#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ice h LEU 3 N 0.00 -1.35 0.13 1.20 3.38 -1.91 -2.18 115.31 114.59 3ice h LEU 3 Ca 0.00 0.20 0.02 0.00 0.09 0.00 0.00 57.88 58.19 3ice h LEU 3 Cb 0.00 0.59 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 3ice h LEU 3 CO 0.00 -0.16 -0.42 0.71 0.09 0.00 0.00 178.44 178.66 3ice h THR 4 N -0.03 0.16 -0.43 0.22 1.35 -1.95 0.26 112.91 112.49 3ice h THR 4 Ca 0.09 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 66.04 3ice h THR 4 Cb 0.27 0.16 -0.09 0.00 -1.73 0.00 0.00 68.15 66.76 3ice h THR 4 CO -0.57 0.00 -0.24 -0.33 -0.25 0.00 0.00 175.52 174.13 3ice h GLU 5 N -0.66 -0.15 -0.57 4.72 5.08 -1.91 0.31 114.58 121.39 3ice h GLU 5 Ca 0.02 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 3ice h GLU 5 Cb 0.68 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.90 3ice h GLU 5 CO -0.23 -0.10 0.21 -0.07 -1.00 0.00 0.00 179.01 177.81 3ice h LEU 6 N -0.16 0.21 -0.91 1.33 3.38 -0.89 0.15 115.31 118.42 3ice h LEU 6 Ca 0.20 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.33 3ice h LEU 6 Cb 0.48 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.21 3ice h LEU 6 CO -0.52 0.13 0.56 0.50 0.09 0.00 0.00 178.44 179.20 3ice h LYS 7 N 0.39 0.94 0.03 1.13 3.64 0.29 -3.11 116.57 119.88 3ice h LYS 7 Ca 0.29 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.54 3ice h LYS 7 Cb 0.34 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3ice h LYS 7 CO -0.29 0.62 -0.33 -0.91 -2.27 0.00 0.00 179.45 176.27 3ice h ASN 8 N 0.97 0.09 -2.90 4.20 2.35 -0.06 -3.47 115.58 116.76 3ice h ASN 8 Ca 0.42 -0.93 -0.58 0.00 -0.55 0.00 0.00 56.30 54.66 3ice h ASN 8 Cb 0.29 -0.03 0.18 0.00 0.05 0.00 0.00 38.32 38.81 3ice h ASN 8 CO -0.21 1.15 -0.52 0.35 -1.65 0.00 0.00 177.43 176.54 3ice n THR 9 N -4.48 1.82 -1.97 2.81 -2.24 0.46 -4.93 114.28 105.74 3ice n THR 9 Ca -0.14 -0.47 -0.32 0.00 -2.27 0.00 0.00 64.05 60.85 3ice n THR 9 Cb 0.58 -0.60 0.01 0.00 -2.10 0.00 0.00 70.33 68.22 3ice n THR 9 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3ice s PRO 10 N -2.16 3.37 0.12 -0.78 0.04 -1.26 -4.94 135.00 129.38 3ice s PRO 10 Ca 0.66 1.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.45 3ice s PRO 10 Cb -0.41 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.00 3ice s PRO 10 CO 0.57 -0.76 1.60 0.28 0.04 0.00 0.00 177.00 178.74 3ice h VAL 11 N 0.15 0.24 -0.94 -0.36 2.07 -1.94 -3.08 116.25 112.39 3ice h VAL 11 Ca -0.46 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.26 3ice h VAL 11 Cb 1.21 0.24 -0.18 0.00 -1.52 0.00 0.00 31.29 31.04 3ice h VAL 11 CO 0.58 0.00 -0.21 -0.24 0.02 0.00 0.00 177.57 177.73 3ice n SER 12 N -5.44 -0.31 0.13 0.57 2.88 -1.26 -0.94 113.62 109.26 3ice n SER 12 Ca -0.06 1.62 -0.00 0.00 -1.33 0.00 0.00 58.87 59.09 3ice n SER 12 Cb 0.35 -0.50 0.13 0.00 -0.75 0.00 0.00 64.21 63.44 3ice n SER 12 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 3ice h GLU 13 N 0.00 0.00 -0.10 -1.46 5.08 -1.94 -2.95 114.58 113.21 3ice h GLU 13 Ca 0.46 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.71 3ice h GLU 13 Cb 0.74 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3ice h GLU 13 CO -0.96 0.62 -0.45 -0.07 -1.00 0.00 0.00 179.01 177.15 3ice h LEU 14 N 0.00 0.26 -1.67 1.33 3.38 -1.05 -2.80 115.31 114.76 3ice h LEU 14 Ca -0.01 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3ice h LEU 14 Cb 1.23 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3ice h LEU 14 CO 0.08 0.68 0.15 0.40 0.09 0.00 0.00 178.44 179.84 3ice h ILE 15 N 0.20 1.09 -0.58 1.22 1.08 -1.27 -1.72 117.51 117.53 3ice h ILE 15 Ca 0.01 -0.22 -0.02 0.00 -0.39 0.00 0.00 64.86 64.24 3ice h ILE 15 Cb 0.88 0.72 -0.03 0.00 -3.07 0.00 0.00 36.82 35.32 3ice h ILE 15 CO 0.07 0.10 0.30 0.71 -0.69 0.00 0.00 178.15 178.63 3ice h THR 16 N 0.37 1.20 -0.29 -0.27 1.35 -1.54 -1.79 112.91 111.94 3ice h THR 16 Ca 0.10 -0.54 -0.04 0.00 -0.55 0.00 0.00 66.41 65.38 3ice h THR 16 Cb 0.01 0.49 -0.01 0.00 -1.73 0.00 0.00 68.15 66.91 3ice h THR 16 CO -0.02 0.22 0.01 0.25 -0.25 0.00 0.00 175.52 175.74 3ice h LEU 17 N 0.78 0.49 -0.31 3.87 6.46 -1.50 -2.35 115.31 122.75 3ice h LEU 17 Ca 0.20 -0.30 0.07 0.00 -0.12 0.00 0.00 57.88 57.73 3ice h LEU 17 Cb 0.08 -0.13 -0.08 0.00 -0.73 0.00 0.00 40.66 39.80 3ice h LEU 17 CO -0.03 0.66 -0.38 1.23 -0.62 0.00 0.00 178.44 179.31 3ice h GLY 18 N 0.30 -0.46 1.49 3.75 0.00 -0.95 -0.30 103.07 106.90 3ice h GLY 18 Ca 0.08 0.47 -0.04 0.00 0.00 0.00 0.00 47.33 47.85 3ice h GLY 18 CO 0.01 -0.20 0.09 0.83 0.00 0.00 0.00 176.54 177.27 3ice h GLU 19 N -0.34 0.64 0.00 4.80 4.39 -1.37 -0.67 114.58 122.03 3ice h GLU 19 Ca 0.13 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3ice h GLU 19 Cb 0.57 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 3ice h GLU 19 CO -0.50 0.60 0.00 0.09 -1.16 0.00 0.00 179.01 178.04 3ice n ASN 20 N -4.30 0.00 0.06 1.42 4.13 -0.12 -4.80 115.26 111.64 3ice n ASN 20 Ca 0.03 -1.88 0.00 0.00 1.68 0.00 0.00 54.58 54.41 3ice n ASN 20 Cb 0.21 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.45 3ice n ASN 20 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3ice n LEU 23 N -0.53 0.00 -3.80 3.41 4.32 -0.26 -4.98 117.00 115.17 3ice n LEU 23 Ca 0.01 0.00 -0.17 0.00 -0.02 0.00 0.00 56.01 55.83 3ice n LEU 23 Cb 0.01 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 41.64 3ice n LEU 23 CO 0.01 -0.06 -0.37 -0.70 -1.22 0.00 0.00 177.39 175.05 3ice s GLU 24 N 0.00 0.25 -1.26 3.23 2.12 -1.24 -4.92 118.70 116.87 3ice s GLU 24 Ca 0.00 0.11 -0.31 0.00 0.36 0.00 0.00 54.97 55.13 3ice s GLU 24 Cb 0.00 -0.48 0.04 0.00 0.26 0.00 0.00 34.13 33.96 3ice s GLU 24 CO 0.00 -0.16 0.58 0.09 -0.54 0.00 0.00 175.26 175.23 3ice n ASN 25 N 4.27 -3.38 -0.41 -1.70 4.13 -1.26 -4.83 115.26 112.08 3ice n ASN 25 Ca -0.24 -1.31 0.08 0.00 1.68 0.00 0.00 54.58 54.79 3ice n ASN 25 Cb 0.50 -1.57 0.18 0.00 -1.54 0.00 0.00 39.78 37.35 3ice n ASN 25 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ice n LEU 26 N -5.02 2.91 0.08 3.41 -0.00 -1.26 -4.78 117.00 112.34 3ice n LEU 26 Ca -0.14 -3.21 -0.11 0.00 -0.00 0.00 0.00 56.01 52.55 3ice n LEU 26 Cb 0.58 -0.48 -0.06 0.00 -0.00 0.00 0.00 43.42 43.45 3ice n LEU 26 CO 0.76 0.81 0.16 0.00 -0.00 0.00 0.00 177.39 179.12 3ice h ALA 27 N 0.64 0.37 0.00 1.47 0.00 -1.94 -3.43 119.26 116.37 3ice h ALA 27 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.15 3ice h ALA 27 Cb 1.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3ice h ALA 27 CO 0.08 0.94 0.00 -2.13 0.00 0.00 0.00 179.25 178.14 3ice n ARG 28 N -3.62 0.50 -3.15 0.00 3.00 -1.26 -4.99 116.66 107.14 3ice n ARG 28 Ca -0.05 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.47 3ice n ARG 28 Cb 0.88 -1.25 -0.06 0.00 0.00 0.00 0.00 32.46 32.02 3ice n ARG 28 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 3ice s ARG 30 N 0.38 4.01 0.16 -0.14 1.70 -1.26 -5.12 118.95 118.68 3ice s ARG 30 Ca 0.00 0.67 -0.30 0.00 -0.47 0.00 0.00 55.73 55.63 3ice s ARG 30 Cb 0.00 -2.47 -0.05 0.00 -0.57 0.00 0.00 34.95 31.86 3ice s ARG 30 CO 0.00 0.18 1.54 -0.22 -1.08 0.00 0.00 175.30 175.72 3ice h LYS 31 N 2.35 -0.02 -0.94 3.89 3.64 -1.98 -1.01 116.57 122.51 3ice h LYS 31 Ca -0.48 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.04 3ice h LYS 31 Cb 1.18 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.85 3ice h LYS 31 CO 0.65 -0.01 -0.41 1.96 -2.27 0.00 0.00 179.45 179.37 3ice h GLN 32 N -0.02 -0.03 -0.30 1.90 1.08 -2.00 0.18 115.11 115.92 3ice h GLN 32 Ca 0.17 0.00 0.07 0.00 -1.45 0.00 0.00 58.65 57.44 3ice h GLN 32 Cb 0.43 0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.79 3ice h GLN 32 CO -0.92 -0.02 -0.28 -0.44 -0.95 0.00 0.00 178.83 176.21 3ice h ASP 33 N -0.03 -0.92 -0.28 1.46 3.45 -1.62 -0.16 116.42 118.32 3ice h ASP 33 Ca 0.30 0.16 0.07 0.00 0.43 0.00 0.00 57.03 57.99 3ice h ASP 33 Cb 0.57 0.43 -0.07 0.00 -0.56 0.00 0.00 39.33 39.69 3ice h ASP 33 CO -0.94 -0.31 -0.22 0.40 -1.57 0.00 0.00 179.24 176.61 3ice h ILE 34 N -0.27 0.42 -0.05 0.35 5.03 -0.49 0.71 117.51 123.22 3ice h ILE 34 Ca 0.15 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.91 3ice h ILE 34 Cb 0.50 0.42 -0.05 0.00 -3.03 0.00 0.00 36.82 34.66 3ice h ILE 34 CO -0.45 0.00 -0.46 0.40 -0.68 0.00 0.00 178.15 176.96 3ice h ILE 35 N -0.21 0.00 -0.79 -0.67 1.08 -0.09 0.27 117.51 117.10 3ice h ILE 35 Ca 0.15 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 64.78 3ice h ILE 35 Cb 0.44 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 34.04 3ice h ILE 35 CO -0.40 0.00 -0.18 -0.26 -0.69 0.00 0.00 178.15 176.62 3ice h PHE 36 N -0.54 -0.38 -0.53 1.37 0.05 -0.57 0.45 116.94 116.78 3ice h PHE 36 Ca 0.02 0.07 0.02 0.00 3.82 0.00 0.00 57.97 61.90 3ice h PHE 36 Cb 0.60 0.29 -0.04 0.00 2.00 0.00 0.00 35.95 38.81 3ice h PHE 36 CO -0.52 -0.33 0.32 0.00 -0.18 0.00 0.00 178.31 177.59 3ice h ALA 37 N 1.79 0.69 -0.71 2.45 0.00 0.79 -1.14 119.26 123.13 3ice h ALA 37 Ca 0.39 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 3ice h ALA 37 Cb 0.60 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 3ice h ALA 37 CO -0.80 0.04 0.28 0.82 0.00 0.00 0.00 179.25 179.59 3ice h ILE 38 N 0.64 1.24 -0.12 0.00 2.04 0.14 -2.49 117.51 118.96 3ice h ILE 38 Ca 0.21 -0.75 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 3ice h ILE 38 Cb 0.02 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 3ice h ILE 38 CO -0.09 0.30 -0.10 -0.07 0.00 0.00 0.00 178.15 178.19 3ice h LEU 39 N 1.02 0.30 -0.64 1.44 -0.00 -0.33 -0.79 115.31 116.30 3ice h LEU 39 Ca 0.24 -0.46 -0.08 0.00 -0.00 0.00 0.00 57.88 57.58 3ice h LEU 39 Cb 0.19 -0.08 -0.03 0.00 -0.00 0.00 0.00 40.66 40.74 3ice h LEU 39 CO -0.02 0.70 0.10 0.07 -0.00 0.00 0.00 178.44 179.29 3ice h LYS 40 N -0.10 1.07 -0.55 1.13 2.10 -1.19 0.48 116.57 119.51 3ice h LYS 40 Ca 0.02 -0.29 -0.05 0.00 -2.00 0.00 0.00 60.65 58.33 3ice h LYS 40 Cb 0.61 -0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 31.79 3ice h LYS 40 CO 0.03 0.99 0.15 0.37 -2.00 0.00 0.00 179.45 178.99 3ice h GLN 41 N 0.99 0.87 -0.05 0.07 5.75 -1.49 0.82 115.11 122.07 3ice h GLN 41 Ca 0.20 -0.20 -0.03 0.00 -0.15 0.00 0.00 58.65 58.46 3ice h GLN 41 Cb 0.44 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 3ice h GLN 41 CO 0.01 0.81 -0.12 1.25 -2.65 0.00 0.00 178.83 178.13 3ice h HIS 42 N 0.78 0.07 0.01 3.99 2.76 -0.61 -1.86 115.15 120.28 3ice h HIS 42 Ca 0.18 -0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 58.14 3ice h HIS 42 Cb 0.31 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.23 3ice h HIS 42 CO 0.02 0.20 -0.95 0.00 -1.30 0.00 0.00 177.93 175.90 3ice h ALA 43 N 1.81 0.44 0.04 5.26 0.00 0.45 -2.94 119.26 124.32 3ice h ALA 43 Ca 0.01 -0.84 0.03 0.00 0.00 0.00 0.00 54.91 54.11 3ice h ALA 43 Cb 0.27 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3ice h ALA 43 CO 0.02 1.13 -0.26 -0.22 0.00 0.00 0.00 179.25 179.92 3ice h LYS 44 N 0.01 -0.41 0.00 0.00 1.63 0.01 -0.16 116.57 117.65 3ice h LYS 44 Ca -0.02 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 3ice h LYS 44 Cb 1.66 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.39 3ice h LYS 44 CO 0.13 -0.27 0.02 -1.13 -3.45 0.00 0.00 179.45 174.74 3ice n SER 45 N -5.38 0.00 0.00 4.20 3.41 -1.16 -4.75 113.62 109.94 3ice n SER 45 Ca -0.05 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 3ice n SER 45 Cb 0.29 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 3ice n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ice n GLY 46 N -1.29 0.59 3.78 5.00 0.00 -0.07 -5.04 105.19 108.15 3ice n GLY 46 Ca 0.00 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 3ice n GLY 46 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ice s GLU 47 N -0.87 2.97 0.29 1.61 0.41 -1.11 -5.01 118.70 116.99 3ice s GLU 47 Ca 0.00 1.36 -0.26 0.00 -0.41 0.00 0.00 54.97 55.66 3ice s GLU 47 Cb 0.00 -1.98 -0.09 0.00 -1.78 0.00 0.00 34.13 30.28 3ice s GLU 47 CO 0.00 -1.11 0.91 -0.51 -0.49 0.00 0.00 175.26 174.06 3ice s ASP 48 N -2.58 7.35 0.16 -0.19 1.11 -1.26 -4.62 116.67 116.64 3ice s ASP 48 Ca 0.66 1.79 0.09 0.00 0.18 0.00 0.00 52.55 55.28 3ice s ASP 48 Cb -0.20 -2.56 -0.04 0.00 1.07 0.00 0.00 42.92 41.19 3ice s ASP 48 CO 0.39 -0.01 -0.21 -0.63 1.18 0.00 0.00 175.17 175.90 3ice s ILE 49 N -1.51 1.99 0.00 0.77 1.01 -1.26 -4.92 121.20 117.28 3ice s ILE 49 Ca 0.47 -1.89 0.01 0.00 0.00 0.00 0.00 60.65 59.24 3ice s ILE 49 Cb -0.20 -1.90 -0.00 0.00 0.01 0.00 0.00 42.46 40.37 3ice s ILE 49 CO 0.25 -0.20 -0.03 -0.36 0.00 0.00 0.00 174.94 174.60 3ice s PHE 50 N -1.76 0.23 0.39 3.97 0.08 -1.26 -0.49 117.98 119.15 3ice s PHE 50 Ca 0.16 -0.10 0.05 0.00 0.12 0.00 0.00 56.93 57.16 3ice s PHE 50 Cb -0.07 -0.15 -0.02 0.00 -0.57 0.00 0.00 43.02 42.21 3ice s PHE 50 CO 0.07 -0.02 0.17 0.41 -0.10 0.00 0.00 175.22 175.75 3ice n GLY 51 N 2.84 3.19 3.61 4.36 0.00 -1.11 -2.54 105.19 115.53 3ice n GLY 51 Ca -0.14 -2.08 -0.11 0.00 0.00 0.00 0.00 46.02 43.70 3ice n GLY 51 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3ice s ASP 52 N -3.46 -0.46 0.05 1.61 3.84 -1.26 -3.48 116.67 113.51 3ice s ASP 52 Ca 0.23 0.73 -0.14 0.00 -0.00 0.00 0.00 52.55 53.38 3ice s ASP 52 Cb 0.01 0.68 0.05 0.00 -1.38 0.00 0.00 42.92 42.28 3ice s ASP 52 CO 0.17 -0.27 0.64 0.61 -0.00 0.00 0.00 175.17 176.32 3ice n GLY 53 N 1.60 0.69 3.47 2.12 0.00 -1.07 -4.83 105.19 107.17 3ice n GLY 53 Ca -0.12 -1.01 -0.35 0.00 0.00 0.00 0.00 46.02 44.54 3ice n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ice s VAL 54 N -2.19 4.17 0.34 1.61 1.01 -0.84 -1.50 120.40 123.00 3ice s VAL 54 Ca 0.15 -0.23 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 3ice s VAL 54 Cb -0.01 -2.91 -0.12 0.00 0.00 0.00 0.00 36.38 33.34 3ice s VAL 54 CO 0.02 0.40 1.33 -0.11 0.00 0.00 0.00 175.10 176.74 3ice n LEU 55 N 4.36 3.69 -3.59 3.92 7.94 0.13 -2.38 117.00 131.05 3ice n LEU 55 Ca -0.17 1.21 -0.29 0.00 -1.11 0.00 0.00 56.01 55.65 3ice n LEU 55 Cb 0.52 -1.50 -0.15 0.00 0.53 0.00 0.00 43.42 42.82 3ice n LEU 55 CO 0.32 -0.40 -0.33 -0.70 -1.11 0.00 0.00 177.39 175.17 3ice s GLU 56 N -1.79 0.33 -0.04 1.96 2.12 0.08 -0.62 118.70 120.74 3ice s GLU 56 Ca 0.56 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 54.92 3ice s GLU 56 Cb -0.56 -1.39 -0.04 0.00 0.26 0.00 0.00 34.13 32.40 3ice s GLU 56 CO 0.61 -1.01 1.22 0.42 -0.54 0.00 0.00 175.26 175.96 3ice s ILE 57 N 1.97 4.20 0.74 -3.70 1.01 -1.26 -2.15 121.20 122.00 3ice s ILE 57 Ca 0.09 1.53 -0.04 0.00 0.00 0.00 0.00 60.65 62.24 3ice s ILE 57 Cb -0.16 -3.99 0.15 0.00 0.01 0.00 0.00 42.46 38.47 3ice s ILE 57 CO -0.34 0.01 1.01 0.18 0.00 0.00 0.00 174.94 175.80 3ice n LEU 58 N 5.12 0.00 0.17 2.97 4.77 -0.40 -4.95 117.00 124.67 3ice n LEU 58 Ca 0.11 -1.82 0.02 0.00 -0.03 0.00 0.00 56.01 54.29 3ice n LEU 58 Cb 0.46 -0.69 0.36 0.00 -2.33 0.00 0.00 43.42 41.22 3ice n LEU 58 CO 0.55 -1.06 0.76 -0.61 -1.33 0.00 0.00 177.39 175.70 3ice h GLN 59 N 0.00 0.07 -0.08 3.23 4.15 -1.96 -2.52 115.11 118.00 3ice h GLN 59 Ca -0.33 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.06 3ice h GLN 59 Cb 1.13 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.82 3ice h GLN 59 CO 0.32 0.38 0.00 -0.25 -1.93 0.00 0.00 178.83 177.35 3ice n ASP 60 N -4.15 0.50 0.00 -0.69 8.00 -1.26 -4.87 116.55 114.09 3ice n ASP 60 Ca -0.02 -1.80 0.00 0.00 0.71 0.00 0.00 54.79 53.69 3ice n ASP 60 Cb 0.37 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 3ice n ASP 60 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ice n GLY 61 N 0.75 1.25 3.65 0.44 0.00 -0.95 -5.00 105.19 105.33 3ice n GLY 61 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 3ice n GLY 61 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ice s PHE 62 N -2.89 2.86 0.40 1.61 -0.12 -1.26 -4.10 117.98 114.48 3ice s PHE 62 Ca 0.00 -0.11 0.04 0.00 -0.05 0.00 0.00 56.93 56.80 3ice s PHE 62 Cb 0.00 -1.44 -0.03 0.00 -0.63 0.00 0.00 43.02 40.93 3ice s PHE 62 CO 0.00 0.48 0.11 0.20 -0.05 0.00 0.00 175.22 175.96 3ice s GLY 63 N -2.58 2.56 0.24 1.99 0.00 -0.90 -1.27 107.32 107.36 3ice s GLY 63 Ca 0.25 -1.30 0.04 0.00 0.00 0.00 0.00 44.72 43.72 3ice s GLY 63 CO 0.17 -1.85 -0.02 -1.36 0.00 0.00 0.00 173.10 170.04 3ice s PHE 64 N -3.20 1.66 -0.49 1.90 0.08 -0.92 -1.09 117.98 115.92 3ice s PHE 64 Ca 0.24 -0.86 -0.04 0.00 0.12 0.00 0.00 56.93 56.39 3ice s PHE 64 Cb 0.03 -0.96 0.13 0.00 -0.57 0.00 0.00 43.02 41.65 3ice s PHE 64 CO 0.14 0.05 0.31 -0.51 -0.10 0.00 0.00 175.22 175.11 3ice s LEU 65 N -3.34 5.37 0.64 -0.37 1.43 -0.76 -0.74 118.68 120.90 3ice s LEU 65 Ca 0.28 -2.26 -0.11 0.00 -1.03 0.00 0.00 54.13 51.01 3ice s LEU 65 Cb 0.05 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 3ice s LEU 65 CO 0.09 -0.52 1.04 -0.13 0.23 0.00 0.00 176.35 177.06 3ice s ARG 66 N 0.82 3.35 0.18 1.70 1.81 -1.00 -3.56 118.95 122.24 3ice s ARG 66 Ca 0.10 0.86 0.08 0.00 -1.72 0.00 0.00 55.73 55.06 3ice s ARG 66 Cb -0.22 -2.05 -0.04 0.00 -0.45 0.00 0.00 34.95 32.19 3ice s ARG 66 CO -0.03 -0.77 -0.04 -1.54 -0.68 0.00 0.00 175.30 172.24 3ice s SER 67 N -3.90 4.57 0.52 0.23 1.04 -1.26 -1.99 113.70 112.92 3ice s SER 67 Ca 0.57 -0.46 0.29 0.00 0.48 0.00 0.00 55.95 56.82 3ice s SER 67 Cb -0.12 -0.90 1.43 0.00 0.10 0.00 0.00 66.02 66.53 3ice s SER 67 CO 0.52 0.10 2.05 0.00 0.98 0.00 0.00 173.24 176.88 3ice h ALA 68 N 2.79 1.19 -0.91 5.32 0.00 -1.95 -1.37 119.26 124.33 3ice h ALA 68 Ca -0.47 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.44 3ice h ALA 68 Cb 1.20 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 3ice h ALA 68 CO 0.57 0.14 0.55 -0.44 0.00 0.00 0.00 179.25 180.07 3ice h ASP 69 N 0.00 0.79 -0.72 0.00 3.32 -1.98 -1.40 116.42 116.43 3ice h ASP 69 Ca -0.00 0.05 -0.18 0.00 0.02 0.00 0.00 57.03 56.92 3ice h ASP 69 Cb 0.39 -0.11 -0.11 0.00 0.22 0.00 0.00 39.33 39.73 3ice h ASP 69 CO 0.02 0.43 0.23 -1.20 -1.72 0.00 0.00 179.24 176.99 3ice n SER 70 N -4.69 5.02 -2.16 6.45 7.64 -1.03 -4.89 113.62 119.96 3ice n SER 70 Ca 0.16 -3.18 -0.19 0.00 1.01 0.00 0.00 58.87 56.67 3ice n SER 70 Cb 0.32 -0.74 -0.03 0.00 -1.01 0.00 0.00 64.21 62.75 3ice n SER 70 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3ice n SER 71 N -0.02 -5.44 -0.47 6.43 7.64 -0.53 -1.16 113.62 120.07 3ice n SER 71 Ca 0.39 0.16 -0.06 0.00 1.01 0.00 0.00 58.87 60.36 3ice n SER 71 Cb 1.36 -4.62 -0.03 0.00 -1.01 0.00 0.00 64.21 59.91 3ice n SER 71 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3ice n TYR 72 N -3.42 0.00 -2.53 1.43 4.01 -0.55 -4.71 117.16 111.39 3ice n TYR 72 Ca -0.22 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.28 3ice n TYR 72 Cb 0.66 -1.41 0.04 0.00 -0.31 0.00 0.00 39.34 38.32 3ice n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ice s LEU 73 N -1.41 3.19 0.13 7.72 1.43 -0.31 -4.84 118.68 124.60 3ice s LEU 73 Ca 0.00 0.28 -0.35 0.00 -1.03 0.00 0.00 54.13 53.03 3ice s LEU 73 Cb 0.00 -3.09 -0.16 0.00 0.03 0.00 0.00 46.19 42.98 3ice s LEU 73 CO 0.00 -1.19 1.38 0.00 0.23 0.00 0.00 176.35 176.76 3ice n ALA 74 N -2.50 -0.21 -2.86 4.21 0.00 -1.26 -4.62 120.51 113.27 3ice n ALA 74 Ca 0.06 0.48 -0.12 0.00 0.00 0.00 0.00 53.44 53.87 3ice n ALA 74 Cb 0.59 -2.15 -0.11 0.00 0.00 0.00 0.00 19.45 17.78 3ice n ALA 74 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3ice s GLY 75 N 0.49 0.44 0.52 0.00 0.00 -1.26 -5.03 107.32 102.47 3ice s GLY 75 Ca 0.80 -0.74 0.22 0.00 0.00 0.00 0.00 44.72 45.00 3ice s GLY 75 CO 0.46 -0.80 2.10 -2.55 0.00 0.00 0.00 173.10 172.31 3ice h PRO 76 N 4.47 0.00 -0.57 2.90 0.11 -1.99 -2.66 132.00 134.26 3ice h PRO 76 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3ice h PRO 76 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3ice h PRO 76 CO 0.42 0.09 0.00 -0.25 -0.21 0.00 0.00 178.00 178.05 3ice n ASP 77 N -4.03 3.28 -4.73 -2.05 10.43 -1.26 -4.79 116.55 113.41 3ice n ASP 77 Ca -0.02 -1.98 -0.33 0.00 2.57 0.00 0.00 54.79 55.03 3ice n ASP 77 Cb 0.18 -0.38 0.10 0.00 1.84 0.00 0.00 41.12 42.87 3ice n ASP 77 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3ice s ASP 78 N -1.11 4.13 -0.17 -2.24 1.01 -1.01 -4.86 116.67 112.42 3ice s ASP 78 Ca 0.41 2.14 -0.03 0.00 0.71 0.00 0.00 52.55 55.78 3ice s ASP 78 Cb 0.22 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.56 3ice s ASP 78 CO 0.29 -2.30 -0.05 -0.63 0.21 0.00 0.00 175.17 172.70 3ice s ILE 79 N -2.39 3.71 0.37 0.77 1.09 -1.23 -3.96 121.20 119.56 3ice s ILE 79 Ca 0.68 -0.41 -0.27 0.00 -1.10 0.00 0.00 60.65 59.55 3ice s ILE 79 Cb -0.24 -2.63 -0.09 0.00 -1.06 0.00 0.00 42.46 38.44 3ice s ILE 79 CO 0.50 0.48 1.30 -0.47 -0.10 0.00 0.00 174.94 176.64 3ice s TYR 80 N 0.62 2.93 -0.21 3.97 5.04 -0.31 -1.83 117.35 127.56 3ice s TYR 80 Ca -0.03 1.41 -0.02 0.00 -2.44 0.00 0.00 57.07 56.00 3ice s TYR 80 Cb -0.15 -3.67 0.06 0.00 0.35 0.00 0.00 41.96 38.56 3ice s TYR 80 CO 0.02 -1.97 0.01 0.08 -1.34 0.00 0.00 175.55 172.36 3ice s VAL 81 N -1.21 0.81 0.49 3.14 1.01 -0.25 -2.37 120.40 122.01 3ice s VAL 81 Ca 0.53 -0.76 -0.22 0.00 0.00 0.00 0.00 61.98 61.53 3ice s VAL 81 Cb -0.39 -1.25 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 3ice s VAL 81 CO 0.50 -0.19 1.24 -0.94 0.00 0.00 0.00 175.10 175.71 3ice s SER 82 N 1.73 5.81 0.55 3.32 1.04 -1.26 -2.11 113.70 122.77 3ice s SER 82 Ca -0.02 2.48 0.30 0.00 0.48 0.00 0.00 55.95 59.19 3ice s SER 82 Cb -0.18 -2.61 1.46 0.00 0.10 0.00 0.00 66.02 64.79 3ice s SER 82 CO -0.08 -1.18 1.91 -0.65 0.98 0.00 0.00 173.24 174.23 3ice h PRO 83 N 1.80 0.00 -0.49 4.02 0.11 -1.95 -0.19 132.00 135.29 3ice h PRO 83 Ca -0.50 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3ice h PRO 83 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 3ice h PRO 83 CO 0.59 0.00 0.29 1.03 -0.21 0.00 0.00 178.00 179.70 3ice h SER 84 N 0.00 0.60 -0.27 -2.05 0.87 -1.90 -1.66 113.55 109.15 3ice h SER 84 Ca 0.35 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.82 3ice h SER 84 Cb 1.47 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 63.27 3ice h SER 84 CO -0.00 0.48 0.04 1.56 -0.53 0.00 0.00 176.83 178.38 3ice h GLN 85 N 0.66 0.44 -0.28 2.24 4.20 -1.39 -0.88 115.11 120.10 3ice h GLN 85 Ca 0.18 -0.12 0.04 0.00 0.06 0.00 0.00 58.65 58.81 3ice h GLN 85 Cb -0.00 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.69 3ice h GLN 85 CO -0.03 0.57 0.04 0.82 -0.67 0.00 0.00 178.83 179.55 3ice h ILE 86 N 0.25 0.85 -0.00 2.54 2.04 -1.29 0.19 117.51 122.09 3ice h ILE 86 Ca 0.08 -0.05 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 3ice h ILE 86 Cb 0.34 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3ice h ILE 86 CO 0.01 0.02 -0.34 0.03 0.00 0.00 0.00 178.15 177.87 3ice h ARG 87 N 0.14 0.00 0.64 2.37 3.08 -1.27 0.40 114.38 119.74 3ice h ARG 87 Ca 0.13 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 3ice h ARG 87 Cb 0.14 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.20 3ice h ARG 87 CO -0.18 0.34 -0.31 -0.09 -1.07 0.00 0.00 179.97 178.66 3ice h ARG 88 N 0.00 -0.83 -0.63 0.04 2.43 0.36 -3.19 114.38 112.56 3ice h ARG 88 Ca -0.00 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3ice h ARG 88 Cb 0.60 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 3ice h ARG 88 CO 0.04 -0.52 0.00 1.19 -1.51 0.00 0.00 179.97 179.18 3ice n PHE 89 N -5.41 1.10 -2.43 2.20 3.72 -0.10 -4.91 117.46 111.62 3ice n PHE 89 Ca -0.13 -0.47 -0.13 0.00 -0.05 0.00 0.00 57.45 56.67 3ice n PHE 89 Cb 0.36 -0.14 -0.01 0.00 -0.94 0.00 0.00 39.48 38.76 3ice n PHE 89 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3ice n ASN 90 N 1.04 -4.13 -4.56 4.37 4.13 0.12 -4.38 115.26 111.85 3ice n ASN 90 Ca 0.21 0.17 -0.31 0.00 1.68 0.00 0.00 54.58 56.33 3ice n ASN 90 Cb 0.68 -3.50 0.16 0.00 -1.54 0.00 0.00 39.78 35.58 3ice n ASN 90 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3ice n LEU 91 N -2.83 1.74 -3.88 3.41 4.77 -0.08 -4.97 117.00 115.16 3ice n LEU 91 Ca -0.16 0.34 -0.10 0.00 -0.03 0.00 0.00 56.01 56.06 3ice n LEU 91 Cb 0.62 -1.36 -0.09 0.00 -2.33 0.00 0.00 43.42 40.26 3ice n LEU 91 CO 0.18 -2.73 -0.15 -0.60 -1.33 0.00 0.00 177.39 172.76 3ice s ARG 92 N -4.27 0.61 0.15 3.23 3.52 -1.26 -4.90 118.95 116.04 3ice s ARG 92 Ca 0.63 -0.61 -0.34 0.00 -0.13 0.00 0.00 55.73 55.29 3ice s ARG 92 Cb -0.22 0.25 -0.13 0.00 -1.56 0.00 0.00 34.95 33.28 3ice s ARG 92 CO 0.62 -0.16 1.62 2.41 -0.81 0.00 0.00 175.30 178.98 3ice n THR 93 N 0.90 0.04 0.00 4.11 -1.04 -1.26 -1.64 114.28 115.39 3ice n THR 93 Ca -0.20 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 3ice n THR 93 Cb 0.58 -1.64 0.00 0.00 -1.82 0.00 0.00 70.33 67.45 3ice n THR 93 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ice n GLY 94 N 3.57 1.45 3.75 3.41 0.00 0.21 -4.65 105.19 112.94 3ice n GLY 94 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3ice n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ice s ASP 95 N -1.72 6.57 -0.22 1.61 1.01 -0.65 -4.28 116.67 118.99 3ice s ASP 95 Ca 0.00 2.77 -0.22 0.00 0.71 0.00 0.00 52.55 55.82 3ice s ASP 95 Cb 0.00 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.28 3ice s ASP 95 CO 0.00 -0.74 0.68 -0.89 0.21 0.00 0.00 175.17 174.42 3ice s THR 96 N -0.28 4.97 0.06 -1.27 2.01 -1.26 0.17 115.64 120.04 3ice s THR 96 Ca 0.58 1.26 0.09 0.00 0.31 0.00 0.00 61.69 63.94 3ice s THR 96 Cb -0.43 -3.98 -0.03 0.00 0.01 0.00 0.00 72.50 68.06 3ice s THR 96 CO 0.48 0.04 -0.26 -0.63 -0.69 0.00 0.00 174.62 173.56 3ice s ILE 97 N 2.31 2.24 -0.05 1.82 -1.09 -0.56 -0.04 121.20 125.84 3ice s ILE 97 Ca 0.29 -1.45 -0.04 0.00 -2.23 0.00 0.00 60.65 57.22 3ice s ILE 97 Cb -0.16 -1.91 0.01 0.00 -1.58 0.00 0.00 42.46 38.83 3ice s ILE 97 CO 0.09 0.30 0.12 -0.94 -1.23 0.00 0.00 174.94 173.29 3ice s SER 98 N -1.44 -0.12 0.00 3.58 1.04 -0.17 -2.58 113.70 114.00 3ice s SER 98 Ca 0.13 0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.80 3ice s SER 98 Cb -0.10 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.26 3ice s SER 98 CO 0.03 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.81 3ice n GLY 99 N 3.11 -0.21 3.77 7.32 0.00 -1.23 -0.42 105.19 117.53 3ice n GLY 99 Ca -0.13 -0.94 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 3ice n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ice s LYS 100 N -2.00 4.45 0.40 1.61 1.02 -0.87 -2.75 119.74 121.60 3ice s LYS 100 Ca 0.00 1.61 0.03 0.00 0.02 0.00 0.00 55.97 57.63 3ice s LYS 100 Cb 0.00 -2.89 -0.03 0.00 -0.52 0.00 0.00 37.83 34.39 3ice s LYS 100 CO 0.00 0.10 0.09 0.96 -0.92 0.00 0.00 175.35 175.58 3ice s ILE 101 N -1.42 0.85 0.03 2.17 -4.36 0.36 -1.05 121.20 117.79 3ice s ILE 101 Ca 0.50 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.91 3ice s ILE 101 Cb -0.26 -2.45 -0.02 0.00 1.25 0.00 0.00 42.46 40.98 3ice s ILE 101 CO 0.33 0.00 -0.07 0.00 0.24 0.00 0.00 174.94 175.44 3ice s ARG 102 N -3.78 0.51 0.52 0.37 1.70 -0.90 -4.00 118.95 113.37 3ice s ARG 102 Ca 0.25 -0.55 -0.22 0.00 -0.47 0.00 0.00 55.73 54.73 3ice s ARG 102 Cb 0.04 -0.37 -0.07 0.00 -0.57 0.00 0.00 34.95 33.98 3ice s ARG 102 CO 0.13 0.08 1.16 -2.30 -1.08 0.00 0.00 175.30 173.29 3ice n PRO 103 N 2.02 1.43 -1.97 3.89 -0.02 -1.26 -2.90 135.00 136.18 3ice n PRO 103 Ca -0.19 0.52 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 3ice n PRO 103 Cb 0.56 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 3ice n PRO 103 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3ice s PRO 104 N -2.57 4.24 1.23 0.52 0.04 -1.26 -4.82 135.00 132.37 3ice s PRO 104 Ca 0.69 2.34 -0.16 0.00 0.04 0.00 0.00 61.00 63.91 3ice s PRO 104 Cb -0.46 -3.12 0.28 0.00 0.04 0.00 0.00 34.50 31.24 3ice s PRO 104 CO 0.51 -0.50 0.77 1.63 0.04 0.00 0.00 177.00 179.45 3ice n LYS 105 N 2.98 -2.83 -1.91 4.56 4.76 -1.26 -4.74 118.16 119.72 3ice n LYS 105 Ca 0.10 -0.81 -0.42 0.00 -2.87 0.00 0.00 58.31 54.31 3ice n LYS 105 Cb 0.39 -2.01 -0.03 0.00 -1.84 0.00 0.00 35.03 31.55 3ice n LYS 105 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3ice s GLU 106 N -4.27 4.19 0.00 1.97 -6.30 -1.26 -0.99 118.70 112.04 3ice s GLU 106 Ca 0.65 2.36 0.00 0.00 -2.50 0.00 0.00 54.97 55.48 3ice s GLU 106 Cb -0.21 -3.56 0.00 0.00 0.00 0.00 0.00 34.13 30.37 3ice s GLU 106 CO 0.64 -0.73 0.00 0.41 0.02 0.00 0.00 175.26 175.59 3ice n GLY 107 N 3.99 0.67 3.54 -1.50 0.00 -1.26 -5.05 105.19 105.59 3ice n GLY 107 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 3ice n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ice s GLU 108 N -0.72 3.80 0.18 1.61 0.41 -0.16 -4.98 118.70 118.85 3ice s GLU 108 Ca 0.00 -0.41 0.11 0.00 -0.41 0.00 0.00 54.97 54.26 3ice s GLU 108 Cb 0.00 -3.60 -0.09 0.00 -1.78 0.00 0.00 34.13 28.66 3ice s GLU 108 CO 0.00 -0.22 1.32 0.00 -0.49 0.00 0.00 175.26 175.87 3ice h ARG 109 N 8.35 0.00 -6.07 1.61 3.08 -1.94 -3.42 114.38 115.99 3ice h ARG 109 Ca -0.35 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.14 3ice h ARG 109 Cb 1.18 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 31.00 3ice h ARG 109 CO 0.57 0.76 -0.83 0.71 -1.07 0.00 0.00 179.97 180.10 3ice s TYR 110 N -2.82 1.76 0.60 3.04 2.02 -1.26 -4.99 117.35 115.70 3ice s TYR 110 Ca 0.02 -0.40 -0.19 0.00 -0.37 0.00 0.00 57.07 56.14 3ice s TYR 110 Cb 0.09 -1.00 -0.04 0.00 -0.40 0.00 0.00 41.96 40.61 3ice s TYR 110 CO 0.79 0.15 1.04 1.19 -1.57 0.00 0.00 175.55 177.14 3ice n PHE 111 N 1.45 1.08 -4.31 2.71 0.99 -1.25 -4.52 117.46 113.60 3ice n PHE 111 Ca -0.19 0.43 -0.27 0.00 -0.00 0.00 0.00 57.45 57.43 3ice n PHE 111 Cb 0.53 -2.17 -0.10 0.00 -1.00 0.00 0.00 39.48 36.74 3ice n PHE 111 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3ice s ALA 112 N -1.48 2.83 -0.53 4.37 0.00 -1.14 -1.16 121.76 124.65 3ice s ALA 112 Ca 0.77 -1.48 -0.24 0.00 0.00 0.00 0.00 51.96 51.01 3ice s ALA 112 Cb -0.41 -0.65 0.04 0.00 0.00 0.00 0.00 23.12 22.09 3ice s ALA 112 CO 0.46 0.49 0.91 -1.17 0.00 0.00 0.00 175.76 176.45 3ice s LEU 113 N -2.67 4.14 0.03 0.00 2.96 -1.00 -2.13 118.68 120.01 3ice s LEU 113 Ca 0.23 -0.30 -0.25 0.00 -0.22 0.00 0.00 54.13 53.59 3ice s LEU 113 Cb -0.09 -2.87 -0.18 0.00 0.50 0.00 0.00 46.19 43.56 3ice s LEU 113 CO 0.13 -1.17 1.43 0.25 -1.32 0.00 0.00 176.35 175.68 3ice h LEU 114 N 10.80 -0.10 -7.66 -0.68 5.85 -1.39 -3.46 115.31 118.67 3ice h LEU 114 Ca -0.26 -0.24 -0.18 0.00 0.84 0.00 0.00 57.88 58.04 3ice h LEU 114 Cb 1.08 0.03 -0.25 0.00 0.37 0.00 0.00 40.66 41.88 3ice h LEU 114 CO 1.07 0.18 -0.55 -0.75 -0.34 0.00 0.00 178.44 178.05 3ice s LYS 115 N -5.06 0.25 -0.13 1.25 2.47 -0.83 -5.01 119.74 112.67 3ice s LYS 115 Ca -0.15 -0.01 -0.20 0.00 -1.56 0.00 0.00 55.97 54.05 3ice s LYS 115 Cb 0.03 0.11 -0.04 0.00 -1.46 0.00 0.00 37.83 36.48 3ice s LYS 115 CO 0.64 -0.04 0.58 0.08 0.16 0.00 0.00 175.35 176.77 3ice s VAL 116 N -0.39 5.10 -0.20 4.02 1.01 -1.26 -2.04 120.40 126.64 3ice s VAL 116 Ca -0.05 1.16 -0.08 0.00 0.00 0.00 0.00 61.98 63.02 3ice s VAL 116 Cb -0.03 -3.92 -0.10 0.00 0.00 0.00 0.00 36.38 32.33 3ice s VAL 116 CO 0.00 0.24 -0.24 0.59 0.00 0.00 0.00 175.10 175.69 3ice n ASN 117 N 4.11 1.69 -3.68 3.32 3.02 0.44 -4.95 115.26 119.21 3ice n ASN 117 Ca -0.04 0.17 -0.14 0.00 -0.03 0.00 0.00 54.58 54.54 3ice n ASN 117 Cb 0.51 -0.53 -0.14 0.00 -0.61 0.00 0.00 39.78 39.01 3ice n ASN 117 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3ice s GLU 118 N -2.38 0.14 -0.21 3.52 2.12 0.08 -4.41 118.70 117.58 3ice s GLU 118 Ca -0.28 0.66 -0.06 0.00 0.36 0.00 0.00 54.97 55.65 3ice s GLU 118 Cb 0.10 -0.09 -0.03 0.00 0.26 0.00 0.00 34.13 34.37 3ice s GLU 118 CO 0.38 -0.26 0.03 0.54 -0.54 0.00 0.00 175.26 175.41 3ice s VAL 119 N 2.12 4.22 -1.46 3.70 0.11 -0.10 -1.00 120.40 127.99 3ice s VAL 119 Ca -0.01 -0.22 -0.08 0.00 -2.93 0.00 0.00 61.98 58.74 3ice s VAL 119 Cb -0.12 -2.92 0.04 0.00 -1.53 0.00 0.00 36.38 31.86 3ice s VAL 119 CO -0.08 0.42 0.72 0.59 -3.33 0.00 0.00 175.10 173.42 3ice n ASN 120 N 4.21 -5.27 0.00 3.54 3.02 0.94 -1.61 115.26 120.09 3ice n ASN 120 Ca -0.17 -0.44 0.00 0.00 -0.03 0.00 0.00 54.58 53.94 3ice n ASN 120 Cb 0.52 -4.25 0.00 0.00 -0.61 0.00 0.00 39.78 35.44 3ice n ASN 120 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3ice n PHE 121 N -4.46 0.00 -4.42 3.10 3.72 -1.26 -5.00 117.46 109.14 3ice n PHE 121 Ca -0.04 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.15 3ice n PHE 121 Cb 0.57 -0.28 -0.10 0.00 -0.94 0.00 0.00 39.48 38.73 3ice n PHE 121 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ice s ASP 122 N -2.27 2.05 0.61 4.37 1.11 -0.63 -5.08 116.67 116.84 3ice s ASP 122 Ca 0.00 -1.42 -0.19 0.00 0.18 0.00 0.00 52.55 51.12 3ice s ASP 122 Cb 0.00 0.07 -0.03 0.00 1.07 0.00 0.00 42.92 44.03 3ice s ASP 122 CO 0.00 -0.69 1.27 -0.54 1.18 0.00 0.00 175.17 176.39 3ice s LYS 123 N -3.91 2.79 0.00 8.23 1.02 -1.26 -0.93 119.74 125.68 3ice s LYS 123 Ca 0.35 1.99 0.23 0.00 0.02 0.00 0.00 55.97 58.56 3ice s LYS 123 Cb 0.08 -1.93 1.14 0.00 -0.52 0.00 0.00 37.83 36.60 3ice s LYS 123 CO 0.15 -1.39 1.74 -2.30 -0.92 0.00 0.00 175.35 172.63 3ice n PRO 124 N -1.67 0.32 -0.09 -1.68 -0.02 -1.26 -3.83 135.00 126.76 3ice n PRO 124 Ca 0.14 0.07 -0.14 0.00 -2.02 0.00 0.00 63.50 61.55 3ice n PRO 124 Cb 0.48 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.43 3ice n PRO 124 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3ice h GLU 125 N 0.00 0.89 -0.03 -0.52 9.09 -1.97 -3.24 114.58 118.80 3ice h GLU 125 Ca 0.00 -0.55 -0.05 0.00 0.05 0.00 0.00 59.36 58.81 3ice h GLU 125 Cb 0.22 0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.37 3ice h GLU 125 CO 0.00 1.19 -0.21 -2.95 0.05 0.00 0.00 179.01 177.08 3ice h ASN 126 N 0.70 0.05 -0.99 3.06 -1.07 -1.90 -3.02 115.58 112.41 3ice h ASN 126 Ca 0.02 -0.01 0.08 0.00 0.07 0.00 0.00 56.30 56.46 3ice h ASN 126 Cb 1.12 -0.01 -0.07 0.00 -2.07 0.00 0.00 38.32 37.29 3ice h ASN 126 CO 0.12 0.27 0.64 0.00 0.07 0.00 0.00 177.43 178.53 3ice h ALA 127 N 1.74 1.44 -0.78 4.14 0.00 -1.80 -1.90 119.26 122.09 3ice h ALA 127 Ca 0.01 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3ice h ALA 127 Cb 0.41 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3ice h ALA 127 CO 0.03 0.40 0.52 0.00 0.00 0.00 0.00 179.25 180.19 3ice h ARG 128 N 1.13 1.01 -4.49 0.00 3.08 -1.70 -3.36 114.38 110.05 3ice h ARG 128 Ca 0.44 -0.06 -0.65 0.00 0.07 0.00 0.00 59.98 59.77 3ice h ARG 128 Cb 0.23 -0.23 -0.40 0.00 0.08 0.00 0.00 29.97 29.65 3ice h ARG 128 CO -0.18 0.67 -0.71 -0.80 -1.07 0.00 0.00 179.97 177.87 3ice s ASN 129 N -6.31 4.68 -0.20 7.04 -0.87 -0.71 -5.04 114.94 113.53 3ice s ASN 129 Ca -0.11 -2.24 -0.28 0.00 -1.57 0.00 0.00 52.86 48.65 3ice s ASN 129 Cb 0.18 -1.60 0.12 0.00 -0.02 0.00 0.00 41.25 39.93 3ice s ASN 129 CO 0.79 -0.36 0.97 -0.54 -2.57 0.00 0.00 177.10 175.38 3ice s LYS 130 N 0.79 0.62 0.33 -0.60 -0.14 -1.25 -4.87 119.74 114.62 3ice s LYS 130 Ca 0.12 0.35 -0.29 0.00 -1.36 0.00 0.00 55.97 54.79 3ice s LYS 130 Cb -0.20 0.30 -0.10 0.00 -1.68 0.00 0.00 37.83 36.15 3ice s LYS 130 CO -0.08 -0.15 1.26 0.42 -0.76 0.00 0.00 175.35 176.04 3ice s ILE 131 N -0.59 2.88 0.48 2.17 -1.09 -1.26 -5.00 121.20 118.79 3ice s ILE 131 Ca -0.01 0.88 -0.19 0.00 -2.23 0.00 0.00 60.65 59.10 3ice s ILE 131 Cb -0.02 -3.56 -0.09 0.00 -1.58 0.00 0.00 42.46 37.21 3ice s ILE 131 CO -0.00 0.20 0.98 -0.76 -1.23 0.00 0.00 174.94 174.13 3ice s LEU 132 N -1.78 3.78 0.42 2.97 1.43 -1.26 -4.91 118.68 119.32 3ice s LEU 132 Ca 0.49 1.67 0.12 0.00 -1.03 0.00 0.00 54.13 55.38 3ice s LEU 132 Cb -0.38 -4.53 0.96 0.00 0.03 0.00 0.00 46.19 42.28 3ice s LEU 132 CO 0.50 -0.53 1.97 0.15 0.23 0.00 0.00 176.35 178.67 3ice h PHE 133 N 1.40 0.52 0.00 0.29 3.57 -1.95 -0.38 116.94 120.39 3ice h PHE 133 Ca -0.48 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.01 3ice h PHE 133 Cb 1.19 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.76 3ice h PHE 133 CO 0.62 0.25 -0.09 0.93 -2.23 0.00 0.00 178.31 177.79 3ice h GLU 134 N 0.49 0.00 -0.00 1.11 3.07 -1.95 -3.08 114.58 114.22 3ice h GLU 134 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 3ice h GLU 134 Cb 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.42 3ice h GLU 134 CO -0.09 0.09 -0.75 0.09 -1.40 0.00 0.00 179.01 176.95 3ice n ASN 135 N -3.13 0.76 -4.71 1.42 4.13 -0.23 -4.93 115.26 108.56 3ice n ASN 135 Ca 0.03 -0.64 -0.43 0.00 1.68 0.00 0.00 54.58 55.22 3ice n ASN 135 Cb 0.52 0.63 -0.02 0.00 -1.54 0.00 0.00 39.78 39.37 3ice n ASN 135 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3ice n LEU 136 N -1.49 3.79 -4.67 3.41 4.77 -0.71 -4.93 117.00 117.17 3ice n LEU 136 Ca 0.05 1.14 -0.43 0.00 -0.03 0.00 0.00 56.01 56.74 3ice n LEU 136 Cb 0.33 -1.52 -0.02 0.00 -2.33 0.00 0.00 43.42 39.88 3ice n LEU 136 CO 0.39 -0.11 0.91 0.42 -1.33 0.00 0.00 177.39 177.67 3ice s THR 137 N 0.11 4.62 0.33 -5.08 -4.23 -1.26 -4.97 115.64 105.16 3ice s THR 137 Ca 0.67 1.94 -0.17 0.00 -1.18 0.00 0.00 61.69 62.95 3ice s THR 137 Cb -0.56 -4.25 -0.09 0.00 1.34 0.00 0.00 72.50 68.93 3ice s THR 137 CO 0.47 -0.11 0.77 -2.84 -0.54 0.00 0.00 174.62 172.37 3ice s PRO 138 N 2.86 4.08 0.24 3.99 0.02 -1.26 -1.64 135.00 143.28 3ice s PRO 138 Ca 0.47 0.78 0.05 0.00 0.02 0.00 0.00 61.00 62.33 3ice s PRO 138 Cb -0.17 -2.44 -0.02 0.00 0.02 0.00 0.00 34.50 31.88 3ice s PRO 138 CO 0.11 0.15 0.20 1.28 -0.33 0.00 0.00 177.00 178.42 3ice n LEU 139 N -0.28 0.00 -4.89 -5.54 4.77 0.95 -4.89 117.00 107.11 3ice n LEU 139 Ca 0.03 -2.27 -0.29 0.00 -0.03 0.00 0.00 56.01 53.46 3ice n LEU 139 Cb 0.53 1.21 -0.02 0.00 -2.33 0.00 0.00 43.42 42.81 3ice n LEU 139 CO 0.41 -0.38 0.39 -1.00 -1.33 0.00 0.00 177.39 175.48 3ice s HIS 140 N -2.98 3.51 -0.22 -1.77 3.76 -1.26 -3.61 115.29 112.73 3ice s HIS 140 Ca 0.29 0.86 -0.39 0.00 -0.15 0.00 0.00 55.06 55.67 3ice s HIS 140 Cb 0.01 -2.31 -0.15 0.00 1.11 0.00 0.00 32.58 31.24 3ice s HIS 140 CO 0.20 -0.12 1.72 0.00 -0.85 0.00 0.00 174.74 175.69 3ice n ALA 141 N -1.63 -0.13 0.19 -1.40 0.00 -1.26 -4.85 120.51 111.42 3ice n ALA 141 Ca 0.01 0.39 0.05 0.00 0.00 0.00 0.00 53.44 53.88 3ice n ALA 141 Cb 0.54 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.68 3ice n ALA 141 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ice n ASN 142 N 5.23 1.78 -4.17 0.00 4.13 -1.26 -4.57 115.26 116.40 3ice n ASN 142 Ca 0.25 -0.30 -0.34 0.00 1.68 0.00 0.00 54.58 55.87 3ice n ASN 142 Cb 0.15 1.27 -0.15 0.00 -1.54 0.00 0.00 39.78 39.51 3ice n ASN 142 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3ice s SER 143 N -2.63 3.52 0.29 6.41 0.15 -1.26 -4.85 113.70 115.32 3ice s SER 143 Ca -0.01 -0.63 -0.02 0.00 0.70 0.00 0.00 55.95 55.99 3ice s SER 143 Cb 0.07 -1.55 -0.04 0.00 -1.71 0.00 0.00 66.02 62.78 3ice s SER 143 CO 0.41 -0.02 0.52 -0.60 1.20 0.00 0.00 173.24 174.75 3ice s ARG 144 N 1.33 3.56 -0.41 5.44 3.52 -1.26 -0.26 118.95 130.87 3ice s ARG 144 Ca 0.04 -0.16 0.02 0.00 -0.13 0.00 0.00 55.73 55.50 3ice s ARG 144 Cb -0.14 -2.69 0.12 0.00 -1.56 0.00 0.00 34.95 30.68 3ice s ARG 144 CO -0.10 0.23 0.17 -0.51 -0.81 0.00 0.00 175.30 174.28 3ice s LEU 145 N -3.75 3.44 0.00 -0.88 1.43 0.00 -4.92 118.68 114.01 3ice s LEU 145 Ca 0.42 -2.40 -0.10 0.00 -1.03 0.00 0.00 54.13 51.02 3ice s LEU 145 Cb -0.10 -1.27 0.16 0.00 0.03 0.00 0.00 46.19 45.01 3ice s LEU 145 CO 0.32 -0.32 0.37 -1.14 0.23 0.00 0.00 176.35 175.81 3ice n ARG 146 N 3.89 -1.75 -0.04 1.70 3.00 -1.26 -4.61 116.66 117.59 3ice n ARG 146 Ca 0.04 -0.62 0.00 0.00 -0.00 0.00 0.00 57.85 57.28 3ice n ARG 146 Cb 0.37 -1.05 0.00 0.00 0.00 0.00 0.00 32.46 31.78 3ice n ARG 146 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 3ice n GLU 148 N -2.13 0.00 -3.67 -0.14 0.28 -1.26 -4.94 120.64 108.78 3ice n GLU 148 Ca 0.06 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.98 3ice n GLU 148 Cb 0.25 -0.04 -0.09 0.00 1.43 0.00 0.00 31.44 33.00 3ice n GLU 148 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 3ice s ARG 149 N -0.40 0.48 0.00 3.44 0.52 -1.26 -5.02 118.95 116.71 3ice s ARG 149 Ca 0.00 1.03 0.00 0.00 -0.52 0.00 0.00 55.73 56.24 3ice s ARG 149 Cb 0.00 0.20 0.00 0.00 0.52 0.00 0.00 34.95 35.67 3ice s ARG 149 CO 0.00 -0.18 0.34 0.41 0.02 0.00 0.00 175.30 175.89 3ice n GLY 150 N 4.65 0.00 0.03 -3.53 0.00 -1.26 -3.12 105.19 101.96 3ice n GLY 150 Ca -0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.85 3ice n GLY 150 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ice n ASN 151 N -0.82 0.07 -3.78 1.61 4.13 -1.26 -4.81 115.26 110.40 3ice n ASN 151 Ca 0.00 0.41 -0.25 0.00 1.68 0.00 0.00 54.58 56.42 3ice n ASN 151 Cb 0.00 -0.41 0.04 0.00 -1.54 0.00 0.00 39.78 37.86 3ice n ASN 151 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ice n GLY 152 N -1.35 -0.40 3.94 7.41 0.00 -1.18 -4.96 105.19 108.64 3ice n GLY 152 Ca -0.00 0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 3ice n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ice s SER 153 N -3.83 3.32 0.09 1.61 0.01 -1.26 -4.99 113.70 108.65 3ice s SER 153 Ca 0.33 0.16 0.23 0.00 1.31 0.00 0.00 55.95 57.99 3ice s SER 153 Cb -0.16 -0.26 0.02 0.00 0.21 0.00 0.00 66.02 65.82 3ice s SER 153 CO 0.81 -2.59 0.99 0.41 0.41 0.00 0.00 173.24 173.27 3ice n THR 154 N -3.62 0.29 0.01 1.44 -1.04 -1.26 -4.05 114.28 106.06 3ice n THR 154 Ca 0.15 -0.36 -0.03 0.00 -2.04 0.00 0.00 64.05 61.77 3ice n THR 154 Cb 0.60 -0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 69.00 3ice n THR 154 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3ice n GLU 155 N -2.21 0.63 0.29 -2.82 4.71 -1.26 -3.87 120.64 116.10 3ice n GLU 155 Ca 0.01 0.22 0.19 0.00 -0.01 0.00 0.00 57.16 57.57 3ice n GLU 155 Cb 0.49 -1.78 1.02 0.00 -1.01 0.00 0.00 31.44 30.16 3ice n GLU 155 CO 0.00 0.00 0.00 0.22 0.09 0.00 0.00 177.13 177.44 3ice h ASP 156 N 0.00 0.00 -0.12 1.62 3.58 -1.93 -0.35 116.42 119.22 3ice h ASP 156 Ca -0.22 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.26 3ice h ASP 156 Cb 1.73 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.75 3ice h ASP 156 CO 0.05 0.00 -0.08 -0.07 -2.88 0.00 0.00 179.24 176.27 3ice h LEU 157 N 0.00 -0.25 0.14 2.28 3.38 -1.77 -1.18 115.31 117.91 3ice h LEU 157 Ca 0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3ice h LEU 157 Cb 0.02 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3ice h LEU 157 CO 0.00 -0.11 -0.31 0.74 0.09 0.00 0.00 178.44 178.86 3ice h THR 158 N -0.08 0.00 -0.56 0.22 2.02 -1.30 0.44 112.91 113.65 3ice h THR 158 Ca 0.07 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.38 3ice h THR 158 Cb 0.19 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.57 3ice h THR 158 CO -0.17 0.00 0.39 0.00 0.37 0.00 0.00 175.52 176.11 3ice h ALA 159 N -1.04 2.30 0.13 6.16 0.00 -1.60 -0.88 119.26 124.33 3ice h ALA 159 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3ice h ALA 159 Cb 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3ice h ALA 159 CO -0.13 -0.44 -0.06 -0.09 0.00 0.00 0.00 179.25 178.52 3ice h ARG 160 N 0.17 -0.16 -0.36 0.00 2.43 -0.47 -1.21 114.38 114.77 3ice h ARG 160 Ca 0.27 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.47 3ice h ARG 160 Cb 0.82 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 3ice h ARG 160 CO -0.04 0.19 0.24 0.28 -1.51 0.00 0.00 179.97 179.13 3ice h VAL 161 N -0.54 1.04 0.11 0.20 2.07 -0.38 -1.96 116.25 116.79 3ice h VAL 161 Ca -0.02 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3ice h VAL 161 Cb 0.43 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 3ice h VAL 161 CO 0.03 0.07 -0.05 -0.07 0.02 0.00 0.00 177.57 177.57 3ice h LEU 162 N 0.40 -0.13 -2.06 2.57 3.38 -0.93 0.19 115.31 118.74 3ice h LEU 162 Ca 0.14 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.15 3ice h LEU 162 Cb 0.07 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3ice h LEU 162 CO -0.03 -0.06 0.15 0.44 0.09 0.00 0.00 178.44 179.02 3ice h ASP 163 N -0.18 0.00 0.24 -0.43 3.32 -0.50 0.16 116.42 119.03 3ice h ASP 163 Ca -0.02 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.69 3ice h ASP 163 Cb 0.14 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 3ice h ASP 163 CO 0.03 0.00 -1.87 -0.07 -1.72 0.00 0.00 179.24 175.60 3ice h LEU 164 N 0.00 0.34 0.00 1.55 3.38 -1.02 -3.37 115.31 116.19 3ice h LEU 164 Ca 0.09 -0.71 -0.03 0.00 0.09 0.00 0.00 57.88 57.33 3ice h LEU 164 Cb 0.40 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3ice h LEU 164 CO -0.00 1.63 -0.23 0.00 0.09 0.00 0.00 178.44 179.93 3ice h ALA 165 N 0.32 0.03 -2.90 1.53 0.00 -0.42 -3.46 119.26 114.37 3ice h ALA 165 Ca -0.37 -0.38 -0.55 0.00 0.00 0.00 0.00 54.91 53.62 3ice h ALA 165 Cb 2.03 0.17 -0.40 0.00 0.00 0.00 0.00 17.79 19.59 3ice h ALA 165 CO 0.10 0.17 -0.77 -1.54 0.00 0.00 0.00 179.25 177.20 3ice s SER 166 N -5.94 3.68 0.78 0.00 1.04 0.56 -3.43 113.70 110.40 3ice s SER 166 Ca -0.11 -1.39 -0.13 0.00 0.48 0.00 0.00 55.95 54.80 3ice s SER 166 Cb 0.00 -0.50 0.07 0.00 0.10 0.00 0.00 66.02 65.68 3ice s SER 166 CO 0.31 -0.43 1.16 -2.84 0.98 0.00 0.00 173.24 172.42 3ice s PRO 167 N 1.96 1.94 -0.10 4.02 0.02 -1.24 -4.41 135.00 137.19 3ice s PRO 167 Ca 0.09 1.56 0.03 0.00 0.02 0.00 0.00 61.00 62.71 3ice s PRO 167 Cb -0.16 -1.83 -0.01 0.00 0.02 0.00 0.00 34.50 32.52 3ice s PRO 167 CO -0.33 -1.95 -0.21 0.42 -0.33 0.00 0.00 177.00 174.59 3ice s ILE 168 N -2.35 2.31 0.23 2.83 1.09 -1.26 -4.84 121.20 119.21 3ice s ILE 168 Ca 0.69 -0.94 0.01 0.00 -1.10 0.00 0.00 60.65 59.31 3ice s ILE 168 Cb -0.24 -1.90 0.01 0.00 -1.06 0.00 0.00 42.46 39.27 3ice s ILE 168 CO 0.50 0.55 0.04 0.61 -0.10 0.00 0.00 174.94 176.55 3ice n GLY 169 N 3.39 3.68 3.64 6.18 0.00 -1.26 -0.81 105.19 119.99 3ice n GLY 169 Ca -0.18 -2.27 -0.40 0.00 0.00 0.00 0.00 46.02 43.16 3ice n GLY 169 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ice s ARG 170 N -2.86 4.14 0.00 1.61 0.52 0.64 -3.27 118.95 119.72 3ice s ARG 170 Ca 0.03 0.54 0.00 0.00 -0.52 0.00 0.00 55.73 55.79 3ice s ARG 170 Cb -0.00 -3.62 0.00 0.00 0.52 0.00 0.00 34.95 31.84 3ice s ARG 170 CO 0.02 -0.34 0.00 0.41 0.02 0.00 0.00 175.30 175.41 3ice n GLY 171 N 4.05 1.02 3.59 -3.53 0.00 -1.24 -4.26 105.19 104.83 3ice n GLY 171 Ca -0.01 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3ice n GLY 171 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ice s GLN 172 N -0.26 3.57 -1.58 1.61 2.00 -1.20 -3.94 119.66 119.86 3ice s GLN 172 Ca 0.00 0.62 -0.10 0.00 -2.00 0.00 0.00 55.36 53.88 3ice s GLN 172 Cb 0.00 -4.00 -0.05 0.00 0.80 0.00 0.00 33.01 29.76 3ice s GLN 172 CO 0.00 -1.59 2.82 -2.13 -0.50 0.00 0.00 175.29 173.89 3ice n ARG 173 N 8.16 3.70 -2.39 1.67 0.63 -1.26 -2.70 116.66 124.47 3ice n ARG 173 Ca 0.13 -2.38 -0.26 0.00 -0.92 0.00 0.00 57.85 54.42 3ice n ARG 173 Cb 0.49 -2.84 0.04 0.00 0.45 0.00 0.00 32.46 30.60 3ice n ARG 173 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3ice s GLY 174 N 2.09 1.65 -0.19 5.14 0.00 -0.33 -1.84 107.32 113.84 3ice s GLY 174 Ca 0.66 -0.84 -0.11 0.00 0.00 0.00 0.00 44.72 44.42 3ice s GLY 174 CO -0.07 -0.53 0.47 -2.27 0.00 0.00 0.00 173.10 170.71 3ice s LEU 175 N -5.03 -0.27 -0.32 0.66 2.96 -1.26 -3.28 118.68 112.15 3ice s LEU 175 Ca 0.56 1.03 -0.06 0.00 -0.22 0.00 0.00 54.13 55.44 3ice s LEU 175 Cb -0.11 1.59 0.03 0.00 0.50 0.00 0.00 46.19 48.20 3ice s LEU 175 CO 0.44 -0.20 0.08 0.27 -1.32 0.00 0.00 176.35 175.62 3ice s ILE 176 N 1.40 3.73 -0.01 6.68 -4.36 0.15 -2.23 121.20 126.56 3ice s ILE 176 Ca -0.09 -1.01 -0.06 0.00 -0.26 0.00 0.00 60.65 59.23 3ice s ILE 176 Cb -0.07 -3.05 -0.04 0.00 1.25 0.00 0.00 42.46 40.54 3ice s ILE 176 CO -0.14 -0.08 0.23 -0.69 0.24 0.00 0.00 174.94 174.51 3ice s VAL 177 N 1.42 5.36 -0.24 8.37 1.01 -0.85 -0.66 120.40 134.81 3ice s VAL 177 Ca -0.01 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 3ice s VAL 177 Cb -0.19 -3.54 0.17 0.00 0.00 0.00 0.00 36.38 32.82 3ice s VAL 177 CO 0.02 0.39 1.24 0.00 0.00 0.00 0.00 175.10 176.75 3ice s ALA 178 N -1.27 -2.06 0.89 5.51 0.00 -0.25 -2.02 121.76 122.55 3ice s ALA 178 Ca 0.26 1.78 -0.12 0.00 0.00 0.00 0.00 51.96 53.88 3ice s ALA 178 Cb -0.13 -1.14 0.12 0.00 0.00 0.00 0.00 23.12 21.97 3ice s ALA 178 CO 0.15 -0.30 1.12 -2.14 0.00 0.00 0.00 175.76 174.59 3ice s PRO 179 N -1.19 1.32 0.21 0.00 0.02 -1.26 -2.89 135.00 131.21 3ice s PRO 179 Ca 0.06 0.47 -0.32 0.00 0.02 0.00 0.00 61.00 61.23 3ice s PRO 179 Cb -0.01 -1.84 -0.12 0.00 0.02 0.00 0.00 34.50 32.54 3ice s PRO 179 CO -0.05 -2.11 1.69 -2.30 -0.33 0.00 0.00 177.00 173.90 3ice n PRO 180 N -3.74 2.67 -2.58 5.54 -0.02 -1.26 -3.26 135.00 132.35 3ice n PRO 180 Ca 0.06 0.96 -0.06 0.00 -2.02 0.00 0.00 63.50 62.44 3ice n PRO 180 Cb 0.58 -2.79 0.03 0.00 -0.02 0.00 0.00 33.50 31.30 3ice n PRO 180 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3ice n LYS 181 N 3.71 -2.36 -0.12 -0.52 4.81 -1.26 -4.97 118.16 117.45 3ice n LYS 181 Ca 0.15 0.29 0.04 0.00 -0.87 0.00 0.00 58.31 57.93 3ice n LYS 181 Cb 0.34 -3.64 0.06 0.00 0.02 0.00 0.00 35.03 31.81 3ice n LYS 181 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3ice n ALA 182 N -2.37 2.00 -0.94 3.14 0.00 -1.20 -4.87 120.51 116.26 3ice n ALA 182 Ca -0.07 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.70 3ice n ALA 182 Cb 0.55 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.74 3ice n ALA 182 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ice n GLY 183 N -0.77 0.73 0.25 0.00 0.00 -1.26 -4.50 105.19 99.63 3ice n GLY 183 Ca 0.07 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 3ice n GLY 183 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3ice h LYS 184 N 0.00 -0.54 -1.17 1.61 3.64 -1.93 -2.51 116.57 115.67 3ice h LYS 184 Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3ice h LYS 184 Cb 0.28 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3ice h LYS 184 CO 0.00 -0.35 0.00 2.41 -2.27 0.00 0.00 179.45 179.24 3ice n THR 185 N -5.15 0.27 0.00 1.00 -1.04 -1.26 -2.78 114.28 105.31 3ice n THR 185 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 3ice n THR 185 Cb 0.22 -0.53 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 3ice n THR 185 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3ice n LEU 187 N 0.62 0.00 -0.10 -4.42 7.94 -0.95 -2.18 117.00 117.91 3ice n LEU 187 Ca 0.00 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.83 3ice n LEU 187 Cb 0.17 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.13 3ice n LEU 187 CO 0.00 0.00 0.94 0.25 -1.11 0.00 0.00 177.39 177.47 3ice h LEU 188 N 0.00 0.13 -0.46 -1.96 5.85 -1.79 -0.13 115.31 116.95 3ice h LEU 188 Ca 0.00 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.84 3ice h LEU 188 Cb 0.00 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 40.98 3ice h LEU 188 CO 0.00 0.11 0.02 1.56 -0.34 0.00 0.00 178.44 179.80 3ice h GLN 189 N 0.27 0.13 -0.32 1.25 4.20 -1.76 -0.80 115.11 118.09 3ice h GLN 189 Ca 0.16 -0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.92 3ice h GLN 189 Cb 0.13 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 27.81 3ice h GLN 189 CO -0.16 0.09 -0.11 -0.97 -0.67 0.00 0.00 178.83 177.01 3ice h ASN 190 N 0.14 -0.37 -0.94 1.46 -1.24 -1.49 -1.20 115.58 111.94 3ice h ASN 190 Ca 0.23 0.11 0.02 0.00 0.71 0.00 0.00 56.30 57.37 3ice h ASN 190 Cb 0.33 0.23 -0.05 0.00 0.73 0.00 0.00 38.32 39.56 3ice h ASN 190 CO -0.36 -0.14 0.62 0.40 -1.29 0.00 0.00 177.43 176.66 3ice h ILE 191 N -0.04 1.20 0.25 2.57 2.04 -0.51 -0.41 117.51 122.61 3ice h ILE 191 Ca 0.16 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.60 3ice h ILE 191 Cb 0.28 -0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 3ice h ILE 191 CO -0.35 0.22 -0.27 0.00 0.00 0.00 0.00 178.15 177.75 3ice h ALA 192 N 1.36 -0.56 -0.05 1.87 0.00 -0.04 -0.91 119.26 120.93 3ice h ALA 192 Ca 0.36 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 3ice h ALA 192 Cb -0.08 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3ice h ALA 192 CO -0.10 -0.85 0.03 1.96 0.00 0.00 0.00 179.25 180.29 3ice h GLN 193 N -0.57 0.08 -0.79 0.00 4.20 -0.97 -0.54 115.11 116.51 3ice h GLN 193 Ca -0.00 -0.01 0.22 0.00 0.06 0.00 0.00 58.65 58.91 3ice h GLN 193 Cb 0.53 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.26 3ice h GLN 193 CO -0.08 0.16 0.56 1.03 -0.67 0.00 0.00 178.83 179.83 3ice h SER 194 N -0.03 0.10 0.40 1.46 0.87 -1.00 -0.30 113.55 115.05 3ice h SER 194 Ca 0.02 0.01 -0.32 0.00 -1.23 0.00 0.00 61.79 60.27 3ice h SER 194 Cb 0.11 -0.01 0.02 0.00 -0.44 0.00 0.00 62.40 62.08 3ice h SER 194 CO -0.00 0.04 -1.45 -0.29 -0.53 0.00 0.00 176.83 174.60 3ice h ILE 195 N 0.10 1.29 0.00 2.23 2.10 -0.54 -2.78 117.51 119.91 3ice h ILE 195 Ca 0.39 -2.81 0.00 0.00 1.08 0.00 0.00 64.86 63.52 3ice h ILE 195 Cb 1.38 2.94 0.00 0.00 -1.09 0.00 0.00 36.82 40.05 3ice h ILE 195 CO -0.04 0.84 0.00 0.00 -1.08 0.00 0.00 178.15 177.87 3ice n ALA 196 N -2.67 2.19 0.00 0.18 0.00 -0.14 -1.07 120.51 119.01 3ice n ALA 196 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3ice n ALA 196 Cb 1.07 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 3ice n ALA 196 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3ice n TYR 197 N 0.14 0.00 -0.02 0.00 -0.00 -1.10 -4.79 117.16 111.38 3ice n TYR 197 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 57.97 3ice n TYR 197 Cb 0.21 0.00 -0.16 0.00 -0.00 0.00 0.00 39.34 39.39 3ice n TYR 197 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 3ice n ASN 198 N -1.05 0.02 -3.06 2.98 4.13 -1.05 -4.72 115.26 112.52 3ice n ASN 198 Ca 0.00 0.01 -0.19 0.00 1.68 0.00 0.00 54.58 56.08 3ice n ASN 198 Cb 0.12 1.77 -0.03 0.00 -1.54 0.00 0.00 39.78 40.10 3ice n ASN 198 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 3ice n HIS 199 N -2.36 -1.18 0.31 3.10 8.25 -0.23 -4.93 115.22 118.17 3ice n HIS 199 Ca -0.09 -3.07 0.17 0.00 -0.26 0.00 0.00 57.72 54.47 3ice n HIS 199 Cb 0.68 0.20 0.75 0.00 1.12 0.00 0.00 29.99 32.74 3ice n HIS 199 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3ice h PRO 200 N 3.90 0.00 0.00 -0.41 0.11 -1.85 -2.27 132.00 131.48 3ice h PRO 200 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 3ice h PRO 200 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3ice h PRO 200 CO 0.42 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.81 3ice n ASP 201 N -2.78 0.00 -4.81 -2.05 5.75 -1.26 -4.75 116.55 106.64 3ice n ASP 201 Ca -0.00 0.43 -0.38 0.00 -0.01 0.00 0.00 54.79 54.82 3ice n ASP 201 Cb 0.20 -0.47 -0.06 0.00 -1.03 0.00 0.00 41.12 39.76 3ice n ASP 201 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ice s VAL 203 N -0.87 4.45 0.41 0.00 1.01 -0.25 -4.94 120.40 120.22 3ice s VAL 203 Ca 0.26 1.23 0.08 0.00 0.00 0.00 0.00 61.98 63.55 3ice s VAL 203 Cb -0.18 -4.44 0.01 0.00 0.00 0.00 0.00 36.38 31.77 3ice s VAL 203 CO 0.15 -0.70 0.55 -0.22 0.00 0.00 0.00 175.10 174.88 3ice s LEU 204 N 3.82 3.68 -0.30 3.92 2.96 -1.26 -1.34 118.68 130.16 3ice s LEU 204 Ca 0.42 -0.41 -0.13 0.00 -0.22 0.00 0.00 54.13 53.78 3ice s LEU 204 Cb -0.10 -2.64 0.18 0.00 0.50 0.00 0.00 46.19 44.13 3ice s LEU 204 CO 0.23 -0.72 1.07 -0.69 -1.32 0.00 0.00 176.35 174.92 3ice s VAL 206 N -2.34 -0.27 -0.30 1.68 1.01 -0.12 -2.07 120.40 117.98 3ice s VAL 206 Ca 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.43 3ice s VAL 206 Cb -0.10 -0.85 -0.01 0.00 0.00 0.00 0.00 36.38 35.43 3ice s VAL 206 CO 0.33 0.00 0.14 -0.22 0.00 0.00 0.00 175.10 175.34 3ice s LEU 207 N 2.96 4.00 -0.57 3.92 2.96 -1.05 -1.43 118.68 129.47 3ice s LEU 207 Ca 0.04 -0.49 -0.06 0.00 -0.22 0.00 0.00 54.13 53.40 3ice s LEU 207 Cb -0.08 -1.98 0.15 0.00 0.50 0.00 0.00 46.19 44.77 3ice s LEU 207 CO -0.13 -0.17 0.41 -0.76 -1.32 0.00 0.00 176.35 174.38 3ice s LEU 208 N 1.61 5.52 -0.26 -0.68 1.43 -0.97 -1.38 118.68 123.94 3ice s LEU 208 Ca 0.05 -2.45 -0.23 0.00 -1.03 0.00 0.00 54.13 50.46 3ice s LEU 208 Cb -0.17 -1.93 -0.01 0.00 0.03 0.00 0.00 46.19 44.12 3ice s LEU 208 CO 0.06 -0.50 0.77 -0.63 0.23 0.00 0.00 176.35 176.27 3ice s ILE 209 N 0.53 4.86 -1.94 -0.59 1.09 -0.87 -2.11 121.20 122.17 3ice s ILE 209 Ca 0.13 1.36 0.00 0.00 -1.10 0.00 0.00 60.65 61.04 3ice s ILE 209 Cb -0.21 -4.08 0.00 0.00 -1.06 0.00 0.00 42.46 37.12 3ice s ILE 209 CO -0.04 -0.09 0.00 -0.67 -0.10 0.00 0.00 174.94 174.04 3ice n ASP 210 N 5.98 -4.90 -4.98 3.58 -0.08 0.35 -4.52 116.55 111.98 3ice n ASP 210 Ca 0.03 0.43 -0.19 0.00 -1.51 0.00 0.00 54.79 53.56 3ice n ASP 210 Cb 0.48 -4.36 0.03 0.00 2.34 0.00 0.00 41.12 39.60 3ice n ASP 210 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 3ice s GLU 211 N -3.65 2.63 0.40 -0.67 0.41 -1.26 -4.14 118.70 112.42 3ice s GLU 211 Ca 0.00 -1.11 -0.23 0.00 -0.41 0.00 0.00 54.97 53.22 3ice s GLU 211 Cb 0.00 -2.64 -0.13 0.00 -1.78 0.00 0.00 34.13 29.59 3ice s GLU 211 CO 0.00 -0.53 0.64 0.54 -0.49 0.00 0.00 175.26 175.42 3ice n ARG 212 N -2.10 0.70 0.23 1.61 1.74 -1.26 -4.16 116.66 113.42 3ice n ARG 212 Ca 0.09 0.25 -0.15 0.00 -0.77 0.00 0.00 57.85 57.27 3ice n ARG 212 Cb 0.60 -1.58 -0.08 0.00 -1.02 0.00 0.00 32.46 30.38 3ice n ARG 212 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3ice h PRO 213 N 0.99 -0.55 -0.84 5.56 0.11 -1.98 -2.80 132.00 132.48 3ice h PRO 213 Ca -0.40 0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.78 3ice h PRO 213 Cb 1.39 0.13 -0.05 0.00 0.11 0.00 0.00 31.00 32.58 3ice h PRO 213 CO 0.53 -0.37 0.56 1.05 -0.21 0.00 0.00 178.00 179.56 3ice h GLU 214 N -0.57 1.03 -0.87 1.05 9.09 -2.00 -0.44 114.58 121.86 3ice h GLU 214 Ca -0.04 -0.06 0.12 0.00 0.05 0.00 0.00 59.36 59.43 3ice h GLU 214 Cb 0.47 -0.23 -0.07 0.00 -1.65 0.00 0.00 28.75 27.28 3ice h GLU 214 CO 0.04 0.68 0.56 0.93 0.05 0.00 0.00 179.01 181.27 3ice h GLU 215 N 1.06 0.75 0.56 1.06 5.08 -1.88 0.11 114.58 121.32 3ice h GLU 215 Ca 0.33 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.62 3ice h GLU 215 Cb 0.02 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.10 3ice h GLU 215 CO -0.10 0.49 -0.27 0.28 -1.00 0.00 0.00 179.01 178.42 3ice h VAL 216 N 0.77 0.40 -0.24 3.13 2.07 -0.82 -3.14 116.25 118.43 3ice h VAL 216 Ca 0.42 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.69 3ice h VAL 216 Cb 0.55 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 3ice h VAL 216 CO -0.18 0.03 -0.04 0.71 0.02 0.00 0.00 177.57 178.11 3ice h THR 217 N -0.89 1.17 0.00 2.57 1.35 -1.17 0.31 112.91 116.24 3ice h THR 217 Ca -0.08 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 3ice h THR 217 Cb 0.63 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 68.08 3ice h THR 217 CO 0.13 0.22 0.00 -1.84 -0.25 0.00 0.00 175.52 173.78 3ice n GLU 218 N -4.31 0.52 0.00 4.72 0.28 0.34 -2.23 120.64 119.96 3ice n GLU 218 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3ice n GLU 218 Cb 0.23 -1.26 0.00 0.00 1.43 0.00 0.00 31.44 31.84 3ice n GLU 218 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 3ice n GLN 220 N 0.37 0.00 0.22 3.44 7.27 0.11 -1.02 117.38 127.76 3ice n GLN 220 Ca 0.00 0.00 0.12 0.00 0.07 0.00 0.00 57.00 57.19 3ice n GLN 220 Cb 0.16 0.00 0.20 0.00 2.41 0.00 0.00 30.24 33.02 3ice n GLN 220 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3ice h ARG 221 N 0.00 0.00 0.00 3.69 3.08 -1.71 -3.29 114.38 116.15 3ice h ARG 221 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 3ice h ARG 221 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3ice h ARG 221 CO 0.00 0.04 -1.42 1.28 -1.07 0.00 0.00 179.97 178.80 3ice n LEU 222 N -3.11 0.75 -4.85 3.04 4.32 -0.19 -4.93 117.00 112.04 3ice n LEU 222 Ca 0.04 0.32 -0.37 0.00 -0.02 0.00 0.00 56.01 55.98 3ice n LEU 222 Cb 0.53 0.06 -0.06 0.00 -1.62 0.00 0.00 43.42 42.33 3ice n LEU 222 CO 0.34 0.08 -0.08 -0.69 -1.22 0.00 0.00 177.39 175.82 3ice s VAL 223 N -3.03 5.35 -0.90 4.08 1.01 -1.24 -4.91 120.40 120.76 3ice s VAL 223 Ca -0.03 0.41 -0.11 0.00 0.00 0.00 0.00 61.98 62.25 3ice s VAL 223 Cb 0.09 -3.51 0.23 0.00 0.00 0.00 0.00 36.38 33.19 3ice s VAL 223 CO 0.81 0.58 0.84 -0.54 0.00 0.00 0.00 175.10 176.80 3ice s LYS 224 N -0.84 3.67 0.00 2.72 1.02 -1.26 -4.90 119.74 120.15 3ice s LYS 224 Ca 0.17 -2.76 0.00 0.00 0.02 0.00 0.00 55.97 53.40 3ice s LYS 224 Cb -0.13 -4.37 0.00 0.00 -0.52 0.00 0.00 37.83 32.80 3ice s LYS 224 CO 0.06 -1.26 0.00 0.41 -0.92 0.00 0.00 175.35 173.64 3ice n GLY 225 N 3.43 -0.85 3.26 -3.33 0.00 -1.26 -4.88 105.19 101.55 3ice n GLY 225 Ca 0.17 -0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 3ice n GLY 225 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ice s GLU 226 N -0.67 2.82 -0.52 1.61 2.12 -0.88 -5.05 118.70 118.13 3ice s GLU 226 Ca 0.00 -1.01 -0.09 0.00 0.36 0.00 0.00 54.97 54.23 3ice s GLU 226 Cb 0.00 -3.22 0.13 0.00 0.26 0.00 0.00 34.13 31.30 3ice s GLU 226 CO 0.00 -0.49 0.39 0.08 -0.54 0.00 0.00 175.26 174.70 3ice s VAL 227 N 1.38 4.26 -0.18 3.70 1.01 -1.26 -0.94 120.40 128.36 3ice s VAL 227 Ca -0.00 -1.98 -0.13 0.00 0.00 0.00 0.00 61.98 59.86 3ice s VAL 227 Cb -0.18 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 3ice s VAL 227 CO -0.00 -0.81 0.28 0.68 0.00 0.00 0.00 175.10 175.25 3ice s VAL 228 N 1.10 5.30 0.23 2.92 -7.23 -0.52 -4.97 120.40 117.24 3ice s VAL 228 Ca 0.08 0.49 0.01 0.00 -1.81 0.00 0.00 61.98 60.75 3ice s VAL 228 Cb -0.24 -3.62 -0.04 0.00 0.56 0.00 0.00 36.38 33.04 3ice s VAL 228 CO -0.02 0.36 0.15 0.00 -0.31 0.00 0.00 175.10 175.28 3ice s ALA 229 N 0.72 1.37 -0.41 1.32 0.00 -1.26 -2.30 121.76 121.20 3ice s ALA 229 Ca 0.15 -1.77 0.07 0.00 0.00 0.00 0.00 51.96 50.41 3ice s ALA 229 Cb -0.13 1.35 0.18 0.00 0.00 0.00 0.00 23.12 24.52 3ice s ALA 229 CO 0.04 -0.58 0.60 0.45 0.00 0.00 0.00 175.76 176.27 3ice s SER 230 N -3.22 -1.16 1.15 0.00 0.15 -0.90 -4.93 113.70 104.81 3ice s SER 230 Ca 0.39 -0.92 -0.17 0.00 0.70 0.00 0.00 55.95 55.94 3ice s SER 230 Cb 0.06 1.77 0.19 0.00 -1.71 0.00 0.00 66.02 66.33 3ice s SER 230 CO 0.15 -0.18 0.34 0.35 1.20 0.00 0.00 173.24 175.10 3ice n THR 231 N 4.35 0.00 1.61 6.45 -2.24 -1.26 -0.50 114.28 122.69 3ice n THR 231 Ca 0.11 -0.20 0.08 0.00 -2.27 0.00 0.00 64.05 61.77 3ice n THR 231 Cb 0.55 -0.67 0.45 0.00 -2.10 0.00 0.00 70.33 68.56 3ice n THR 231 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3ice n PHE 232 N -4.73 0.00 0.18 4.78 1.16 -1.26 -2.20 117.46 115.39 3ice n PHE 232 Ca 0.04 0.00 0.05 0.00 -1.87 0.00 0.00 57.45 55.67 3ice n PHE 232 Cb 0.53 0.00 0.27 0.00 -1.61 0.00 0.00 39.48 38.68 3ice n PHE 232 CO 0.00 0.00 0.00 -0.44 -1.87 0.00 0.00 176.76 174.45 3ice h ASP 233 N 0.00 0.00 -3.93 5.98 3.32 -1.94 -3.46 116.42 116.39 3ice h ASP 233 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 3ice h ASP 233 Cb 0.00 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.56 3ice h ASP 233 CO 0.00 0.41 0.24 -1.61 -1.72 0.00 0.00 179.24 176.56 3ice s GLU 234 N -3.47 3.83 0.68 3.56 0.41 -0.94 -5.07 118.70 117.70 3ice s GLU 234 Ca 0.01 0.67 -0.11 0.00 -0.41 0.00 0.00 54.97 55.13 3ice s GLU 234 Cb 0.10 -2.27 -0.00 0.00 -1.78 0.00 0.00 34.13 30.18 3ice s GLU 234 CO 0.70 -0.17 1.06 -2.14 -0.49 0.00 0.00 175.26 174.22 3ice s PRO 235 N -4.06 3.05 0.61 0.39 0.02 -1.26 -4.92 135.00 128.83 3ice s PRO 235 Ca 0.54 0.76 0.29 0.00 0.02 0.00 0.00 61.00 62.62 3ice s PRO 235 Cb -0.10 -2.02 1.57 0.00 0.02 0.00 0.00 34.50 33.97 3ice s PRO 235 CO 0.33 -0.97 1.95 0.00 -0.33 0.00 0.00 177.00 177.99 3ice h ALA 236 N -0.61 1.86 0.04 -1.55 0.00 -1.97 -1.86 119.26 115.15 3ice h ALA 236 Ca -0.44 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 3ice h ALA 236 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3ice h ALA 236 CO 0.60 -0.51 -0.02 0.77 0.00 0.00 0.00 179.25 180.09 3ice h SER 237 N 0.00 -0.05 -0.34 0.00 0.02 -1.92 -1.86 113.55 109.41 3ice h SER 237 Ca 0.13 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 3ice h SER 237 Cb 0.87 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 3ice h SER 237 CO -0.00 -0.01 0.08 -0.09 -1.14 0.00 0.00 176.83 175.67 3ice h ARG 238 N -0.08 0.54 -0.34 3.45 2.43 -1.71 -2.18 114.38 116.48 3ice h ARG 238 Ca -0.01 -0.13 0.07 0.00 -0.81 0.00 0.00 59.98 59.10 3ice h ARG 238 Cb 0.06 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.48 3ice h ARG 238 CO 0.01 0.59 -0.04 0.45 -1.51 0.00 0.00 179.97 179.47 3ice h HIS 239 N 0.39 -0.09 -0.13 2.20 3.86 -1.40 -0.43 115.15 119.55 3ice h HIS 239 Ca 0.11 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 3ice h HIS 239 Cb 0.30 0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 3ice h HIS 239 CO 0.01 -0.10 0.05 0.28 0.86 0.00 0.00 177.93 179.04 3ice h VAL 240 N 0.05 1.15 -0.19 2.45 2.07 -1.30 -1.48 116.25 119.00 3ice h VAL 240 Ca 0.17 -0.44 0.04 0.00 0.82 0.00 0.00 66.70 67.28 3ice h VAL 240 Cb 0.24 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 3ice h VAL 240 CO -0.31 0.14 -0.06 -0.61 0.02 0.00 0.00 177.57 176.74 3ice h GLN 241 N 0.06 -0.02 -0.37 1.57 5.75 -0.90 -0.16 115.11 121.04 3ice h GLN 241 Ca 0.04 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.51 3ice h GLN 241 Cb 0.17 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 3ice h GLN 241 CO -0.00 -0.01 0.09 0.28 -2.65 0.00 0.00 178.83 176.54 3ice h VAL 242 N -0.02 1.22 -0.86 2.39 2.07 -1.09 -2.92 116.25 117.05 3ice h VAL 242 Ca 0.09 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3ice h VAL 242 Cb 0.16 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 3ice h VAL 242 CO -0.20 0.26 0.55 0.00 0.02 0.00 0.00 177.57 178.19 3ice h ALA 243 N 0.94 1.09 0.00 1.67 0.00 -1.10 -1.47 119.26 120.39 3ice h ALA 243 Ca 0.12 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3ice h ALA 243 Cb 0.30 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ice h ALA 243 CO 0.00 0.52 0.00 0.39 0.00 0.00 0.00 179.25 180.16 3ice n GLU 244 N -4.46 0.31 0.00 0.00 -0.58 -0.09 -1.08 120.64 114.74 3ice n GLU 244 Ca 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 3ice n GLU 244 Cb 0.03 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 3ice n GLU 244 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3ice n VAL 246 N 0.80 0.00 -0.34 2.62 0.31 -0.55 -2.31 118.33 118.85 3ice n VAL 246 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.30 3ice n VAL 246 Cb 0.15 0.00 0.10 0.00 -0.91 0.00 0.00 33.84 33.17 3ice n VAL 246 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 3ice h ILE 247 N 0.00 1.22 -0.42 2.52 6.09 -1.37 -1.46 117.51 124.09 3ice h ILE 247 Ca 0.00 -0.42 -0.02 0.00 -1.37 0.00 0.00 64.86 63.04 3ice h ILE 247 Cb 0.00 -0.11 -0.02 0.00 0.47 0.00 0.00 36.82 37.16 3ice h ILE 247 CO 0.00 0.22 0.16 -0.33 -3.07 0.00 0.00 178.15 175.14 3ice h GLU 248 N 1.23 0.62 -0.95 2.19 4.39 -1.71 -1.03 114.58 119.33 3ice h GLU 248 Ca 0.34 -0.12 0.11 0.00 0.34 0.00 0.00 59.36 60.03 3ice h GLU 248 Cb -0.12 -0.10 -0.08 0.00 -0.10 0.00 0.00 28.75 28.35 3ice h GLU 248 CO -0.08 0.59 0.59 -0.22 -1.16 0.00 0.00 179.01 178.72 3ice h LYS 249 N 0.53 0.92 0.57 2.33 3.64 -1.62 -0.87 116.57 122.07 3ice h LYS 249 Ca 0.14 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.44 3ice h LYS 249 Cb 0.20 -0.21 0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3ice h LYS 249 CO -0.01 0.61 -0.27 0.00 -2.27 0.00 0.00 179.45 177.51 3ice h ALA 250 N 1.51 -0.76 -0.05 5.00 0.00 -0.72 -2.29 119.26 121.95 3ice h ALA 250 Ca 0.47 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.19 3ice h ALA 250 Cb 0.43 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 3ice h ALA 250 CO -0.26 -0.79 0.13 0.87 0.00 0.00 0.00 179.25 179.21 3ice h LYS 251 N -1.04 0.00 0.24 0.00 1.57 -0.92 -0.67 116.57 115.75 3ice h LYS 251 Ca -0.08 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.36 3ice h LYS 251 Cb 0.65 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.99 3ice h LYS 251 CO 0.13 0.00 -1.54 -0.09 -0.57 0.00 0.00 179.45 177.38 3ice h ARG 252 N 0.00 0.51 -0.19 3.15 9.65 -0.98 -3.09 114.38 123.42 3ice h ARG 252 Ca 0.03 -0.87 -0.18 0.00 -1.10 0.00 0.00 59.98 57.85 3ice h ARG 252 Cb 0.29 0.32 -0.00 0.00 -1.39 0.00 0.00 29.97 29.20 3ice h ARG 252 CO -0.00 1.42 -0.63 -0.07 2.80 0.00 0.00 179.97 183.49 3ice h LEU 253 N 0.13 0.76 -2.63 3.80 3.38 -0.65 -2.80 115.31 117.30 3ice h LEU 253 Ca -0.28 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.25 3ice h LEU 253 Cb 2.15 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.68 3ice h LEU 253 CO 0.25 1.20 -0.01 0.58 0.09 0.00 0.00 178.44 180.55 3ice h VAL 254 N 0.49 0.30 0.00 1.22 2.07 -1.26 0.11 116.25 119.19 3ice h VAL 254 Ca -0.01 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 3ice h VAL 254 Cb 1.21 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 3ice h VAL 254 CO 0.12 0.01 -0.17 -0.08 0.02 0.00 0.00 177.57 177.47 3ice h GLU 255 N 0.00 0.00 -1.26 1.57 4.81 -1.40 -1.82 114.58 116.48 3ice h GLU 255 Ca -0.00 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.87 3ice h GLU 255 Cb 0.03 0.00 -0.17 0.00 0.63 0.00 0.00 28.75 29.24 3ice h GLU 255 CO 0.00 0.17 0.46 0.72 -0.73 0.00 0.00 179.01 179.63 3ice n HIS 256 N -4.24 1.84 -4.12 0.92 8.25 0.39 -4.86 115.22 113.40 3ice n HIS 256 Ca -0.02 -1.83 -0.32 0.00 -0.26 0.00 0.00 57.72 55.29 3ice n HIS 256 Cb 0.24 -0.90 -0.03 0.00 1.12 0.00 0.00 29.99 30.42 3ice n HIS 256 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3ice n LYS 257 N -0.12 -3.17 -4.14 -0.41 5.02 -0.68 -4.89 118.16 109.77 3ice n LYS 257 Ca 0.36 0.38 -0.22 0.00 -2.02 0.00 0.00 58.31 56.80 3ice n LYS 257 Cb 0.82 -4.83 -0.05 0.00 -0.02 0.00 0.00 35.03 30.96 3ice n LYS 257 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3ice s LYS 258 N -6.81 2.83 -0.38 1.97 1.02 -1.21 -3.25 119.74 113.90 3ice s LYS 258 Ca 0.43 -1.11 -0.10 0.00 0.02 0.00 0.00 55.97 55.21 3ice s LYS 258 Cb -0.24 -2.50 0.04 0.00 -0.52 0.00 0.00 37.83 34.62 3ice s LYS 258 CO 0.91 0.39 0.22 -0.51 -0.92 0.00 0.00 175.35 175.44 3ice s ASP 259 N -3.82 5.69 -0.02 2.83 1.01 -1.26 -0.12 116.67 120.98 3ice s ASP 259 Ca 0.33 -1.14 -0.01 0.00 0.71 0.00 0.00 52.55 52.44 3ice s ASP 259 Cb -0.08 -2.01 -0.04 0.00 1.01 0.00 0.00 42.92 41.81 3ice s ASP 259 CO 0.24 -0.42 0.06 -0.69 0.21 0.00 0.00 175.17 174.56 3ice s VAL 260 N 1.51 4.60 -0.22 -1.27 1.01 0.52 -1.09 120.40 125.46 3ice s VAL 260 Ca 0.02 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 3ice s VAL 260 Cb -0.20 -3.06 0.07 0.00 0.00 0.00 0.00 36.38 33.18 3ice s VAL 260 CO 0.05 0.41 0.02 -0.63 0.00 0.00 0.00 175.10 174.96 3ice s ILE 261 N -1.11 0.85 -0.21 2.22 -1.09 -0.45 -0.85 121.20 120.56 3ice s ILE 261 Ca 0.20 -0.87 -0.14 0.00 -2.23 0.00 0.00 60.65 57.61 3ice s ILE 261 Cb -0.12 -1.34 -0.04 0.00 -1.58 0.00 0.00 42.46 39.38 3ice s ILE 261 CO 0.11 -0.25 0.30 -0.63 -1.23 0.00 0.00 174.94 173.24 3ice s ILE 262 N 1.69 5.27 -0.53 2.92 1.01 0.17 -4.45 121.20 127.28 3ice s ILE 262 Ca -0.01 0.51 -0.08 0.00 0.00 0.00 0.00 60.65 61.07 3ice s ILE 262 Cb -0.18 -3.64 0.14 0.00 0.01 0.00 0.00 42.46 38.79 3ice s ILE 262 CO -0.10 0.30 0.40 -0.76 0.00 0.00 0.00 174.94 174.78 3ice s LEU 263 N 1.12 5.69 -0.19 2.97 1.43 -1.26 -1.30 118.68 127.14 3ice s LEU 263 Ca 0.15 -2.19 -0.14 0.00 -1.03 0.00 0.00 54.13 50.92 3ice s LEU 263 Cb -0.14 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 3ice s LEU 263 CO 0.06 -0.61 0.31 -0.22 0.23 0.00 0.00 176.35 176.13 3ice s LEU 264 N 0.94 4.18 -0.12 1.79 2.96 -0.65 -2.54 118.68 125.23 3ice s LEU 264 Ca 0.09 0.44 -0.12 0.00 -0.22 0.00 0.00 54.13 54.32 3ice s LEU 264 Cb -0.23 -2.39 -0.05 0.00 0.50 0.00 0.00 46.19 44.03 3ice s LEU 264 CO -0.02 0.02 0.26 -0.62 -1.32 0.00 0.00 176.35 174.66 3ice s ASP 265 N 0.82 6.47 -0.44 3.68 2.15 -0.48 -2.25 116.67 126.62 3ice s ASP 265 Ca 0.16 0.56 -0.02 0.00 0.43 0.00 0.00 52.55 53.68 3ice s ASP 265 Cb -0.14 -2.16 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 3ice s ASP 265 CO 0.06 0.22 0.38 -1.20 -0.17 0.00 0.00 175.17 174.46 3ice n SER 266 N 2.88 -2.98 0.27 -0.34 7.64 -1.25 -2.06 113.62 117.77 3ice n SER 266 Ca -0.15 -0.19 0.09 0.00 1.01 0.00 0.00 58.87 59.64 3ice n SER 266 Cb 0.53 -2.04 0.70 0.00 -1.01 0.00 0.00 64.21 62.38 3ice n SER 266 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 3ice h ILE 267 N -0.82 0.90 -0.07 0.44 2.10 -1.68 -0.78 117.51 117.60 3ice h ILE 267 Ca -0.19 -0.01 -0.15 0.00 1.08 0.00 0.00 64.86 65.59 3ice h ILE 267 Cb 1.12 1.00 -0.01 0.00 -1.09 0.00 0.00 36.82 37.84 3ice h ILE 267 CO 0.18 0.00 -0.62 0.71 -1.08 0.00 0.00 178.15 177.35 3ice h THR 268 N 0.00 1.39 -0.29 2.19 1.35 -1.93 -2.10 112.91 113.52 3ice h THR 268 Ca -0.00 -2.00 -0.05 0.00 -0.55 0.00 0.00 66.41 63.81 3ice h THR 268 Cb 0.00 2.01 -0.02 0.00 -1.73 0.00 0.00 68.15 68.42 3ice h THR 268 CO 0.00 0.59 -0.03 0.03 -0.25 0.00 0.00 175.52 175.86 3ice h ARG 269 N 0.19 0.46 -0.46 4.72 2.47 -1.50 -0.33 114.38 119.93 3ice h ARG 269 Ca -0.01 -0.10 -0.08 0.00 -1.26 0.00 0.00 59.98 58.54 3ice h ARG 269 Cb 1.13 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.37 3ice h ARG 269 CO 0.10 0.51 -0.02 1.25 0.56 0.00 0.00 179.97 182.37 3ice h LEU 270 N 0.44 0.81 -1.37 3.04 5.85 -1.08 -0.32 115.31 122.68 3ice h LEU 270 Ca 0.09 -0.32 0.01 0.00 0.84 0.00 0.00 57.88 58.51 3ice h LEU 270 Cb 0.34 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 3ice h LEU 270 CO 0.01 0.93 0.43 0.00 -0.34 0.00 0.00 178.44 179.47 3ice h ALA 271 N 0.91 1.56 -0.33 1.25 0.00 -0.78 -1.21 119.26 120.66 3ice h ALA 271 Ca 0.13 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3ice h ALA 271 Cb 0.52 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3ice h ALA 271 CO 0.03 0.41 0.01 0.00 0.00 0.00 0.00 179.25 179.69 3ice h ARG 272 N 0.86 0.57 -0.74 0.00 3.08 -0.56 -0.81 114.38 116.78 3ice h ARG 272 Ca 0.24 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3ice h ARG 272 Cb -0.07 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 29.89 3ice h ARG 272 CO -0.06 0.70 0.44 0.00 -1.07 0.00 0.00 179.97 179.98 3ice h ALA 273 N 0.85 1.38 -0.15 0.04 0.00 -0.52 -1.51 119.26 119.35 3ice h ALA 273 Ca 0.09 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3ice h ALA 273 Cb 0.43 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3ice h ALA 273 CO 0.02 0.53 -0.06 1.88 0.00 0.00 0.00 179.25 181.62 3ice h TYR 274 N 1.02 0.35 -0.05 0.00 0.05 -1.04 -2.36 116.97 114.94 3ice h TYR 274 Ca 0.26 -0.08 0.04 0.00 0.05 0.00 0.00 58.73 59.00 3ice h TYR 274 Cb -0.03 -0.08 -0.06 0.00 1.01 0.00 0.00 36.73 37.57 3ice h TYR 274 CO 0.00 0.61 -0.34 -0.97 -1.05 0.00 0.00 178.16 176.42 3ice h ASN 275 N -0.01 -1.03 -0.42 3.88 -1.24 -0.62 -0.64 115.58 115.49 3ice h ASN 275 Ca 0.04 0.14 0.06 0.00 0.71 0.00 0.00 56.30 57.24 3ice h ASN 275 Cb 0.51 0.42 -0.02 0.00 0.73 0.00 0.00 38.32 39.96 3ice h ASN 275 CO 0.02 -0.39 0.28 0.71 -1.29 0.00 0.00 177.43 176.76 3ice h THR 276 N -0.46 0.97 0.00 -3.57 1.35 -1.32 -2.41 112.91 107.46 3ice h THR 276 Ca 0.07 -0.12 -0.13 0.00 -0.55 0.00 0.00 66.41 65.69 3ice h THR 276 Cb 0.57 0.60 -0.02 0.00 -1.73 0.00 0.00 68.15 67.57 3ice h THR 276 CO -0.31 0.06 -0.61 0.58 -0.25 0.00 0.00 175.52 174.99 3ice h VAL 277 N 0.34 1.36 -2.93 6.82 2.07 -0.59 -3.45 116.25 119.86 3ice h VAL 277 Ca 0.18 -2.15 -0.53 0.00 0.82 0.00 0.00 66.70 65.03 3ice h VAL 277 Cb 0.29 2.18 0.04 0.00 -1.52 0.00 0.00 31.29 32.29 3ice h VAL 277 CO -0.04 0.60 0.83 -0.69 0.02 0.00 0.00 177.57 178.29 3ice s VAL 278 N -3.50 2.75 0.10 2.57 1.01 -0.60 -4.96 120.40 117.77 3ice s VAL 278 Ca -0.01 0.55 -0.18 0.00 0.00 0.00 0.00 61.98 62.34 3ice s VAL 278 Cb 0.12 -3.35 -0.06 0.00 0.00 0.00 0.00 36.38 33.09 3ice s VAL 278 CO 0.75 0.05 1.63 1.55 0.00 0.00 0.00 175.10 179.08 3ice h PRO 279 N 6.55 0.42 0.00 2.72 0.13 -1.89 -3.46 132.00 136.46 3ice h PRO 279 Ca -0.43 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3ice h PRO 279 Cb 1.21 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3ice h PRO 279 CO 0.89 0.47 0.00 0.00 -0.23 0.00 0.00 178.00 179.13 3ice n ALA 280 N -2.28 2.37 -1.14 -0.56 0.00 -1.26 -5.06 120.51 112.58 3ice n ALA 280 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.36 3ice n ALA 280 Cb 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.58 3ice n ALA 280 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3ice n SER 281 N -2.27 -3.91 0.00 0.00 2.88 -1.26 -4.85 113.62 104.22 3ice n SER 281 Ca 0.00 0.12 0.00 0.00 -1.33 0.00 0.00 58.87 57.66 3ice n SER 281 Cb 0.00 -1.85 0.00 0.00 -0.75 0.00 0.00 64.21 61.61 3ice n SER 281 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ice n GLY 282 N -1.97 3.72 3.76 0.46 0.00 -1.26 -4.56 105.19 105.34 3ice n GLY 282 Ca -0.05 0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 3ice n GLY 282 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ice s LYS 283 N 0.00 3.31 -0.23 1.61 0.00 -1.26 -5.01 119.74 118.16 3ice s LYS 283 Ca 0.00 2.11 -0.07 0.00 0.00 0.00 0.00 55.97 58.01 3ice s LYS 283 Cb 0.00 -2.30 -0.03 0.00 0.00 0.00 0.00 37.83 35.49 3ice s LYS 283 CO 0.00 -1.01 0.07 0.08 0.00 0.00 0.00 175.35 174.49 3ice s VAL 284 N -1.37 4.50 0.69 1.79 1.01 -1.26 -3.98 120.40 121.78 3ice s VAL 284 Ca 0.69 -0.12 -0.17 0.00 0.00 0.00 0.00 61.98 62.39 3ice s VAL 284 Cb -0.37 -3.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.84 3ice s VAL 284 CO 0.44 0.37 0.15 0.18 0.00 0.00 0.00 175.10 176.25 3ice n LEU 285 N 4.48 -1.43 -4.77 3.92 4.77 0.21 -4.87 117.00 119.31 3ice n LEU 285 Ca -0.16 0.56 -0.40 0.00 -0.03 0.00 0.00 56.01 55.98 3ice n LEU 285 Cb 0.52 -1.04 0.01 0.00 -2.33 0.00 0.00 43.42 40.57 3ice n LEU 285 CO 0.32 -4.00 1.07 -0.89 -1.33 0.00 0.00 177.39 172.56 3ice s THR 286 N -1.94 2.17 0.00 -5.08 2.01 -1.26 -2.97 115.64 108.57 3ice s THR 286 Ca 0.60 0.16 0.00 0.00 0.31 0.00 0.00 61.69 62.76 3ice s THR 286 Cb -0.37 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 69.04 3ice s THR 286 CO 0.64 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.20 3ice n GLY 287 N 0.57 0.60 1.28 4.40 0.00 -1.26 -4.22 105.19 106.56 3ice n GLY 287 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3ice n GLY 287 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ice n GLY 288 N -2.01 0.61 3.84 -0.02 0.00 -1.16 -4.65 105.19 101.80 3ice n GLY 288 Ca 0.00 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.98 3ice n GLY 288 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ice s VAL 289 N -2.00 5.12 0.51 1.61 1.01 -1.19 -4.98 120.40 120.47 3ice s VAL 289 Ca 0.00 -0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.61 3ice s VAL 289 Cb 0.00 -3.33 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 3ice s VAL 289 CO 0.00 0.41 1.01 -0.62 0.00 0.00 0.00 175.10 175.89 3ice s ASP 290 N -1.62 6.45 0.32 3.32 2.15 -1.26 0.68 116.67 126.70 3ice s ASP 290 Ca 0.22 1.73 0.16 0.00 0.43 0.00 0.00 52.55 55.09 3ice s ASP 290 Cb -0.12 -2.53 0.47 0.00 -0.30 0.00 0.00 42.92 40.44 3ice s ASP 290 CO 0.13 -0.70 1.64 0.00 -0.17 0.00 0.00 175.17 176.07 3ice h ALA 291 N 1.19 0.91 -0.44 3.66 0.00 -1.80 -3.06 119.26 119.72 3ice h ALA 291 Ca -0.48 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 53.98 3ice h ALA 291 Cb 1.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3ice h ALA 291 CO 0.60 0.61 0.00 0.09 0.00 0.00 0.00 179.25 180.55 3ice n ASN 292 N -3.55 3.18 0.09 0.00 4.13 -1.26 -4.50 115.26 113.34 3ice n ASN 292 Ca -0.00 -1.99 0.04 0.00 1.68 0.00 0.00 54.58 54.31 3ice n ASN 292 Cb 0.59 -0.29 -0.02 0.00 -1.54 0.00 0.00 39.78 38.52 3ice n ASN 292 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ice h ALA 293 N 2.66 0.65 0.00 5.41 0.00 -1.89 -3.33 119.26 122.76 3ice h ALA 293 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3ice h ALA 293 Cb 0.80 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3ice h ALA 293 CO 0.00 0.59 -0.92 -0.07 0.00 0.00 0.00 179.25 178.85 3ice h LEU 294 N 0.00 0.00 -0.66 0.00 3.38 -1.79 -3.36 115.31 112.88 3ice h LEU 294 Ca -0.08 -0.02 0.12 0.00 0.09 0.00 0.00 57.88 57.99 3ice h LEU 294 Cb 1.37 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.04 3ice h LEU 294 CO 0.04 0.01 0.19 -0.74 0.09 0.00 0.00 178.44 178.03 3ice h HIS 295 N 0.00 0.32 0.05 1.13 2.76 -1.84 0.81 115.15 118.38 3ice h HIS 295 Ca 0.00 0.04 -0.00 0.00 -2.20 0.00 0.00 60.37 58.20 3ice h HIS 295 Cb 0.98 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.90 3ice h HIS 295 CO 0.00 0.01 -0.02 0.00 -1.30 0.00 0.00 177.93 176.61 3ice h ARG 296 N 0.33 -0.06 -0.14 5.26 2.47 -1.78 -1.13 114.38 119.33 3ice h ARG 296 Ca 0.35 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 59.04 3ice h ARG 296 Cb 0.52 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.84 3ice h ARG 296 CO -0.40 0.07 -0.08 -1.35 0.56 0.00 0.00 179.97 178.77 3ice h PRO 297 N -0.18 0.21 -0.08 0.04 0.11 -1.66 -1.12 132.00 129.32 3ice h PRO 297 Ca -0.01 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 3ice h PRO 297 Cb 0.16 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.23 3ice h PRO 297 CO 0.01 0.30 -0.07 0.87 -0.21 0.00 0.00 178.00 178.90 3ice h LYS 298 N 0.20 0.19 -0.01 1.05 1.57 -0.63 0.71 116.57 119.66 3ice h LYS 298 Ca 0.04 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3ice h LYS 298 Cb 0.27 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 3ice h LYS 298 CO 0.01 0.61 0.01 -0.09 -0.57 0.00 0.00 179.45 179.42 3ice h ARG 299 N -0.22 0.00 0.06 3.15 2.43 -1.08 0.41 114.38 119.13 3ice h ARG 299 Ca 0.01 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.06 3ice h ARG 299 Cb 0.57 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3ice h ARG 299 CO 0.02 0.00 -0.52 0.35 -1.51 0.00 0.00 179.97 178.31 3ice h PHE 300 N 0.00 0.41 -0.14 2.20 3.57 -0.94 -3.23 116.94 118.82 3ice h PHE 300 Ca 0.00 -0.27 -0.20 0.00 3.53 0.00 0.00 57.97 61.03 3ice h PHE 300 Cb 0.02 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.73 3ice h PHE 300 CO 0.00 1.15 -0.74 0.35 -2.23 0.00 0.00 178.31 176.84 3ice h PHE 301 N -0.44 0.88 0.00 0.41 3.57 -0.47 -2.88 116.94 118.01 3ice h PHE 301 Ca -0.08 -0.38 0.00 0.00 3.53 0.00 0.00 57.97 61.04 3ice h PHE 301 Cb 1.34 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.94 3ice h PHE 301 CO 0.20 1.18 0.00 0.41 -2.23 0.00 0.00 178.31 177.87 3ice n GLY 302 N 0.61 -0.53 0.17 2.40 0.00 0.14 -3.29 105.19 104.69 3ice n GLY 302 Ca -0.06 -0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 3ice n GLY 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ice h ALA 303 N 2.50 0.10 -2.24 4.61 0.00 -1.52 -3.45 119.26 119.26 3ice h ALA 303 Ca 0.00 -0.65 -0.59 0.00 0.00 0.00 0.00 54.91 53.67 3ice h ALA 303 Cb 0.00 0.05 0.07 0.00 0.00 0.00 0.00 17.79 17.91 3ice h ALA 303 CO 0.00 0.55 0.70 0.00 0.00 0.00 0.00 179.25 180.49 3ice n ALA 304 N -2.63 1.07 -3.85 0.00 0.00 -1.21 -4.88 120.51 109.02 3ice n ALA 304 Ca -0.11 0.44 -0.05 0.00 0.00 0.00 0.00 53.44 53.72 3ice n ALA 304 Cb 0.80 -2.30 0.02 0.00 0.00 0.00 0.00 19.45 17.97 3ice n ALA 304 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3ice s ARG 305 N 0.38 1.66 -0.17 0.00 1.70 -0.11 -4.68 118.95 117.72 3ice s ARG 305 Ca 0.75 -1.05 -0.01 0.00 -0.47 0.00 0.00 55.73 54.95 3ice s ARG 305 Cb -0.69 0.47 -0.01 0.00 -0.57 0.00 0.00 34.95 34.15 3ice s ARG 305 CO 0.43 -0.77 -0.11 1.21 -1.08 0.00 0.00 175.30 174.98 3ice s ASN 306 N -3.24 4.01 -0.12 -2.89 3.84 -1.24 -2.17 114.94 113.13 3ice s ASN 306 Ca 0.18 -0.39 -0.09 0.00 0.21 0.00 0.00 52.86 52.78 3ice s ASN 306 Cb -0.04 -1.64 -0.04 0.00 -0.55 0.00 0.00 41.25 38.98 3ice s ASN 306 CO 0.07 0.08 0.18 -0.69 -2.79 0.00 0.00 177.10 173.95 3ice s VAL 307 N 0.88 5.43 -2.01 -5.21 1.01 -1.24 -0.03 120.40 119.22 3ice s VAL 307 Ca -0.03 0.30 0.10 0.00 0.00 0.00 0.00 61.98 62.35 3ice s VAL 307 Cb -0.15 -3.46 0.29 0.00 0.00 0.00 0.00 36.38 33.06 3ice s VAL 307 CO 0.00 0.57 1.39 1.21 0.00 0.00 0.00 175.10 178.27 3ice n GLU 308 N 2.34 1.04 0.00 2.72 2.13 -0.65 -3.36 120.64 124.85 3ice n GLU 308 Ca -0.18 -0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.57 3ice n GLU 308 Cb 0.54 -1.17 0.00 0.00 0.27 0.00 0.00 31.44 31.08 3ice n GLU 308 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3ice n GLU 309 N -0.60 0.64 0.00 5.31 1.02 -1.26 -5.05 120.64 120.71 3ice n GLU 309 Ca 0.08 -0.28 0.00 0.00 -0.02 0.00 0.00 57.16 56.94 3ice n GLU 309 Cb 0.05 -0.75 0.00 0.00 -0.02 0.00 0.00 31.44 30.72 3ice n GLU 309 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ice n GLY 310 N 0.17 3.60 0.00 0.62 0.00 -1.21 -4.90 105.19 103.46 3ice n GLY 310 Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.39 3ice n GLY 310 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ice n GLY 311 N -0.90 -1.63 3.55 -0.02 0.00 -1.20 -4.22 105.19 100.77 3ice n GLY 311 Ca 0.00 -1.54 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 3ice n GLY 311 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ice s SER 312 N -4.20 -0.41 -0.13 1.61 1.04 0.83 -3.64 113.70 108.80 3ice s SER 312 Ca 0.00 0.36 0.02 0.00 0.48 0.00 0.00 55.95 56.82 3ice s SER 312 Cb 0.00 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.48 3ice s SER 312 CO 0.00 -0.45 -0.21 -0.22 0.98 0.00 0.00 173.24 173.34 3ice s LEU 313 N -1.42 2.20 -0.15 2.42 2.96 -0.92 -0.35 118.68 123.41 3ice s LEU 313 Ca -0.02 -0.55 -0.00 0.00 -0.22 0.00 0.00 54.13 53.34 3ice s LEU 313 Cb -0.00 -1.46 0.03 0.00 0.50 0.00 0.00 46.19 45.25 3ice s LEU 313 CO 0.01 0.11 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.17 3ice s THR 314 N 0.63 1.26 -0.15 3.68 2.01 -0.03 -0.93 115.64 122.10 3ice s THR 314 Ca -0.11 -0.55 0.01 0.00 0.31 0.00 0.00 61.69 61.35 3ice s THR 314 Cb -0.16 -1.30 -0.00 0.00 0.01 0.00 0.00 72.50 71.05 3ice s THR 314 CO 0.03 0.30 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.47 3ice s ILE 315 N 1.60 2.68 -0.18 1.82 1.01 -1.10 0.43 121.20 127.46 3ice s ILE 315 Ca 0.03 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.92 3ice s ILE 315 Cb -0.14 -2.12 0.02 0.00 0.01 0.00 0.00 42.46 40.24 3ice s ILE 315 CO -0.09 0.52 -0.17 -0.63 0.00 0.00 0.00 174.94 174.57 3ice s ILE 316 N 0.69 1.90 0.31 2.92 -1.09 -0.42 -1.18 121.20 124.33 3ice s ILE 316 Ca -0.08 -0.89 0.06 0.00 -2.23 0.00 0.00 60.65 57.51 3ice s ILE 316 Cb -0.16 -1.76 -0.06 0.00 -1.58 0.00 0.00 42.46 38.90 3ice s ILE 316 CO 0.02 0.47 -0.01 0.00 -1.23 0.00 0.00 174.94 174.18 3ice s ALA 317 N 1.34 2.43 -0.14 9.38 0.00 -1.20 -1.64 121.76 131.93 3ice s ALA 317 Ca 0.04 -1.99 -0.04 0.00 0.00 0.00 0.00 51.96 49.97 3ice s ALA 317 Cb -0.13 0.34 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 3ice s ALA 317 CO -0.12 -0.15 -0.01 0.95 0.00 0.00 0.00 175.76 176.43 3ice s THR 318 N -3.07 4.15 -0.04 0.00 -4.23 -0.96 0.30 115.64 111.79 3ice s THR 318 Ca 0.32 -0.27 0.04 0.00 -1.18 0.00 0.00 61.69 60.60 3ice s THR 318 Cb 0.06 -2.81 -0.03 0.00 1.34 0.00 0.00 72.50 71.06 3ice s THR 318 CO 0.14 0.51 -0.16 0.00 -0.54 0.00 0.00 174.62 174.57 3ice s ALA 319 N 0.07 2.58 -0.13 3.99 0.00 0.17 -2.40 121.76 126.05 3ice s ALA 319 Ca 0.01 -1.01 -0.10 0.00 0.00 0.00 0.00 51.96 50.87 3ice s ALA 319 Cb -0.13 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.05 3ice s ALA 319 CO 0.02 0.55 0.19 -0.51 0.00 0.00 0.00 175.76 176.02 3ice s LEU 320 N -0.73 4.34 0.31 0.00 1.02 -1.26 -1.09 118.68 121.27 3ice s LEU 320 Ca 0.11 0.48 0.06 0.00 0.02 0.00 0.00 54.13 54.80 3ice s LEU 320 Cb -0.10 -2.18 -0.03 0.00 0.02 0.00 0.00 46.19 43.89 3ice s LEU 320 CO 0.00 0.30 0.27 0.27 0.02 0.00 0.00 176.35 177.21 3ice s ILE 321 N -0.51 0.00 -1.47 -0.59 -4.36 -1.14 -4.63 121.20 108.51 3ice s ILE 321 Ca 0.15 -1.98 -0.07 0.00 -0.26 0.00 0.00 60.65 58.49 3ice s ILE 321 Cb -0.13 -2.51 0.05 0.00 1.25 0.00 0.00 42.46 41.13 3ice s ILE 321 CO 0.04 0.00 0.70 -0.67 0.24 0.00 0.00 174.94 175.24 3ice n ASP 322 N -1.36 -2.19 -0.90 4.36 2.03 -1.26 -4.16 116.55 113.08 3ice n ASP 322 Ca 0.06 -0.90 0.09 0.00 0.52 0.00 0.00 54.79 54.57 3ice n ASP 322 Cb 0.63 -3.47 0.16 0.00 -0.72 0.00 0.00 41.12 37.72 3ice n ASP 322 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3ice n THR 323 N -4.44 0.42 -1.01 5.18 -2.24 -1.26 -4.87 114.28 106.07 3ice n THR 323 Ca -0.15 -0.71 -0.00 0.00 -2.27 0.00 0.00 64.05 60.91 3ice n THR 323 Cb 0.61 1.02 -0.00 0.00 -2.10 0.00 0.00 70.33 69.85 3ice n THR 323 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ice n GLY 324 N 1.13 0.42 2.99 3.38 0.00 -1.26 -5.00 105.19 106.85 3ice n GLY 324 Ca 0.15 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 3ice n GLY 324 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ice s SER 325 N -2.05 1.92 0.00 1.61 0.15 -1.26 -5.12 113.70 108.95 3ice s SER 325 Ca 0.00 -0.31 -0.00 0.00 0.70 0.00 0.00 55.95 56.34 3ice s SER 325 Cb 0.00 -0.84 -0.01 0.00 -1.71 0.00 0.00 66.02 63.46 3ice s SER 325 CO 0.00 -0.01 0.37 0.29 1.20 0.00 0.00 173.24 175.09 3ice n LYS 326 N 4.15 0.14 0.00 5.44 5.02 -1.26 -3.45 118.16 128.21 3ice n LYS 326 Ca -0.20 -0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 3ice n LYS 326 Cb 0.51 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 3ice n LYS 326 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3ice n ASP 328 N 2.16 0.00 -0.05 4.39 9.92 -1.26 -0.88 116.55 130.83 3ice n ASP 328 Ca 0.01 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.16 3ice n ASP 328 Cb 0.07 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.50 3ice n ASP 328 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 3ice h GLU 329 N 0.00 0.26 -0.14 -1.24 4.39 -1.82 -1.01 114.58 115.03 3ice h GLU 329 Ca 0.00 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.70 3ice h GLU 329 Cb 0.00 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.56 3ice h GLU 329 CO 0.00 0.33 -0.17 0.28 -1.16 0.00 0.00 179.01 178.29 3ice h VAL 330 N 0.14 0.55 -0.63 3.13 2.07 -1.33 -2.07 116.25 118.12 3ice h VAL 330 Ca 0.06 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.64 3ice h VAL 330 Cb 0.17 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 30.44 3ice h VAL 330 CO -0.01 0.00 0.33 0.40 0.02 0.00 0.00 177.57 178.32 3ice h ILE 331 N -0.21 0.94 -0.23 4.57 2.04 -1.74 0.05 117.51 122.94 3ice h ILE 331 Ca 0.10 -0.21 0.04 0.00 1.00 0.00 0.00 64.86 65.79 3ice h ILE 331 Cb 0.35 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 3ice h ILE 331 CO -0.26 0.11 -0.03 0.22 0.00 0.00 0.00 178.15 178.19 3ice h TYR 332 N 0.61 -0.08 -0.25 1.37 3.20 -0.66 -1.27 116.97 119.89 3ice h TYR 332 Ca 0.29 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 62.05 3ice h TYR 332 Cb 0.20 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 3ice h TYR 332 CO -0.09 -0.07 -0.35 0.93 -1.64 0.00 0.00 178.16 176.94 3ice h GLU 333 N 0.03 0.55 0.00 1.82 4.39 -0.76 0.18 114.58 120.79 3ice h GLU 333 Ca 0.11 -0.26 -0.04 0.00 0.34 0.00 0.00 59.36 59.51 3ice h GLU 333 Cb 0.15 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 3ice h GLU 333 CO -0.21 0.82 -0.21 1.49 -1.16 0.00 0.00 179.01 179.75 3ice h GLU 334 N 0.47 0.00 0.09 2.33 4.57 -0.59 -2.57 114.58 118.89 3ice h GLU 334 Ca 0.05 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.90 3ice h GLU 334 Cb 0.83 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.40 3ice h GLU 334 CO 0.07 0.21 -1.75 0.74 -1.18 0.00 0.00 179.01 177.10 3ice h PHE 335 N 0.00 0.36 -0.43 0.92 0.05 -0.91 -3.37 116.94 113.57 3ice h PHE 335 Ca -0.00 -0.27 0.05 0.00 3.82 0.00 0.00 57.97 61.57 3ice h PHE 335 Cb 0.61 -0.01 -0.02 0.00 2.00 0.00 0.00 35.95 38.52 3ice h PHE 335 CO 0.00 1.45 0.29 -0.22 -0.18 0.00 0.00 178.31 179.64 3ice h LYS 336 N 0.05 0.35 -0.07 1.51 3.64 -0.58 0.50 116.57 121.98 3ice h LYS 336 Ca -0.32 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 3ice h LYS 336 Cb 2.03 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.77 3ice h LYS 336 CO 0.12 0.23 0.00 0.41 -2.27 0.00 0.00 179.45 177.94 3ice n GLY 337 N -1.52 -0.58 0.00 5.01 0.00 -1.03 -3.52 105.19 103.55 3ice n GLY 337 Ca 0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 46.02 45.92 3ice n GLY 337 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ice n THR 338 N -0.34 0.02 -2.10 2.61 -1.04 0.10 -5.07 114.28 108.46 3ice n THR 338 Ca 0.09 -0.01 -0.28 0.00 -2.04 0.00 0.00 64.05 61.80 3ice n THR 338 Cb 0.11 -0.44 0.15 0.00 -1.82 0.00 0.00 70.33 68.34 3ice n THR 338 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 3ice s GLY 339 N -2.68 1.76 -0.20 3.41 0.00 -0.76 -4.91 107.32 103.94 3ice s GLY 339 Ca -0.00 -1.27 0.12 0.00 0.00 0.00 0.00 44.72 43.57 3ice s GLY 339 CO 0.02 -0.59 1.21 0.70 0.00 0.00 0.00 173.10 174.44 3ice n ASN 340 N -3.47 2.10 0.00 1.64 3.02 -0.77 -5.00 115.26 112.78 3ice n ASN 340 Ca 0.14 -3.62 0.00 0.00 -0.03 0.00 0.00 54.58 51.07 3ice n ASN 340 Cb 0.60 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 3ice n ASN 340 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 3ice n GLU 342 N -0.86 0.00 -4.05 3.52 0.28 -1.11 -0.72 120.64 117.69 3ice n GLU 342 Ca 0.21 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.89 3ice n GLU 342 Cb 0.79 0.00 -0.15 0.00 1.43 0.00 0.00 31.44 33.50 3ice n GLU 342 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 3ice s LEU 343 N 0.00 2.86 0.49 -1.84 2.96 -0.95 -1.72 118.68 120.48 3ice s LEU 343 Ca 0.00 -1.12 -0.09 0.00 -0.22 0.00 0.00 54.13 52.70 3ice s LEU 343 Cb 0.00 -1.44 -0.05 0.00 0.50 0.00 0.00 46.19 45.20 3ice s LEU 343 CO 0.00 -0.15 0.85 -1.00 -1.32 0.00 0.00 176.35 174.74 3ice s HIS 344 N 1.23 3.54 -0.03 5.38 3.76 -1.26 -2.00 115.29 125.91 3ice s HIS 344 Ca -0.04 1.04 -0.01 0.00 -0.15 0.00 0.00 55.06 55.90 3ice s HIS 344 Cb -0.18 -2.48 0.03 0.00 1.11 0.00 0.00 32.58 31.06 3ice s HIS 344 CO -0.07 -0.32 0.05 -0.51 -0.85 0.00 0.00 174.74 173.04 3ice s LEU 345 N -4.51 1.12 0.02 0.89 1.43 -0.86 -1.19 118.68 115.58 3ice s LEU 345 Ca 0.51 0.10 -0.14 0.00 -1.03 0.00 0.00 54.13 53.56 3ice s LEU 345 Cb -0.10 0.04 -0.06 0.00 0.03 0.00 0.00 46.19 46.10 3ice s LEU 345 CO 0.42 -0.12 0.43 -0.55 0.23 0.00 0.00 176.35 176.76 3ice s SER 346 N 0.94 6.81 0.00 2.29 0.15 0.12 -4.23 113.70 119.79 3ice s SER 346 Ca -0.08 0.97 0.20 0.00 0.70 0.00 0.00 55.95 57.74 3ice s SER 346 Cb -0.11 -2.25 0.86 0.00 -1.71 0.00 0.00 66.02 62.81 3ice s SER 346 CO -0.03 0.29 1.64 -1.14 1.20 0.00 0.00 173.24 175.20 3ice n ARG 347 N 1.64 0.00 -0.07 5.44 0.63 -1.26 -3.07 116.66 119.97 3ice n ARG 347 Ca -0.13 0.16 -0.16 0.00 -0.92 0.00 0.00 57.85 56.80 3ice n ARG 347 Cb 0.52 -1.50 -0.14 0.00 0.45 0.00 0.00 32.46 31.79 3ice n ARG 347 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 3ice n LYS 348 N -1.51 0.69 0.00 -0.14 5.02 -1.26 -2.87 118.16 118.09 3ice n LYS 348 Ca 0.05 0.17 0.08 0.00 -2.02 0.00 0.00 58.31 56.59 3ice n LYS 348 Cb 0.23 -1.61 0.37 0.00 -0.02 0.00 0.00 35.03 34.01 3ice n LYS 348 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3ice n ILE 349 N -3.18 0.78 -0.03 -0.18 5.41 -1.18 -2.69 119.36 118.28 3ice n ILE 349 Ca -0.35 0.19 0.02 0.00 1.00 0.00 0.00 62.75 63.61 3ice n ILE 349 Cb 1.05 -0.91 -0.12 0.00 -0.71 0.00 0.00 39.64 38.95 3ice n ILE 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ice n ALA 350 N -1.45 2.22 0.19 -1.39 0.00 -1.18 -1.70 120.51 117.21 3ice n ALA 350 Ca 0.05 -0.63 0.05 0.00 0.00 0.00 0.00 53.44 52.91 3ice n ALA 350 Cb 0.18 -0.37 0.40 0.00 0.00 0.00 0.00 19.45 19.66 3ice n ALA 350 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3ice h GLU 351 N 0.00 0.00 -0.01 0.00 5.08 -1.36 -1.65 114.58 116.64 3ice h GLU 351 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3ice h GLU 351 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3ice h GLU 351 CO 0.01 0.35 -0.02 1.17 -1.00 0.00 0.00 179.01 179.52 3ice n LYS 352 N -3.84 1.25 -3.27 2.33 4.81 -1.12 -4.92 118.16 113.41 3ice n LYS 352 Ca -0.01 -0.48 -0.18 0.00 -0.87 0.00 0.00 58.31 56.76 3ice n LYS 352 Cb 0.43 -1.49 0.06 0.00 0.02 0.00 0.00 35.03 34.04 3ice n LYS 352 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 3ice n ARG 353 N -0.46 -5.82 -3.72 1.64 0.63 -0.62 -4.99 116.66 103.32 3ice n ARG 353 Ca 0.20 0.66 -0.38 0.00 -0.92 0.00 0.00 57.85 57.40 3ice n ARG 353 Cb 0.25 -5.14 -0.12 0.00 0.45 0.00 0.00 32.46 27.90 3ice n ARG 353 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3ice s VAL 354 N -3.21 3.98 0.14 5.15 1.01 -0.69 -5.02 120.40 121.76 3ice s VAL 354 Ca 0.42 -1.01 0.10 0.00 0.00 0.00 0.00 61.98 61.49 3ice s VAL 354 Cb -0.19 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 3ice s VAL 354 CO 0.52 -0.16 -0.23 -0.36 0.00 0.00 0.00 175.10 174.87 3ice s PHE 355 N 1.45 2.07 0.30 5.22 0.08 -1.26 -3.23 117.98 122.61 3ice s PHE 355 Ca -0.00 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.36 3ice s PHE 355 Cb -0.19 -1.10 -0.10 0.00 -0.57 0.00 0.00 43.02 41.06 3ice s PHE 355 CO 0.04 0.32 1.31 -1.25 -0.10 0.00 0.00 175.22 175.54 3ice s PRO 356 N -2.21 4.37 -1.16 0.24 0.04 -1.26 -4.98 135.00 130.04 3ice s PRO 356 Ca 0.13 2.18 -0.07 0.00 0.04 0.00 0.00 61.00 63.28 3ice s PRO 356 Cb -0.09 -3.10 0.01 0.00 0.04 0.00 0.00 34.50 31.36 3ice s PRO 356 CO 0.06 -0.20 2.75 0.00 0.04 0.00 0.00 177.00 179.65 3ice n ALA 357 N 1.23 6.96 -1.72 8.56 0.00 -1.20 -4.96 120.51 129.38 3ice n ALA 357 Ca 0.01 -3.54 -0.33 0.00 0.00 0.00 0.00 53.44 49.59 3ice n ALA 357 Cb 0.42 -2.83 -0.00 0.00 0.00 0.00 0.00 19.45 17.04 3ice n ALA 357 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ice s ILE 358 N -0.06 3.99 -1.01 0.00 1.01 -1.26 -0.70 121.20 123.18 3ice s ILE 358 Ca 0.61 0.97 -0.04 0.00 0.00 0.00 0.00 60.65 62.19 3ice s ILE 358 Cb 0.22 -3.47 0.28 0.00 0.01 0.00 0.00 42.46 39.50 3ice s ILE 358 CO -0.09 -0.54 1.21 -0.67 0.00 0.00 0.00 174.94 174.85 3ice n ASP 359 N -1.85 5.57 -0.34 3.58 -0.08 -0.34 -4.57 116.55 118.52 3ice n ASP 359 Ca 0.08 -3.29 0.23 0.00 -1.51 0.00 0.00 54.79 50.30 3ice n ASP 359 Cb 0.53 -1.19 0.48 0.00 2.34 0.00 0.00 41.12 43.28 3ice n ASP 359 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 3ice h TYR 360 N 5.65 0.77 -0.26 -0.67 3.20 -1.92 0.11 116.97 123.85 3ice h TYR 360 Ca 0.19 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.99 3ice h TYR 360 Cb 0.71 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 3ice h TYR 360 CO 0.87 0.01 -0.26 -0.91 -1.64 0.00 0.00 178.16 176.23 3ice h ASN 361 N 0.41 0.51 1.43 -2.11 4.21 -1.95 -3.05 115.58 115.04 3ice h ASN 361 Ca 0.65 -0.18 -0.03 0.00 1.21 0.00 0.00 56.30 57.95 3ice h ASN 361 Cb 1.56 -0.14 -0.00 0.00 -1.12 0.00 0.00 38.32 38.61 3ice h ASN 361 CO -0.39 0.77 -0.58 0.03 -1.29 0.00 0.00 177.43 175.97 3ice h ARG 362 N 0.44 0.00 -7.60 0.81 3.08 -1.23 -3.47 114.38 106.42 3ice h ARG 362 Ca 0.06 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.66 3ice h ARG 362 Cb 0.70 0.00 0.13 0.00 0.08 0.00 0.00 29.97 30.88 3ice h ARG 362 CO 0.05 0.08 0.35 -1.12 -1.07 0.00 0.00 179.97 178.26 3ice s SER 363 N -5.86 3.51 0.00 7.04 0.01 -0.76 -4.76 113.70 112.87 3ice s SER 363 Ca 0.03 0.72 0.00 0.00 1.31 0.00 0.00 55.95 58.01 3ice s SER 363 Cb 0.07 -1.12 0.00 0.00 0.21 0.00 0.00 66.02 65.18 3ice s SER 363 CO 0.74 -2.53 0.00 0.61 0.41 0.00 0.00 173.24 172.47 3ice n GLY 364 N -2.80 4.38 3.55 3.44 0.00 -0.70 -4.91 105.19 108.15 3ice n GLY 364 Ca 0.09 -1.46 -0.24 0.00 0.00 0.00 0.00 46.02 44.42 3ice n GLY 364 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ice s THR 365 N -2.07 2.86 0.06 2.61 -4.23 -1.26 -2.74 115.64 110.87 3ice s THR 365 Ca 0.00 -2.18 -0.21 0.00 -1.18 0.00 0.00 61.69 58.12 3ice s THR 365 Cb 0.00 -2.55 -0.06 0.00 1.34 0.00 0.00 72.50 71.22 3ice s THR 365 CO 0.00 -0.37 0.62 -0.13 -0.54 0.00 0.00 174.62 174.20 3ice s ARG 366 N -3.59 4.31 -0.87 3.99 0.52 0.10 -4.31 118.95 119.10 3ice s ARG 366 Ca 0.31 0.83 -0.05 0.00 -0.52 0.00 0.00 55.73 56.30 3ice s ARG 366 Cb -0.05 -3.28 -0.06 0.00 0.52 0.00 0.00 34.95 32.08 3ice s ARG 366 CO 0.17 0.52 0.76 1.63 0.02 0.00 0.00 175.30 178.41 3ice n LYS 367 N 2.07 -1.92 0.08 3.54 4.76 -1.26 -4.94 118.16 120.50 3ice n LYS 367 Ca -0.08 0.72 -0.07 0.00 -2.87 0.00 0.00 58.31 56.01 3ice n LYS 367 Cb 0.50 -5.10 0.04 0.00 -1.84 0.00 0.00 35.03 28.64 3ice n LYS 367 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 3ice h GLU 368 N -0.90 0.23 -0.86 1.97 5.08 -1.99 -3.26 114.58 114.85 3ice h GLU 368 Ca -0.51 -0.21 0.25 0.00 -1.00 0.00 0.00 59.36 57.89 3ice h GLU 368 Cb 1.26 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 3ice h GLU 368 CO 0.37 0.89 0.69 1.05 -1.00 0.00 0.00 179.01 181.01 3ice h GLU 369 N 0.15 0.00 0.00 2.33 9.09 -1.92 0.35 114.58 124.58 3ice h GLU 369 Ca -0.03 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.32 3ice h GLU 369 Cb 1.34 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.43 3ice h GLU 369 CO 0.12 0.00 -0.33 -0.07 0.05 0.00 0.00 179.01 178.78 3ice h LEU 370 N 0.00 0.00 0.00 3.06 3.38 -1.87 -3.32 115.31 116.56 3ice h LEU 370 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3ice h LEU 370 Cb 1.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.54 3ice h LEU 370 CO -0.00 0.28 -1.77 0.18 0.09 0.00 0.00 178.44 177.21 3ice n LEU 371 N -3.15 0.19 -4.25 1.67 4.77 0.11 -4.77 117.00 111.58 3ice n LEU 371 Ca 0.02 0.07 -0.25 0.00 -0.03 0.00 0.00 56.01 55.82 3ice n LEU 371 Cb 0.65 -0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.58 3ice n LEU 371 CO 0.38 -0.04 -0.52 0.42 -1.33 0.00 0.00 177.39 176.30 3ice s THR 372 N -3.48 1.63 0.48 -5.08 -4.23 -0.62 -4.71 115.64 99.63 3ice s THR 372 Ca -0.06 -1.21 -0.22 0.00 -1.18 0.00 0.00 61.69 59.02 3ice s THR 372 Cb 0.13 -1.43 -0.07 0.00 1.34 0.00 0.00 72.50 72.47 3ice s THR 372 CO 0.88 0.18 1.12 0.42 -0.54 0.00 0.00 174.62 176.68 3ice s THR 373 N -0.83 3.30 0.22 3.99 -4.23 -1.26 -4.71 115.64 112.12 3ice s THR 373 Ca 0.07 0.90 -0.11 0.00 -1.18 0.00 0.00 61.69 61.38 3ice s THR 373 Cb -0.09 -3.42 0.30 0.00 1.34 0.00 0.00 72.50 70.63 3ice s THR 373 CO 0.02 -0.08 1.33 0.00 -0.54 0.00 0.00 174.62 175.34 3ice n GLN 374 N -0.74 -0.13 0.14 3.99 6.02 -1.26 -0.37 117.38 125.03 3ice n GLN 374 Ca 0.09 1.32 -0.14 0.00 -0.01 0.00 0.00 57.00 58.26 3ice n GLN 374 Cb 0.50 -1.97 -0.06 0.00 1.02 0.00 0.00 30.24 29.72 3ice n GLN 374 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3ice h GLU 375 N 0.00 -0.57 -0.55 -1.09 3.07 -1.99 -0.14 114.58 113.31 3ice h GLU 375 Ca 0.36 0.04 0.09 0.00 -0.50 0.00 0.00 59.36 59.35 3ice h GLU 375 Cb 0.57 0.13 -0.07 0.00 -0.84 0.00 0.00 28.75 28.53 3ice h GLU 375 CO -0.86 -0.38 0.14 1.49 -1.40 0.00 0.00 179.01 178.00 3ice h GLU 376 N -0.59 0.28 0.04 2.33 4.81 -1.06 -0.08 114.58 120.31 3ice h GLU 376 Ca 0.02 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 3ice h GLU 376 Cb 0.59 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.86 3ice h GLU 376 CO -0.15 0.19 -0.51 -0.07 -0.73 0.00 0.00 179.01 177.74 3ice h LEU 377 N 0.29 -1.56 -1.35 1.64 3.38 -0.39 -2.92 115.31 114.40 3ice h LEU 377 Ca 0.28 0.17 -0.07 0.00 0.09 0.00 0.00 57.88 58.36 3ice h LEU 377 Cb 0.38 0.59 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 3ice h LEU 377 CO -0.34 -0.51 -0.32 1.56 0.09 0.00 0.00 178.44 178.92 3ice h GLN 378 N -0.67 0.00 -0.98 1.13 4.20 -0.55 0.28 115.11 118.52 3ice h GLN 378 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3ice h GLN 378 Cb 0.70 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.48 3ice h GLN 378 CO -0.32 0.32 0.00 0.36 -0.67 0.00 0.00 178.83 178.52 3ice n LYS 379 N -4.01 0.55 0.00 1.46 2.85 -0.09 -1.15 118.16 117.76 3ice n LYS 379 Ca -0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 3ice n LYS 379 Cb 0.38 -1.25 0.00 0.00 -0.65 0.00 0.00 35.03 33.51 3ice n LYS 379 CO 0.00 0.00 0.00 1.87 -0.05 0.00 0.00 177.40 179.22 3ice n TRP 381 N 0.46 0.00 -0.11 5.58 -0.00 0.98 -1.05 117.44 123.31 3ice n TRP 381 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.50 57.45 3ice n TRP 381 Cb 0.20 0.00 0.02 0.00 -0.00 0.00 0.00 31.31 31.53 3ice n TRP 381 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 3ice h ILE 382 N 0.00 0.76 -0.31 5.87 2.04 -1.39 -2.01 117.51 122.47 3ice h ILE 382 Ca 0.00 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 65.88 3ice h ILE 382 Cb 0.00 0.61 -0.06 0.00 -0.74 0.00 0.00 36.82 36.63 3ice h ILE 382 CO 0.00 0.02 -0.06 0.25 0.00 0.00 0.00 178.15 178.36 3ice h LEU 383 N 0.13 -0.26 -0.93 1.44 5.85 -1.36 -1.34 115.31 118.86 3ice h LEU 383 Ca 0.18 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.94 3ice h LEU 383 Cb 0.24 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 3ice h LEU 383 CO -0.28 -0.09 0.23 0.03 -0.34 0.00 0.00 178.44 178.00 3ice h ARG 384 N 0.02 1.02 -0.53 1.25 3.08 -1.76 -0.49 114.38 116.96 3ice h ARG 384 Ca 0.15 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 3ice h ARG 384 Cb 0.22 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3ice h ARG 384 CO -0.31 0.85 0.14 0.87 -1.07 0.00 0.00 179.97 180.46 3ice h LYS 385 N 0.99 0.83 -0.64 0.04 1.57 -0.76 0.42 116.57 119.02 3ice h LYS 385 Ca 0.22 -0.19 -0.09 0.00 -1.87 0.00 0.00 60.65 58.72 3ice h LYS 385 Cb 0.25 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 3ice h LYS 385 CO -0.01 0.78 0.04 0.82 -0.57 0.00 0.00 179.45 180.51 3ice h ILE 386 N 0.73 1.27 0.06 1.86 2.04 -0.94 -3.25 117.51 119.28 3ice h ILE 386 Ca 0.17 -1.12 -0.25 0.00 1.00 0.00 0.00 64.86 64.66 3ice h ILE 386 Cb 0.31 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3ice h ILE 386 CO -0.00 0.41 -1.15 0.40 0.00 0.00 0.00 178.15 177.82 3ice h ILE 387 N 1.01 1.58 -0.95 -0.67 1.08 -0.86 -3.37 117.51 115.33 3ice h ILE 387 Ca 0.19 -3.22 0.28 0.00 -0.39 0.00 0.00 64.86 61.71 3ice h ILE 387 Cb 0.53 2.88 -0.14 0.00 -3.07 0.00 0.00 36.82 37.02 3ice h ILE 387 CO 0.03 0.92 0.44 -0.74 -0.69 0.00 0.00 178.15 178.11 3ice h HIS 388 N 0.04 0.71 0.00 1.37 2.76 -0.20 -3.44 115.15 116.39 3ice h HIS 388 Ca -0.08 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 3ice h HIS 388 Cb 1.88 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 30.68 3ice h HIS 388 CO 0.03 -0.16 0.00 -2.30 -1.30 0.00 0.00 177.93 174.20 3ice n PRO 389 N -5.10 0.60 -3.88 5.26 -0.02 -1.26 -5.04 135.00 125.55 3ice n PRO 389 Ca 0.27 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.53 3ice n PRO 389 Cb 0.84 -1.20 -0.05 0.00 -0.02 0.00 0.00 33.50 33.07 3ice n PRO 389 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3ice s GLY 391 N 1.54 2.03 0.06 -1.23 0.00 -1.26 -5.13 107.32 103.33 3ice s GLY 391 Ca 0.00 -1.85 -0.31 0.00 0.00 0.00 0.00 44.72 42.56 3ice s GLY 391 CO 0.00 -1.73 1.47 0.83 0.00 0.00 0.00 173.10 173.67 3ice h GLU 392 N 1.31 -0.99 -0.18 2.90 5.08 -1.97 0.25 114.58 120.97 3ice h GLU 392 Ca -0.43 0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.01 3ice h GLU 392 Cb 1.26 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 3ice h GLU 392 CO 0.62 -0.66 0.09 0.82 -1.00 0.00 0.00 179.01 178.88 3ice h ILE 393 N -1.03 1.00 -0.73 3.13 5.03 -1.93 -2.90 117.51 120.08 3ice h ILE 393 Ca -0.09 -0.07 -0.05 0.00 -0.12 0.00 0.00 64.86 64.52 3ice h ILE 393 Cb 0.82 0.78 -0.03 0.00 -3.03 0.00 0.00 36.82 35.36 3ice h ILE 393 CO 0.11 0.04 0.25 0.44 -0.68 0.00 0.00 178.15 178.30 3ice h ASP 394 N 0.20 1.04 0.00 1.72 3.32 -2.01 -1.89 116.42 118.80 3ice h ASP 394 Ca 0.07 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.93 3ice h ASP 394 Cb 0.01 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.29 3ice h ASP 394 CO -0.05 0.96 0.00 0.00 -1.72 0.00 0.00 179.24 178.43 3ice n ALA 395 N -2.43 1.46 0.00 3.45 0.00 0.88 -1.01 120.51 122.86 3ice n ALA 395 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3ice n ALA 395 Cb 0.21 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3ice n ALA 395 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3ice n GLU 397 N 0.44 0.00 -0.13 0.00 1.02 -0.71 -1.19 120.64 120.06 3ice n GLU 397 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 3ice n GLU 397 Cb 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.50 3ice n GLU 397 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 3ice h PHE 398 N 0.00 -0.77 -0.03 -0.32 3.57 -1.33 0.14 116.94 118.20 3ice h PHE 398 Ca 0.00 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3ice h PHE 398 Cb 0.00 0.40 -0.00 0.00 2.79 0.00 0.00 35.95 39.14 3ice h PHE 398 CO 0.00 -0.35 0.01 1.25 -2.23 0.00 0.00 178.31 176.99 3ice h LEU 399 N -0.20 0.03 0.05 0.59 5.85 -1.41 0.12 115.31 120.34 3ice h LEU 399 Ca 0.20 -0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.83 3ice h LEU 399 Cb 0.51 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 3ice h LEU 399 CO -0.55 0.14 -0.31 0.40 -0.34 0.00 0.00 178.44 177.78 3ice h ILE 400 N -0.08 0.32 -0.32 4.05 2.04 -1.73 -0.20 117.51 121.59 3ice h ILE 400 Ca 0.01 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.81 3ice h ILE 400 Cb 0.12 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 3ice h ILE 400 CO -0.00 0.00 -0.06 0.78 0.00 0.00 0.00 178.15 178.87 3ice h ASN 401 N -0.49 0.50 1.31 1.72 2.35 -0.68 0.26 115.58 120.55 3ice h ASN 401 Ca 0.05 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 3ice h ASN 401 Cb 0.56 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 3ice h ASN 401 CO -0.23 0.61 -0.05 0.11 -1.65 0.00 0.00 177.43 176.22 3ice h LYS 402 N 0.49 0.00 0.00 0.81 1.79 -0.65 -3.08 116.57 115.93 3ice h LYS 402 Ca 0.10 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.43 3ice h LYS 402 Cb 0.41 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.04 3ice h LYS 402 CO 0.02 0.05 -1.64 1.28 -1.08 0.00 0.00 179.45 178.08 3ice n LEU 403 N -3.14 0.52 -1.97 2.94 4.77 -0.12 -4.67 117.00 115.34 3ice n LEU 403 Ca 0.02 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 3ice n LEU 403 Cb 0.40 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3ice n LEU 403 CO 0.30 0.12 0.00 0.00 -1.33 0.00 0.00 177.39 176.48 3ice n ALA 404 N -2.39 1.12 -1.35 -1.18 0.00 -0.00 -4.59 120.51 112.12 3ice n ALA 404 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.03 3ice n ALA 404 Cb 0.78 -1.38 0.10 0.00 0.00 0.00 0.00 19.45 18.96 3ice n ALA 404 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3ice s THR 406 N 1.38 3.07 0.81 0.00 -4.23 -1.26 -5.12 115.64 110.29 3ice s THR 406 Ca 0.00 0.35 -0.16 0.00 -1.18 0.00 0.00 61.69 60.70 3ice s THR 406 Cb 0.00 -2.93 -0.08 0.00 1.34 0.00 0.00 72.50 70.83 3ice s THR 406 CO 0.00 -0.45 -0.01 1.17 -0.54 0.00 0.00 174.62 174.78 3ice n LYS 407 N -3.60 0.04 -0.11 3.99 4.81 -1.26 -4.54 118.16 117.50 3ice n LYS 407 Ca 0.07 0.04 -0.08 0.00 -0.87 0.00 0.00 58.31 57.47 3ice n LYS 407 Cb 0.55 -1.44 -0.00 0.00 0.02 0.00 0.00 35.03 34.16 3ice n LYS 407 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 3ice h THR 408 N -0.72 1.06 -0.71 3.15 2.02 -1.98 -2.09 112.91 113.64 3ice h THR 408 Ca -0.44 -0.15 0.07 0.00 0.77 0.00 0.00 66.41 66.65 3ice h THR 408 Cb 1.34 0.57 -0.06 0.00 -1.74 0.00 0.00 68.15 68.26 3ice h THR 408 CO 0.35 0.08 0.40 -1.13 0.37 0.00 0.00 175.52 175.59 3ice h ASN 409 N 0.45 0.60 -0.98 4.18 -1.24 -2.00 0.12 115.58 116.70 3ice h ASN 409 Ca 0.14 0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.18 3ice h ASN 409 Cb -0.02 -0.09 -0.05 0.00 0.73 0.00 0.00 38.32 38.89 3ice h ASN 409 CO -0.05 0.38 0.63 0.44 -1.29 0.00 0.00 177.43 177.54 3ice h ASP 410 N 0.73 1.15 -0.45 1.15 3.32 -1.81 -1.44 116.42 119.06 3ice h ASP 410 Ca 0.32 -0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.34 3ice h ASP 410 Cb 0.22 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3ice h ASP 410 CO -0.19 0.85 0.30 -0.78 -1.72 0.00 0.00 179.24 177.69 3ice h ASP 411 N 1.34 0.50 -0.35 6.45 3.58 -0.15 0.47 116.42 128.26 3ice h ASP 411 Ca 0.36 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.72 3ice h ASP 411 Cb -0.12 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 40.79 3ice h ASP 411 CO -0.07 0.36 -0.07 0.15 -2.88 0.00 0.00 179.24 176.73 3ice h PHE 412 N 0.59 0.74 -0.23 0.28 3.57 -0.10 -3.19 116.94 118.60 3ice h PHE 412 Ca 0.17 -0.15 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 3ice h PHE 412 Cb -0.05 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.50 3ice h PHE 412 CO -0.00 0.81 -0.18 0.74 -2.23 0.00 0.00 178.31 177.45 3ice h PHE 413 N 0.46 0.63 0.00 0.41 0.04 -0.77 -3.52 116.94 114.19 3ice h PHE 413 Ca 0.09 -0.18 0.00 0.00 2.80 0.00 0.00 57.97 60.68 3ice h PHE 413 Cb 0.56 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.58 3ice h PHE 413 CO 0.05 0.84 0.00 -1.91 -0.60 0.00 0.00 178.31 176.69