09 2wro n ALA 68 Ca -0.01 -0.79 0.09 0.00 0.00 0.00 0.00 53.44 52.73 2wro n ALA 68 Cb 0.41 -0.27 0.17 0.00 0.00 0.00 0.00 19.45 19.76 2wro n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wro h ARG 70 N 0.00 0.80 0.00 0.00 2.43 0.17 -0.93 114.38 116.85 2wro h ARG 70 Ca -0.00 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 2wro h ARG 70 Cb 1.09 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2wro h ARG 70 CO 0.03 1.01 0.00 0.94 -1.51 0.00 0.00 179.97 180.43 2wro n GLN 71 N -4.07 0.46 -1.37 0.20 7.27 -1.12 -2.51 117.38 116.25 2wro n GLN 71 Ca -0.01 0.00 -0.06 0.00 0.07 0.00 0.00 57.00 57.00 2wro n GLN 71 Cb 0.50 -1.22 0.11 0.00 2.41 0.00 0.00 30.24 32.04 2wro n GLN 71 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2wro n HIS 72 N -0.72 1.10 -0.51 3.69 8.25 -0.37 -4.97 115.22 121.70 2wro n HIS 72 Ca 0.05 -1.72 0.00 0.00 -0.26 0.00 0.00 57.72 55.79 2wro n HIS 72 Cb 0.02 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 30.86 2wro n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wro n GLY 73 N -0.78 1.92 1.59 -1.41 0.00 -1.04 -4.99 105.19 100.48 2wro n GLY 73 Ca 0.26 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.16 2wro n GLY 73 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2wro n LEU 74 N 0.00 0.00 -4.39 0.99 -0.00 -1.14 -5.05 117.00 107.41 2wro n LEU 74 Ca 0.00 -1.48 -0.20 0.00 -0.00 0.00 0.00 56.01 54.32 2wro n LEU 74 Cb 0.00 0.49 -0.10 0.00 -0.00 0.00 0.00 43.42 43.81 2wro n LEU 74 CO 0.00 -0.23 -0.41 0.54 -0.00 0.00 0.00 177.39 177.29 2wro s ASN 75 N -2.19 2.75 0.03 1.45 2.20 -1.26 -3.01 114.94 114.91 2wro s ASN 75 Ca 0.10 -1.10 -0.07 0.00 -0.94 0.00 0.00 52.86 50.85 2wro s ASN 75 Cb 0.00 -0.17 -0.02 0.00 -2.00 0.00 0.00 41.25 39.07 2wro s ASN 75 CO 0.07 -0.23 1.11 0.22 -2.94 0.00 0.00 177.10 175.33 2wro h TYR 76 N 2.41 -0.34 -0.80 1.54 3.20 -1.91 -0.96 116.97 120.10 2wro h TYR 76 Ca -0.39 0.02 0.18 0.00 3.14 0.00 0.00 58.73 61.68 2wro h TYR 76 Cb 1.23 0.16 -0.15 0.00 1.54 0.00 0.00 36.73 39.51 2wro h TYR 76 CO 0.71 -0.11 -0.11 0.43 -1.64 0.00 0.00 178.16 177.44 2wro n SER 77 N -3.21 -0.21 -0.04 -2.11 7.64 -1.26 -0.53 113.62 113.90 2wro n SER 77 Ca -0.01 1.37 -0.14 0.00 1.01 0.00 0.00 58.87 61.10 2wro n SER 77 Cb 0.07 -0.45 -0.09 0.00 -1.01 0.00 0.00 64.21 62.74 2wro n SER 77 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2wro h THR 78 N 0.00 1.41 0.00 0.44 2.02 -1.92 -2.67 112.91 112.20 2wro h THR 78 Ca 0.43 -1.55 0.00 0.00 0.77 0.00 0.00 66.41 66.05 2wro h THR 78 Cb 0.75 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 69.39 2wro h THR 78 CO -0.80 0.44 0.00 0.33 0.37 0.00 0.00 175.52 175.87 2wro n PHE 79 N -4.53 0.00 0.55 3.16 -0.00 0.31 0.05 117.46 117.00 2wro n PHE 79 Ca -0.08 0.00 0.06 0.00 -0.00 0.00 0.00 57.45 57.43 2wro n PHE 79 Cb 0.42 -0.27 -0.03 0.00 -0.00 0.00 0.00 39.48 39.60 2wro n PHE 79 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 2wro n ILE 80 N -1.27 0.00 -0.03 -2.13 2.08 0.26 -4.20 119.36 114.07 2wro n ILE 80 Ca 0.03 -0.30 -0.02 0.00 0.56 0.00 0.00 62.75 63.02 2wro n ILE 80 Cb 0.05 1.08 -0.01 0.00 -0.75 0.00 0.00 39.64 40.01 2wro n ILE 80 CO 0.00 0.00 0.00 -0.74 0.56 0.00 0.00 176.55 176.37 2wro h HIS 81 N 0.71 0.00 0.00 1.39 2.76 -0.04 -3.30 115.15 116.67 2wro h HIS 81 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2wro h HIS 81 Cb 0.35 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.31 2wro h HIS 81 CO 0.00 0.00 0.00 0.41 -1.30 0.00 0.00 177.93 177.04 2wro n GLY 82 N 1.73 -2.16 0.27 5.26 0.00 -0.04 0.47 105.19 110.72 2wro n GLY 82 Ca -0.02 0.41 0.05 0.00 0.00 0.00 0.00 46.02 46.45 2wro n GLY 82 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wro h LEU 83 N 0.00 -0.25 0.06 0.99 4.07 -1.75 0.18 115.31 118.60 2wro h LEU 83 Ca 0.00 0.18 -0.00 0.00 0.08 0.00 0.00 57.88 58.14 2wro h LEU 83 Cb 0.00 0.30 0.00 0.00 1.08 0.00 0.00 40.66 42.05 2wro h LEU 83 CO 0.00 -0.15 -0.03 0.50 -1.08 0.00 0.00 178.44 177.69 2wro h LYS 84 N 0.14 -0.07 -0.78 1.13 1.63 -0.73 -2.50 116.57 115.39 2wro h LYS 84 Ca 0.41 0.00 0.12 0.00 -0.85 0.00 0.00 60.65 60.33 2wro h LYS 84 Cb 0.73 0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.32 2wro h LYS 84 CO -0.62 0.18 0.51 -0.22 -3.45 0.00 0.00 179.45 175.85 2wro h LYS 85 N -0.32 0.60 -3.15 1.90 3.64 0.11 -2.84 116.57 116.51 2wro h LYS 85 Ca -0.01 -0.04 -0.75 0.00 -1.27 0.00 0.00 60.65 58.58 2wro h LYS 85 Cb 0.28 -0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 31.83 2wro h LYS 85 CO 0.01 0.39 2.17 0.00 -2.27 0.00 0.00 179.45 179.75 2wro n ALA 86 N -2.47 5.93 -0.51 5.00 0.00 0.52 -4.86 120.51 124.13 2wro n ALA 86 Ca 0.14 -4.23 0.00 0.00 0.00 0.00 0.00 53.44 49.34 2wro n ALA 86 Cb 0.40 -2.89 0.00 0.00 0.00 0.00 0.00 19.45 16.96 2wro n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wro n GLY 87 N 2.36 -0.02 3.06 0.00 0.00 -1.07 -4.83 105.19 104.70 2wro n GLY 87 Ca 0.48 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.15 2wro n GLY 87 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wro s ILE 88 N -0.09 3.60 0.00 -0.61 -4.36 -1.04 -4.84 121.20 113.86 2wro s ILE 88 Ca 0.00 -3.24 0.00 0.00 -0.26 0.00 0.00 60.65 57.15 2wro s ILE 88 Cb 0.00 -3.34 0.00 0.00 1.25 0.00 0.00 42.46 40.37 2wro s ILE 88 CO 0.00 -0.91 1.31 1.21 0.24 0.00 0.00 174.94 176.79 2wro n GLU 89 N 3.15 0.92 0.00 0.37 2.13 -1.26 -4.48 120.64 121.47 2wro n GLU 89 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 2wro n GLU 89 Cb 0.37 -1.04 0.00 0.00 0.27 0.00 0.00 31.44 31.04 2wro n GLU 89 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2wro n VAL 90 N 0.96 0.00 0.00 6.31 0.31 -1.26 -4.65 118.33 119.99 2wro n VAL 90 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2wro n VAL 90 Cb 0.46 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.39 2wro n VAL 90 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2wro n ASP 91 N 0.00 0.00 -1.96 4.52 -0.08 -1.26 -4.76 116.55 113.01 2wro n ASP 91 Ca 0.00 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.27 2wro n ASP 91 Cb 0.00 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.45 2wro n ASP 91 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 2wro n ARG 92 N -0.47 -3.41 -0.23 -0.67 0.63 -1.26 -3.20 116.66 108.04 2wro n ARG 92 Ca 0.00 2.66 0.21 0.00 -0.92 0.00 0.00 57.85 59.79 2wro n ARG 92 Cb 0.00 -3.39 0.36 0.00 0.45 0.00 0.00 32.46 29.87 2wro n ARG 92 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2wro n LYS 93 N 1.21 -0.02 0.00 -0.14 4.01 -1.26 -0.56 118.16 121.40 2wro n LYS 93 Ca -0.05 0.72 0.00 0.00 -0.51 0.00 0.00 58.31 58.47 2wro n LYS 93 Cb 0.07 -1.37 0.00 0.00 -0.51 0.00 0.00 35.03 33.23 2wro n LYS 93 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2wro n ASN 94 N -3.94 0.00 -1.00 4.39 5.15 -1.26 -2.64 115.26 115.97 2wro n ASN 94 Ca 0.22 0.34 0.00 0.00 -0.60 0.00 0.00 54.58 54.54 2wro n ASN 94 Cb 0.81 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.06 2wro n ASN 94 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2wro n LEU 95 N -0.46 0.00 -1.88 1.20 4.77 0.28 -2.90 117.00 118.01 2wro n LEU 95 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 2wro n LEU 95 Cb 0.00 0.00 0.28 0.00 -2.33 0.00 0.00 43.42 41.37 2wro n LEU 95 CO 0.00 0.00 0.96 0.00 -1.33 0.00 0.00 177.39 177.02 2wro n ALA 96 N 0.95 4.35 1.47 -1.18 0.00 -1.08 -3.84 120.51 121.18 2wro n ALA 96 Ca 0.00 -2.05 0.01 0.00 0.00 0.00 0.00 53.44 51.40 2wro n ALA 96 Cb 0.00 -1.23 0.05 0.00 0.00 0.00 0.00 19.45 18.27 2wro n ALA 96 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2wro n ASP 97 N -0.05 0.78 0.05 0.00 5.75 -1.14 -2.79 116.55 119.14 2wro n ASP 97 Ca 0.36 -2.03 0.12 0.00 -0.01 0.00 0.00 54.79 53.23 2wro n ASP 97 Cb 1.28 -0.17 0.20 0.00 -1.03 0.00 0.00 41.12 41.40 2wro n ASP 97 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2wro n LEU 98 N -0.15 0.64 0.04 -2.12 4.77 -1.25 -0.23 117.00 118.70 2wro n LEU 98 Ca 0.03 0.21 -0.19 0.00 -0.03 0.00 0.00 56.01 56.03 2wro n LEU 98 Cb 0.15 -0.21 -0.09 0.00 -2.33 0.00 0.00 43.42 40.94 2wro n LEU 98 CO 0.03 -0.02 0.11 0.00 -1.33 0.00 0.00 177.39 176.17 2wro h ALA 99 N 2.61 0.18 -1.39 -1.18 0.00 -1.82 -3.30 119.26 114.36 2wro h ALA 99 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2wro h ALA 99 Cb 0.69 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2wro h ALA 99 CO 0.00 0.70 0.00 0.28 0.00 0.00 0.00 179.25 180.23 2wro n VAL 100 N -3.85 0.00 0.00 0.00 0.31 -1.13 -4.63 118.33 109.03 2wro n VAL 100 Ca -0.10 1.25 0.00 0.00 -0.01 0.00 0.00 64.34 65.48 2wro n VAL 100 Cb 0.86 -2.24 0.00 0.00 -0.91 0.00 0.00 33.84 31.55 2wro n VAL 100 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2wro n ARG 101 N -1.31 2.22 -1.23 5.55 1.74 0.68 -4.58 116.66 119.73 2wro n ARG 101 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2wro n ARG 101 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2wro n ARG 101 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2wro n GLU 102 N 0.00 -0.20 -0.10 5.56 -0.58 -1.25 -4.70 120.64 119.37 2wro n GLU 102 Ca 0.00 -0.10 0.13 0.00 -0.42 0.00 0.00 57.16 56.77 2wro n GLU 102 Cb 0.00 0.17 0.51 0.00 -0.57 0.00 0.00 31.44 31.55 2wro n GLU 102 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2wro h PRO 103 N 0.80 0.39 0.22 3.49 0.13 -1.81 0.91 132.00 136.13 2wro h PRO 103 Ca 0.00 -0.02 -0.32 0.00 -0.87 0.00 0.00 66.00 64.78 2wro h PRO 103 Cb 0.00 -0.09 0.03 0.00 0.13 0.00 0.00 31.00 31.07 2wro h PRO 103 CO 0.00 0.26 -1.43 1.96 -0.23 0.00 0.00 178.00 178.56 2wro h GLN 104 N 0.40 0.46 -0.25 0.86 4.20 -1.91 0.30 115.11 119.19 2wro h GLN 104 Ca 0.30 -0.79 -0.07 0.00 0.06 0.00 0.00 58.65 58.14 2wro h GLN 104 Cb 0.64 0.30 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 2wro h GLN 104 CO -0.09 1.38 -0.16 0.28 -0.67 0.00 0.00 178.83 179.57 2wro h VAL 105 N 0.13 1.23 0.13 -0.54 2.07 -1.55 0.89 116.25 118.60 2wro h VAL 105 Ca -0.23 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 2wro h VAL 105 Cb 2.12 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 2wro h VAL 105 CO 0.25 0.34 -0.06 0.15 0.02 0.00 0.00 177.57 178.27 2wro h PHE 106 N 0.39 -0.16 -1.78 1.57 3.57 0.83 -2.10 116.94 119.27 2wro h PHE 106 Ca 0.07 -0.00 0.54 0.00 3.53 0.00 0.00 57.97 62.11 2wro h PHE 106 Cb 0.52 0.05 -0.10 0.00 2.79 0.00 0.00 35.95 39.21 2wro h PHE 106 CO 0.01 -0.10 1.25 0.00 -2.23 0.00 0.00 178.31 177.24 2wro h ALA 107 N -1.83 3.54 0.03 2.41 0.00 -0.19 0.45 119.26 123.67 2wro h ALA 107 Ca -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2wro h ALA 107 Cb 0.13 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2wro h ALA 107 CO 0.03 -2.14 -0.01 1.49 0.00 0.00 0.00 179.25 178.62 2wro h GLU 108 N 0.00 -0.03 -0.23 0.00 4.22 0.11 -2.30 114.58 116.36 2wro h GLU 108 Ca 0.92 0.00 0.07 0.00 0.08 0.00 0.00 59.36 60.42 2wro h GLU 108 Cb 3.45 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 32.70 2wro h GLU 108 CO -0.15 -0.02 0.26 -0.07 -2.18 0.00 0.00 179.01 176.84 2wro h LEU 109 N -0.04 0.00 0.18 1.64 3.38 0.37 -0.42 115.31 120.42 2wro h LEU 109 Ca -0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2wro h LEU 109 Cb 0.03 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2wro h LEU 109 CO 0.01 0.00 -0.47 0.58 0.09 0.00 0.00 178.44 178.64 2wro h VAL 110 N 0.00 0.08 -0.22 1.22 2.07 0.05 1.42 116.25 120.87 2wro h VAL 110 Ca 0.11 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.56 2wro h VAL 110 Cb 0.63 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2wro h VAL 110 CO -0.00 0.00 -0.15 -0.33 0.02 0.00 0.00 177.57 177.11 2wro h GLU 111 N -0.75 0.49 0.00 1.57 4.39 -0.65 -1.58 114.58 118.05 2wro h GLU 111 Ca -0.00 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2wro h GLU 111 Cb 0.74 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 2wro h GLU 111 CO -0.23 0.79 0.00 0.54 -1.16 0.00 0.00 179.01 178.95 2wro n ARG 112 N -4.48 0.02 0.18 2.33 5.12 -0.30 -2.09 116.66 117.44 2wro n ARG 112 Ca -0.05 0.49 -0.08 0.00 -1.93 0.00 0.00 57.85 56.28 2wro n ARG 112 Cb 0.37 -1.57 -0.04 0.00 -1.16 0.00 0.00 32.46 30.06 2wro n ARG 112 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2wro h ALA 113 N 2.06 -0.55 0.00 7.54 0.00 0.30 -2.92 119.26 125.69 2wro h ALA 113 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2wro h ALA 113 Cb 0.04 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2wro h ALA 113 CO 0.00 -0.51 0.00 0.36 0.00 0.00 0.00 179.25 179.10 2wro n LYS 114 N -4.93 0.61 0.02 0.00 0.00 -0.89 -2.64 118.16 110.34 2wro n LYS 114 Ca -0.07 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.12 2wro n LYS 114 Cb 0.21 -1.05 -0.08 0.00 -0.00 0.00 0.00 35.03 34.11 2wro n LYS 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wro h ALA 115 N 2.33 0.01 -0.65 0.58 0.00 -1.25 -2.02 119.26 118.26 2wro h ALA 115 Ca 0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2wro h ALA 115 Cb 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2wro h ALA 115 CO 0.00 -0.43 0.24 0.00 0.00 0.00 0.00 179.25 179.06 2wro h ALA 116 N 0.87 0.85 -0.47 0.00 0.00 -1.65 -3.04 119.26 115.83 2wro h ALA 116 Ca 0.00 -0.19 -0.73 0.00 0.00 0.00 0.00 54.91 53.99 2wro h ALA 116 Cb 0.13 -0.25 -0.09 0.00 0.00 0.00 0.00 17.79 17.57 2wro h ALA 116 CO -0.00 0.49 2.68 1.04 0.00 0.00 0.00 179.25 183.46 2wro n GLN 117 N -4.39 3.60 0.00 0.00 1.13 -0.78 -5.04 117.38 111.90 2wro n GLN 117 Ca 0.04 -3.06 0.00 0.00 -1.94 0.00 0.00 57.00 52.04 2wro n GLN 117 Cb 0.19 -2.95 0.00 0.00 0.11 0.00 0.00 30.24 27.59 2wro n GLN 117 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03