#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hvy s LEU 2 N 0.00 2.96 0.25 0.99 1.43 -1.26 -5.13 118.68 117.91 3hvy s LEU 2 Ca 0.00 -0.47 -0.05 0.00 -1.03 0.00 0.00 54.13 52.57 3hvy s LEU 2 Cb 0.00 -1.73 0.28 0.00 0.03 0.00 0.00 46.19 44.77 3hvy s LEU 2 CO 0.00 0.16 1.92 1.05 0.23 0.00 0.00 176.35 179.71 3hvy h GLU 3 N 3.45 1.30 0.00 1.70 -0.00 -2.05 -1.29 114.58 117.69 3hvy h GLU 3 Ca -0.49 -0.08 -0.05 0.00 -0.00 0.00 0.00 59.36 58.75 3hvy h GLU 3 Cb 1.18 -0.29 -0.01 0.00 -0.00 0.00 0.00 28.75 29.63 3hvy h GLU 3 CO 0.51 0.86 -0.23 0.27 -0.00 0.00 0.00 179.01 180.42 3hvy h PHE 4 N 1.34 0.00 -0.03 2.06 -0.00 -2.01 -0.56 116.94 117.75 3hvy h PHE 4 Ca 0.38 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.34 3hvy h PHE 4 Cb -0.11 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 35.84 3hvy h PHE 4 CO -0.00 0.23 -0.01 1.15 -0.00 0.00 0.00 178.31 179.68 3hvy h THR 5 N 0.00 1.33 -0.12 0.88 2.02 -1.70 -2.08 112.91 113.23 3hvy h THR 5 Ca -0.00 -1.01 0.04 0.00 0.77 0.00 0.00 66.41 66.21 3hvy h THR 5 Cb 0.83 1.95 -0.05 0.00 -1.74 0.00 0.00 68.15 69.15 3hvy h THR 5 CO 0.03 0.27 -0.16 0.50 0.37 0.00 0.00 175.52 176.53 3hvy h LYS 6 N -0.34 -0.20 -0.87 6.66 3.64 -1.01 -0.33 116.57 124.11 3hvy h LYS 6 Ca 0.01 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3hvy h LYS 6 Cb 0.44 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.26 3hvy h LYS 6 CO 0.00 -0.13 0.57 0.00 -2.27 0.00 0.00 179.45 177.62 3hvy h ARG 7 N -0.20 1.11 -0.38 1.90 -0.00 -1.15 -2.76 114.38 112.89 3hvy h ARG 7 Ca 0.09 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.98 59.43 3hvy h ARG 7 Cb 0.34 -0.25 -0.01 0.00 0.00 0.00 0.00 29.97 30.05 3hvy h ARG 7 CO -0.24 0.73 -0.07 1.03 0.00 0.00 0.00 179.97 181.42 3hvy h SER 8 N 1.14 0.72 0.00 7.04 0.87 -0.71 -0.21 113.55 122.40 3hvy h SER 8 Ca 0.33 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 3hvy h SER 8 Cb -0.07 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.69 3hvy h SER 8 CO -0.09 0.91 0.00 0.18 -0.53 0.00 0.00 176.83 177.29 3hvy n LEU 9 N -4.39 0.00 0.00 2.23 4.77 -0.20 -0.43 117.00 118.99 3hvy n LEU 9 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3hvy n LEU 9 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3hvy n LEU 9 CO 0.42 0.00 0.00 0.59 -1.33 0.00 0.00 177.39 177.07 3hvy n ASN 11 N 0.31 0.00 0.05 -1.43 3.02 -0.09 -1.19 115.26 115.92 3hvy n ASN 11 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.33 3hvy n ASN 11 Cb 0.00 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.03 3hvy n ASN 11 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3hvy h LYS 12 N 0.00 0.34 -0.09 3.52 3.64 -0.97 -3.41 116.57 119.61 3hvy h LYS 12 Ca 0.00 -0.59 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 3hvy h LYS 12 Cb 0.00 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3hvy h LYS 12 CO 0.00 1.28 0.00 0.66 -2.27 0.00 0.00 179.45 179.12 3hvy n TYR 13 N -3.58 0.10 -3.36 1.91 4.01 -0.33 -4.98 117.16 110.93 3hvy n TYR 13 Ca -0.27 -0.14 -0.24 0.00 -0.16 0.00 0.00 57.90 57.08 3hvy n TYR 13 Cb 1.05 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 40.11 3hvy n TYR 13 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3hvy n ASN 14 N 0.44 -5.32 -4.74 7.72 3.02 -1.16 -4.95 115.26 110.27 3hvy n ASN 14 Ca 0.06 -0.44 -0.41 0.00 -0.03 0.00 0.00 54.58 53.76 3hvy n ASN 14 Cb 0.27 -4.29 -0.03 0.00 -0.61 0.00 0.00 39.78 35.12 3hvy n ASN 14 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hvy s ILE 15 N -3.16 3.00 0.38 2.41 1.01 -1.15 -4.94 121.20 118.76 3hvy s ILE 15 Ca 0.44 0.85 0.08 0.00 0.00 0.00 0.00 60.65 62.02 3hvy s ILE 15 Cb -0.21 -3.54 -0.03 0.00 0.01 0.00 0.00 42.46 38.69 3hvy s ILE 15 CO 0.54 0.14 0.29 0.54 0.00 0.00 0.00 174.94 176.45 3hvy s ASN 16 N 0.19 4.95 0.30 3.58 2.20 -1.26 -4.85 114.94 120.05 3hvy s ASN 16 Ca 0.56 -0.74 -0.00 0.00 -0.94 0.00 0.00 52.86 51.73 3hvy s ASN 16 Cb -0.38 -0.68 0.46 0.00 -2.00 0.00 0.00 41.25 38.65 3hvy s ASN 16 CO 0.42 -0.51 1.87 -0.33 -2.94 0.00 0.00 177.10 175.61 3hvy h GLU 17 N 1.22 0.83 -0.17 3.55 4.39 -1.98 -1.01 114.58 121.41 3hvy h GLU 17 Ca -0.43 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.14 3hvy h GLU 17 Cb 1.26 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 3hvy h GLU 17 CO 0.60 0.70 0.11 -0.09 -1.16 0.00 0.00 179.01 179.17 3hvy h ARG 18 N 0.81 0.22 -0.77 2.33 2.43 -1.96 -0.24 114.38 117.21 3hvy h ARG 18 Ca 0.19 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 3hvy h ARG 18 Cb 0.19 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 3hvy h ARG 18 CO -0.01 0.16 0.33 0.28 -1.51 0.00 0.00 179.97 179.22 3hvy h VAL 19 N 0.22 1.25 -0.52 0.20 2.07 -1.77 -1.64 116.25 116.06 3hvy h VAL 19 Ca 0.06 -0.76 -0.05 0.00 0.82 0.00 0.00 66.70 66.77 3hvy h VAL 19 Cb -0.01 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 3hvy h VAL 19 CO -0.01 0.32 0.12 -0.07 0.02 0.00 0.00 177.57 177.95 3hvy h LEU 20 N 1.10 0.73 -0.24 2.57 3.38 -0.83 0.68 115.31 122.70 3hvy h LEU 20 Ca 0.26 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3hvy h LEU 20 Cb 0.18 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3hvy h LEU 20 CO -0.03 0.72 0.04 -0.33 0.09 0.00 0.00 178.44 178.94 3hvy h GLU 21 N 0.76 0.40 -0.76 1.13 5.08 -0.59 -1.81 114.58 118.79 3hvy h GLU 21 Ca 0.17 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 3hvy h GLU 21 Cb 0.28 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 3hvy h GLU 21 CO -0.00 0.53 0.41 -0.07 -1.00 0.00 0.00 179.01 178.87 3hvy h LEU 22 N 0.21 0.96 -0.08 1.33 3.38 -0.95 -2.38 115.31 117.78 3hvy h LEU 22 Ca 0.07 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.99 3hvy h LEU 22 Cb 0.32 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 3hvy h LEU 22 CO 0.00 0.78 -0.15 0.22 0.09 0.00 0.00 178.44 179.39 3hvy h TYR 23 N 1.07 -0.38 -0.39 1.13 3.20 -0.57 0.11 116.97 121.14 3hvy h TYR 23 Ca 0.27 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.16 3hvy h TYR 23 Cb 0.04 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 3hvy h TYR 23 CO 0.01 -0.22 0.25 0.93 -1.64 0.00 0.00 178.16 177.50 3hvy h GLU 24 N -0.21 0.50 0.11 1.82 3.07 -1.04 0.03 114.58 118.86 3hvy h GLU 24 Ca 0.07 -0.03 0.01 0.00 -0.50 0.00 0.00 59.36 58.92 3hvy h GLU 24 Cb 0.31 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 3hvy h GLU 24 CO -0.20 0.33 -0.17 0.00 -1.40 0.00 0.00 179.01 177.58 3hvy h ARG 25 N 0.52 -0.32 -0.72 2.33 3.08 -1.29 -2.16 114.38 115.82 3hvy h ARG 25 Ca 0.15 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.17 3hvy h ARG 25 Cb -0.05 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 3hvy h ARG 25 CO -0.04 -0.21 0.24 0.00 -1.07 0.00 0.00 179.97 178.88 3hvy h ALA 26 N 0.50 1.06 -0.53 0.04 0.00 -0.45 0.54 119.26 120.44 3hvy h ALA 26 Ca 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3hvy h ALA 26 Cb 0.35 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3hvy h ALA 26 CO -0.09 0.64 0.20 1.25 0.00 0.00 0.00 179.25 181.26 3hvy h LEU 27 N 1.06 0.73 -0.66 0.00 5.85 -0.91 -1.52 115.31 119.87 3hvy h LEU 27 Ca 0.24 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.72 3hvy h LEU 27 Cb 0.28 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3hvy h LEU 27 CO -0.01 0.71 0.19 0.78 -0.34 0.00 0.00 178.44 179.77 3hvy h ASN 28 N 0.71 0.97 0.17 1.25 2.35 -0.76 -3.00 115.58 117.27 3hvy h ASN 28 Ca 0.17 -0.22 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 3hvy h ASN 28 Cb 0.21 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 3hvy h ASN 28 CO -0.01 0.94 -0.21 0.44 -1.65 0.00 0.00 177.43 176.94 3hvy h ASP 29 N 0.96 0.07 -0.08 5.81 3.32 -0.41 -3.01 116.42 123.09 3hvy h ASP 29 Ca 0.21 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3hvy h ASP 29 Cb 0.33 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3hvy h ASP 29 CO -0.00 0.28 0.00 1.33 -1.72 0.00 0.00 179.24 179.13 3hvy n VAL 30 N -4.26 0.08 -0.21 -1.35 0.24 -0.62 -4.54 118.33 107.68 3hvy n VAL 30 Ca -0.02 -0.37 -0.02 0.00 -2.04 0.00 0.00 64.34 61.90 3hvy n VAL 30 Cb 0.29 0.74 0.09 0.00 -1.47 0.00 0.00 33.84 33.48 3hvy n VAL 30 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3hvy h GLU 31 N 3.03 0.55 -0.29 7.34 4.81 -1.50 -0.63 114.58 127.89 3hvy h GLU 31 Ca 0.00 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 3hvy h GLU 31 Cb 0.65 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3hvy h GLU 31 CO 0.00 0.36 -0.24 0.87 -0.73 0.00 0.00 179.01 179.27 3hvy h LYS 32 N 0.57 0.56 -0.36 1.92 1.57 -1.84 -1.47 116.57 117.52 3hvy h LYS 32 Ca 0.28 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 3hvy h LYS 32 Cb 0.22 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 3hvy h LYS 32 CO -0.20 0.75 0.15 0.93 -0.57 0.00 0.00 179.45 180.51 3hvy h GLU 33 N 0.49 0.53 -0.41 3.15 4.39 -1.59 -2.20 114.58 118.95 3hvy h GLU 33 Ca 0.07 -0.09 0.02 0.00 0.34 0.00 0.00 59.36 59.70 3hvy h GLU 33 Cb 0.68 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.21 3hvy h GLU 33 CO 0.05 0.51 0.23 0.74 -1.16 0.00 0.00 179.01 179.38 3hvy h PHE 34 N 0.43 0.42 -0.60 4.33 -1.00 -0.97 -1.52 116.94 118.03 3hvy h PHE 34 Ca 0.12 0.01 0.05 0.00 2.81 0.00 0.00 57.97 60.97 3hvy h PHE 34 Cb 0.17 -0.13 -0.04 0.00 3.61 0.00 0.00 35.95 39.56 3hvy h PHE 34 CO -0.01 0.24 0.40 0.87 -1.61 0.00 0.00 178.31 178.20 3hvy h LYS 35 N 0.46 0.60 -0.31 1.51 6.56 -1.13 0.25 116.57 124.51 3hvy h LYS 35 Ca 0.17 -0.04 -0.03 0.00 -1.06 0.00 0.00 60.65 59.69 3hvy h LYS 35 Cb 0.03 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 31.54 3hvy h LYS 35 CO -0.09 0.40 0.08 -0.92 -2.06 0.00 0.00 179.45 176.86 3hvy h TYR 36 N 0.62 0.53 -0.03 -1.35 5.03 -0.68 -2.92 116.97 118.17 3hvy h TYR 36 Ca 0.26 -0.06 -0.09 0.00 2.58 0.00 0.00 58.73 61.41 3hvy h TYR 36 Cb 0.22 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.34 3hvy h TYR 36 CO -0.00 0.55 -0.40 1.88 -1.32 0.00 0.00 178.16 178.87 3hvy h TYR 37 N 0.35 0.08 -0.12 -3.82 0.05 -0.40 -2.40 116.97 110.70 3hvy h TYR 37 Ca 0.10 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 3hvy h TYR 37 Cb 0.29 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.01 3hvy h TYR 37 CO 0.01 0.46 0.03 -0.44 -1.05 0.00 0.00 178.16 177.17 3hvy h ASP 38 N 0.06 0.15 -0.35 3.88 3.32 -0.82 0.10 116.42 122.76 3hvy h ASP 38 Ca 0.00 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.94 3hvy h ASP 38 Cb 0.74 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 3hvy h ASP 38 CO 0.06 0.16 -0.19 -0.33 -1.72 0.00 0.00 179.24 177.22 3hvy h GLU 39 N 0.17 0.75 -0.49 3.56 5.08 -1.25 -1.47 114.58 120.93 3hvy h GLU 39 Ca 0.04 -0.33 -0.09 0.00 -1.00 0.00 0.00 59.36 57.98 3hvy h GLU 39 Cb 0.08 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 3hvy h GLU 39 CO -0.00 0.95 -0.03 0.82 -1.00 0.00 0.00 179.01 179.75 3hvy h ILE 40 N 0.53 1.27 -0.46 3.13 2.04 -1.42 -2.61 117.51 119.98 3hvy h ILE 40 Ca 0.08 -1.12 -0.00 0.00 1.00 0.00 0.00 64.86 64.81 3hvy h ILE 40 Cb 0.73 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 3hvy h ILE 40 CO 0.05 0.39 0.27 -0.09 0.00 0.00 0.00 178.15 178.78 3hvy h ARG 41 N 0.74 0.63 -0.53 2.37 2.43 -0.68 -0.56 114.38 118.78 3hvy h ARG 41 Ca 0.13 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 3hvy h ARG 41 Cb 0.55 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 3hvy h ARG 41 CO 0.03 0.47 0.32 1.49 -1.51 0.00 0.00 179.97 180.77 3hvy h GLU 42 N 0.61 0.62 -0.09 0.20 4.81 -1.24 0.16 114.58 119.65 3hvy h GLU 42 Ca 0.16 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3hvy h GLU 42 Cb 0.00 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 3hvy h GLU 42 CO -0.03 0.41 0.04 -0.92 -0.73 0.00 0.00 179.01 177.78 3hvy h TYR 43 N 0.64 0.07 -0.46 0.92 3.20 -1.06 -2.10 116.97 118.18 3hvy h TYR 43 Ca 0.21 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 3hvy h TYR 43 Cb 0.01 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 3hvy h TYR 43 CO -0.06 0.04 -0.08 -0.91 -1.64 0.00 0.00 178.16 175.51 3hvy h ASN 44 N 0.08 0.80 -0.77 -2.11 2.35 -0.82 -0.62 115.58 114.49 3hvy h ASN 44 Ca 0.03 -0.23 0.05 0.00 -0.55 0.00 0.00 56.30 55.60 3hvy h ASN 44 Cb 0.01 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 38.11 3hvy h ASN 44 CO -0.03 0.91 0.48 -0.61 -1.65 0.00 0.00 177.43 176.53 3hvy h GLN 45 N 0.74 0.88 -0.32 0.81 5.75 -0.58 -1.05 115.11 121.34 3hvy h GLN 45 Ca 0.13 -0.05 -0.18 0.00 -0.15 0.00 0.00 58.65 58.40 3hvy h GLN 45 Cb 0.57 -0.20 -0.00 0.00 1.07 0.00 0.00 27.48 28.92 3hvy h GLN 45 CO 0.03 0.58 -0.50 1.25 -2.65 0.00 0.00 178.83 177.55 3hvy h LEU 46 N 0.90 0.99 -1.02 -2.39 5.85 -0.96 -1.37 115.31 117.31 3hvy h LEU 46 Ca 0.32 -0.51 -0.07 0.00 0.84 0.00 0.00 57.88 58.46 3hvy h LEU 46 Cb 0.09 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 3hvy h LEU 46 CO -0.14 1.31 -0.09 0.07 -0.34 0.00 0.00 178.44 179.25 3hvy h LYS 47 N 0.71 0.60 -0.10 1.25 2.10 -0.76 0.15 116.57 120.52 3hvy h LYS 47 Ca 0.03 -0.17 -0.02 0.00 -2.00 0.00 0.00 60.65 58.49 3hvy h LYS 47 Cb 1.10 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 32.36 3hvy h LYS 47 CO 0.11 0.69 0.00 0.28 -2.00 0.00 0.00 179.45 178.54 3hvy h VAL 48 N 0.56 1.24 -0.41 0.07 2.07 -1.02 -2.56 116.25 116.20 3hvy h VAL 48 Ca 0.10 -0.77 0.06 0.00 0.82 0.00 0.00 66.70 66.91 3hvy h VAL 48 Cb 0.49 1.56 -0.05 0.00 -1.52 0.00 0.00 31.29 31.77 3hvy h VAL 48 CO 0.03 0.22 0.10 0.25 0.02 0.00 0.00 177.57 178.19 3hvy h LEU 49 N -0.09 0.05 -0.95 2.57 5.85 -0.93 -0.65 115.31 121.16 3hvy h LEU 49 Ca 0.03 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.85 3hvy h LEU 49 Cb 0.34 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 3hvy h LEU 49 CO 0.00 0.06 0.62 0.11 -0.34 0.00 0.00 178.44 178.90 3hvy h LYS 50 N 0.24 1.15 -0.62 1.25 6.56 -0.95 -1.22 116.57 122.98 3hvy h LYS 50 Ca 0.20 -0.07 -0.03 0.00 -1.06 0.00 0.00 60.65 59.68 3hvy h LYS 50 Cb 0.23 -0.26 -0.03 0.00 -0.57 0.00 0.00 32.23 31.60 3hvy h LYS 50 CO -0.24 0.76 0.26 0.00 -2.06 0.00 0.00 179.45 178.17 3hvy h ALA 51 N 1.40 0.81 -0.51 3.86 0.00 -0.73 0.22 119.26 124.30 3hvy h ALA 51 Ca 0.38 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 3hvy h ALA 51 Cb 0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3hvy h ALA 51 CO -0.13 0.42 0.30 0.74 0.00 0.00 0.00 179.25 180.58 3hvy h PHE 52 N 0.87 0.68 -0.23 0.00 -1.00 -0.83 -2.41 116.94 114.02 3hvy h PHE 52 Ca 0.21 -0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.81 3hvy h PHE 52 Cb 0.19 -0.22 -0.00 0.00 3.61 0.00 0.00 35.95 39.53 3hvy h PHE 52 CO 0.01 0.47 -0.58 1.96 -1.61 0.00 0.00 178.31 178.57 3hvy h GLN 53 N 0.68 0.72 0.00 1.51 4.20 -0.77 -2.22 115.11 119.23 3hvy h GLN 53 Ca 0.18 -0.47 -0.05 0.00 0.06 0.00 0.00 58.65 58.37 3hvy h GLN 53 Cb -0.00 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3hvy h GLN 53 CO -0.03 1.09 -0.25 0.93 -0.67 0.00 0.00 178.83 179.90 3hvy h GLU 54 N 0.54 0.00 -0.01 1.46 5.08 -0.48 -1.76 114.58 119.41 3hvy h GLU 54 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hvy h GLU 54 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3hvy h GLU 54 CO 0.12 0.25 -0.17 -1.91 -1.00 0.00 0.00 179.01 176.29 3hvy n GLU 55 N -3.98 1.11 -3.53 2.33 4.07 -0.92 -4.96 120.64 114.78 3hvy n GLU 55 Ca -0.02 -0.66 -0.19 0.00 -0.06 0.00 0.00 57.16 56.24 3hvy n GLU 55 Cb 0.32 -1.49 0.07 0.00 -0.06 0.00 0.00 31.44 30.29 3hvy n GLU 55 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3hvy n ARG 56 N -0.37 -6.18 -1.81 5.31 5.12 -0.66 -4.90 116.66 113.18 3hvy n ARG 56 Ca 0.14 0.78 -0.42 0.00 -1.93 0.00 0.00 57.85 56.42 3hvy n ARG 56 Cb 0.35 -5.66 -0.02 0.00 -1.16 0.00 0.00 32.46 25.97 3hvy n ARG 56 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3hvy s ILE 57 N -3.45 2.17 0.32 0.55 -1.09 -0.94 -4.99 121.20 113.78 3hvy s ILE 57 Ca 0.04 0.14 0.04 0.00 -2.23 0.00 0.00 60.65 58.64 3hvy s ILE 57 Cb -0.02 -3.09 -0.03 0.00 -1.58 0.00 0.00 42.46 37.74 3hvy s ILE 57 CO 0.76 0.02 0.18 -0.55 -1.23 0.00 0.00 174.94 174.11 3hvy s SER 58 N 0.72 1.66 0.54 3.58 0.15 -1.26 -5.00 113.70 114.09 3hvy s SER 58 Ca 0.66 -1.60 0.22 0.00 0.70 0.00 0.00 55.95 55.93 3hvy s SER 58 Cb -0.47 0.43 1.47 0.00 -1.71 0.00 0.00 66.02 65.74 3hvy s SER 58 CO 0.42 -0.92 2.17 -0.08 1.20 0.00 0.00 173.24 176.02 3hvy h GLU 59 N 2.16 0.00 0.00 5.44 4.57 -2.00 -0.84 114.58 123.92 3hvy h GLU 59 Ca -0.32 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 3hvy h GLU 59 Cb 1.25 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 3hvy h GLU 59 CO 0.50 0.03 0.00 -1.13 -1.18 0.00 0.00 179.01 177.23 3hvy n SER 60 N -4.17 0.00 0.05 1.04 3.41 -1.26 -1.49 113.62 111.20 3hvy n SER 60 Ca -0.03 0.48 0.13 0.00 -0.26 0.00 0.00 58.87 59.19 3hvy n SER 60 Cb 0.12 -0.49 0.37 0.00 -0.26 0.00 0.00 64.21 63.95 3hvy n SER 60 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3hvy n HIS 61 N -1.49 0.41 -1.90 7.33 -0.00 -0.32 -4.27 115.22 114.99 3hvy n HIS 61 Ca 0.03 0.12 -0.41 0.00 -0.00 0.00 0.00 57.72 57.45 3hvy n HIS 61 Cb 0.12 -0.62 -0.00 0.00 -0.00 0.00 0.00 29.99 29.49 3hvy n HIS 61 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 3hvy n PHE 62 N -1.88 2.99 -1.41 4.41 3.72 -0.55 -3.88 117.46 120.86 3hvy n PHE 62 Ca 0.05 -2.91 -0.30 0.00 -0.05 0.00 0.00 57.45 54.24 3hvy n PHE 62 Cb 0.39 -2.23 0.10 0.00 -0.94 0.00 0.00 39.48 36.80 3hvy n PHE 62 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3hvy s THR 63 N 1.40 3.00 -0.36 4.37 -4.23 -1.26 -4.85 115.64 113.72 3hvy s THR 63 Ca 0.50 0.33 0.14 0.00 -1.18 0.00 0.00 61.69 61.48 3hvy s THR 63 Cb 0.14 -2.96 0.41 0.00 1.34 0.00 0.00 72.50 71.43 3hvy s THR 63 CO -0.05 -0.43 0.88 -3.20 -0.54 0.00 0.00 174.62 171.28 3hvy n ASN 64 N -3.58 1.55 -4.78 3.99 5.15 -1.26 -4.27 115.26 112.05 3hvy n ASN 64 Ca 0.07 -2.93 -0.32 0.00 -0.60 0.00 0.00 54.58 50.81 3hvy n ASN 64 Cb 0.55 -0.56 0.06 0.00 -0.53 0.00 0.00 39.78 39.30 3hvy n ASN 64 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3hvy s SER 65 N -2.90 5.01 0.31 1.20 1.04 -1.26 -4.83 113.70 112.26 3hvy s SER 65 Ca 0.34 1.82 0.03 0.00 0.48 0.00 0.00 55.95 58.62 3hvy s SER 65 Cb 0.41 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 63.96 3hvy s SER 65 CO -0.03 -1.70 0.11 -0.94 0.98 0.00 0.00 173.24 171.67 3hvy s SER 66 N -3.20 1.77 1.00 7.02 1.04 -1.26 -4.19 113.70 115.88 3hvy s SER 66 Ca 0.62 -1.48 0.00 0.00 0.48 0.00 0.00 55.95 55.57 3hvy s SER 66 Cb -0.17 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.18 3hvy s SER 66 CO 0.50 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.54 3hvy n GLY 67 N -0.61 2.98 0.27 7.32 0.00 -1.26 -1.43 105.19 112.46 3hvy n GLY 67 Ca -0.01 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.03 3hvy n GLY 67 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hvy h TYR 68 N 0.00 0.00 -0.79 1.61 0.05 -1.98 -3.29 116.97 112.57 3hvy h TYR 68 Ca 0.00 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.61 3hvy h TYR 68 Cb 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.70 3hvy h TYR 68 CO 0.00 0.04 -0.19 0.41 -1.05 0.00 0.00 178.16 177.38 3hvy n GLY 69 N -1.25 0.56 3.71 3.88 0.00 -0.52 0.42 105.19 111.99 3hvy n GLY 69 Ca -0.03 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 3hvy n GLY 69 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hvy n TYR 70 N -3.34 2.48 -3.74 1.61 4.01 -1.26 -2.81 117.16 114.11 3hvy n TYR 70 Ca -0.09 0.36 -0.24 0.00 -0.16 0.00 0.00 57.90 57.76 3hvy n TYR 70 Cb 0.42 -2.52 0.04 0.00 -0.31 0.00 0.00 39.34 36.97 3hvy n TYR 70 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3hvy n ASN 71 N 2.12 -2.96 -4.56 7.72 5.15 -1.26 -4.92 115.26 116.55 3hvy n ASN 71 Ca 0.10 -0.76 -0.41 0.00 -0.60 0.00 0.00 54.58 52.91 3hvy n ASN 71 Cb 0.34 -4.18 -0.03 0.00 -0.53 0.00 0.00 39.78 35.38 3hvy n ASN 71 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3hvy s ASP 72 N -3.91 6.13 0.32 1.20 -1.08 -1.12 -4.86 116.67 113.34 3hvy s ASP 72 Ca 0.28 -0.26 0.13 0.00 -0.52 0.00 0.00 52.55 52.18 3hvy s ASP 72 Cb -0.14 -2.56 0.51 0.00 -1.46 0.00 0.00 42.92 39.27 3hvy s ASP 72 CO 0.80 -1.82 1.69 0.16 0.52 0.00 0.00 175.17 176.52 3hvy h ILE 73 N 6.14 1.30 -0.20 4.11 3.07 -1.91 -1.27 117.51 128.74 3hvy h ILE 73 Ca -0.27 -1.81 -0.02 0.00 1.55 0.00 0.00 64.86 64.31 3hvy h ILE 73 Cb 1.06 2.00 -0.01 0.00 -0.27 0.00 0.00 36.82 39.60 3hvy h ILE 73 CO 1.26 0.51 0.06 1.23 -1.05 0.00 0.00 178.15 180.15 3hvy h GLY 74 N 1.71 0.33 0.90 0.16 0.00 -1.82 -0.67 103.07 103.68 3hvy h GLY 74 Ca -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 3hvy h GLY 74 CO 0.07 0.18 -0.18 -0.09 0.00 0.00 0.00 176.54 176.51 3hvy h ARG 75 N 0.15 -0.44 -0.57 4.80 2.43 -1.76 -1.66 114.38 117.34 3hvy h ARG 75 Ca 0.06 0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 3hvy h ARG 75 Cb 0.22 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 3hvy h ARG 75 CO -0.00 -0.29 0.05 -0.44 -1.51 0.00 0.00 179.97 177.78 3hvy h ASP 76 N -0.46 0.90 -0.01 -3.80 3.32 -1.21 -2.44 116.42 112.72 3hvy h ASP 76 Ca -0.03 -0.21 -0.09 0.00 0.02 0.00 0.00 57.03 56.72 3hvy h ASP 76 Cb 0.38 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3hvy h ASP 76 CO 0.02 0.93 -0.24 0.28 -1.72 0.00 0.00 179.24 178.51 3hvy h SER 77 N 0.88 0.40 -0.33 6.45 0.02 -1.08 -2.75 113.55 117.15 3hvy h SER 77 Ca 0.17 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.89 3hvy h SER 77 Cb 0.44 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 3hvy h SER 77 CO 0.02 0.65 -0.17 0.25 -1.14 0.00 0.00 176.83 176.43 3hvy h LEU 78 N 0.36 0.80 -0.87 5.07 5.85 -0.84 -0.75 115.31 124.93 3hvy h LEU 78 Ca 0.06 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.56 3hvy h LEU 78 Cb 0.62 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 3hvy h LEU 78 CO 0.04 0.97 0.55 0.44 -0.34 0.00 0.00 178.44 180.10 3hvy h ASP 79 N 0.70 0.88 -0.39 1.25 3.32 -1.31 -0.75 116.42 120.13 3hvy h ASP 79 Ca 0.11 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.10 3hvy h ASP 79 Cb 0.68 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 3hvy h ASP 79 CO 0.05 0.58 0.00 0.03 -1.72 0.00 0.00 179.24 178.18 3hvy h ARG 80 N 1.02 0.68 -0.23 3.56 3.08 -1.09 -1.63 114.38 119.77 3hvy h ARG 80 Ca 0.37 -0.22 0.01 0.00 0.07 0.00 0.00 59.98 60.21 3hvy h ARG 80 Cb 0.12 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3hvy h ARG 80 CO -0.16 0.78 0.13 0.28 -1.07 0.00 0.00 179.97 179.93 3hvy h VAL 81 N 0.50 1.02 -0.67 2.04 2.07 -0.88 -0.57 116.25 119.75 3hvy h VAL 81 Ca 0.11 -0.09 0.05 0.00 0.82 0.00 0.00 66.70 67.59 3hvy h VAL 81 Cb 0.47 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 3hvy h VAL 81 CO 0.02 0.05 0.39 1.88 0.02 0.00 0.00 177.57 179.93 3hvy h TYR 82 N 0.27 0.72 -0.59 1.57 -1.99 -1.05 -1.22 116.97 114.67 3hvy h TYR 82 Ca 0.09 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.80 3hvy h TYR 82 Cb 0.00 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 38.48 3hvy h TYR 82 CO -0.08 0.36 0.20 0.00 -0.00 0.00 0.00 178.16 178.64 3hvy h ALA 83 N 1.33 1.24 -0.08 3.88 0.00 -0.89 -0.97 119.26 123.77 3hvy h ALA 83 Ca 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3hvy h ALA 83 Cb 0.14 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3hvy h ALA 83 CO -0.16 0.54 0.00 -0.97 0.00 0.00 0.00 179.25 178.66 3hvy h ASN 84 N 0.85 0.14 -0.76 0.00 -0.73 -0.79 0.70 115.58 114.99 3hvy h ASN 84 Ca 0.20 -0.30 0.03 0.00 1.87 0.00 0.00 56.30 58.09 3hvy h ASN 84 Cb 0.23 -0.04 -0.05 0.00 0.27 0.00 0.00 38.32 38.73 3hvy h ASN 84 CO -0.01 0.41 0.48 0.40 -0.37 0.00 0.00 177.43 178.34 3hvy h ILE 85 N -0.13 1.11 -0.01 2.57 2.04 -0.90 -2.31 117.51 119.89 3hvy h ILE 85 Ca 0.02 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.56 3hvy h ILE 85 Cb 0.34 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3hvy h ILE 85 CO 0.00 0.17 -0.11 0.49 0.00 0.00 0.00 178.15 178.70 3hvy n PHE 86 N -4.62 0.00 -3.66 1.37 3.72 -0.40 -4.94 117.46 108.93 3hvy n PHE 86 Ca 0.09 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.27 3hvy n PHE 86 Cb 0.09 -0.11 0.04 0.00 -0.94 0.00 0.00 39.48 38.56 3hvy n PHE 86 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3hvy n ASN 87 N -0.62 -2.08 -4.50 4.37 3.02 -0.38 -4.30 115.26 110.76 3hvy n ASN 87 Ca 0.16 -0.83 -0.24 0.00 -0.03 0.00 0.00 54.58 53.63 3hvy n ASN 87 Cb 0.30 -4.08 -0.10 0.00 -0.61 0.00 0.00 39.78 35.29 3hvy n ASN 87 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3hvy s THR 88 N -3.62 2.54 0.30 3.41 -4.23 0.10 -4.84 115.64 109.29 3hvy s THR 88 Ca 0.09 -2.31 0.00 0.00 -1.18 0.00 0.00 61.69 58.29 3hvy s THR 88 Cb -0.02 -2.42 0.15 0.00 1.34 0.00 0.00 72.50 71.54 3hvy s THR 88 CO 0.81 -0.36 1.83 -0.33 -0.54 0.00 0.00 174.62 176.03 3hvy h GLU 89 N 2.18 0.73 -3.92 3.99 5.08 -1.83 -3.42 114.58 117.38 3hvy h GLU 89 Ca -0.41 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 57.69 3hvy h GLU 89 Cb 1.26 -0.11 -0.13 0.00 0.50 0.00 0.00 28.75 30.27 3hvy h GLU 89 CO 0.62 0.69 -0.35 -1.12 -1.00 0.00 0.00 179.01 177.85 3hvy s SER 90 N -6.64 0.07 0.06 1.42 0.01 -0.29 -4.80 113.70 103.53 3hvy s SER 90 Ca -0.09 -0.88 -0.18 0.00 1.31 0.00 0.00 55.95 56.11 3hvy s SER 90 Cb 0.15 0.42 0.04 0.00 0.21 0.00 0.00 66.02 66.84 3hvy s SER 90 CO 0.79 -0.87 0.42 0.00 0.41 0.00 0.00 173.24 174.00 3hvy s ALA 91 N -3.96 -1.02 -0.23 1.44 0.00 -1.26 -1.31 121.76 115.41 3hvy s ALA 91 Ca 0.17 0.26 -0.04 0.00 0.00 0.00 0.00 51.96 52.35 3hvy s ALA 91 Cb 0.04 0.42 0.09 0.00 0.00 0.00 0.00 23.12 23.67 3hvy s ALA 91 CO -0.01 -0.50 0.14 0.12 0.00 0.00 0.00 175.76 175.51 3hvy s PHE 92 N -2.75 0.13 -0.17 0.00 5.36 0.86 -4.75 117.98 116.66 3hvy s PHE 92 Ca -0.04 -0.47 0.00 0.00 -0.96 0.00 0.00 56.93 55.47 3hvy s PHE 92 Cb -0.00 -0.72 0.01 0.00 -0.34 0.00 0.00 43.02 41.97 3hvy s PHE 92 CO -0.04 -0.69 -0.16 0.08 -1.46 0.00 0.00 175.22 172.94 3hvy s VAL 93 N 2.17 2.45 -0.08 3.12 1.01 -1.26 -1.12 120.40 126.69 3hvy s VAL 93 Ca 0.06 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.13 3hvy s VAL 93 Cb -0.16 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.20 3hvy s VAL 93 CO -0.23 0.52 0.24 -0.13 0.00 0.00 0.00 175.10 175.50 3hvy s ARG 94 N 1.10 0.34 0.06 2.72 1.81 -0.77 -4.88 118.95 119.32 3hvy s ARG 94 Ca -0.00 0.23 0.19 0.00 -1.72 0.00 0.00 55.73 54.43 3hvy s ARG 94 Cb -0.14 0.16 0.79 0.00 -0.45 0.00 0.00 34.95 35.31 3hvy s ARG 94 CO -0.06 -0.05 1.60 -0.35 -0.68 0.00 0.00 175.30 175.76 3hvy n PRO 95 N 2.66 0.05 0.27 3.54 -0.04 -1.26 -1.79 135.00 138.43 3hvy n PRO 95 Ca -0.14 0.24 0.15 0.00 -0.04 0.00 0.00 63.50 63.71 3hvy n PRO 95 Cb 0.58 -1.58 0.73 0.00 -0.04 0.00 0.00 33.50 33.19 3hvy n PRO 95 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3hvy h HIS 96 N 0.00 0.00 -2.98 0.54 3.86 -1.94 -3.34 115.15 111.29 3hvy h HIS 96 Ca 0.00 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.68 3hvy h HIS 96 Cb 0.33 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.83 3hvy h HIS 96 CO 0.00 0.08 0.74 -0.06 0.86 0.00 0.00 177.93 179.55 3hvy s PHE 97 N -3.87 3.22 -0.43 2.45 0.08 -1.21 -4.89 117.98 113.33 3hvy s PHE 97 Ca -0.01 0.92 0.23 0.00 0.12 0.00 0.00 56.93 58.19 3hvy s PHE 97 Cb 0.11 -3.70 0.32 0.00 -0.57 0.00 0.00 43.02 39.18 3hvy s PHE 97 CO 0.55 -2.47 1.57 -0.39 -0.10 0.00 0.00 175.22 174.39 3hvy h VAL 98 N 4.25 0.00 -2.11 -0.44 -1.51 -1.90 -3.02 116.25 111.53 3hvy h VAL 98 Ca -0.42 -1.00 0.17 0.00 -1.23 0.00 0.00 66.70 64.22 3hvy h VAL 98 Cb 1.21 1.97 -0.03 0.00 -2.13 0.00 0.00 31.29 32.30 3hvy h VAL 98 CO 0.87 0.00 0.52 -0.46 -1.23 0.00 0.00 177.57 177.27 3hvy n ASN 99 N -3.07 -1.09 -0.01 4.19 0.23 -1.26 -4.79 115.26 109.46 3hvy n ASN 99 Ca 0.04 -1.45 -0.01 0.00 -0.53 0.00 0.00 54.58 52.62 3hvy n ASN 99 Cb 0.53 1.74 0.26 0.00 -2.08 0.00 0.00 39.78 40.23 3hvy n ASN 99 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3hvy h GLY 100 N 1.42 0.60 1.13 4.83 0.00 -1.84 -2.75 103.07 106.46 3hvy h GLY 100 Ca -0.18 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.76 3hvy h GLY 100 CO 0.25 0.35 0.48 -0.84 0.00 0.00 0.00 176.54 176.78 3hvy h THR 101 N 0.52 1.24 -0.45 4.70 2.02 -1.96 -1.54 112.91 117.43 3hvy h THR 101 Ca 0.11 -0.56 0.01 0.00 0.77 0.00 0.00 66.41 66.73 3hvy h THR 101 Cb 0.41 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 3hvy h THR 101 CO 0.02 0.26 0.30 -0.74 0.37 0.00 0.00 175.52 175.73 3hvy h HIS 102 N 1.15 0.57 -0.20 3.16 6.17 -1.89 0.20 115.15 124.32 3hvy h HIS 102 Ca 0.30 0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.39 3hvy h HIS 102 Cb -0.01 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 29.72 3hvy h HIS 102 CO 0.01 0.36 0.11 0.00 0.71 0.00 0.00 177.93 179.12 3hvy h ALA 103 N 1.17 0.26 -0.06 5.26 0.00 -1.31 -0.53 119.26 124.06 3hvy h ALA 103 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hvy h ALA 103 Cb -0.07 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3hvy h ALA 103 CO -0.04 -0.21 0.03 0.82 0.00 0.00 0.00 179.25 179.86 3hvy h ILE 104 N 0.23 1.07 -0.93 0.00 2.04 -1.08 -1.79 117.51 117.04 3hvy h ILE 104 Ca 0.07 -0.19 0.06 0.00 1.00 0.00 0.00 64.86 65.81 3hvy h ILE 104 Cb 0.07 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 3hvy h ILE 104 CO -0.01 0.06 0.59 1.23 0.00 0.00 0.00 178.15 180.02 3hvy h GLY 105 N 0.02 1.41 0.99 5.37 0.00 -0.45 -1.04 103.07 109.38 3hvy h GLY 105 Ca 0.02 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 3hvy h GLY 105 CO -0.00 0.31 0.06 0.00 0.00 0.00 0.00 176.54 176.90 3hvy h ALA 106 N 1.43 0.67 -0.97 3.60 0.00 -0.90 0.12 119.26 123.21 3hvy h ALA 106 Ca 0.40 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hvy h ALA 106 Cb 0.16 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 3hvy h ALA 106 CO -0.17 0.43 0.60 0.00 0.00 0.00 0.00 179.25 180.11 3hvy h ALA 107 N 0.96 1.24 0.44 0.00 0.00 -0.88 0.30 119.26 121.33 3hvy h ALA 107 Ca 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3hvy h ALA 107 Cb 0.43 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3hvy h ALA 107 CO 0.01 0.67 -0.21 -0.07 0.00 0.00 0.00 179.25 179.65 3hvy h LEU 108 N 1.33 -0.50 -0.46 0.00 3.38 -0.78 -3.12 115.31 115.16 3hvy h LEU 108 Ca 0.35 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.26 3hvy h LEU 108 Cb -0.09 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3hvy h LEU 108 CO -0.07 -0.11 0.23 -0.26 0.09 0.00 0.00 178.44 178.33 3hvy h PHE 109 N -0.98 0.43 -0.45 1.13 0.04 -0.74 -2.29 116.94 114.10 3hvy h PHE 109 Ca -0.06 0.02 0.10 0.00 2.80 0.00 0.00 57.97 60.82 3hvy h PHE 109 Cb 0.57 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.57 3hvy h PHE 109 CO 0.02 0.22 0.31 0.78 -0.60 0.00 0.00 178.31 179.04 3hvy h GLY 110 N 0.47 0.25 -2.18 -1.45 0.00 -1.01 -2.23 103.07 96.91 3hvy h GLY 110 Ca 0.20 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.45 3hvy h GLY 110 CO -0.13 0.05 0.00 0.70 0.00 0.00 0.00 176.54 177.15 3hvy n ASN 111 N -4.45 4.26 -4.20 0.19 3.02 -0.89 -4.51 115.26 108.67 3hvy n ASN 111 Ca 0.07 -2.75 -0.19 0.00 -0.03 0.00 0.00 54.58 51.68 3hvy n ASN 111 Cb 0.39 -0.53 -0.12 0.00 -0.61 0.00 0.00 39.78 38.91 3hvy n ASN 111 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3hvy s LEU 112 N -2.37 2.30 0.12 3.41 1.43 -0.84 -4.91 118.68 117.82 3hvy s LEU 112 Ca 0.43 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 3hvy s LEU 112 Cb 0.32 -0.57 -0.04 0.00 0.03 0.00 0.00 46.19 45.93 3hvy s LEU 112 CO 0.14 -0.07 -0.01 -0.13 0.23 0.00 0.00 176.35 176.51 3hvy s ARG 113 N -1.93 0.89 0.39 1.70 1.81 -1.26 -4.92 118.95 115.63 3hvy s ARG 113 Ca 0.01 -1.40 -0.26 0.00 -1.72 0.00 0.00 55.73 52.36 3hvy s ARG 113 Cb -0.09 -0.02 -0.11 0.00 -0.45 0.00 0.00 34.95 34.28 3hvy s ARG 113 CO 0.03 -0.14 1.14 -2.30 -0.68 0.00 0.00 175.30 173.35 3hvy n PRO 114 N -0.08 1.67 -0.19 3.54 -0.02 -1.24 -1.27 135.00 137.40 3hvy n PRO 114 Ca -0.09 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 3hvy n PRO 114 Cb 0.62 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 3hvy n PRO 114 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hvy n ASN 115 N 0.57 0.00 -4.78 2.55 3.02 0.80 -4.94 115.26 112.48 3hvy n ASN 115 Ca 0.08 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.31 3hvy n ASN 115 Cb 0.38 -0.23 0.05 0.00 -0.61 0.00 0.00 39.78 39.37 3hvy n ASN 115 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3hvy s ASP 116 N -3.55 5.11 0.29 6.41 1.01 -0.40 -4.81 116.67 120.73 3hvy s ASP 116 Ca 0.00 1.86 0.00 0.00 0.71 0.00 0.00 52.55 55.12 3hvy s ASP 116 Cb 0.00 -2.53 -0.00 0.00 1.01 0.00 0.00 42.92 41.40 3hvy s ASP 116 CO 0.00 -1.63 0.00 0.41 0.21 0.00 0.00 175.17 174.17 3hvy n THR 117 N -2.75 0.00 -3.76 -1.27 -1.04 0.10 -0.30 114.28 105.25 3hvy n THR 117 Ca 0.09 -1.37 -0.14 0.00 -2.04 0.00 0.00 64.05 60.59 3hvy n THR 117 Cb 0.53 0.27 -0.15 0.00 -1.82 0.00 0.00 70.33 69.16 3hvy n THR 117 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 3hvy s SER 120 N -2.59 0.00 0.00 8.00 0.01 -0.26 -1.55 113.70 117.31 3hvy s SER 120 Ca 0.00 0.14 0.10 0.00 1.31 0.00 0.00 55.95 57.50 3hvy s SER 120 Cb 0.00 0.03 0.12 0.00 0.21 0.00 0.00 66.02 66.38 3hvy s SER 120 CO 0.00 -0.14 0.90 2.30 0.41 0.00 0.00 173.24 176.71 3hvy n ILE 121 N 4.20 0.21 -1.68 1.44 -5.35 -0.69 -0.58 119.36 116.91 3hvy n ILE 121 Ca -0.27 -0.60 -0.28 0.00 -0.27 0.00 0.00 62.75 61.33 3hvy n ILE 121 Cb 0.51 1.06 0.06 0.00 -1.74 0.00 0.00 39.64 39.52 3hvy n ILE 121 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hvy n GLY 123 N -0.83 1.12 3.50 0.00 0.00 -0.46 -4.81 105.19 103.71 3hvy n GLY 123 Ca 0.52 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 46.28 3hvy n GLY 123 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hvy s PRO 125 N 0.00 1.73 0.17 1.61 0.04 -1.26 -4.80 135.00 132.49 3hvy s PRO 125 Ca 0.00 -1.89 -0.32 0.00 0.04 0.00 0.00 61.00 58.83 3hvy s PRO 125 Cb 0.00 -1.51 -0.16 0.00 0.04 0.00 0.00 34.50 32.87 3hvy s PRO 125 CO 0.00 0.10 0.94 2.48 0.04 0.00 0.00 177.00 180.56 3hvy n TYR 126 N -0.72 0.69 -0.27 0.56 4.11 -1.26 -4.87 117.16 115.39 3hvy n TYR 126 Ca -0.05 0.82 0.21 0.00 -0.00 0.00 0.00 57.90 58.88 3hvy n TYR 126 Cb 0.63 -2.16 0.52 0.00 -0.00 0.00 0.00 39.34 38.34 3hvy n TYR 126 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.86 176.42 3hvy h ASP 127 N 2.42 0.40 0.40 9.48 3.32 -2.03 -0.85 116.42 129.56 3hvy h ASP 127 Ca -0.39 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 56.69 3hvy h ASP 127 Cb 1.38 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.91 3hvy h ASP 127 CO 0.64 0.13 -0.08 0.71 -1.72 0.00 0.00 179.24 178.92 3hvy h THR 128 N 0.38 0.40 -0.00 0.35 1.35 -2.05 -1.65 112.91 111.69 3hvy h THR 128 Ca 0.52 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.94 3hvy h THR 128 Cb 1.34 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 69.07 3hvy h THR 128 CO -0.21 0.08 -0.08 0.18 -0.25 0.00 0.00 175.52 175.24 3hvy n LEU 129 N -3.48 0.12 -0.24 3.87 4.77 -0.32 -4.28 117.00 117.43 3hvy n LEU 129 Ca -0.02 0.34 -0.05 0.00 -0.03 0.00 0.00 56.01 56.26 3hvy n LEU 129 Cb 0.22 -0.39 0.11 0.00 -2.33 0.00 0.00 43.42 41.03 3hvy n LEU 129 CO 0.28 0.03 1.03 0.45 -1.33 0.00 0.00 177.39 177.85 3hvy h HIS 130 N 0.06 1.10 -0.05 -1.77 3.86 -1.42 -2.20 115.15 114.73 3hvy h HIS 130 Ca 0.00 -0.09 -0.17 0.00 -1.16 0.00 0.00 60.37 58.96 3hvy h HIS 130 Cb 0.44 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 3hvy h HIS 130 CO 0.00 0.85 -0.70 -0.44 0.86 0.00 0.00 177.93 178.50 3hvy h ASP 131 N 1.04 0.29 -0.44 2.45 3.32 -1.79 0.13 116.42 121.43 3hvy h ASP 131 Ca 0.24 -0.19 0.03 0.00 0.02 0.00 0.00 57.03 57.13 3hvy h ASP 131 Cb 0.24 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 3hvy h ASP 131 CO -0.02 0.90 0.23 0.40 -1.72 0.00 0.00 179.24 179.03 3hvy h ILE 132 N 0.17 0.98 -0.18 0.35 2.04 -1.71 -3.03 117.51 116.13 3hvy h ILE 132 Ca -0.02 -0.16 -0.09 0.00 1.00 0.00 0.00 64.86 65.59 3hvy h ILE 132 Cb 1.25 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 37.81 3hvy h ILE 132 CO 0.11 0.08 -0.25 0.40 0.00 0.00 0.00 178.15 178.49 3hvy h ILE 133 N 0.45 1.34 -0.02 -0.67 2.04 -1.28 0.21 117.51 119.60 3hvy h ILE 133 Ca 0.19 -1.46 0.00 0.00 1.00 0.00 0.00 64.86 64.59 3hvy h ILE 133 Cb 0.09 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 3hvy h ILE 133 CO -0.13 0.44 0.00 0.61 0.00 0.00 0.00 178.15 179.07 3hvy n GLY 134 N 0.31 1.29 0.00 5.37 0.00 0.45 -1.50 105.19 111.12 3hvy n GLY 134 Ca -0.06 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.72 3hvy n GLY 134 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hvy n ASP 136 N -0.00 0.00 0.00 1.61 -0.08 -1.26 -4.80 116.55 112.01 3hvy n ASP 136 Ca 0.00 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.38 3hvy n ASP 136 Cb 0.00 0.00 0.59 0.00 2.34 0.00 0.00 41.12 44.05 3hvy n ASP 136 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 3hvy n ASP 137 N 0.03 0.00 -0.80 1.67 5.68 -1.26 -2.30 116.55 119.56 3hvy n ASP 137 Ca 0.00 -0.56 0.12 0.00 -0.50 0.00 0.00 54.79 53.85 3hvy n ASP 137 Cb 0.00 -0.03 0.30 0.00 -1.14 0.00 0.00 41.12 40.24 3hvy n ASP 137 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3hvy n SER 138 N -1.03 2.45 -4.43 -1.12 3.41 -1.26 -4.89 113.62 106.74 3hvy n SER 138 Ca 0.15 -1.82 -0.32 0.00 -0.26 0.00 0.00 58.87 56.62 3hvy n SER 138 Cb 0.08 -0.10 -0.14 0.00 -0.26 0.00 0.00 64.21 63.79 3hvy n SER 138 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3hvy s LYS 139 N -1.80 2.31 -0.40 4.33 1.02 -0.97 -5.09 119.74 119.14 3hvy s LYS 139 Ca 0.34 -0.81 -0.07 0.00 0.02 0.00 0.00 55.97 55.45 3hvy s LYS 139 Cb 0.20 -2.25 0.08 0.00 -0.52 0.00 0.00 37.83 35.34 3hvy s LYS 139 CO 0.30 0.59 0.21 0.21 -0.92 0.00 0.00 175.35 175.74 3hvy s LYS 140 N -0.85 2.46 -0.00 1.68 2.20 -1.26 -4.90 119.74 119.06 3hvy s LYS 140 Ca 0.12 -1.50 0.00 0.00 -0.36 0.00 0.00 55.97 54.23 3hvy s LYS 140 Cb -0.10 -3.66 0.00 0.00 -1.51 0.00 0.00 37.83 32.56 3hvy s LYS 140 CO 0.01 -0.93 0.66 1.33 -0.36 0.00 0.00 175.35 176.06 3hvy n VAL 141 N 4.81 0.28 -2.42 4.02 0.24 -1.26 -5.01 118.33 119.00 3hvy n VAL 141 Ca -0.09 -0.29 -0.09 0.00 -2.04 0.00 0.00 64.34 61.83 3hvy n VAL 141 Cb 0.43 0.83 0.01 0.00 -1.47 0.00 0.00 33.84 33.64 3hvy n VAL 141 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hvy n GLY 142 N -0.15 0.12 3.73 7.63 0.00 -1.26 -5.00 105.19 110.26 3hvy n GLY 142 Ca 0.00 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.29 3hvy n GLY 142 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hvy s SER 143 N -2.78 3.01 0.27 1.61 1.04 -1.26 -4.85 113.70 110.74 3hvy s SER 143 Ca 0.08 1.03 -0.02 0.00 0.48 0.00 0.00 55.95 57.52 3hvy s SER 143 Cb -0.03 -1.63 0.41 0.00 0.10 0.00 0.00 66.02 64.86 3hvy s SER 143 CO 0.10 -2.87 1.90 -0.07 0.98 0.00 0.00 173.24 173.27 3hvy h LEU 144 N -1.72 1.03 -0.45 2.42 3.38 -0.61 -1.21 115.31 118.16 3hvy h LEU 144 Ca -0.52 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.48 3hvy h LEU 144 Cb 1.33 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 3hvy h LEU 144 CO 0.59 0.68 0.24 -0.09 0.09 0.00 0.00 178.44 179.95 3hvy h ARG 145 N 1.18 0.46 0.00 1.13 2.43 -1.36 -0.49 114.38 117.74 3hvy h ARG 145 Ca 0.41 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.54 3hvy h ARG 145 Cb 0.10 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3hvy h ARG 145 CO -0.15 0.30 -0.07 0.93 -1.51 0.00 0.00 179.97 179.48 3hvy h GLU 146 N 0.47 0.00 -0.75 0.20 5.08 -1.54 0.53 114.58 118.58 3hvy h GLU 146 Ca 0.19 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.48 3hvy h GLU 146 Cb 0.08 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 3hvy h GLU 146 CO -0.12 0.07 0.08 0.66 -1.00 0.00 0.00 179.01 178.70 3hvy n TYR 147 N -3.63 1.67 -1.11 4.33 4.01 -0.41 -4.92 117.16 117.11 3hvy n TYR 147 Ca -0.02 -0.70 -0.04 0.00 -0.16 0.00 0.00 57.90 56.98 3hvy n TYR 147 Cb 0.18 -0.47 -0.02 0.00 -0.31 0.00 0.00 39.34 38.73 3hvy n TYR 147 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hvy n GLY 148 N 0.26 0.67 3.65 2.72 0.00 0.18 -3.73 105.19 108.93 3hvy n GLY 148 Ca 0.25 -0.44 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 3hvy n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hvy s VAL 149 N -2.01 5.03 0.52 1.61 1.01 -0.33 -0.14 120.40 126.09 3hvy s VAL 149 Ca 0.00 1.11 -0.15 0.00 0.00 0.00 0.00 61.98 62.94 3hvy s VAL 149 Cb 0.00 -3.92 -0.07 0.00 0.00 0.00 0.00 36.38 32.39 3hvy s VAL 149 CO 0.00 0.09 0.97 -0.54 0.00 0.00 0.00 175.10 175.62 3hvy s LYS 150 N 2.07 3.86 -0.04 2.72 3.01 0.59 -3.77 119.74 128.19 3hvy s LYS 150 Ca 0.27 0.85 0.03 0.00 -1.01 0.00 0.00 55.97 56.11 3hvy s LYS 150 Cb -0.16 -2.15 0.01 0.00 -1.01 0.00 0.00 37.83 34.52 3hvy s LYS 150 CO 0.10 -0.30 -0.10 -0.47 0.51 0.00 0.00 175.35 175.08 3hvy s TYR 151 N -2.71 1.15 0.00 3.18 5.04 -1.26 -4.22 117.35 118.53 3hvy s TYR 151 Ca 0.57 -0.33 0.00 0.00 -2.44 0.00 0.00 57.07 54.87 3hvy s TYR 151 Cb -0.10 -0.83 0.00 0.00 0.35 0.00 0.00 41.96 41.38 3hvy s TYR 151 CO 0.36 -0.15 0.00 1.63 -1.34 0.00 0.00 175.55 176.04 3hvy n LYS 152 N 3.45 1.84 -3.50 4.97 5.02 -1.26 -5.08 118.16 123.60 3hvy n LYS 152 Ca -0.20 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.06 3hvy n LYS 152 Cb 0.53 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.48 3hvy n LYS 152 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hvy s VAL 154 N -0.95 -0.83 0.65 -0.18 1.01 0.25 -1.10 120.40 119.25 3hvy s VAL 154 Ca 0.00 0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.85 3hvy s VAL 154 Cb 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 3hvy s VAL 154 CO 0.00 0.00 1.19 -1.81 0.00 0.00 0.00 175.10 174.49 3hvy s ASP 155 N 2.75 4.84 0.62 3.32 1.01 -1.26 -1.36 116.67 126.59 3hvy s ASP 155 Ca 0.04 2.32 -0.17 0.00 0.71 0.00 0.00 52.55 55.45 3hvy s ASP 155 Cb -0.13 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.19 3hvy s ASP 155 CO -0.17 -1.83 1.16 -0.76 0.21 0.00 0.00 175.17 173.79 3hvy s LEU 156 N -4.55 3.56 -0.13 1.23 1.43 -1.26 -4.29 118.68 114.67 3hvy s LEU 156 Ca 0.75 2.23 0.02 0.00 -1.03 0.00 0.00 54.13 56.10 3hvy s LEU 156 Cb -0.29 -4.58 0.01 0.00 0.03 0.00 0.00 46.19 41.37 3hvy s LEU 156 CO 0.38 -1.62 -0.18 -0.75 0.23 0.00 0.00 176.35 174.41 3hvy s LYS 157 N -3.60 2.56 -1.50 1.70 2.20 0.91 -4.71 119.74 117.29 3hvy s LYS 157 Ca 0.73 -0.68 -0.08 0.00 -0.36 0.00 0.00 55.97 55.58 3hvy s LYS 157 Cb -0.26 -2.16 0.06 0.00 -1.51 0.00 0.00 37.83 33.96 3hvy s LYS 157 CO 0.36 -0.09 0.68 -0.25 -0.36 0.00 0.00 175.35 175.69 3hvy n ASP 158 N 4.28 -2.18 0.00 1.43 8.00 -1.26 -0.69 116.55 126.14 3hvy n ASP 158 Ca -0.19 -0.93 0.00 0.00 0.71 0.00 0.00 54.79 54.38 3hvy n ASP 158 Cb 0.51 -3.30 0.00 0.00 -0.02 0.00 0.00 41.12 38.31 3hvy n ASP 158 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hvy n GLY 159 N -1.71 1.29 3.51 0.44 0.00 -1.26 -4.99 105.19 102.46 3hvy n GLY 159 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 3hvy n GLY 159 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hvy s LYS 160 N -0.17 1.81 0.19 1.61 0.00 0.13 -4.99 119.74 118.33 3hvy s LYS 160 Ca 0.00 -1.68 -0.32 0.00 0.00 0.00 0.00 55.97 53.98 3hvy s LYS 160 Cb 0.00 -1.86 -0.11 0.00 0.00 0.00 0.00 37.83 35.85 3hvy s LYS 160 CO 0.00 0.34 1.73 0.08 0.00 0.00 0.00 175.35 177.50 3hvy s VAL 161 N -2.43 2.20 -1.31 1.79 1.01 -1.26 -0.07 120.40 120.34 3hvy s VAL 161 Ca 0.30 0.08 -0.16 0.00 0.00 0.00 0.00 61.98 62.20 3hvy s VAL 161 Cb -0.05 -3.05 0.09 0.00 0.00 0.00 0.00 36.38 33.37 3hvy s VAL 161 CO 0.16 0.00 1.78 -0.67 0.00 0.00 0.00 175.10 176.37 3hvy n ASP 162 N 4.33 4.82 0.14 3.32 2.03 -1.26 -4.80 116.55 125.12 3hvy n ASP 162 Ca 0.16 -2.93 0.03 0.00 0.52 0.00 0.00 54.79 52.58 3hvy n ASP 162 Cb 0.36 -1.68 0.43 0.00 -0.72 0.00 0.00 41.12 39.51 3hvy n ASP 162 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 3hvy h ILE 163 N 5.00 1.15 -0.19 5.18 6.09 -1.95 -1.17 117.51 131.62 3hvy h ILE 163 Ca 0.44 -0.62 -0.13 0.00 -1.37 0.00 0.00 64.86 63.17 3hvy h ILE 163 Cb 0.81 1.14 -0.01 0.00 0.47 0.00 0.00 36.82 39.23 3hvy h ILE 163 CO 1.50 0.20 -0.45 0.78 -3.07 0.00 0.00 178.15 177.11 3hvy h ASN 164 N 0.20 0.49 -0.36 2.19 2.35 -1.99 -1.15 115.58 117.31 3hvy h ASN 164 Ca 0.04 -0.23 -0.10 0.00 -0.55 0.00 0.00 56.30 55.47 3hvy h ASN 164 Cb 0.29 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3hvy h ASN 164 CO 0.01 0.88 -0.16 0.74 -1.65 0.00 0.00 177.43 177.25 3hvy h THR 165 N 0.37 1.28 -0.60 2.81 2.02 -1.69 -1.32 112.91 115.79 3hvy h THR 165 Ca 0.03 -1.28 0.06 0.00 0.77 0.00 0.00 66.41 65.99 3hvy h THR 165 Cb 0.94 1.35 -0.06 0.00 -1.74 0.00 0.00 68.15 68.64 3hvy h THR 165 CO 0.08 0.42 0.30 0.58 0.37 0.00 0.00 175.52 177.27 3hvy h VAL 166 N 0.54 0.91 -0.50 3.16 2.07 -1.02 -0.45 116.25 120.96 3hvy h VAL 166 Ca 0.08 -0.19 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 3hvy h VAL 166 Cb 0.70 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 3hvy h VAL 166 CO 0.05 0.10 -0.04 0.11 0.02 0.00 0.00 177.57 177.81 3hvy h LYS 167 N 0.55 0.86 -0.51 1.57 1.57 -1.15 -1.77 116.57 117.70 3hvy h LYS 167 Ca 0.28 -0.26 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 3hvy h LYS 167 Cb 0.22 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 3hvy h LYS 167 CO -0.21 0.89 0.05 0.93 -0.57 0.00 0.00 179.45 180.54 3hvy h GLU 168 N 0.79 0.87 -0.21 3.15 5.08 -0.38 -1.33 114.58 122.55 3hvy h GLU 168 Ca 0.14 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3hvy h GLU 168 Cb 0.53 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3hvy h GLU 168 CO 0.03 0.87 0.14 0.93 -1.00 0.00 0.00 179.01 179.98 3hvy h GLU 169 N 0.74 0.28 -0.85 2.33 4.39 -0.95 -2.07 114.58 118.44 3hvy h GLU 169 Ca 0.15 -0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.88 3hvy h GLU 169 Cb 0.45 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.99 3hvy h GLU 169 CO 0.02 0.18 0.56 -0.07 -1.16 0.00 0.00 179.01 178.54 3hvy h LEU 170 N 0.28 0.88 -0.89 1.33 3.38 -1.12 0.19 115.31 119.35 3hvy h LEU 170 Ca 0.08 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 3hvy h LEU 170 Cb -0.03 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 3hvy h LEU 170 CO -0.02 0.59 -0.17 0.11 0.09 0.00 0.00 178.44 179.04 3hvy h LYS 171 N 1.01 0.63 0.00 1.13 6.56 -0.84 -3.33 116.57 121.72 3hvy h LYS 171 Ca 0.35 -0.22 -0.03 0.00 -1.06 0.00 0.00 60.65 59.70 3hvy h LYS 171 Cb 0.12 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.72 3hvy h LYS 171 CO -0.12 0.77 -1.83 0.36 -2.06 0.00 0.00 179.45 176.57 3hvy n LYS 172 N -4.15 0.65 -3.94 3.15 2.85 -0.81 -4.83 118.16 111.08 3hvy n LYS 172 Ca 0.01 -0.12 -0.30 0.00 -1.05 0.00 0.00 58.31 56.85 3hvy n LYS 172 Cb 0.38 -1.58 -0.14 0.00 -0.65 0.00 0.00 35.03 33.03 3hvy n LYS 172 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 3hvy s ASP 173 N -4.78 4.44 0.00 -5.58 -1.08 0.01 -4.95 116.67 104.73 3hvy s ASP 173 Ca -0.07 -2.42 0.13 0.00 -0.52 0.00 0.00 52.55 49.67 3hvy s ASP 173 Cb 0.12 -1.50 0.56 0.00 -1.46 0.00 0.00 42.92 40.65 3hvy s ASP 173 CO 0.88 -0.33 1.40 -0.67 0.52 0.00 0.00 175.17 176.98 3hvy n ASP 174 N 3.88 0.00 -0.14 -0.34 -0.08 -1.26 -2.67 116.55 115.94 3hvy n ASP 174 Ca 0.04 0.46 0.13 0.00 -1.51 0.00 0.00 54.79 53.91 3hvy n ASP 174 Cb 0.38 -0.48 0.43 0.00 2.34 0.00 0.00 41.12 43.80 3hvy n ASP 174 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3hvy n SER 175 N -1.48 0.70 -4.59 1.67 3.41 -1.26 -4.80 113.62 107.28 3hvy n SER 175 Ca 0.03 -0.59 -0.42 0.00 -0.26 0.00 0.00 58.87 57.64 3hvy n SER 175 Cb 0.14 0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.13 3hvy n SER 175 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hvy s ILE 176 N -2.62 3.74 -0.03 -1.33 1.01 -1.09 -0.73 121.20 120.15 3hvy s ILE 176 Ca 0.22 0.69 0.17 0.00 0.00 0.00 0.00 60.65 61.74 3hvy s ILE 176 Cb 0.19 -4.17 -0.27 0.00 0.01 0.00 0.00 42.46 38.23 3hvy s ILE 176 CO 0.54 -0.86 0.37 0.29 0.00 0.00 0.00 174.94 175.28 3hvy n LYS 177 N 8.45 0.56 -3.80 2.79 4.76 -0.60 -4.84 118.16 125.47 3hvy n LYS 177 Ca 0.16 -0.15 -0.13 0.00 -2.87 0.00 0.00 58.31 55.32 3hvy n LYS 177 Cb 0.49 -1.41 -0.14 0.00 -1.84 0.00 0.00 35.03 32.12 3hvy n LYS 177 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3hvy s LEU 178 N -4.24 1.31 -0.15 -0.35 0.20 -1.22 -1.46 118.68 112.77 3hvy s LEU 178 Ca -0.06 0.15 -0.05 0.00 0.69 0.00 0.00 54.13 54.86 3hvy s LEU 178 Cb 0.11 0.18 -0.03 0.00 -0.43 0.00 0.00 46.19 46.02 3hvy s LEU 178 CO 0.72 -0.08 0.00 -0.63 -0.29 0.00 0.00 176.35 176.07 3hvy s ILE 179 N 0.60 4.27 -0.24 6.68 1.01 0.11 -4.80 121.20 128.83 3hvy s ILE 179 Ca -0.05 -0.23 -0.06 0.00 0.00 0.00 0.00 60.65 60.31 3hvy s ILE 179 Cb -0.07 -2.87 -0.02 0.00 0.01 0.00 0.00 42.46 39.51 3hvy s ILE 179 CO -0.02 0.51 0.04 -2.28 0.00 0.00 0.00 174.94 173.18 3hvy s HIS 180 N 0.11 3.05 -0.07 3.97 5.65 -1.26 -0.51 115.29 126.24 3hvy s HIS 180 Ca 0.02 -0.54 0.04 0.00 0.25 0.00 0.00 55.06 54.83 3hvy s HIS 180 Cb -0.13 -2.20 -0.02 0.00 -1.18 0.00 0.00 32.58 29.05 3hvy s HIS 180 CO 0.02 -0.39 -0.19 0.42 -0.65 0.00 0.00 174.74 173.95 3hvy s ILE 181 N 1.54 2.59 -0.22 0.89 1.01 -0.10 -1.70 121.20 125.21 3hvy s ILE 181 Ca 0.06 -0.87 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 3hvy s ILE 181 Cb -0.15 -2.00 -0.02 0.00 0.01 0.00 0.00 42.46 40.31 3hvy s ILE 181 CO 0.02 0.57 -0.01 -1.58 0.00 0.00 0.00 174.94 173.94 3hvy s GLN 182 N -0.23 3.49 -0.05 2.79 0.74 -1.26 -1.09 119.66 124.04 3hvy s GLN 182 Ca -0.00 -0.57 -0.26 0.00 0.05 0.00 0.00 55.36 54.57 3hvy s GLN 182 Cb -0.13 -3.09 -0.21 0.00 1.10 0.00 0.00 33.01 30.68 3hvy s GLN 182 CO 0.03 -0.15 1.10 -0.09 -0.55 0.00 0.00 175.29 175.63 3hvy h ARG 183 N 7.99 -0.03 -5.84 1.67 2.43 -1.75 -3.43 114.38 115.41 3hvy h ARG 183 Ca -0.39 0.00 -0.57 0.00 -0.81 0.00 0.00 59.98 58.21 3hvy h ARG 183 Cb 1.17 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.66 3hvy h ARG 183 CO 0.60 0.56 -0.08 0.45 -1.51 0.00 0.00 179.97 179.99 3hvy s SER 184 N -5.77 6.78 0.44 -3.80 0.15 -1.26 -0.91 113.70 109.33 3hvy s SER 184 Ca -0.16 0.94 -0.25 0.00 0.70 0.00 0.00 55.95 57.18 3hvy s SER 184 Cb 0.00 -2.32 -0.08 0.00 -1.71 0.00 0.00 66.02 61.91 3hvy s SER 184 CO 0.65 -0.01 1.31 -0.89 1.20 0.00 0.00 173.24 175.51 3hvy s THR 185 N 0.54 2.51 0.00 6.45 2.01 -1.26 -4.97 115.64 120.92 3hvy s THR 185 Ca 0.29 0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.73 3hvy s THR 185 Cb -0.16 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.10 3hvy s THR 185 CO 0.13 0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 3hvy n GLY 186 N 0.63 0.82 3.54 4.40 0.00 -1.26 -4.82 105.19 108.50 3hvy n GLY 186 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 3hvy n GLY 186 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hvy n TYR 187 N 0.00 4.63 -2.89 1.61 4.01 -1.26 -4.87 117.16 118.39 3hvy n TYR 187 Ca 0.00 -2.86 0.00 0.00 -0.16 0.00 0.00 57.90 54.88 3hvy n TYR 187 Cb 0.00 -2.62 0.00 0.00 -0.31 0.00 0.00 39.34 36.41 3hvy n TYR 187 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hvy n GLY 188 N 5.30 5.21 2.28 2.72 0.00 -1.26 -5.08 105.19 114.35 3hvy n GLY 188 Ca 0.49 -1.39 -0.25 0.00 0.00 0.00 0.00 46.02 44.86 3hvy n GLY 188 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3hvy n TRP 189 N 0.00 0.14 -3.68 1.61 -0.00 -1.26 -5.06 117.44 109.18 3hvy n TRP 189 Ca 0.00 -3.61 -0.14 0.00 -0.00 0.00 0.00 57.50 53.75 3hvy n TRP 189 Cb 0.00 -0.27 -0.08 0.00 -0.00 0.00 0.00 31.31 30.95 3hvy n TRP 189 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 177.69 176.71 3hvy s ARG 190 N -1.12 0.67 0.27 5.87 1.70 -1.26 -5.14 118.95 119.94 3hvy s ARG 190 Ca 0.35 0.74 -0.30 0.00 -0.47 0.00 0.00 55.73 56.05 3hvy s ARG 190 Cb 0.14 0.33 -0.10 0.00 -0.57 0.00 0.00 34.95 34.74 3hvy s ARG 190 CO -0.12 -0.09 1.37 0.15 -1.08 0.00 0.00 175.30 175.54 3hvy s LYS 191 N 0.20 4.32 0.74 3.89 1.02 -1.26 -4.75 119.74 123.90 3hvy s LYS 191 Ca -0.01 2.24 -0.15 0.00 0.02 0.00 0.00 55.97 58.07 3hvy s LYS 191 Cb -0.04 -3.11 0.04 0.00 -0.52 0.00 0.00 37.83 34.21 3hvy s LYS 191 CO 0.01 -0.31 1.19 -1.12 -0.92 0.00 0.00 175.35 174.20 3hvy s SER 192 N 0.06 4.17 -0.15 2.83 0.01 -1.26 -4.82 113.70 114.54 3hvy s SER 192 Ca 0.55 2.31 -0.29 0.00 1.31 0.00 0.00 55.95 59.83 3hvy s SER 192 Cb -0.40 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.24 3hvy s SER 192 CO 0.46 -2.28 1.10 -0.76 0.41 0.00 0.00 173.24 172.17 3hvy s LEU 193 N -5.25 4.19 0.62 2.44 1.43 -0.09 -4.90 118.68 117.11 3hvy s LEU 193 Ca 0.73 1.55 -0.15 0.00 -1.03 0.00 0.00 54.13 55.24 3hvy s LEU 193 Cb -0.28 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 3hvy s LEU 193 CO 0.46 -0.61 1.06 -0.13 0.23 0.00 0.00 176.35 177.37 3hvy s ARG 194 N 2.75 3.17 0.27 1.70 1.81 -1.26 -4.83 118.95 122.55 3hvy s ARG 194 Ca 0.49 1.19 -0.01 0.00 -1.72 0.00 0.00 55.73 55.68 3hvy s ARG 194 Cb -0.19 -2.01 0.48 0.00 -0.45 0.00 0.00 34.95 32.78 3hvy s ARG 194 CO 0.14 -0.93 1.84 0.82 -0.68 0.00 0.00 175.30 176.49 3hvy h ILE 195 N 0.19 0.97 0.00 1.52 1.08 -1.95 -0.14 117.51 119.18 3hvy h ILE 195 Ca -0.46 -0.35 -0.06 0.00 -0.39 0.00 0.00 64.86 63.60 3hvy h ILE 195 Cb 1.22 -0.13 -0.01 0.00 -3.07 0.00 0.00 36.82 34.83 3hvy h ILE 195 CO 0.57 0.18 -0.27 0.00 -0.69 0.00 0.00 178.15 177.94 3hvy h ALA 196 N 1.50 1.41 -0.14 1.87 0.00 -1.99 0.63 119.26 122.54 3hvy h ALA 196 Ca 0.46 -0.25 -0.22 0.00 0.00 0.00 0.00 54.91 54.90 3hvy h ALA 196 Cb 0.37 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.13 3hvy h ALA 196 CO -0.23 0.34 -0.78 0.93 0.00 0.00 0.00 179.25 179.51 3hvy h GLU 197 N 0.00 0.77 -0.18 0.00 5.08 -1.45 -2.48 114.58 116.32 3hvy h GLU 197 Ca -0.00 -0.64 -0.00 0.00 -1.00 0.00 0.00 59.36 57.71 3hvy h GLU 197 Cb 0.53 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 3hvy h GLU 197 CO 0.04 1.25 0.09 0.82 -1.00 0.00 0.00 179.01 180.21 3hvy h ILE 198 N 0.50 1.11 -0.71 3.13 2.04 -0.89 -1.15 117.51 121.54 3hvy h ILE 198 Ca -0.06 -0.32 0.14 0.00 1.00 0.00 0.00 64.86 65.62 3hvy h ILE 198 Cb 1.41 1.00 -0.10 0.00 -0.74 0.00 0.00 36.82 38.39 3hvy h ILE 198 CO 0.16 0.11 0.22 0.00 0.00 0.00 0.00 178.15 178.64 3hvy h ALA 199 N 0.97 0.94 -0.41 1.87 0.00 -0.82 -0.88 119.26 120.93 3hvy h ALA 199 Ca 0.06 0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 3hvy h ALA 199 Cb 0.09 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3hvy h ALA 199 CO -0.01 -0.27 -0.20 0.93 0.00 0.00 0.00 179.25 179.70 3hvy h GLU 200 N 0.34 0.86 -0.31 0.00 4.39 -1.16 -1.03 114.58 117.69 3hvy h GLU 200 Ca 0.39 -0.38 0.04 0.00 0.34 0.00 0.00 59.36 59.76 3hvy h GLU 200 Cb 0.61 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.20 3hvy h GLU 200 CO -0.44 1.02 0.06 0.82 -1.16 0.00 0.00 179.01 179.31 3hvy h ILE 201 N 0.68 0.85 -0.54 3.13 2.04 -0.46 -0.52 117.51 122.68 3hvy h ILE 201 Ca 0.09 -0.06 -0.10 0.00 1.00 0.00 0.00 64.86 65.80 3hvy h ILE 201 Cb 0.76 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 3hvy h ILE 201 CO 0.06 0.03 -0.05 0.40 0.00 0.00 0.00 178.15 178.59 3hvy h ILE 202 N 0.17 1.27 -0.47 -0.67 2.04 -1.02 -0.05 117.51 118.76 3hvy h ILE 202 Ca 0.14 -1.19 0.05 0.00 1.00 0.00 0.00 64.86 64.87 3hvy h ILE 202 Cb 0.16 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 3hvy h ILE 202 CO -0.19 0.42 0.21 0.50 0.00 0.00 0.00 178.15 179.08 3hvy h LYS 203 N 0.86 0.40 -0.55 2.37 1.63 -0.96 0.22 116.57 120.53 3hvy h LYS 203 Ca 0.15 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.93 3hvy h LYS 203 Cb 0.61 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 32.12 3hvy h LYS 203 CO 0.04 0.26 0.37 0.77 -3.45 0.00 0.00 179.45 177.44 3hvy h SER 204 N 0.41 0.63 -0.57 4.20 0.02 -0.59 -2.29 113.55 115.36 3hvy h SER 204 Ca 0.22 -0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.19 3hvy h SER 204 Cb 0.18 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 3hvy h SER 204 CO -0.19 0.46 0.32 0.40 -1.14 0.00 0.00 176.83 176.68 3hvy h ILE 205 N 0.75 1.00 0.00 3.27 2.04 -0.16 -2.38 117.51 122.03 3hvy h ILE 205 Ca 0.20 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3hvy h ILE 205 Cb -0.09 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 3hvy h ILE 205 CO -0.04 0.11 0.00 0.03 0.00 0.00 0.00 178.15 178.25 3hvy h ARG 206 N 0.62 0.00 0.00 2.37 2.47 -0.23 -0.17 114.38 119.44 3hvy h ARG 206 Ca 0.25 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.92 3hvy h ARG 206 Cb 0.10 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.41 3hvy h ARG 206 CO -0.14 0.00 -0.21 0.93 0.56 0.00 0.00 179.97 181.11 3hvy h GLU 207 N 0.00 0.00 0.00 0.04 5.08 -0.87 -3.34 114.58 115.49 3hvy h GLU 207 Ca 0.00 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 3hvy h GLU 207 Cb 0.32 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 3hvy h GLU 207 CO 0.00 0.21 -1.79 0.28 -1.00 0.00 0.00 179.01 176.72 3hvy n VAL 208 N -3.58 0.79 -3.48 3.13 0.31 -0.45 -5.00 118.33 110.04 3hvy n VAL 208 Ca -0.01 -0.44 -0.07 0.00 -0.01 0.00 0.00 64.34 63.81 3hvy n VAL 208 Cb 0.36 -0.77 -0.07 0.00 -0.91 0.00 0.00 33.84 32.44 3hvy n VAL 208 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3hvy s ASN 209 N -4.62 -0.29 0.00 4.52 3.84 -0.20 -4.96 114.94 113.23 3hvy s ASN 209 Ca -0.09 0.75 0.27 0.00 0.21 0.00 0.00 52.86 54.00 3hvy s ASN 209 Cb 0.04 1.44 0.81 0.00 -0.55 0.00 0.00 41.25 42.99 3hvy s ASN 209 CO 0.43 -0.26 1.60 -1.84 -2.79 0.00 0.00 177.10 174.25 3hvy n GLU 210 N 5.39 0.53 -0.07 0.43 -0.00 -1.26 -4.07 120.64 121.59 3hvy n GLU 210 Ca -0.06 -0.28 -0.07 0.00 -0.00 0.00 0.00 57.16 56.75 3hvy n GLU 210 Cb 0.50 -1.49 -0.12 0.00 -0.00 0.00 0.00 31.44 30.33 3hvy n GLU 210 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3hvy n ASN 211 N -0.99 1.35 -4.66 -1.84 3.02 -1.26 -5.00 115.26 105.88 3hvy n ASN 211 Ca 0.10 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.21 3hvy n ASN 211 Cb 0.33 0.88 -0.02 0.00 -0.61 0.00 0.00 39.78 40.36 3hvy n ASN 211 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 3hvy n VAL 212 N -2.54 1.60 -2.49 2.41 3.14 -1.26 -4.90 118.33 114.30 3hvy n VAL 212 Ca -0.24 -0.40 -0.42 0.00 -2.96 0.00 0.00 64.34 60.32 3hvy n VAL 212 Cb 0.97 -1.36 -0.03 0.00 -1.06 0.00 0.00 33.84 32.36 3hvy n VAL 212 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 3hvy s ILE 213 N -0.71 4.31 -0.32 1.55 1.01 -0.53 -4.91 121.20 121.60 3hvy s ILE 213 Ca 0.61 1.63 -0.08 0.00 0.00 0.00 0.00 60.65 62.81 3hvy s ILE 213 Cb -0.64 -4.05 0.01 0.00 0.01 0.00 0.00 42.46 37.79 3hvy s ILE 213 CO 0.57 0.01 0.13 -0.69 0.00 0.00 0.00 174.94 174.96 3hvy s VAL 214 N 2.08 4.23 -0.15 2.92 1.01 -1.26 0.09 120.40 129.32 3hvy s VAL 214 Ca 0.55 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 3hvy s VAL 214 Cb -0.24 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 3hvy s VAL 214 CO 0.22 -0.02 0.05 0.12 0.00 0.00 0.00 175.10 175.47 3hvy s PHE 215 N 1.53 3.25 -0.16 5.22 5.36 0.34 -0.58 117.98 132.93 3hvy s PHE 215 Ca 0.02 0.11 0.01 0.00 -0.96 0.00 0.00 56.93 56.12 3hvy s PHE 215 Cb -0.18 -1.99 0.02 0.00 -0.34 0.00 0.00 43.02 40.53 3hvy s PHE 215 CO 0.04 0.27 -0.17 0.08 -1.46 0.00 0.00 175.22 173.98 3hvy s VAL 216 N -0.05 1.83 -0.35 3.12 1.01 -0.52 -0.92 120.40 124.51 3hvy s VAL 216 Ca 0.06 -0.80 -0.29 0.00 0.00 0.00 0.00 61.98 60.95 3hvy s VAL 216 Cb -0.12 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 3hvy s VAL 216 CO 0.01 0.50 1.61 -0.62 0.00 0.00 0.00 175.10 176.60 3hvy s ASP 217 N 1.37 6.15 0.00 3.32 -1.08 -0.25 -2.72 116.67 123.46 3hvy s ASP 217 Ca 0.05 1.14 0.25 0.00 -0.52 0.00 0.00 52.55 53.46 3hvy s ASP 217 Cb -0.13 -2.53 0.51 0.00 -1.46 0.00 0.00 42.92 39.31 3hvy s ASP 217 CO -0.12 -1.53 1.44 -3.20 0.52 0.00 0.00 175.17 172.29 3hvy n ASN 218 N 9.40 2.53 -4.54 -0.34 5.15 -0.55 -2.05 115.26 124.86 3hvy n ASN 218 Ca 0.20 -1.83 -0.46 0.00 -0.60 0.00 0.00 54.58 51.88 3hvy n ASN 218 Cb 0.47 -0.04 -0.02 0.00 -0.53 0.00 0.00 39.78 39.66 3hvy n ASN 218 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hvy n TYR 220 N 0.26 0.00 0.72 0.00 4.01 -1.26 -4.42 117.16 116.46 3hvy n TYR 220 Ca 0.12 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.95 3hvy n TYR 220 Cb 0.29 -0.50 -0.11 0.00 -0.31 0.00 0.00 39.34 38.71 3hvy n TYR 220 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hvy n GLY 221 N -2.00 -0.76 3.73 2.72 0.00 -0.34 -2.92 105.19 105.61 3hvy n GLY 221 Ca 0.00 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 3hvy n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hvy s GLU 222 N -2.84 4.15 -0.19 1.61 8.01 -1.25 -2.28 118.70 125.91 3hvy s GLU 222 Ca 0.05 2.54 0.00 0.00 0.01 0.00 0.00 54.97 57.56 3hvy s GLU 222 Cb 0.14 -3.08 0.00 0.00 -4.31 0.00 0.00 34.13 26.88 3hvy s GLU 222 CO 0.76 -0.68 0.00 1.19 0.01 0.00 0.00 175.26 176.55 3hvy n PHE 223 N 3.42 0.00 0.10 1.61 3.72 -1.26 -4.81 117.46 120.25 3hvy n PHE 223 Ca 0.13 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.37 3hvy n PHE 223 Cb 0.37 -1.73 -0.14 0.00 -0.94 0.00 0.00 39.48 37.03 3hvy n PHE 223 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3hvy h VAL 224 N 0.00 1.51 -0.60 -4.37 2.07 -1.73 -3.45 116.25 109.68 3hvy h VAL 224 Ca -0.04 -3.08 -0.59 0.00 0.82 0.00 0.00 66.70 63.81 3hvy h VAL 224 Cb 0.83 2.94 -0.06 0.00 -1.52 0.00 0.00 31.29 33.48 3hvy h VAL 224 CO 0.05 0.90 -0.33 -1.61 0.02 0.00 0.00 177.57 176.60 3hvy s GLU 225 N -2.66 2.25 0.14 1.57 2.02 -1.26 -4.87 118.70 115.90 3hvy s GLU 225 Ca -0.04 -2.04 0.25 0.00 0.02 0.00 0.00 54.97 53.16 3hvy s GLU 225 Cb 0.07 -2.04 0.46 0.00 0.10 0.00 0.00 34.13 32.72 3hvy s GLU 225 CO 0.88 -0.57 1.44 -0.85 0.02 0.00 0.00 175.26 176.18 3hvy n GLU 226 N -1.69 0.28 -4.49 1.61 0.00 -1.26 -4.86 120.64 110.24 3hvy n GLU 226 Ca -0.03 0.12 -0.25 0.00 0.00 0.00 0.00 57.16 57.00 3hvy n GLU 226 Cb 0.64 -1.72 -0.10 0.00 0.00 0.00 0.00 31.44 30.27 3hvy n GLU 226 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 3hvy s LYS 227 N -3.15 1.78 0.34 3.44 1.02 -1.26 -4.96 119.74 116.95 3hvy s LYS 227 Ca 0.07 -1.83 0.08 0.00 0.02 0.00 0.00 55.97 54.32 3hvy s LYS 227 Cb 0.13 -1.77 -0.07 0.00 -0.52 0.00 0.00 37.83 35.61 3hvy s LYS 227 CO 0.69 0.24 -0.07 -1.21 -0.92 0.00 0.00 175.35 174.09 3hvy s GLU 228 N -3.57 1.79 0.54 1.68 0.41 -1.26 -4.90 118.70 113.39 3hvy s GLU 228 Ca 0.31 -1.94 0.20 0.00 -0.41 0.00 0.00 54.97 53.14 3hvy s GLU 228 Cb -0.02 -1.56 1.43 0.00 -1.78 0.00 0.00 34.13 32.20 3hvy s GLU 228 CO 0.16 0.08 2.18 -1.35 -0.49 0.00 0.00 175.26 175.83 3hvy h PRO 229 N 2.03 0.00 0.00 0.39 0.11 -1.95 0.13 132.00 132.71 3hvy h PRO 229 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3hvy h PRO 229 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3hvy h PRO 229 CO 0.72 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 180.30 3hvy h THR 230 N 0.00 0.00 0.00 -1.15 1.35 -1.82 -1.56 112.91 109.73 3hvy h THR 230 Ca 0.01 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 3hvy h THR 230 Cb 0.03 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.44 3hvy h THR 230 CO -0.00 0.00 -0.05 0.47 -0.25 0.00 0.00 175.52 175.69 3hvy n ASP 231 N -2.71 0.37 -0.99 5.36 8.00 0.46 -4.06 116.55 122.97 3hvy n ASP 231 Ca -0.01 0.47 0.05 0.00 0.71 0.00 0.00 54.79 56.02 3hvy n ASP 231 Cb 0.15 -0.55 0.13 0.00 -0.02 0.00 0.00 41.12 40.84 3hvy n ASP 231 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3hvy n VAL 232 N -1.82 1.29 0.00 2.53 0.24 -0.66 -4.98 118.33 114.93 3hvy n VAL 232 Ca 0.06 -2.32 0.00 0.00 -2.04 0.00 0.00 64.34 60.04 3hvy n VAL 232 Cb 0.38 0.28 0.00 0.00 -1.47 0.00 0.00 33.84 33.02 3hvy n VAL 232 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hvy n GLY 233 N -0.44 0.69 3.77 7.63 0.00 -1.18 -4.51 105.19 111.15 3hvy n GLY 233 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3hvy n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvy s ALA 234 N -2.00 3.55 -0.07 4.61 0.00 -0.79 -4.87 121.76 122.20 3hvy s ALA 234 Ca 0.00 1.39 0.14 0.00 0.00 0.00 0.00 51.96 53.49 3hvy s ALA 234 Cb 0.00 -3.54 -0.13 0.00 0.00 0.00 0.00 23.12 19.44 3hvy s ALA 234 CO 0.00 -0.81 0.98 -0.44 0.00 0.00 0.00 175.76 175.48 3hvy h ASP 235 N 3.56 0.00 -3.84 0.00 3.32 -1.19 -3.42 116.42 114.85 3hvy h ASP 235 Ca -0.49 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.55 3hvy h ASP 235 Cb 1.23 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.55 3hvy h ASP 235 CO 0.67 0.74 0.25 -0.51 -1.72 0.00 0.00 179.24 178.67 3hvy s ILE 236 N -2.81 0.00 0.16 0.35 2.07 -1.07 -1.26 121.20 118.63 3hvy s ILE 236 Ca -0.01 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.25 3hvy s ILE 236 Cb 0.08 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.63 3hvy s ILE 236 CO 0.80 0.00 -0.02 0.27 -1.91 0.00 0.00 174.94 174.08 3hvy s ILE 237 N 0.15 0.72 0.06 2.00 -4.36 0.28 -1.44 121.20 118.61 3hvy s ILE 237 Ca 0.00 -1.98 -0.11 0.00 -0.26 0.00 0.00 60.65 58.30 3hvy s ILE 237 Cb -0.04 -2.01 0.01 0.00 1.25 0.00 0.00 42.46 41.66 3hvy s ILE 237 CO -0.00 -0.58 0.24 0.00 0.24 0.00 0.00 174.94 174.84 3hvy s ALA 238 N -3.62 -0.47 0.13 2.27 0.00 -1.10 -1.61 121.76 117.35 3hvy s ALA 238 Ca 0.21 -0.26 -0.14 0.00 0.00 0.00 0.00 51.96 51.77 3hvy s ALA 238 Cb 0.06 0.37 0.05 0.00 0.00 0.00 0.00 23.12 23.60 3hvy s ALA 238 CO 0.02 -0.44 0.65 0.41 0.00 0.00 0.00 175.76 176.41 3hvy n GLY 239 N 0.40 0.88 3.67 0.00 0.00 -0.62 -1.49 105.19 108.04 3hvy n GLY 239 Ca -0.18 -1.07 -0.35 0.00 0.00 0.00 0.00 46.02 44.42 3hvy n GLY 239 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hvy s SER 240 N -2.56 5.23 0.00 1.61 0.15 -1.26 -1.32 113.70 115.55 3hvy s SER 240 Ca 0.14 0.13 0.29 0.00 0.70 0.00 0.00 55.95 57.21 3hvy s SER 240 Cb -0.02 -1.52 1.25 0.00 -1.71 0.00 0.00 66.02 64.02 3hvy s SER 240 CO 0.04 0.36 1.92 0.18 1.20 0.00 0.00 173.24 176.94 3hvy n LEU 241 N 2.29 0.03 -1.15 3.45 4.77 -0.34 -2.99 117.00 123.05 3hvy n LEU 241 Ca -0.18 0.45 0.11 0.00 -0.03 0.00 0.00 56.01 56.35 3hvy n LEU 241 Cb 0.53 -0.46 0.28 0.00 -2.33 0.00 0.00 43.42 41.44 3hvy n LEU 241 CO 0.29 0.01 0.74 2.30 -1.33 0.00 0.00 177.39 179.39 3hvy n ILE 242 N -1.47 0.75 0.00 -0.08 -5.35 -1.26 -2.76 119.36 109.19 3hvy n ILE 242 Ca 0.08 -0.81 0.00 0.00 -0.27 0.00 0.00 62.75 61.75 3hvy n ILE 242 Cb 0.33 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 38.77 3hvy n ILE 242 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3hvy n LYS 243 N 1.35 0.00 0.00 6.28 5.02 -1.16 -2.26 118.16 127.39 3hvy n LYS 243 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 3hvy n LYS 243 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.56 3hvy n LYS 243 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3hvy n ASN 244 N 0.00 0.00 0.10 4.39 4.13 -1.26 -5.71 115.26 116.91 3hvy n ASN 244 Ca 0.00 0.00 0.12 0.00 1.68 0.00 0.00 54.58 56.38 3hvy n ASN 244 Cb 0.00 0.00 0.46 0.00 -1.54 0.00 0.00 39.78 38.70 3hvy n ASN 244 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3hvy n ILE 245 N 0.00 0.76 1.41 2.41 3.06 -1.26 -1.60 119.36 124.14 3hvy n ILE 245 Ca 0.00 0.12 0.14 0.00 -2.50 0.00 0.00 62.75 60.51 3hvy n ILE 245 Cb 0.00 -0.99 0.67 0.00 0.54 0.00 0.00 39.64 39.86 3hvy n ILE 245 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3hvy n GLY 246 N 0.34 -1.12 2.60 4.50 0.00 -1.11 -3.84 105.19 106.56 3hvy n GLY 246 Ca 0.03 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 3hvy n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hvy n GLY 247 N 1.29 1.43 2.81 -0.02 0.00 -0.63 -1.26 105.19 108.81 3hvy n GLY 247 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3hvy n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hvy n GLY 248 N -0.46 1.79 0.11 -0.02 0.00 -1.26 -4.77 105.19 100.58 3hvy n GLY 248 Ca -0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 3hvy n GLY 248 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hvy n ILE 249 N -2.00 1.31 -1.75 -0.61 5.41 -0.39 -4.94 119.36 116.40 3hvy n ILE 249 Ca 0.00 -0.57 -0.42 0.00 1.00 0.00 0.00 62.75 62.77 3hvy n ILE 249 Cb 0.00 -1.14 -0.00 0.00 -0.71 0.00 0.00 39.64 37.79 3hvy n ILE 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hvy n ALA 250 N -3.06 1.97 0.21 -1.39 0.00 -0.96 -4.93 120.51 112.35 3hvy n ALA 250 Ca -0.38 0.35 0.10 0.00 0.00 0.00 0.00 53.44 53.51 3hvy n ALA 250 Cb 0.97 -2.36 -0.15 0.00 0.00 0.00 0.00 19.45 17.91 3hvy n ALA 250 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3hvy n THR 251 N 0.41 0.00 -3.92 0.00 -2.24 -1.26 -4.74 114.28 102.53 3hvy n THR 251 Ca 0.03 -0.38 -0.01 0.00 -2.27 0.00 0.00 64.05 61.42 3hvy n THR 251 Cb 0.38 0.24 0.02 0.00 -2.10 0.00 0.00 70.33 68.86 3hvy n THR 251 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3hvy s THR 252 N -3.35 0.00 0.00 4.28 -1.32 -1.26 -4.85 115.64 109.14 3hvy s THR 252 Ca -0.04 -0.40 0.00 0.00 -1.21 0.00 0.00 61.69 60.04 3hvy s THR 252 Cb 0.14 -2.89 0.00 0.00 -1.51 0.00 0.00 72.50 68.24 3hvy s THR 252 CO 0.87 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.89 3hvy n GLY 253 N -0.78 -1.36 3.79 6.08 0.00 -1.14 -4.66 105.19 107.12 3hvy n GLY 253 Ca -0.00 -2.24 -0.09 0.00 0.00 0.00 0.00 46.02 43.69 3hvy n GLY 253 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hvy s GLY 254 N 0.00 0.43 0.03 -0.02 0.00 -0.74 -1.20 107.32 105.81 3hvy s GLY 254 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 43.93 3hvy s GLY 254 CO 0.00 -0.35 -0.03 -2.52 0.00 0.00 0.00 173.10 170.20 3hvy s TYR 255 N -2.43 0.33 -0.04 1.90 1.13 -0.44 -1.85 117.35 115.95 3hvy s TYR 255 Ca 0.16 -0.58 0.03 0.00 -1.41 0.00 0.00 57.07 55.27 3hvy s TYR 255 Cb -0.05 -0.23 0.00 0.00 -1.10 0.00 0.00 41.96 40.58 3hvy s TYR 255 CO 0.12 -0.20 -0.13 0.42 -2.51 0.00 0.00 175.55 173.25 3hvy s ILE 256 N -1.71 1.09 0.00 -3.49 1.01 -0.28 -1.58 121.20 116.24 3hvy s ILE 256 Ca -0.13 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 59.98 3hvy s ILE 256 Cb -0.08 -0.96 -0.01 0.00 0.01 0.00 0.00 42.46 41.42 3hvy s ILE 256 CO -0.02 0.33 0.05 0.00 0.00 0.00 0.00 174.94 175.31 3hvy s ALA 257 N 0.26 -0.11 0.00 9.38 0.00 -0.63 -0.10 121.76 130.56 3hvy s ALA 257 Ca -0.06 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 51.67 3hvy s ALA 257 Cb -0.11 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.08 3hvy s ALA 257 CO 0.02 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.04 3hvy n GLY 258 N 1.90 0.16 3.75 0.00 0.00 -0.42 -0.56 105.19 110.02 3hvy n GLY 258 Ca -0.21 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 3hvy n GLY 258 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hvy n LYS 259 N 0.00 2.52 -0.22 1.61 5.02 -0.39 -1.14 118.16 125.56 3hvy n LYS 259 Ca 0.00 0.88 0.01 0.00 -2.02 0.00 0.00 58.31 57.18 3hvy n LYS 259 Cb 0.00 -2.58 0.12 0.00 -0.02 0.00 0.00 35.03 32.56 3hvy n LYS 259 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3hvy h GLU 260 N 3.01 0.45 -0.45 1.97 4.22 -1.90 -0.53 114.58 121.34 3hvy h GLU 260 Ca -0.49 -0.03 0.09 0.00 0.08 0.00 0.00 59.36 59.02 3hvy h GLU 260 Cb 1.25 -0.10 -0.09 0.00 0.50 0.00 0.00 28.75 30.31 3hvy h GLU 260 CO 0.65 0.30 -0.18 1.49 -2.18 0.00 0.00 179.01 179.08 3hvy h GLU 261 N 0.47 -0.08 0.05 1.92 4.81 -1.98 0.23 114.58 119.99 3hvy h GLU 261 Ca 0.33 0.01 -0.25 0.00 -0.13 0.00 0.00 59.36 59.32 3hvy h GLU 261 Cb 0.40 0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.81 3hvy h GLU 261 CO -0.31 -0.06 -1.05 1.88 -0.73 0.00 0.00 179.01 178.74 3hvy h TYR 262 N -0.09 0.66 -0.36 0.92 0.05 -1.63 -2.54 116.97 113.98 3hvy h TYR 262 Ca 0.22 -0.39 -0.07 0.00 0.05 0.00 0.00 58.73 58.54 3hvy h TYR 262 Cb 0.42 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.09 3hvy h TYR 262 CO -0.45 1.23 -0.03 0.28 -1.05 0.00 0.00 178.16 178.14 3hvy h VAL 263 N 0.21 1.27 -0.79 -2.88 2.07 -0.98 -2.34 116.25 112.81 3hvy h VAL 263 Ca -0.11 -1.05 0.03 0.00 0.82 0.00 0.00 66.70 66.39 3hvy h VAL 263 Cb 1.72 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 32.67 3hvy h VAL 263 CO 0.18 0.35 0.51 0.74 0.02 0.00 0.00 177.57 179.37 3hvy h THR 264 N 0.46 1.13 -0.62 2.57 2.02 -0.53 -1.75 112.91 116.20 3hvy h THR 264 Ca 0.10 -0.34 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 3hvy h THR 264 Cb 0.51 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 3hvy h THR 264 CO 0.03 0.18 0.16 1.56 0.37 0.00 0.00 175.52 177.82 3hvy h GLN 265 N 1.00 0.96 -0.86 6.66 1.08 -1.36 -1.80 115.11 120.79 3hvy h GLN 265 Ca 0.31 -0.21 0.03 0.00 -1.45 0.00 0.00 58.65 57.33 3hvy h GLN 265 Cb -0.01 -0.14 -0.05 0.00 -0.05 0.00 0.00 27.48 27.23 3hvy h GLN 265 CO -0.11 0.85 0.57 0.00 -0.95 0.00 0.00 178.83 179.19 3hvy h ALA 266 N 1.25 1.45 -0.18 3.87 0.00 -0.81 -2.64 119.26 122.19 3hvy h ALA 266 Ca 0.20 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3hvy h ALA 266 Cb 0.31 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3hvy h ALA 266 CO -0.00 0.48 -0.12 1.79 0.00 0.00 0.00 179.25 181.40 3hvy h THR 267 N 1.09 1.19 0.00 0.00 1.35 -0.50 -1.29 112.91 114.75 3hvy h THR 267 Ca 0.34 -0.82 -0.02 0.00 -0.55 0.00 0.00 66.41 65.35 3hvy h THR 267 Cb -0.01 1.19 -0.00 0.00 -1.73 0.00 0.00 68.15 67.59 3hvy h THR 267 CO -0.09 0.26 -0.09 -0.26 -0.25 0.00 0.00 175.52 175.09 3hvy h PHE 268 N 0.28 0.00 0.13 4.73 0.04 -1.28 -0.70 116.94 120.14 3hvy h PHE 268 Ca 0.06 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.52 3hvy h PHE 268 Cb 0.39 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.54 3hvy h PHE 268 CO 0.01 0.09 -1.52 -0.09 -0.60 0.00 0.00 178.31 176.20 3hvy h ARG 269 N 0.00 0.28 -0.46 1.51 9.65 -1.26 -3.13 114.38 120.97 3hvy h ARG 269 Ca -0.00 -0.48 -0.10 0.00 -1.10 0.00 0.00 59.98 58.30 3hvy h ARG 269 Cb 0.41 0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.16 3hvy h ARG 269 CO 0.01 1.16 -0.10 0.28 2.80 0.00 0.00 179.97 184.12 3hvy h VAL 270 N 0.08 1.27 0.00 0.20 2.07 -0.92 -3.43 116.25 115.52 3hvy h VAL 270 Ca -0.24 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.06 3hvy h VAL 270 Cb 2.03 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.90 3hvy h VAL 270 CO 0.17 0.42 0.00 0.35 0.02 0.00 0.00 177.57 178.53 3hvy n THR 271 N -4.25 0.00 -3.83 2.57 -2.24 -0.31 -5.10 114.28 101.12 3hvy n THR 271 Ca -0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3hvy n THR 271 Cb 0.38 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.53 3hvy n THR 271 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3hvy s VAL 272 N 1.62 0.12 0.35 2.28 -7.23 -1.19 -4.92 120.40 111.44 3hvy s VAL 272 Ca 0.00 -0.96 -0.26 0.00 -1.81 0.00 0.00 61.98 58.96 3hvy s VAL 272 Cb 0.00 -1.06 -0.13 0.00 0.56 0.00 0.00 36.38 35.75 3hvy s VAL 272 CO 0.00 -0.53 0.86 -2.65 -0.31 0.00 0.00 175.10 172.47 3hvy n PRO 273 N 0.41 1.07 0.00 4.82 -0.02 -1.19 -1.64 135.00 138.44 3hvy n PRO 273 Ca -0.17 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3hvy n PRO 273 Cb 0.60 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 3hvy n PRO 273 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hvy n GLY 274 N 1.40 2.96 0.35 -1.23 0.00 -1.26 -4.74 105.19 102.67 3hvy n GLY 274 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 3hvy n GLY 274 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hvy n ILE 275 N -1.46 1.29 -1.40 -0.61 5.41 -0.65 -5.03 119.36 116.90 3hvy n ILE 275 Ca 0.00 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.72 3hvy n ILE 275 Cb 0.00 -1.97 0.00 0.00 -0.71 0.00 0.00 39.64 36.96 3hvy n ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3hvy n GLY 276 N 1.85 3.43 0.98 7.39 0.00 -0.77 -2.12 105.19 115.94 3hvy n GLY 276 Ca -0.25 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.69 3hvy n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hvy n GLY 277 N 0.00 1.44 0.26 -0.02 0.00 -1.26 -4.23 105.19 101.38 3hvy n GLY 277 Ca 0.00 -0.59 0.16 0.00 0.00 0.00 0.00 46.02 45.58 3hvy n GLY 277 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hvy h GLU 278 N 3.25 0.00 -6.62 1.61 4.39 -1.83 -3.43 114.58 111.95 3hvy h GLU 278 Ca 0.00 0.00 -0.65 0.00 0.34 0.00 0.00 59.36 59.05 3hvy h GLU 278 Cb 0.74 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.18 3hvy h GLU 278 CO 0.00 0.00 -0.84 0.00 -1.16 0.00 0.00 179.01 177.01 3hvy n GLY 280 N 0.62 1.23 3.70 0.00 0.00 0.17 -4.96 105.19 105.94 3hvy n GLY 280 Ca -0.16 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 3hvy n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hvy s SER 281 N 0.00 3.21 -0.09 1.61 1.04 -1.24 -4.72 113.70 113.51 3hvy s SER 281 Ca 0.00 1.49 0.12 0.00 0.48 0.00 0.00 55.95 58.04 3hvy s SER 281 Cb 0.00 -2.16 0.23 0.00 0.10 0.00 0.00 66.02 64.18 3hvy s SER 281 CO 0.00 -2.80 1.11 0.35 0.98 0.00 0.00 173.24 172.88 3hvy n THR 282 N -3.99 1.15 -1.66 2.02 -2.24 -1.26 -4.99 114.28 103.31 3hvy n THR 282 Ca 0.07 -1.55 -0.17 0.00 -2.27 0.00 0.00 64.05 60.13 3hvy n THR 282 Cb 0.55 0.11 -0.06 0.00 -2.10 0.00 0.00 70.33 68.83 3hvy n THR 282 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3hvy n PHE 283 N -0.76 -0.36 -1.15 4.78 3.72 -1.26 -1.77 117.46 120.66 3hvy n PHE 283 Ca 0.10 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.45 3hvy n PHE 283 Cb 0.71 -3.10 -0.02 0.00 -0.94 0.00 0.00 39.48 36.13 3hvy n PHE 283 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hvy n GLY 284 N -0.42 0.76 2.88 1.37 0.00 -1.26 -5.02 105.19 103.50 3hvy n GLY 284 Ca -0.18 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 3hvy n GLY 284 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hvy n VAL 285 N -2.75 4.25 0.00 1.61 0.24 -0.73 -4.78 118.33 116.17 3hvy n VAL 285 Ca -0.05 -4.27 0.00 0.00 -2.04 0.00 0.00 64.34 57.98 3hvy n VAL 285 Cb 0.22 -2.39 0.00 0.00 -1.47 0.00 0.00 33.84 30.20 3hvy n VAL 285 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3hvy n ARG 287 N 4.18 0.00 -0.03 7.34 0.63 -1.26 -1.90 116.66 125.62 3hvy n ARG 287 Ca 0.41 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 57.33 3hvy n ARG 287 Cb 0.37 0.00 0.27 0.00 0.45 0.00 0.00 32.46 33.55 3hvy n ARG 287 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3hvy h SER 288 N 0.00 0.56 0.09 6.15 4.64 -1.95 0.34 113.55 123.38 3hvy h SER 288 Ca 0.00 -0.11 -0.16 0.00 -0.47 0.00 0.00 61.79 61.05 3hvy h SER 288 Cb 0.00 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 3hvy h SER 288 CO 0.00 0.61 -0.59 -0.07 -0.87 0.00 0.00 176.83 175.91 3hvy h LEU 289 N 0.58 0.57 -0.23 5.97 3.38 -1.74 -0.73 115.31 123.12 3hvy h LEU 289 Ca 0.12 -0.32 -0.11 0.00 0.09 0.00 0.00 57.88 57.67 3hvy h LEU 289 Cb 0.33 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3hvy h LEU 289 CO 0.01 1.03 -0.28 1.88 0.09 0.00 0.00 178.44 181.18 3hvy h TYR 290 N 0.38 0.72 -0.26 1.13 0.05 -1.75 -1.97 116.97 115.27 3hvy h TYR 290 Ca -0.00 -0.23 -0.15 0.00 0.05 0.00 0.00 58.73 58.40 3hvy h TYR 290 Cb 1.14 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.72 3hvy h TYR 290 CO 0.04 0.94 -0.44 1.49 -1.05 0.00 0.00 178.16 179.15 3hvy h GLU 291 N 0.28 0.64 -0.79 4.88 4.81 -0.93 -1.79 114.58 121.69 3hvy h GLU 291 Ca 0.03 -0.35 -0.01 0.00 -0.13 0.00 0.00 59.36 58.90 3hvy h GLU 291 Cb 0.85 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.21 3hvy h GLU 291 CO 0.07 0.96 0.46 0.78 -0.73 0.00 0.00 179.01 180.54 3hvy h GLY 292 N 0.99 1.16 1.00 1.92 0.00 -1.12 -2.22 103.07 104.80 3hvy h GLY 292 Ca 0.04 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 3hvy h GLY 292 CO 0.09 0.48 0.26 -2.00 0.00 0.00 0.00 176.54 175.37 3hvy h LEU 293 N 1.08 0.84 -1.39 3.11 5.85 -1.08 -0.63 115.31 123.09 3hvy h LEU 293 Ca 0.28 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.84 3hvy h LEU 293 Cb -0.01 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.80 3hvy h LEU 293 CO -0.05 0.77 0.00 0.33 -0.34 0.00 0.00 178.44 179.15 3hvy n PHE 294 N -4.46 0.00 0.00 1.25 7.35 -0.70 -4.28 117.46 116.63 3hvy n PHE 294 Ca 0.04 -0.02 0.00 0.00 -0.76 0.00 0.00 57.45 56.71 3hvy n PHE 294 Cb 0.15 -0.05 0.00 0.00 0.35 0.00 0.00 39.48 39.93 3hvy n PHE 294 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3hvy n ALA 296 N 0.65 0.00 -0.34 3.13 0.00 -0.26 -4.71 120.51 118.99 3hvy n ALA 296 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3hvy n ALA 296 Cb 0.03 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.74 3hvy n ALA 296 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3hvy h PRO 297 N 0.00 0.81 0.15 0.00 0.11 -1.88 0.03 132.00 131.22 3hvy h PRO 297 Ca 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 3hvy h PRO 297 Cb 0.00 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 30.93 3hvy h PRO 297 CO 0.00 0.54 -0.07 1.25 -0.21 0.00 0.00 178.00 179.50 3hvy h HIS 298 N 0.83 -0.19 -0.83 0.65 -0.00 -1.89 -3.00 115.15 110.73 3hvy h HIS 298 Ca 0.51 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.84 3hvy h HIS 298 Cb 0.63 0.06 -0.04 0.00 -0.00 0.00 0.00 27.41 28.07 3hvy h HIS 298 CO -0.03 0.23 0.39 0.28 -0.00 0.00 0.00 177.93 178.81 3hvy h VAL 299 N -0.71 1.26 -0.78 5.26 2.07 -1.86 -1.36 116.25 120.13 3hvy h VAL 299 Ca -0.02 -0.73 0.06 0.00 0.82 0.00 0.00 66.70 66.83 3hvy h VAL 299 Cb 0.51 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 30.42 3hvy h VAL 299 CO 0.03 0.31 0.46 0.74 0.02 0.00 0.00 177.57 179.14 3hvy h THR 300 N 1.18 1.01 0.00 2.57 2.02 -1.06 -2.00 112.91 116.63 3hvy h THR 300 Ca 0.28 -0.29 -0.11 0.00 0.77 0.00 0.00 66.41 67.06 3hvy h THR 300 Cb 0.13 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.61 3hvy h THR 300 CO -0.03 0.15 -0.55 0.40 0.37 0.00 0.00 175.52 175.86 3hvy h ILE 301 N 0.85 1.22 -0.72 3.11 1.08 -1.22 0.21 117.51 122.04 3hvy h ILE 301 Ca 0.34 -1.99 0.00 0.00 -0.39 0.00 0.00 64.86 62.83 3hvy h ILE 301 Cb 0.18 2.12 -0.04 0.00 -3.07 0.00 0.00 36.82 36.02 3hvy h ILE 301 CO -0.18 0.54 0.46 -0.33 -0.69 0.00 0.00 178.15 177.95 3hvy h GLU 302 N 0.00 0.96 -0.49 2.37 4.39 -0.58 -0.00 114.58 121.23 3hvy h GLU 302 Ca -0.01 -0.07 -0.12 0.00 0.34 0.00 0.00 59.36 59.50 3hvy h GLU 302 Cb 1.08 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 3hvy h GLU 302 CO 0.07 0.65 -0.17 0.00 -1.16 0.00 0.00 179.01 178.41 3hvy h ALA 303 N 1.25 0.68 -0.80 3.43 0.00 -0.85 -1.55 119.26 121.42 3hvy h ALA 303 Ca 0.26 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.81 3hvy h ALA 303 Cb -0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 3hvy h ALA 303 CO -0.05 0.63 0.52 0.28 0.00 0.00 0.00 179.25 180.63 3hvy h VAL 304 N 0.83 1.21 -0.67 0.00 2.07 -0.59 -1.57 116.25 117.53 3hvy h VAL 304 Ca 0.12 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 3hvy h VAL 304 Cb 0.74 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 3hvy h VAL 304 CO 0.06 0.20 0.26 0.11 0.02 0.00 0.00 177.57 178.22 3hvy h LYS 305 N 1.09 1.01 -0.34 1.57 1.57 -0.81 -0.76 116.57 119.89 3hvy h LYS 305 Ca 0.29 -0.19 0.02 0.00 -1.87 0.00 0.00 60.65 58.90 3hvy h LYS 305 Cb -0.11 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.01 3hvy h LYS 305 CO -0.06 0.85 0.19 0.78 -0.57 0.00 0.00 179.45 180.64 3hvy h GLY 306 N 0.96 0.47 1.00 3.86 0.00 -0.86 0.33 103.07 108.82 3hvy h GLY 306 Ca 0.22 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.41 3hvy h GLY 306 CO -0.02 0.13 0.22 0.00 0.00 0.00 0.00 176.54 176.87 3hvy h ALA 307 N 1.16 0.42 -0.36 3.60 0.00 -0.85 0.60 119.26 123.83 3hvy h ALA 307 Ca 0.14 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3hvy h ALA 307 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hvy h ALA 307 CO -0.07 -0.12 -0.02 0.28 0.00 0.00 0.00 179.25 179.32 3hvy h VAL 308 N 0.45 1.26 -0.11 0.00 2.07 -0.98 0.11 116.25 119.05 3hvy h VAL 308 Ca 0.12 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 3hvy h VAL 308 Cb -0.05 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3hvy h VAL 308 CO -0.03 0.34 0.07 0.15 0.02 0.00 0.00 177.57 178.12 3hvy h PHE 309 N 0.46 0.15 -0.70 1.57 3.57 -0.23 -2.26 116.94 119.49 3hvy h PHE 309 Ca 0.10 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.74 3hvy h PHE 309 Cb 0.49 -0.05 -0.10 0.00 2.79 0.00 0.00 35.95 39.09 3hvy h PHE 309 CO 0.04 0.13 0.21 0.00 -2.23 0.00 0.00 178.31 176.46 3hvy h ALA 311 N 1.54 0.61 -0.02 0.00 0.00 -0.58 -3.08 119.26 117.75 3hvy h ALA 311 Ca 0.38 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 3hvy h ALA 311 Cb 0.60 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3hvy h ALA 311 CO -0.43 -0.09 -0.05 -0.09 0.00 0.00 0.00 179.25 178.59 3hvy h ARG 312 N 0.50 0.06 -1.12 0.00 9.65 -0.84 -1.29 114.38 121.34 3hvy h ARG 312 Ca 0.21 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.04 3hvy h ARG 312 Cb 0.10 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.68 3hvy h ARG 312 CO -0.13 0.65 0.00 1.51 2.80 0.00 0.00 179.97 184.80 3hvy n ILE 313 N -4.74 0.06 0.00 1.20 3.06 -0.36 -0.28 119.36 118.29 3hvy n ILE 313 Ca -0.09 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.16 3hvy n ILE 313 Cb 0.33 -0.33 0.00 0.00 0.54 0.00 0.00 39.64 40.18 3hvy n ILE 313 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 3hvy n GLU 315 N 0.73 0.00 0.19 9.51 2.13 -0.49 -0.63 120.64 132.09 3hvy n GLU 315 Ca 0.00 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.89 3hvy n GLU 315 Cb 0.04 0.00 0.56 0.00 0.27 0.00 0.00 31.44 32.31 3hvy n GLU 315 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3hvy h LEU 316 N 0.00 0.12 0.00 4.31 3.38 -0.90 -0.69 115.31 121.53 3hvy h LEU 316 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hvy h LEU 316 Cb 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3hvy h LEU 316 CO 0.00 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.65 3hvy n ALA 317 N -2.52 2.48 0.00 1.53 0.00 0.20 -4.88 120.51 117.32 3hvy n ALA 317 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3hvy n ALA 317 Cb 0.11 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.11 3hvy n ALA 317 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hvy n GLY 318 N 0.82 1.01 3.91 0.00 0.00 -0.26 -5.10 105.19 105.56 3hvy n GLY 318 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 3hvy n GLY 318 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hvy s PHE 319 N -2.00 3.48 -0.02 1.61 0.08 -1.25 -5.02 117.98 114.86 3hvy s PHE 319 Ca 0.00 0.23 -0.30 0.00 0.12 0.00 0.00 56.93 56.98 3hvy s PHE 319 Cb 0.00 -1.74 -0.03 0.00 -0.57 0.00 0.00 43.02 40.68 3hvy s PHE 319 CO 0.00 0.58 1.09 0.34 -0.10 0.00 0.00 175.22 177.13 3hvy s ASP 320 N -2.52 7.19 0.12 1.36 3.68 -1.26 -4.01 116.67 121.23 3hvy s ASP 320 Ca 0.34 1.75 0.06 0.00 2.13 0.00 0.00 52.55 56.84 3hvy s ASP 320 Cb -0.13 -2.57 -0.04 0.00 -1.45 0.00 0.00 42.92 38.74 3hvy s ASP 320 CO 0.27 -0.43 -0.15 0.68 0.13 0.00 0.00 175.17 175.67 3hvy s VAL 321 N 1.56 1.34 -0.18 1.11 -7.23 -1.26 -0.64 120.40 115.09 3hvy s VAL 321 Ca 0.54 -1.66 -0.08 0.00 -1.81 0.00 0.00 61.98 58.97 3hvy s VAL 321 Cb -0.23 -1.48 0.07 0.00 0.56 0.00 0.00 36.38 35.30 3hvy s VAL 321 CO 0.24 -0.37 0.41 -0.22 -0.31 0.00 0.00 175.10 174.86 3hvy s LEU 322 N -2.33 -0.29 1.01 1.32 0.20 -0.41 -4.39 118.68 113.79 3hvy s LEU 322 Ca 0.07 0.93 -0.13 0.00 0.69 0.00 0.00 54.13 55.69 3hvy s LEU 322 Cb -0.06 1.34 0.19 0.00 -0.43 0.00 0.00 46.19 47.24 3hvy s LEU 322 CO 0.03 -0.21 1.11 -2.84 -0.29 0.00 0.00 176.35 174.15 3hvy s PRO 323 N 1.83 0.32 0.68 0.98 0.02 -1.26 -0.59 135.00 136.98 3hvy s PRO 323 Ca -0.07 0.35 -0.11 0.00 0.02 0.00 0.00 61.00 61.19 3hvy s PRO 323 Cb -0.10 -1.74 0.00 0.00 0.02 0.00 0.00 34.50 32.69 3hvy s PRO 323 CO -0.13 -2.77 1.06 0.15 -0.33 0.00 0.00 177.00 174.98 3hvy s LYS 324 N -5.12 3.03 0.53 5.54 -0.14 -1.26 -4.87 119.74 117.45 3hvy s LYS 324 Ca 0.66 0.95 0.26 0.00 -1.36 0.00 0.00 55.97 56.48 3hvy s LYS 324 Cb -0.16 -2.00 1.41 0.00 -1.68 0.00 0.00 37.83 35.39 3hvy s LYS 324 CO 0.56 -1.03 1.98 0.10 -0.76 0.00 0.00 175.35 176.20 3hvy h TYR 325 N -0.60 0.01 -0.56 3.18 -0.00 -1.83 -1.61 116.97 115.55 3hvy h TYR 325 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.29 3hvy h TYR 325 Cb 1.21 -0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.94 3hvy h TYR 325 CO 0.62 0.00 0.00 0.27 -0.00 0.00 0.00 178.16 179.05 3hvy n ASN 326 N -4.36 3.97 -4.63 0.10 6.94 -1.26 -4.82 115.26 111.20 3hvy n ASN 326 Ca 0.11 -2.25 -0.42 0.00 -0.02 0.00 0.00 54.58 52.01 3hvy n ASN 326 Cb 0.67 -0.46 -0.05 0.00 -2.36 0.00 0.00 39.78 37.58 3hvy n ASN 326 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3hvy s ASP 327 N -1.06 6.76 0.25 0.53 1.01 -0.61 -5.02 116.67 118.53 3hvy s ASP 327 Ca 0.42 0.90 -0.30 0.00 0.71 0.00 0.00 52.55 54.28 3hvy s ASP 327 Cb 0.25 -2.42 -0.11 0.00 1.01 0.00 0.00 42.92 41.66 3hvy s ASP 327 CO 0.23 -0.53 1.54 -0.54 0.21 0.00 0.00 175.17 176.09 3hvy s LYS 328 N 2.84 4.19 0.44 8.23 -0.14 -1.26 -4.81 119.74 129.22 3hvy s LYS 328 Ca 0.33 2.45 -0.08 0.00 -1.36 0.00 0.00 55.97 57.32 3hvy s LYS 328 Cb -0.15 -3.07 -0.05 0.00 -1.68 0.00 0.00 37.83 32.88 3hvy s LYS 328 CO 0.09 -0.56 0.77 1.03 -0.76 0.00 0.00 175.35 175.92 3hvy s ARG 329 N -0.12 3.66 0.00 1.68 1.81 -1.26 -5.00 118.95 119.72 3hvy s ARG 329 Ca 0.64 0.33 0.00 0.00 -1.72 0.00 0.00 55.73 54.98 3hvy s ARG 329 Cb -0.45 -2.39 0.00 0.00 -0.45 0.00 0.00 34.95 31.66 3hvy s ARG 329 CO 0.43 -0.11 0.00 -2.37 -0.68 0.00 0.00 175.30 172.57 3hvy n THR 330 N -1.73 0.00 -4.08 0.02 5.66 -1.26 -4.66 114.28 108.23 3hvy n THR 330 Ca 0.01 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.93 3hvy n THR 330 Cb 0.54 0.33 -0.03 0.00 -1.55 0.00 0.00 70.33 69.62 3hvy n THR 330 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 3hvy n ASP 331 N -1.46 -0.38 -1.27 1.09 5.68 -1.26 -4.36 116.55 114.59 3hvy n ASP 331 Ca 0.00 -2.00 0.11 0.00 -0.50 0.00 0.00 54.79 52.41 3hvy n ASP 331 Cb 0.05 0.84 0.30 0.00 -1.14 0.00 0.00 41.12 41.16 3hvy n ASP 331 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 3hvy n ILE 332 N -0.29 0.94 -3.13 2.12 -5.35 -1.15 -4.91 119.36 107.59 3hvy n ILE 332 Ca 0.03 -0.97 -0.37 0.00 -0.27 0.00 0.00 62.75 61.18 3hvy n ILE 332 Cb 0.28 0.56 -0.06 0.00 -1.74 0.00 0.00 39.64 38.68 3hvy n ILE 332 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3hvy s ILE 333 N -1.05 4.59 -0.07 7.28 -1.09 -1.26 -4.28 121.20 125.32 3hvy s ILE 333 Ca 0.46 1.27 0.02 0.00 -2.23 0.00 0.00 60.65 60.17 3hvy s ILE 333 Cb 0.24 -3.88 0.01 0.00 -1.58 0.00 0.00 42.46 37.25 3hvy s ILE 333 CO 0.32 0.28 -0.13 -1.58 -1.23 0.00 0.00 174.94 172.60 3hvy s GLN 334 N -1.80 1.74 0.02 2.79 2.00 -0.39 -4.73 119.66 119.29 3hvy s GLN 334 Ca 0.40 -0.43 0.02 0.00 -2.00 0.00 0.00 55.36 53.36 3hvy s GLN 334 Cb -0.17 -1.43 -0.04 0.00 0.80 0.00 0.00 33.01 32.17 3hvy s GLN 334 CO 0.21 0.03 -0.00 0.00 -0.50 0.00 0.00 175.29 175.03 3hvy s ALA 335 N 0.66 3.27 -0.05 1.58 0.00 0.24 -1.04 121.76 126.43 3hvy s ALA 335 Ca -0.15 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.83 3hvy s ALA 335 Cb -0.16 -1.29 0.02 0.00 0.00 0.00 0.00 23.12 21.69 3hvy s ALA 335 CO 0.04 0.66 -0.03 0.42 0.00 0.00 0.00 175.76 176.84 3hvy s ILE 336 N -1.13 0.48 -0.44 0.00 1.01 -0.34 -1.29 121.20 119.49 3hvy s ILE 336 Ca 0.21 -0.06 -0.17 0.00 0.00 0.00 0.00 60.65 60.63 3hvy s ILE 336 Cb -0.12 -0.53 0.03 0.00 0.01 0.00 0.00 42.46 41.86 3hvy s ILE 336 CO 0.12 0.22 0.43 -0.75 0.00 0.00 0.00 174.94 174.96 3hvy s LYS 337 N 1.11 3.06 0.12 2.79 2.20 0.19 -0.43 119.74 128.78 3hvy s LYS 337 Ca -0.08 -0.90 0.13 0.00 -0.36 0.00 0.00 55.97 54.75 3hvy s LYS 337 Cb -0.14 -4.01 -0.12 0.00 -1.51 0.00 0.00 37.83 32.06 3hvy s LYS 337 CO -0.01 -0.90 1.11 0.74 -0.36 0.00 0.00 175.35 175.93 3hvy h PHE 338 N 8.74 0.00 -0.86 4.03 0.04 -1.08 -3.35 116.94 124.46 3hvy h PHE 338 Ca -0.27 0.00 -0.37 0.00 2.80 0.00 0.00 57.97 60.13 3hvy h PHE 338 Cb 1.11 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 39.11 3hvy h PHE 338 CO 0.62 0.76 -0.34 0.09 -0.60 0.00 0.00 178.31 178.85 3hvy n ASN 339 N -3.15 -5.44 -3.64 2.17 3.02 0.68 -4.92 115.26 103.98 3hvy n ASN 339 Ca -0.05 0.45 -0.05 0.00 -0.03 0.00 0.00 54.58 54.90 3hvy n ASN 339 Cb 0.88 -4.53 -0.06 0.00 -0.61 0.00 0.00 39.78 35.45 3hvy n ASN 339 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hvy s ASP 340 N -2.72 -0.98 0.12 6.41 2.15 -1.26 -4.94 116.67 115.45 3hvy s ASP 340 Ca 0.00 1.51 -0.17 0.00 0.43 0.00 0.00 52.55 54.32 3hvy s ASP 340 Cb 0.00 1.60 -0.03 0.00 -0.30 0.00 0.00 42.92 44.18 3hvy s ASP 340 CO 0.00 -0.23 1.67 -0.08 -0.17 0.00 0.00 175.17 176.35 3hvy h GLU 341 N 7.21 0.50 -0.57 4.34 4.81 -1.93 -2.31 114.58 126.63 3hvy h GLU 341 Ca -0.27 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 58.79 3hvy h GLU 341 Cb 1.20 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 3hvy h GLU 341 CO 0.15 0.50 0.06 -0.22 -0.73 0.00 0.00 179.01 178.77 3hvy h LYS 342 N 0.40 0.96 -0.62 1.92 3.64 -1.99 -1.76 116.57 119.12 3hvy h LYS 342 Ca 0.11 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 3hvy h LYS 342 Cb 0.18 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 3hvy h LYS 342 CO -0.01 0.93 0.36 0.87 -2.27 0.00 0.00 179.45 179.33 3hvy h LYS 343 N 0.85 0.84 -0.26 1.90 1.57 -1.92 0.04 116.57 119.59 3hvy h LYS 343 Ca 0.17 -0.08 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 3hvy h LYS 343 Cb 0.46 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 3hvy h LYS 343 CO 0.02 0.61 0.03 1.25 -0.57 0.00 0.00 179.45 180.79 3hvy h LEU 344 N 0.83 -0.03 -0.13 2.94 5.85 -1.21 -0.12 115.31 123.44 3hvy h LEU 344 Ca 0.22 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 3hvy h LEU 344 Cb -0.00 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 3hvy h LEU 344 CO -0.04 0.02 -0.00 0.40 -0.34 0.00 0.00 178.44 178.47 3hvy h ILE 345 N 0.12 1.25 -0.92 4.05 2.04 -1.01 -1.78 117.51 121.26 3hvy h ILE 345 Ca 0.12 -0.83 0.06 0.00 1.00 0.00 0.00 64.86 65.22 3hvy h ILE 345 Cb 0.14 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 37.71 3hvy h ILE 345 CO -0.18 0.24 0.60 0.44 0.00 0.00 0.00 178.15 179.25 3hvy h ASP 346 N -0.04 0.93 -0.32 1.72 3.32 -0.89 0.24 116.42 121.37 3hvy h ASP 346 Ca 0.04 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 3hvy h ASP 346 Cb 0.37 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3hvy h ASP 346 CO 0.01 0.60 0.02 0.15 -1.72 0.00 0.00 179.24 178.29 3hvy h PHE 347 N 1.05 0.61 -0.26 4.55 3.57 -0.71 -1.12 116.94 124.64 3hvy h PHE 347 Ca 0.39 -0.10 -0.12 0.00 3.53 0.00 0.00 57.97 61.67 3hvy h PHE 347 Cb 0.19 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 3hvy h PHE 347 CO -0.00 0.67 -0.35 0.82 -2.23 0.00 0.00 178.31 177.22 3hvy h ILE 348 N 0.37 1.29 -0.51 1.41 2.04 -0.47 -2.16 117.51 119.49 3hvy h ILE 348 Ca 0.09 -1.48 -0.08 0.00 1.00 0.00 0.00 64.86 64.40 3hvy h ILE 348 Cb 0.42 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 3hvy h ILE 348 CO 0.01 0.47 0.01 0.11 0.00 0.00 0.00 178.15 178.75 3hvy h LYS 349 N 0.48 0.84 -0.66 2.37 1.57 -0.47 -2.13 116.57 118.57 3hvy h LYS 349 Ca 0.05 -0.23 0.06 0.00 -1.87 0.00 0.00 60.65 58.66 3hvy h LYS 349 Cb 0.83 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.99 3hvy h LYS 349 CO 0.07 0.83 0.37 0.78 -0.57 0.00 0.00 179.45 180.94 3hvy h GLY 350 N 0.98 0.97 1.04 3.86 0.00 -0.69 -1.40 103.07 107.83 3hvy h GLY 350 Ca 0.15 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.18 3hvy h GLY 350 CO 0.02 0.16 0.35 -2.22 0.00 0.00 0.00 176.54 174.85 3hvy h ILE 351 N 0.69 1.26 -0.82 2.60 1.08 -0.88 -1.10 117.51 120.33 3hvy h ILE 351 Ca 0.30 -0.77 -0.01 0.00 -0.39 0.00 0.00 64.86 63.98 3hvy h ILE 351 Cb 0.18 0.28 -0.04 0.00 -3.07 0.00 0.00 36.82 34.16 3hvy h ILE 351 CO -0.18 0.32 0.47 -0.61 -0.69 0.00 0.00 178.15 177.47 3hvy h GLN 352 N 1.15 1.12 0.00 2.37 5.75 -0.96 -1.79 115.11 122.75 3hvy h GLN 352 Ca 0.27 -0.11 0.00 0.00 -0.15 0.00 0.00 58.65 58.66 3hvy h GLN 352 Cb 0.17 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 28.49 3hvy h GLN 352 CO -0.03 0.81 0.00 1.79 -2.65 0.00 0.00 178.83 178.75 3hvy h THR 353 N 1.13 0.00 -0.09 2.39 1.35 -0.12 -1.14 112.91 116.42 3hvy h THR 353 Ca 0.29 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.87 3hvy h THR 353 Cb -0.01 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.51 3hvy h THR 353 CO -0.05 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.22 3hvy n ALA 354 N -1.90 2.54 -2.29 6.62 0.00 -0.69 -4.94 120.51 119.85 3hvy n ALA 354 Ca 0.01 -0.52 -0.34 0.00 0.00 0.00 0.00 53.44 52.58 3hvy n ALA 354 Cb 0.22 -1.10 -0.06 0.00 0.00 0.00 0.00 19.45 18.52 3hvy n ALA 354 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3hvy s SER 355 N -1.82 6.83 0.25 0.00 0.01 -0.43 -4.84 113.70 113.70 3hvy s SER 355 Ca 0.35 1.14 0.09 0.00 1.31 0.00 0.00 55.95 58.84 3hvy s SER 355 Cb 0.20 -2.31 0.28 0.00 0.21 0.00 0.00 66.02 64.40 3hvy s SER 355 CO 0.30 0.02 1.57 1.55 0.41 0.00 0.00 173.24 177.09 3hvy h PRO 356 N 3.19 0.03 -5.65 12.44 0.13 -1.88 -3.37 132.00 136.89 3hvy h PRO 356 Ca -0.48 -0.02 -0.67 0.00 -0.87 0.00 0.00 66.00 63.96 3hvy h PRO 356 Cb 1.19 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.07 3hvy h PRO 356 CO 0.66 0.68 -0.76 0.08 -0.23 0.00 0.00 178.00 178.43 3hvy s VAL 357 N -3.52 3.13 -1.49 1.56 1.01 -1.24 -4.61 120.40 115.23 3hvy s VAL 357 Ca -0.01 -0.66 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 3hvy s VAL 357 Cb 0.12 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 34.23 3hvy s VAL 357 CO 0.77 0.55 0.54 0.47 0.00 0.00 0.00 175.10 177.42 3hvy n ASP 358 N 3.11 -5.52 0.30 3.32 8.00 -1.26 -4.11 116.55 120.39 3hvy n ASP 358 Ca -0.18 -0.28 0.17 0.00 0.71 0.00 0.00 54.79 55.21 3hvy n ASP 358 Cb 0.53 -4.49 0.94 0.00 -0.02 0.00 0.00 41.12 38.08 3hvy n ASP 358 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3hvy h SER 359 N -1.19 0.00 0.51 -2.24 4.64 -1.78 -2.02 113.55 111.47 3hvy h SER 359 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3hvy h SER 359 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 3hvy h SER 359 CO 0.56 0.03 -0.51 2.22 -0.87 0.00 0.00 176.83 178.26 3hvy n PHE 360 N -3.46 0.03 -2.32 4.77 1.16 -1.26 -4.26 117.46 112.11 3hvy n PHE 360 Ca -0.02 0.01 -0.42 0.00 -1.87 0.00 0.00 57.45 55.15 3hvy n PHE 360 Cb 0.15 -0.27 -0.03 0.00 -1.61 0.00 0.00 39.48 37.71 3hvy n PHE 360 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 3hvy s VAL 361 N -3.01 3.63 0.45 1.97 1.01 -0.76 -5.00 120.40 118.69 3hvy s VAL 361 Ca 0.11 1.24 -0.23 0.00 0.00 0.00 0.00 61.98 63.10 3hvy s VAL 361 Cb 0.17 -3.79 -0.08 0.00 0.00 0.00 0.00 36.38 32.68 3hvy s VAL 361 CO 0.70 0.13 1.16 0.00 0.00 0.00 0.00 175.10 177.09 3hvy s GLN 362 N 0.58 3.80 0.12 2.72 0.00 -1.26 -4.96 119.66 120.65 3hvy s GLN 362 Ca 0.58 1.76 -0.07 0.00 -0.00 0.00 0.00 55.36 57.63 3hvy s GLN 362 Cb -0.33 -2.43 -0.01 0.00 0.00 0.00 0.00 33.01 30.24 3hvy s GLN 362 CO 0.32 -0.52 0.19 0.00 0.00 0.00 0.00 175.29 175.29 3hvy n LYS 374 N -0.11 -3.35 -3.86 0.00 4.81 -1.26 -5.08 118.16 109.31 3hvy n LYS 374 Ca -0.11 2.46 -0.27 0.00 -0.87 0.00 0.00 58.31 59.52 3hvy n LYS 374 Cb 0.63 -2.74 -0.17 0.00 0.02 0.00 0.00 35.03 32.77 3hvy n LYS 374 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3hvy s VAL 375 N -2.34 0.93 0.73 3.15 1.01 -1.26 0.83 120.40 123.45 3hvy s VAL 375 Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 3hvy s VAL 375 Cb 0.00 -1.11 0.13 0.00 0.00 0.00 0.00 36.38 35.40 3hvy s VAL 375 CO 0.00 0.15 1.00 -0.51 0.00 0.00 0.00 175.10 175.74 3hvy s ILE 376 N 1.72 2.11 -0.03 2.22 2.07 -0.19 -4.92 121.20 124.17 3hvy s ILE 376 Ca 0.02 -0.60 -0.01 0.00 -1.41 0.00 0.00 60.65 58.65 3hvy s ILE 376 Cb -0.15 -2.50 0.03 0.00 0.13 0.00 0.00 42.46 39.97 3hvy s ILE 376 CO -0.07 0.00 0.03 0.00 -1.91 0.00 0.00 174.94 172.98 3hvy s ALA 378 N -3.15 0.22 -0.39 1.50 0.00 0.48 -1.65 121.76 118.77 3hvy s ALA 378 Ca 0.67 0.21 0.11 0.00 0.00 0.00 0.00 51.96 52.95 3hvy s ALA 378 Cb -0.05 -0.40 0.39 0.00 0.00 0.00 0.00 23.12 23.06 3hvy s ALA 378 CO 0.44 -0.22 1.15 0.00 0.00 0.00 0.00 175.76 177.13 3hvy n ALA 379 N 4.53 1.50 -3.03 0.00 0.00 -1.26 -2.53 120.51 119.71 3hvy n ALA 379 Ca -0.20 -2.00 -0.44 0.00 0.00 0.00 0.00 53.44 50.80 3hvy n ALA 379 Cb 0.50 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.94 3hvy n ALA 379 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3hvy s GLY 380 N -1.83 2.48 0.25 0.00 0.00 -1.26 -4.85 107.32 102.11 3hvy s GLY 380 Ca 0.25 -3.34 0.08 0.00 0.00 0.00 0.00 44.72 41.71 3hvy s GLY 380 CO -0.05 1.88 -0.11 -0.51 0.00 0.00 0.00 173.10 174.31 3hvy s THR 381 N 1.21 1.79 0.13 0.90 -4.23 -1.26 -3.61 115.64 110.59 3hvy s THR 381 Ca 0.38 -2.19 -0.11 0.00 -1.18 0.00 0.00 61.69 58.58 3hvy s THR 381 Cb -0.05 -2.27 -0.07 0.00 1.34 0.00 0.00 72.50 71.45 3hvy s THR 381 CO -0.03 -0.43 1.44 -0.26 -0.54 0.00 0.00 174.62 174.79 3hvy h PHE 382 N 2.38 1.11 -3.37 3.99 0.04 -1.95 -3.43 116.94 115.72 3hvy h PHE 382 Ca -0.39 -0.37 -0.64 0.00 2.80 0.00 0.00 57.97 59.36 3hvy h PHE 382 Cb 1.23 -0.22 -0.23 0.00 2.20 0.00 0.00 35.95 38.94 3hvy h PHE 382 CO 0.71 1.20 -0.67 0.08 -0.60 0.00 0.00 178.31 179.04 3hvy s VAL 383 N -4.23 3.89 -0.13 -0.55 1.01 -1.26 -5.05 120.40 114.08 3hvy s VAL 383 Ca -0.11 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 3hvy s VAL 383 Cb 0.11 -2.73 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 3hvy s VAL 383 CO 0.89 0.46 1.51 -1.58 0.00 0.00 0.00 175.10 176.38 3hvy s GLN 384 N 0.71 4.12 0.00 2.72 0.74 -1.26 -1.71 119.66 124.98 3hvy s GLN 384 Ca -0.01 1.89 0.00 0.00 0.05 0.00 0.00 55.36 57.29 3hvy s GLN 384 Cb -0.14 -3.92 0.00 0.00 1.10 0.00 0.00 33.01 30.05 3hvy s GLN 384 CO 0.02 -0.89 0.00 0.41 -0.55 0.00 0.00 175.29 174.28 3hvy n GLY 385 N 4.07 1.12 3.64 2.59 0.00 -1.26 -5.00 105.19 110.35 3hvy n GLY 385 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3hvy n GLY 385 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvy s ALA 386 N -3.12 3.42 -2.67 4.61 0.00 -0.69 -4.88 121.76 118.41 3hvy s ALA 386 Ca 0.00 0.86 0.26 0.00 0.00 0.00 0.00 51.96 53.07 3hvy s ALA 386 Cb 0.00 -3.83 0.57 0.00 0.00 0.00 0.00 23.12 19.86 3hvy s ALA 386 CO 0.00 -1.74 1.47 -1.13 0.00 0.00 0.00 175.76 174.36 3hvy n SER 387 N 8.07 2.22 0.25 0.00 3.41 -0.96 -3.63 113.62 122.98 3hvy n SER 387 Ca 0.19 -1.71 0.14 0.00 -0.26 0.00 0.00 58.87 57.24 3hvy n SER 387 Cb 0.43 0.03 0.48 0.00 -0.26 0.00 0.00 64.21 64.89 3hvy n SER 387 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3hvy h ILE 388 N 3.42 0.12 -3.95 -1.33 6.09 -1.89 -3.31 117.51 116.67 3hvy h ILE 388 Ca 0.00 -0.82 -0.49 0.00 -1.37 0.00 0.00 64.86 62.18 3hvy h ILE 388 Cb 0.75 1.73 0.02 0.00 0.47 0.00 0.00 36.82 39.79 3hvy h ILE 388 CO 0.00 0.06 0.25 -1.61 -3.07 0.00 0.00 178.15 173.77 3hvy s GLU 389 N -3.51 3.81 0.07 2.19 2.02 -1.24 -0.59 118.70 121.46 3hvy s GLU 389 Ca 0.03 0.66 -0.32 0.00 0.02 0.00 0.00 54.97 55.36 3hvy s GLU 389 Cb 0.08 -2.26 -0.11 0.00 0.10 0.00 0.00 34.13 31.94 3hvy s GLU 389 CO 0.60 -0.19 1.82 -0.11 0.02 0.00 0.00 175.26 177.39 3hvy n LEU 390 N -1.63 3.75 -3.64 1.80 7.94 -1.26 -4.09 117.00 119.86 3hvy n LEU 390 Ca 0.04 0.99 -0.10 0.00 -1.11 0.00 0.00 56.01 55.83 3hvy n LEU 390 Cb 0.54 -1.48 -0.03 0.00 0.53 0.00 0.00 43.42 42.98 3hvy n LEU 390 CO 0.49 0.04 0.32 -0.94 -1.11 0.00 0.00 177.39 176.19 3hvy s SER 391 N 2.88 -0.35 -0.03 1.96 1.04 -0.39 -4.57 113.70 114.23 3hvy s SER 391 Ca 0.85 -0.33 -0.23 0.00 0.48 0.00 0.00 55.95 56.72 3hvy s SER 391 Cb -0.56 0.59 0.05 0.00 0.10 0.00 0.00 66.02 66.20 3hvy s SER 391 CO 0.41 -1.04 0.50 0.00 0.98 0.00 0.00 173.24 174.09 3hvy s ALA 392 N -3.83 -1.29 0.18 5.32 0.00 -1.05 -1.45 121.76 119.64 3hvy s ALA 392 Ca 0.06 0.83 -0.15 0.00 0.00 0.00 0.00 51.96 52.70 3hvy s ALA 392 Cb -0.01 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.17 3hvy s ALA 392 CO -0.06 -0.32 0.45 0.16 0.00 0.00 0.00 175.76 175.99 3hvy s ASP 393 N -1.28 -0.18 -0.29 0.00 1.47 -0.10 -0.38 116.67 115.91 3hvy s ASP 393 Ca -0.12 -0.57 -0.16 0.00 1.18 0.00 0.00 52.55 52.88 3hvy s ASP 393 Cb -0.02 0.53 0.14 0.00 -0.34 0.00 0.00 42.92 43.23 3hvy s ASP 393 CO 0.07 -1.00 0.95 0.00 0.68 0.00 0.00 175.17 175.87 3hvy s ALA 394 N -3.89 -2.24 0.34 2.11 0.00 -0.66 -1.30 121.76 116.12 3hvy s ALA 394 Ca 0.11 2.22 -0.27 0.00 0.00 0.00 0.00 51.96 54.02 3hvy s ALA 394 Cb 0.00 -1.69 -0.09 0.00 0.00 0.00 0.00 23.12 21.35 3hvy s ALA 394 CO -0.03 -0.35 1.14 -1.25 0.00 0.00 0.00 175.76 175.27 3hvy s PRO 395 N 1.36 4.36 -0.94 0.00 0.04 -1.26 -1.02 135.00 137.54 3hvy s PRO 395 Ca -0.09 1.82 -0.20 0.00 0.04 0.00 0.00 61.00 62.57 3hvy s PRO 395 Cb -0.04 -2.93 0.11 0.00 0.04 0.00 0.00 34.50 31.68 3hvy s PRO 395 CO -0.15 -0.05 1.20 0.42 0.04 0.00 0.00 177.00 178.47 3hvy s ILE 396 N -1.31 4.50 0.01 0.56 -1.09 0.24 -4.74 121.20 119.37 3hvy s ILE 396 Ca 0.51 -1.31 -0.28 0.00 -2.23 0.00 0.00 60.65 57.34 3hvy s ILE 396 Cb -0.31 -4.85 0.07 0.00 -1.58 0.00 0.00 42.46 35.79 3hvy s ILE 396 CO 0.40 -1.62 0.65 0.00 -1.23 0.00 0.00 174.94 173.13 3hvy s ARG 397 N 3.35 1.10 0.52 2.79 1.70 -1.26 -4.63 118.95 122.52 3hvy s ARG 397 Ca 0.36 0.05 -0.22 0.00 -0.47 0.00 0.00 55.73 55.45 3hvy s ARG 397 Cb -0.04 0.52 -0.06 0.00 -0.57 0.00 0.00 34.95 34.79 3hvy s ARG 397 CO -0.09 -0.38 1.21 0.39 -1.08 0.00 0.00 175.30 175.35 3hvy n GLU 398 N 0.58 1.52 -0.85 3.89 4.71 -1.26 -1.17 120.64 128.06 3hvy n GLU 398 Ca -0.19 0.56 -0.17 0.00 -0.01 0.00 0.00 57.16 57.35 3hvy n GLU 398 Cb 0.59 -2.38 0.11 0.00 -1.01 0.00 0.00 31.44 28.75 3hvy n GLU 398 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 3hvy n PRO 399 N -0.68 1.87 -3.05 3.49 -0.04 -1.26 -4.90 135.00 130.44 3hvy n PRO 399 Ca 0.10 -2.03 -0.13 0.00 -0.04 0.00 0.00 63.50 61.41 3hvy n PRO 399 Cb 0.44 -1.79 0.06 0.00 -0.04 0.00 0.00 33.50 32.16 3hvy n PRO 399 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3hvy n TYR 400 N -0.53 -2.10 -3.11 0.54 4.01 -0.32 -0.23 117.16 115.41 3hvy n TYR 400 Ca 0.40 0.75 -0.39 0.00 -0.16 0.00 0.00 57.90 58.50 3hvy n TYR 400 Cb 1.19 -4.02 -0.06 0.00 -0.31 0.00 0.00 39.34 36.15 3hvy n TYR 400 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3hvy s ILE 401 N -3.33 4.75 0.14 -0.72 1.01 -1.26 -0.83 121.20 120.95 3hvy s ILE 401 Ca 0.34 1.43 0.08 0.00 0.00 0.00 0.00 60.65 62.50 3hvy s ILE 401 Cb -0.04 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 3hvy s ILE 401 CO 0.64 0.44 -0.10 -0.83 0.00 0.00 0.00 174.94 175.09 3hvy s GLY 402 N -0.43 1.76 -0.15 6.18 0.00 0.42 -4.59 107.32 110.51 3hvy s GLY 402 Ca 0.34 -1.34 0.01 0.00 0.00 0.00 0.00 44.72 43.73 3hvy s GLY 402 CO 0.21 -1.33 -0.17 -0.19 0.00 0.00 0.00 173.10 171.61 3hvy s TYR 403 N -1.40 2.40 -0.08 1.90 2.02 -0.42 -1.20 117.35 120.57 3hvy s TYR 403 Ca 0.23 -1.33 -0.01 0.00 -0.37 0.00 0.00 57.07 55.60 3hvy s TYR 403 Cb -0.10 -1.70 -0.03 0.00 -0.40 0.00 0.00 41.96 39.73 3hvy s TYR 403 CO 0.14 -0.67 -0.04 -1.17 -1.57 0.00 0.00 175.55 172.24 3hvy s LEU 404 N 1.25 3.35 -0.04 -1.29 2.96 -0.20 -0.93 118.68 123.79 3hvy s LEU 404 Ca 0.01 0.05 -0.27 0.00 -0.22 0.00 0.00 54.13 53.70 3hvy s LEU 404 Cb -0.14 -1.75 0.06 0.00 0.50 0.00 0.00 46.19 44.86 3hvy s LEU 404 CO -0.09 0.36 0.58 0.00 -1.32 0.00 0.00 176.35 175.89 3hvy s GLN 405 N -0.80 0.97 0.02 1.98 0.00 -0.53 -1.26 119.66 120.03 3hvy s GLN 405 Ca 0.12 0.13 0.00 0.00 -0.00 0.00 0.00 55.36 55.61 3hvy s GLN 405 Cb -0.11 0.45 0.00 0.00 0.00 0.00 0.00 33.01 33.35 3hvy s GLN 405 CO 0.02 -0.30 0.00 0.41 0.00 0.00 0.00 175.29 175.42 3hvy n GLY 406 N 0.97 -3.60 0.00 2.60 0.00 -1.25 -1.26 105.19 102.65 3hvy n GLY 406 Ca -0.20 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 43.91 3hvy n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hvy n GLY 407 N -0.32 2.54 0.22 -0.02 0.00 0.24 -4.32 105.19 103.53 3hvy n GLY 407 Ca 0.00 0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.09 3hvy n GLY 407 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hvy h LEU 408 N 0.00 0.00 -8.16 0.99 3.38 -1.91 -3.30 115.31 106.32 3hvy h LEU 408 Ca 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 3hvy h LEU 408 Cb 0.00 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 40.55 3hvy h LEU 408 CO 0.00 0.22 -0.72 0.42 0.09 0.00 0.00 178.44 178.45 3hvy s THR 409 N -4.45 0.43 0.25 0.22 -4.23 -1.26 -4.85 115.64 101.75 3hvy s THR 409 Ca -0.03 -1.19 -0.04 0.00 -1.18 0.00 0.00 61.69 59.25 3hvy s THR 409 Cb 0.15 -0.71 0.15 0.00 1.34 0.00 0.00 72.50 73.43 3hvy s THR 409 CO 0.69 -0.51 1.80 0.15 -0.54 0.00 0.00 174.62 176.21 3hvy h PHE 410 N 4.27 0.98 -0.83 3.99 3.57 -1.81 -2.08 116.94 125.02 3hvy h PHE 410 Ca -0.35 -0.09 0.08 0.00 3.53 0.00 0.00 57.97 61.15 3hvy h PHE 410 Cb 1.20 -0.29 -0.07 0.00 2.79 0.00 0.00 35.95 39.58 3hvy h PHE 410 CO 0.64 0.80 0.49 -0.44 -2.23 0.00 0.00 178.31 177.56 3hvy h ASP 411 N 0.91 0.72 0.03 0.41 3.32 -1.96 0.70 116.42 120.55 3hvy h ASP 411 Ca 0.20 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 3hvy h ASP 411 Cb 0.30 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3hvy h ASP 411 CO -0.00 0.43 -0.01 -0.74 -1.72 0.00 0.00 179.24 177.19 3hvy h HIS 412 N 0.84 -0.03 -0.42 4.55 2.76 -1.83 -0.68 115.15 120.33 3hvy h HIS 412 Ca 0.39 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.61 3hvy h HIS 412 Cb 0.31 0.01 -0.05 0.00 1.55 0.00 0.00 27.41 29.23 3hvy h HIS 412 CO -0.05 0.23 0.14 0.00 -1.30 0.00 0.00 177.93 176.95 3hvy h ALA 413 N 0.67 0.49 -0.24 5.26 0.00 -1.08 0.11 119.26 124.48 3hvy h ALA 413 Ca -0.00 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3hvy h ALA 413 Cb 0.28 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3hvy h ALA 413 CO 0.01 -0.25 0.08 -0.22 0.00 0.00 0.00 179.25 178.87 3hvy h LYS 414 N 0.31 0.18 -0.42 0.00 3.64 -0.83 -1.58 116.57 117.87 3hvy h LYS 414 Ca 0.20 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.48 3hvy h LYS 414 Cb 0.19 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3hvy h LYS 414 CO -0.20 0.12 -0.10 -0.07 -2.27 0.00 0.00 179.45 176.93 3hvy h LEU 415 N 0.19 0.74 -0.76 5.20 3.38 -0.59 -1.67 115.31 121.80 3hvy h LEU 415 Ca 0.10 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3hvy h LEU 415 Cb 0.07 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3hvy h LEU 415 CO -0.11 0.86 0.36 1.23 0.09 0.00 0.00 178.44 180.88 3hvy h GLY 416 N 0.97 1.18 1.30 0.83 0.00 -0.69 -1.35 103.07 105.31 3hvy h GLY 416 Ca 0.12 -0.59 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 3hvy h GLY 416 CO 0.03 0.56 0.04 -2.08 0.00 0.00 0.00 176.54 175.10 3hvy h VAL 417 N 1.08 1.24 -0.25 4.60 2.07 -0.76 -0.98 116.25 123.24 3hvy h VAL 417 Ca 0.26 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.78 3hvy h VAL 417 Cb 0.12 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3hvy h VAL 417 CO -0.03 0.35 0.05 -0.07 0.02 0.00 0.00 177.57 177.89 3hvy h LEU 418 N 0.81 0.40 0.16 2.57 3.38 -0.96 0.26 115.31 121.93 3hvy h LEU 418 Ca 0.16 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3hvy h LEU 418 Cb 0.42 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3hvy h LEU 418 CO 0.01 0.55 -0.14 0.40 0.09 0.00 0.00 178.44 179.35 3hvy h ILE 419 N 0.23 0.69 -0.42 1.22 2.04 -1.15 -0.82 117.51 119.30 3hvy h ILE 419 Ca 0.08 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 3hvy h ILE 419 Cb 0.31 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 3hvy h ILE 419 CO 0.00 0.00 0.17 0.00 0.00 0.00 0.00 178.15 178.32 3hvy h ALA 420 N 0.50 0.54 -0.39 1.87 0.00 -1.08 -2.91 119.26 117.78 3hvy h ALA 420 Ca -0.00 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 3hvy h ALA 420 Cb 0.30 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3hvy h ALA 420 CO -0.03 0.15 -0.03 1.25 0.00 0.00 0.00 179.25 180.60 3hvy h LEU 421 N 0.53 0.61 -2.60 0.00 5.85 -0.36 -1.65 115.31 117.69 3hvy h LEU 421 Ca 0.14 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 3hvy h LEU 421 Cb 0.19 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 3hvy h LEU 421 CO -0.01 0.70 -0.01 0.28 -0.34 0.00 0.00 178.44 179.06 3hvy h SER 422 N 0.60 0.00 1.09 1.25 0.02 -0.94 -0.97 113.55 114.60 3hvy h SER 422 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 3hvy h SER 422 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 3hvy h SER 422 CO 0.02 0.01 0.00 0.29 -1.14 0.00 0.00 176.83 176.01 3hvy n LYS 423 N -3.19 0.12 -0.03 3.45 5.02 -0.62 -4.09 118.16 118.82 3hvy n LYS 423 Ca -0.02 0.16 -0.01 0.00 -2.02 0.00 0.00 58.31 56.42 3hvy n LYS 423 Cb 0.13 -1.66 -0.07 0.00 -0.02 0.00 0.00 35.03 33.41 3hvy n LYS 423 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3hvy n LEU 424 N -1.88 0.00 0.00 -0.35 4.77 -0.42 -5.01 117.00 114.11 3hvy n LEU 424 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 3hvy n LEU 424 Cb 0.34 0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 3hvy n LEU 424 CO 0.26 0.13 0.00 2.30 -1.33 0.00 0.00 177.39 178.75