#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rwh n GLY 5 N 0.00 5.84 0.27 0.55 0.00 -1.26 -4.90 105.19 105.69 1rwh n GLY 5 Ca 0.00 -1.89 0.04 0.00 0.00 0.00 0.00 46.02 44.17 1rwh n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh h ALA 6 N 0.92 1.03 -0.32 4.61 0.00 -2.01 -1.18 119.26 122.31 1rwh h ALA 6 Ca 0.00 0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 1rwh h ALA 6 Cb 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1rwh h ALA 6 CO 0.00 -0.17 -0.43 0.00 0.00 0.00 0.00 179.25 178.65 1rwh h ALA 7 N 1.51 0.49 -0.34 0.00 0.00 -1.99 -0.45 119.26 118.48 1rwh h ALA 7 Ca 0.39 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1rwh h ALA 7 Cb 0.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1rwh h ALA 7 CO -0.36 0.62 0.05 0.93 0.00 0.00 0.00 179.25 180.49 1rwh h GLU 8 N 0.65 0.58 -0.58 0.00 3.07 -1.79 -1.13 114.58 115.38 1rwh h GLU 8 Ca 0.04 -0.16 -0.08 0.00 -0.50 0.00 0.00 59.36 58.66 1rwh h GLU 8 Cb 1.03 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.85 1rwh h GLU 8 CO 0.10 0.66 0.04 0.74 -1.40 0.00 0.00 179.01 179.15 1rwh h PHE 9 N 0.41 1.03 -0.74 4.33 -1.00 -1.04 -0.97 116.94 118.95 1rwh h PHE 9 Ca 0.10 -0.15 -0.06 0.00 2.81 0.00 0.00 57.97 60.68 1rwh h PHE 9 Cb 0.37 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.62 1rwh h PHE 9 CO 0.03 0.90 0.22 0.00 -1.61 0.00 0.00 178.31 177.85 1rwh h ALA 10 N 1.15 0.97 -0.65 2.45 0.00 -0.91 -0.21 119.26 122.06 1rwh h ALA 10 Ca 0.17 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1rwh h ALA 10 Cb 0.46 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1rwh h ALA 10 CO 0.02 0.66 0.16 0.00 0.00 0.00 0.00 179.25 180.08 1rwh h ALA 11 N 1.11 0.85 -0.39 0.00 0.00 -0.97 -0.32 119.26 119.55 1rwh h ALA 11 Ca 0.24 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1rwh h ALA 11 Cb 0.32 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1rwh h ALA 11 CO -0.01 0.57 0.12 -0.07 0.00 0.00 0.00 179.25 179.86 1rwh h LEU 12 N 0.96 0.58 -0.48 0.00 3.38 -0.91 0.40 115.31 119.24 1rwh h LEU 12 Ca 0.20 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1rwh h LEU 12 Cb 0.36 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1rwh h LEU 12 CO 0.00 0.64 0.25 0.03 0.09 0.00 0.00 178.44 179.45 1rwh h ARG 13 N 0.49 0.68 -0.80 1.13 3.08 -0.84 -0.41 114.38 117.71 1rwh h ARG 13 Ca 0.13 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1rwh h ARG 13 Cb 0.27 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 1rwh h ARG 13 CO -0.00 0.55 0.51 -0.91 -1.07 0.00 0.00 179.97 179.05 1rwh h ASN 14 N 0.63 0.94 -0.60 7.04 2.35 -0.81 -0.90 115.58 124.22 1rwh h ASN 14 Ca 0.17 -0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.81 1rwh h ASN 14 Cb 0.08 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 1rwh h ASN 14 CO -0.02 0.70 0.11 -0.09 -1.65 0.00 0.00 177.43 176.47 1rwh h ARG 15 N 1.10 0.98 -0.41 0.81 2.43 -0.42 -0.15 114.38 118.72 1rwh h ARG 15 Ca 0.29 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1rwh h ARG 15 Cb -0.09 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.32 1rwh h ARG 15 CO -0.06 0.92 0.11 2.35 -1.51 0.00 0.00 179.97 181.78 1rwh h TRP 16 N 0.89 0.67 -0.86 2.20 2.91 -0.56 -0.30 115.95 120.90 1rwh h TRP 16 Ca 0.18 -0.08 -0.03 0.00 1.13 0.00 0.00 58.89 60.10 1rwh h TRP 16 Cb 0.41 -0.19 -0.04 0.00 -0.51 0.00 0.00 29.16 28.83 1rwh h TRP 16 CO 0.03 0.64 0.43 0.28 -1.03 0.00 0.00 178.44 178.79 1rwh h VAL 17 N 0.51 1.26 -0.54 2.65 2.07 -1.05 -0.52 116.25 120.64 1rwh h VAL 17 Ca 0.13 -0.70 0.02 0.00 0.82 0.00 0.00 66.70 66.97 1rwh h VAL 17 Cb 0.30 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 1rwh h VAL 17 CO -0.00 0.31 0.33 0.44 0.02 0.00 0.00 177.57 178.66 1rwh h ASP 18 N 1.22 0.54 -0.38 0.57 3.32 -0.66 -0.95 116.42 120.08 1rwh h ASP 18 Ca 0.30 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.32 1rwh h ASP 18 Cb 0.09 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1rwh h ASP 18 CO -0.04 0.38 0.10 1.56 -1.72 0.00 0.00 179.24 179.52 1rwh h GLN 19 N 0.65 0.60 0.00 3.56 4.20 -0.36 -0.03 115.11 123.72 1rwh h GLN 19 Ca 0.22 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1rwh h GLN 19 Cb 0.01 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1rwh h GLN 19 CO -0.09 0.62 -0.55 0.44 -0.67 0.00 0.00 178.83 178.58 1rwh n ILE 20 N -4.60 0.38 -0.06 2.54 -5.35 -0.27 -3.94 119.36 108.06 1rwh n ILE 20 Ca -0.01 -0.27 -0.04 0.00 -0.27 0.00 0.00 62.75 62.16 1rwh n ILE 20 Cb 0.19 -0.18 -0.13 0.00 -1.74 0.00 0.00 39.64 37.79 1rwh n ILE 20 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1rwh n THR 21 N -2.13 0.82 -1.60 7.28 -2.24 -0.38 -4.74 114.28 111.29 1rwh n THR 21 Ca 0.04 -0.60 -0.13 0.00 -2.27 0.00 0.00 64.05 61.08 1rwh n THR 21 Cb 0.44 -0.41 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 1rwh n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rwh n GLY 22 N 1.90 0.99 0.25 3.38 0.00 -0.03 -4.43 105.19 107.25 1rwh n GLY 22 Ca -0.20 -0.40 0.07 0.00 0.00 0.00 0.00 46.02 45.49 1rwh n GLY 22 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1rwh h ARG 23 N 0.00 0.00 -0.01 1.61 0.11 -1.83 -1.68 114.38 112.59 1rwh h ARG 23 Ca -0.28 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.80 1rwh h ARG 23 Cb 0.95 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.03 1rwh h ARG 23 CO 0.38 0.07 -0.13 0.27 0.10 0.00 0.00 179.97 180.67 1rwh n ASN 24 N -4.43 0.85 -0.34 0.08 6.94 -1.26 -4.36 115.26 112.74 1rwh n ASN 24 Ca -0.03 -0.91 0.03 0.00 -0.02 0.00 0.00 54.58 53.65 1rwh n ASN 24 Cb 0.15 0.02 0.04 0.00 -2.36 0.00 0.00 39.78 37.63 1rwh n ASN 24 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 1rwh n VAL 25 N -0.61 0.54 -2.28 3.53 0.24 -0.64 -5.05 118.33 114.07 1rwh n VAL 25 Ca 0.15 -0.65 -0.42 0.00 -2.04 0.00 0.00 64.34 61.38 1rwh n VAL 25 Cb 0.31 0.33 -0.03 0.00 -1.47 0.00 0.00 33.84 32.98 1rwh n VAL 25 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1rwh s ILE 26 N -0.81 3.91 -0.28 1.34 1.01 -1.17 -4.90 121.20 120.31 1rwh s ILE 26 Ca 0.09 1.23 -0.21 0.00 0.00 0.00 0.00 60.65 61.76 1rwh s ILE 26 Cb 0.08 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 1rwh s ILE 26 CO 0.01 -0.03 0.66 -1.10 0.00 0.00 0.00 174.94 174.47 1rwh s GLN 27 N 2.76 4.03 0.24 2.79 -0.21 -1.26 -5.04 119.66 122.97 1rwh s GLN 27 Ca 0.62 0.50 -0.31 0.00 0.02 0.00 0.00 55.36 56.19 1rwh s GLN 27 Cb -0.28 -3.68 -0.11 0.00 1.00 0.00 0.00 33.01 29.93 1rwh s GLN 27 CO 0.24 -0.50 1.58 0.00 -2.12 0.00 0.00 175.29 174.49 1rwh s ALA 28 N 2.61 3.77 0.00 6.09 0.00 -1.26 -1.96 121.76 131.01 1rwh s ALA 28 Ca 0.27 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.71 1rwh s ALA 28 Cb -0.15 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.33 1rwh s ALA 28 CO 0.10 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.39 1rwh n GLY 29 N 2.87 0.68 3.70 0.00 0.00 -1.26 -4.99 105.19 106.20 1rwh n GLY 29 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1rwh n GLY 29 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rwh s ASP 30 N -2.52 7.29 0.33 1.61 -1.08 -0.83 -4.93 116.67 116.53 1rwh s ASP 30 Ca 0.00 1.65 0.10 0.00 -0.52 0.00 0.00 52.55 53.78 1rwh s ASP 30 Cb 0.00 -2.57 0.57 0.00 -1.46 0.00 0.00 42.92 39.46 1rwh s ASP 30 CO 0.00 -0.36 1.75 1.55 0.52 0.00 0.00 175.17 178.63 1rwh h PRO 31 N 6.94 0.08 -0.09 4.34 0.13 -1.94 -1.24 132.00 140.23 1rwh h PRO 31 Ca -0.37 -0.04 -0.23 0.00 -0.87 0.00 0.00 66.00 64.49 1rwh h PRO 31 Cb 1.19 -0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 1rwh h PRO 31 CO 0.80 0.50 -0.85 -0.44 -0.23 0.00 0.00 178.00 177.77 1rwh h ASP 32 N 0.06 0.82 -0.68 1.44 3.32 -1.96 -1.57 116.42 117.86 1rwh h ASP 32 Ca 0.00 -0.58 0.00 0.00 0.02 0.00 0.00 57.03 56.48 1rwh h ASP 32 Cb 0.79 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 1rwh h ASP 32 CO 0.06 1.37 0.44 -0.26 -1.72 0.00 0.00 179.24 179.13 1rwh h PHE 33 N 0.43 0.86 -0.96 4.55 -1.00 -1.84 -1.43 116.94 117.56 1rwh h PHE 33 Ca -0.07 0.01 0.03 0.00 2.81 0.00 0.00 57.97 60.75 1rwh h PHE 33 Cb 1.48 -0.29 -0.05 0.00 3.61 0.00 0.00 35.95 40.70 1rwh h PHE 33 CO 0.08 0.56 0.63 0.00 -1.61 0.00 0.00 178.31 177.97 1rwh h ALA 34 N 1.24 1.36 -0.52 2.45 0.00 -1.12 -1.40 119.26 121.28 1rwh h ALA 34 Ca 0.25 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1rwh h ALA 34 Cb -0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.33 1rwh h ALA 34 CO -0.05 0.55 -0.13 0.87 0.00 0.00 0.00 179.25 180.49 1rwh h LYS 35 N 1.23 1.01 -0.78 0.00 1.57 -1.02 -0.09 116.57 118.49 1rwh h LYS 35 Ca 0.37 -0.39 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1rwh h LYS 35 Cb -0.04 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 1rwh h LYS 35 CO -0.11 1.07 0.31 0.00 -0.57 0.00 0.00 179.45 180.16 1rwh h ALA 36 N 0.91 1.08 -0.58 3.86 0.00 -0.87 -0.77 119.26 122.89 1rwh h ALA 36 Ca 0.13 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1rwh h ALA 36 Cb 0.70 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1rwh h ALA 36 CO 0.05 0.65 -0.06 0.82 0.00 0.00 0.00 179.25 180.71 1rwh h ILE 37 N 1.13 1.27 -0.62 0.00 1.08 -0.99 -0.98 117.51 118.39 1rwh h ILE 37 Ca 0.26 -1.23 0.01 0.00 -0.39 0.00 0.00 64.86 63.51 1rwh h ILE 37 Cb 0.21 0.89 -0.03 0.00 -3.07 0.00 0.00 36.82 34.82 1rwh h ILE 37 CO -0.02 0.44 0.41 0.74 -0.69 0.00 0.00 178.15 179.03 1rwh h THR 38 N 0.95 1.14 -0.67 -0.27 2.02 -0.64 0.21 112.91 115.66 1rwh h THR 38 Ca 0.16 -0.28 -0.07 0.00 0.77 0.00 0.00 66.41 66.99 1rwh h THR 38 Cb 0.64 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 1rwh h THR 38 CO 0.04 0.15 0.16 0.00 0.37 0.00 0.00 175.52 176.25 1rwh h ALA 39 N 1.24 0.88 -0.24 6.16 0.00 -0.82 -0.06 119.26 126.42 1rwh h ALA 39 Ca 0.23 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1rwh h ALA 39 Cb -0.07 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1rwh h ALA 39 CO -0.06 0.60 0.08 1.25 0.00 0.00 0.00 179.25 181.13 1rwh h LEU 40 N 1.00 0.10 -0.71 0.00 5.85 -0.79 -1.69 115.31 119.06 1rwh h LEU 40 Ca 0.21 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1rwh h LEU 40 Cb 0.36 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1rwh h LEU 40 CO 0.00 0.09 0.32 0.78 -0.34 0.00 0.00 178.44 179.29 1rwh h ASN 41 N 0.20 0.96 -0.49 1.25 2.35 -0.11 -1.38 115.58 118.35 1rwh h ASN 41 Ca 0.10 -0.15 -0.11 0.00 -0.55 0.00 0.00 56.30 55.59 1rwh h ASN 41 Cb 0.07 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1rwh h ASN 41 CO -0.10 0.84 -0.12 0.78 -1.65 0.00 0.00 177.43 177.18 1rwh h ASN 42 N 1.01 0.98 -0.48 5.81 2.35 -0.77 -0.11 115.58 124.36 1rwh h ASN 42 Ca 0.24 -0.32 -0.08 0.00 -0.55 0.00 0.00 56.30 55.59 1rwh h ASN 42 Cb 0.15 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 1rwh h ASN 42 CO -0.03 1.10 0.00 0.50 -1.65 0.00 0.00 177.43 177.35 1rwh h LYS 43 N 0.87 0.85 -0.53 0.81 1.63 -1.18 -0.92 116.57 118.10 1rwh h LYS 43 Ca 0.14 -0.27 -0.01 0.00 -0.85 0.00 0.00 60.65 59.66 1rwh h LYS 43 Cb 0.67 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.20 1rwh h LYS 43 CO 0.05 0.89 0.30 0.00 -3.45 0.00 0.00 179.45 177.24 1rwh h ALA 44 N 0.93 0.68 -0.41 5.00 0.00 -1.02 -1.50 119.26 122.94 1rwh h ALA 44 Ca 0.14 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1rwh h ALA 44 Cb 0.51 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1rwh h ALA 44 CO 0.02 0.18 -0.04 0.00 0.00 0.00 0.00 179.25 179.42 1rwh h ALA 45 N 1.14 1.16 -0.20 0.00 0.00 -0.82 -0.81 119.26 119.73 1rwh h ALA 45 Ca 0.19 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1rwh h ALA 45 Cb 0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1rwh h ALA 45 CO -0.03 0.54 0.13 0.22 0.00 0.00 0.00 179.25 180.10 1rwh h ASP 46 N 0.64 0.23 -0.59 0.00 1.82 -0.84 -1.10 116.42 116.58 1rwh h ASP 46 Ca 0.12 -0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 56.70 1rwh h ASP 46 Cb 0.46 -0.06 -0.03 0.00 0.68 0.00 0.00 39.33 40.38 1rwh h ASP 46 CO 0.02 0.19 0.25 0.28 -1.61 0.00 0.00 179.24 178.38 1rwh h SER 47 N 0.25 0.80 -0.16 2.28 0.02 -0.98 -2.82 113.55 112.95 1rwh h SER 47 Ca 0.07 -0.16 -0.05 0.00 -0.84 0.00 0.00 61.79 60.82 1rwh h SER 47 Cb -0.00 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 1rwh h SER 47 CO -0.01 0.74 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.32 1rwh h LEU 48 N 0.82 0.41 -1.71 5.07 3.38 -0.93 -1.44 115.31 120.92 1rwh h LEU 48 Ca 0.20 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1rwh h LEU 48 Cb 0.17 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1rwh h LEU 48 CO -0.02 0.49 -0.13 0.00 0.09 0.00 0.00 178.44 178.87 1rwh h ALA 49 N 1.56 1.16 -0.23 1.53 0.00 -0.96 -2.41 119.26 119.92 1rwh h ALA 49 Ca 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rwh h ALA 49 Cb 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1rwh h ALA 49 CO 0.01 0.17 0.00 1.63 0.00 0.00 0.00 179.25 181.06 1rwh n LYS 50 N -3.48 2.28 -1.79 0.00 5.02 -0.56 -4.98 118.16 114.64 1rwh n LYS 50 Ca -0.01 -1.90 -0.41 0.00 -2.02 0.00 0.00 58.31 53.96 1rwh n LYS 50 Cb 0.29 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.81 1rwh n LYS 50 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1rwh s LEU 51 N -1.68 4.34 -0.33 -0.35 1.43 -0.91 -0.20 118.68 120.98 1rwh s LEU 51 Ca 0.35 2.96 -0.26 0.00 -1.03 0.00 0.00 54.13 56.15 1rwh s LEU 51 Cb 0.21 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.80 1rwh s LEU 51 CO 0.31 -0.90 0.92 -0.62 0.23 0.00 0.00 176.35 176.29 1rwh s ASP 52 N 0.35 6.75 0.00 2.29 3.68 0.45 -4.63 116.67 125.56 1rwh s ASP 52 Ca 0.61 0.76 0.23 0.00 2.13 0.00 0.00 52.55 56.28 1rwh s ASP 52 Cb -0.47 -2.47 0.23 0.00 -1.45 0.00 0.00 42.92 38.76 1rwh s ASP 52 CO 0.51 -0.78 1.26 0.00 0.13 0.00 0.00 175.17 176.29 1rwh n ALA 53 N 6.60 2.45 -1.77 3.66 0.00 -1.26 -4.90 120.51 125.29 1rwh n ALA 53 Ca 0.07 -0.75 -0.38 0.00 0.00 0.00 0.00 53.44 52.39 1rwh n ALA 53 Cb 0.48 -0.79 -0.01 0.00 0.00 0.00 0.00 19.45 19.12 1rwh n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rwh s ALA 54 N -1.82 3.05 0.42 0.00 0.00 -1.26 -4.98 121.76 117.17 1rwh s ALA 54 Ca 0.29 0.99 -0.26 0.00 0.00 0.00 0.00 51.96 52.98 1rwh s ALA 54 Cb 0.20 -3.40 -0.09 0.00 0.00 0.00 0.00 23.12 19.84 1rwh s ALA 54 CO 0.29 -0.66 1.32 0.00 0.00 0.00 0.00 175.76 176.72 1rwh s ALA 55 N -1.47 3.25 -1.51 0.00 0.00 -1.26 -2.69 121.76 118.08 1rwh s ALA 55 Ca 0.61 1.27 -0.06 0.00 0.00 0.00 0.00 51.96 53.79 1rwh s ALA 55 Cb -0.31 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.33 1rwh s ALA 55 CO 0.38 -0.89 0.59 0.41 0.00 0.00 0.00 175.76 176.24 1rwh n GLY 56 N 0.65 -0.52 3.75 0.00 0.00 -1.26 -4.93 105.19 102.88 1rwh n GLY 56 Ca 0.04 0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1rwh n GLY 56 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1rwh s ARG 57 N -5.76 3.22 0.00 1.61 1.70 -1.09 -4.93 118.95 113.70 1rwh s ARG 57 Ca 0.32 2.27 0.12 0.00 -0.47 0.00 0.00 55.73 57.97 1rwh s ARG 57 Cb -0.15 -2.32 0.17 0.00 -0.57 0.00 0.00 34.95 32.08 1rwh s ARG 57 CO 0.40 -1.14 1.00 0.25 -1.08 0.00 0.00 175.30 174.73 1rwh n THR 58 N -0.90 0.29 -4.11 4.99 -2.24 -1.26 -4.98 114.28 106.07 1rwh n THR 58 Ca 0.10 -0.65 -0.08 0.00 -2.27 0.00 0.00 64.05 61.15 1rwh n THR 58 Cb 0.44 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.61 1rwh n THR 58 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1rwh s SER 59 N -1.01 0.54 -0.09 3.42 1.04 -1.26 -4.66 113.70 111.68 1rwh s SER 59 Ca 0.18 -1.04 -0.15 0.00 0.48 0.00 0.00 55.95 55.42 1rwh s SER 59 Cb 0.11 0.20 -0.28 0.00 0.10 0.00 0.00 66.02 66.15 1rwh s SER 59 CO 0.16 -0.61 0.60 0.58 0.98 0.00 0.00 173.24 174.95 1rwh h VAL 60 N 3.08 1.03 -3.96 5.02 2.07 -1.91 -3.43 116.25 118.14 1rwh h VAL 60 Ca -0.34 -2.43 -0.69 0.00 0.82 0.00 0.00 66.70 64.05 1rwh h VAL 60 Cb 1.15 2.75 -0.24 0.00 -1.52 0.00 0.00 31.29 33.44 1rwh h VAL 60 CO 0.65 0.74 -0.77 -0.36 0.02 0.00 0.00 177.57 177.85 1rwh s PHE 61 N -2.50 2.72 0.54 1.57 0.40 -1.26 -0.41 117.98 119.04 1rwh s PHE 61 Ca -0.19 -0.20 0.41 0.00 -0.60 0.00 0.00 56.93 56.35 1rwh s PHE 61 Cb 0.04 -1.65 2.16 0.00 0.51 0.00 0.00 43.02 44.08 1rwh s PHE 61 CO 0.79 0.15 2.28 1.79 0.70 0.00 0.00 175.22 180.94 1rwh h THR 62 N 4.44 0.06 -0.51 0.64 1.35 -0.84 -2.74 112.91 115.31 1rwh h THR 62 Ca -0.44 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1rwh h THR 62 Cb 1.16 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 1rwh h THR 62 CO 0.51 0.01 0.00 -0.90 -0.25 0.00 0.00 175.52 174.88 1rwh n ASP 63 N -3.15 3.56 -3.79 5.36 5.75 -1.26 -4.90 116.55 118.11 1rwh n ASP 63 Ca -0.02 -2.12 -0.26 0.00 -0.01 0.00 0.00 54.79 52.38 1rwh n ASP 63 Cb 0.12 -0.38 -0.17 0.00 -1.03 0.00 0.00 41.12 39.66 1rwh n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1rwh s LEU 64 N -1.21 1.06 -0.07 -2.12 1.43 -1.03 -5.10 118.68 111.63 1rwh s LEU 64 Ca 0.37 -0.48 -0.24 0.00 -1.03 0.00 0.00 54.13 52.74 1rwh s LEU 64 Cb 0.21 -0.63 -0.03 0.00 0.03 0.00 0.00 46.19 45.77 1rwh s LEU 64 CO 0.22 -0.23 0.75 -0.55 0.23 0.00 0.00 176.35 176.78 1rwh s SER 65 N 1.84 7.03 0.15 2.29 0.15 -1.26 -4.49 113.70 119.40 1rwh s SER 65 Ca 0.02 1.24 0.22 0.00 0.70 0.00 0.00 55.95 58.13 1rwh s SER 65 Cb -0.15 -2.44 0.87 0.00 -1.71 0.00 0.00 66.02 62.60 1rwh s SER 65 CO -0.07 -0.17 1.66 0.18 1.20 0.00 0.00 173.24 176.05 1rwh n LEU 66 N 3.97 0.42 -0.07 3.45 4.77 -1.26 -1.99 117.00 126.29 1rwh n LEU 66 Ca 0.00 0.59 0.15 0.00 -0.03 0.00 0.00 56.01 56.72 1rwh n LEU 66 Cb 0.51 -0.51 0.73 0.00 -2.33 0.00 0.00 43.42 41.81 1rwh n LEU 66 CO 0.48 -0.36 0.97 0.00 -1.33 0.00 0.00 177.39 177.14 1rwh n ALA 67 N -1.67 2.65 -3.57 -1.18 0.00 -1.26 -4.68 120.51 110.80 1rwh n ALA 67 Ca 0.03 -0.22 -0.35 0.00 0.00 0.00 0.00 53.44 52.90 1rwh n ALA 67 Cb 0.25 -1.41 -0.14 0.00 0.00 0.00 0.00 19.45 18.14 1rwh n ALA 67 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1rwh s LYS 68 N -2.38 3.13 0.41 0.00 1.02 -0.84 -5.02 119.74 116.05 1rwh s LYS 68 Ca 0.33 -0.79 0.10 0.00 0.02 0.00 0.00 55.97 55.64 1rwh s LYS 68 Cb 0.21 -3.03 0.86 0.00 -0.52 0.00 0.00 37.83 35.35 1rwh s LYS 68 CO 0.44 -0.30 1.96 0.38 -0.92 0.00 0.00 175.35 176.91 1rwh h ASP 69 N 8.08 0.20 -0.07 2.83 3.04 -1.84 -0.08 116.42 128.60 1rwh h ASP 69 Ca -0.37 -0.03 -0.12 0.00 -3.24 0.00 0.00 57.03 53.26 1rwh h ASP 69 Cb 1.14 -0.05 -0.01 0.00 -1.04 0.00 0.00 39.33 39.36 1rwh h ASP 69 CO 0.60 0.32 -0.34 0.00 -2.04 0.00 0.00 179.24 177.78 1rwh h ALA 70 N 1.71 0.93 0.00 4.15 0.00 -1.95 -1.80 119.26 122.29 1rwh h ALA 70 Ca 0.05 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 1rwh h ALA 70 Cb 0.29 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1rwh h ALA 70 CO 0.01 0.62 -0.64 0.93 0.00 0.00 0.00 179.25 180.17 1rwh h GLU 71 N 0.47 0.00 -0.22 0.00 5.08 -1.37 -1.47 114.58 117.07 1rwh h GLU 71 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1rwh h GLU 71 Cb 0.82 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 1rwh h GLU 71 CO 0.07 0.64 0.15 1.98 -1.00 0.00 0.00 179.01 180.85 1rwh h MET 72 N 0.00 0.30 -0.13 2.33 4.05 -0.86 -0.40 114.93 120.21 1rwh h MET 72 Ca -0.01 -0.02 0.02 0.00 -0.28 0.00 0.00 59.70 59.41 1rwh h MET 72 Cb 1.25 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.96 1rwh h MET 72 CO 0.08 0.20 0.01 0.28 0.23 0.00 0.00 176.91 177.72 1rwh h VAL 73 N 0.30 0.93 -0.32 -5.77 2.07 -1.04 -2.30 116.25 110.12 1rwh h VAL 73 Ca 0.08 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 1rwh h VAL 73 Cb -0.03 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1rwh h VAL 73 CO -0.02 0.01 0.08 0.74 0.02 0.00 0.00 177.57 178.40 1rwh h THR 74 N 0.06 1.15 -0.22 2.57 2.02 -1.15 0.93 112.91 118.27 1rwh h THR 74 Ca 0.06 -0.52 0.05 0.00 0.77 0.00 0.00 66.41 66.76 1rwh h THR 74 Cb 0.06 0.83 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 1rwh h THR 74 CO -0.09 0.19 -0.09 0.74 0.37 0.00 0.00 175.52 176.64 1rwh h THR 75 N 0.45 0.71 -0.40 3.16 2.02 -0.65 0.23 112.91 118.43 1rwh h THR 75 Ca 0.11 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.17 1rwh h THR 75 Cb 0.17 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1rwh h THR 75 CO -0.00 0.00 -0.22 1.88 0.37 0.00 0.00 175.52 177.55 1rwh h TYR 76 N -0.05 0.90 -0.06 3.16 -1.99 -0.70 -1.86 116.97 116.37 1rwh h TYR 76 Ca 0.12 -0.21 -0.13 0.00 2.00 0.00 0.00 58.73 60.51 1rwh h TYR 76 Cb 0.22 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 1rwh h TYR 76 CO -0.26 0.94 -0.54 1.79 -0.00 0.00 0.00 178.16 180.09 1rwh h THR 77 N 0.69 1.37 -0.68 -2.88 1.35 -0.67 -0.14 112.91 111.95 1rwh h THR 77 Ca 0.10 -1.84 -0.08 0.00 -0.55 0.00 0.00 66.41 64.03 1rwh h THR 77 Cb 0.74 1.93 -0.03 0.00 -1.73 0.00 0.00 68.15 69.06 1rwh h THR 77 CO 0.06 0.54 0.12 0.03 -0.25 0.00 0.00 175.52 176.02 1rwh h ARG 78 N 0.13 1.12 -0.59 4.72 3.08 -0.82 -0.70 114.38 121.32 1rwh h ARG 78 Ca 0.00 -0.29 -0.09 0.00 0.07 0.00 0.00 59.98 59.66 1rwh h ARG 78 Cb 1.00 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 1rwh h ARG 78 CO 0.08 1.02 0.00 -0.07 -1.07 0.00 0.00 179.97 179.93 1rwh h LEU 79 N 1.05 1.01 -0.71 3.04 3.38 -0.81 -0.94 115.31 121.33 1rwh h LEU 79 Ca 0.21 -0.28 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 1rwh h LEU 79 Cb 0.43 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1rwh h LEU 79 CO 0.01 1.05 -0.49 0.77 0.09 0.00 0.00 178.44 179.88 1rwh h SER 80 N 0.94 0.43 -0.58 -0.43 4.64 -0.91 -0.65 113.55 116.99 1rwh h SER 80 Ca 0.17 -0.21 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 1rwh h SER 80 Cb 0.54 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.48 1rwh h SER 80 CO 0.03 0.85 0.21 -0.61 -0.87 0.00 0.00 176.83 176.43 1rwh h GLN 81 N 0.32 0.89 -0.66 4.77 -0.00 -0.95 0.16 115.11 119.64 1rwh h GLN 81 Ca 0.02 -0.18 -0.03 0.00 -0.00 0.00 0.00 58.65 58.46 1rwh h GLN 81 Cb 0.97 -0.14 -0.03 0.00 0.00 0.00 0.00 27.48 28.29 1rwh h GLN 81 CO 0.08 0.78 0.28 -0.07 0.00 0.00 0.00 178.83 179.90 1rwh h LEU 82 N 0.81 0.89 -0.98 -2.39 3.38 -0.94 -0.35 115.31 115.74 1rwh h LEU 82 Ca 0.19 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1rwh h LEU 82 Cb 0.24 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1rwh h LEU 82 CO -0.01 0.81 0.08 0.00 0.09 0.00 0.00 178.44 179.41 1rwh h ALA 83 N 1.12 1.17 -0.21 1.53 0.00 -0.90 0.05 119.26 122.02 1rwh h ALA 83 Ca 0.22 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rwh h ALA 83 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1rwh h ALA 83 CO -0.02 0.56 0.12 1.15 0.00 0.00 0.00 179.25 181.06 1rwh h THR 84 N 0.78 1.09 -0.63 0.00 2.02 -0.40 -1.88 112.91 113.88 1rwh h THR 84 Ca 0.16 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.11 1rwh h THR 84 Cb 0.36 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 1rwh h THR 84 CO 0.01 0.09 0.40 0.00 0.37 0.00 0.00 175.52 176.39 1rwh h ALA 85 N 1.02 0.80 0.00 6.16 0.00 -0.77 -1.97 119.26 124.51 1rwh h ALA 85 Ca 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1rwh h ALA 85 Cb 0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1rwh h ALA 85 CO -0.01 0.25 -0.02 2.35 0.00 0.00 0.00 179.25 181.82 1rwh h TRP 86 N 0.86 0.00 -0.02 0.00 7.01 -0.77 -1.91 115.95 121.11 1rwh h TRP 86 Ca 0.23 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.23 1rwh h TRP 86 Cb -0.07 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 26.99 1rwh h TRP 86 CO -0.02 0.02 -0.06 0.00 -2.79 0.00 0.00 178.44 175.59 1rwh n ALA 87 N -2.34 2.63 -2.74 2.65 0.00 -0.73 -1.21 120.51 118.78 1rwh n ALA 87 Ca -0.03 -0.59 -0.40 0.00 0.00 0.00 0.00 53.44 52.42 1rwh n ALA 87 Cb 0.11 -0.94 -0.11 0.00 0.00 0.00 0.00 19.45 18.51 1rwh n ALA 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1rwh s THR 88 N -2.07 4.82 0.30 0.00 2.01 -0.72 -4.88 115.64 115.10 1rwh s THR 88 Ca 0.30 -0.49 -0.28 0.00 0.31 0.00 0.00 61.69 61.53 1rwh s THR 88 Cb 0.20 -3.54 -0.14 0.00 0.01 0.00 0.00 72.50 69.04 1rwh s THR 88 CO 0.35 -0.05 1.07 -2.65 -0.69 0.00 0.00 174.62 172.64 1rwh n PRO 89 N 5.03 1.51 -0.23 4.92 -0.02 -1.26 -1.45 135.00 143.49 1rwh n PRO 89 Ca -0.13 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1rwh n PRO 89 Cb 0.48 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1rwh n PRO 89 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1rwh n THR 90 N 0.25 0.00 -1.77 3.45 -2.24 -1.26 -5.02 114.28 107.69 1rwh n THR 90 Ca 0.09 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.51 1rwh n THR 90 Cb 0.33 -0.04 0.06 0.00 -2.10 0.00 0.00 70.33 68.57 1rwh n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rwh s ALA 91 N -2.57 2.38 0.29 6.98 0.00 -0.53 -4.89 121.76 123.42 1rwh s ALA 91 Ca 0.00 1.00 0.01 0.00 0.00 0.00 0.00 51.96 52.96 1rwh s ALA 91 Cb 0.00 -3.47 0.52 0.00 0.00 0.00 0.00 23.12 20.17 1rwh s ALA 91 CO 0.00 -1.48 1.88 0.00 0.00 0.00 0.00 175.76 176.17 1rwh h ALA 92 N 0.42 1.51 -0.63 0.00 0.00 -1.89 -1.50 119.26 117.17 1rwh h ALA 92 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1rwh h ALA 92 Cb 1.30 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1rwh h ALA 92 CO 0.53 0.32 0.00 1.33 0.00 0.00 0.00 179.25 181.43 1rwh n VAL 93 N -4.53 1.20 -1.68 0.00 0.24 -1.26 -4.91 118.33 107.39 1rwh n VAL 93 Ca 0.16 -0.96 -0.48 0.00 -2.04 0.00 0.00 64.34 61.01 1rwh n VAL 93 Cb 0.25 0.29 -0.05 0.00 -1.47 0.00 0.00 33.84 32.87 1rwh n VAL 93 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1rwh n PHE 94 N 1.27 2.29 -1.16 6.34 7.35 -0.57 -1.46 117.46 131.52 1rwh n PHE 94 Ca 0.23 0.09 -0.06 0.00 -0.76 0.00 0.00 57.45 56.95 1rwh n PHE 94 Cb 0.67 -2.62 -0.02 0.00 0.35 0.00 0.00 39.48 37.85 1rwh n PHE 94 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1rwh n GLY 95 N 4.16 0.70 3.63 7.13 0.00 -0.35 -4.94 105.19 115.52 1rwh n GLY 95 Ca 0.22 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1rwh n GLY 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rwh s ASP 96 N -2.36 6.87 0.33 1.61 -1.08 -0.54 -4.91 116.67 116.60 1rwh s ASP 96 Ca 0.00 0.99 0.07 0.00 -0.52 0.00 0.00 52.55 53.10 1rwh s ASP 96 Cb 0.00 -2.54 0.59 0.00 -1.46 0.00 0.00 42.92 39.51 1rwh s ASP 96 CO 0.00 -0.94 1.80 0.00 0.52 0.00 0.00 175.17 176.54 1rwh h ALA 97 N 8.33 1.28 -0.31 3.66 0.00 -1.92 -0.42 119.26 129.89 1rwh h ALA 97 Ca -0.21 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.23 1rwh h ALA 97 Cb 1.06 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1rwh h ALA 97 CO 1.05 0.48 -0.41 0.00 0.00 0.00 0.00 179.25 180.37 1rwh h ALA 98 N 1.49 0.47 -0.13 0.00 0.00 -1.98 -0.70 119.26 118.41 1rwh h ALA 98 Ca 0.04 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1rwh h ALA 98 Cb 0.60 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1rwh h ALA 98 CO 0.04 0.59 0.08 0.28 0.00 0.00 0.00 179.25 180.24 1rwh h VAL 99 N 0.60 1.05 -0.43 0.00 2.07 -1.88 -2.01 116.25 115.65 1rwh h VAL 99 Ca 0.04 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.54 1rwh h VAL 99 Cb 1.00 0.89 -0.08 0.00 -1.52 0.00 0.00 31.29 31.59 1rwh h VAL 99 CO 0.10 0.04 -0.06 0.25 0.02 0.00 0.00 177.57 177.92 1rwh h LEU 100 N 0.16 -0.30 -1.00 2.57 5.85 -0.94 -0.16 115.31 121.48 1rwh h LEU 100 Ca 0.05 0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1rwh h LEU 100 Cb 0.00 0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 1rwh h LEU 100 CO -0.01 -0.10 0.66 0.00 -0.34 0.00 0.00 178.44 178.64 1rwh h ALA 101 N 1.41 1.33 -0.61 1.25 0.00 -0.91 -1.05 119.26 120.68 1rwh h ALA 101 Ca 0.21 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1rwh h ALA 101 Cb 0.32 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1rwh h ALA 101 CO -0.40 0.55 0.07 0.00 0.00 0.00 0.00 179.25 179.47 1rwh h ALA 102 N 1.41 0.97 -0.15 0.00 0.00 -0.58 -0.46 119.26 120.45 1rwh h ALA 102 Ca 0.40 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1rwh h ALA 102 Cb 0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1rwh h ALA 102 CO -0.13 0.64 0.05 0.82 0.00 0.00 0.00 179.25 180.64 1rwh h ILE 103 N 0.95 1.17 -0.55 0.00 2.04 -0.46 -0.84 117.51 119.82 1rwh h ILE 103 Ca 0.18 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 1rwh h ILE 103 Cb 0.45 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1rwh h ILE 103 CO 0.02 0.15 0.33 0.11 0.00 0.00 0.00 178.15 178.76 1rwh h LYS 104 N 0.07 0.75 -0.38 2.37 1.57 -1.06 -0.07 116.57 119.82 1rwh h LYS 104 Ca 0.05 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1rwh h LYS 104 Cb 0.19 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1rwh h LYS 104 CO -0.00 0.54 -0.00 0.00 -0.57 0.00 0.00 179.45 179.42 1rwh h ALA 105 N 1.17 1.28 -0.32 3.86 0.00 -0.98 -0.63 119.26 123.64 1rwh h ALA 105 Ca 0.20 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1rwh h ALA 105 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1rwh h ALA 105 CO -0.04 0.48 0.10 0.78 0.00 0.00 0.00 179.25 180.57 1rwh h GLY 106 N 0.89 0.53 1.02 0.00 0.00 -0.62 0.07 103.07 104.97 1rwh h GLY 106 Ca 0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1rwh h GLY 106 CO 0.01 0.29 0.43 1.41 0.00 0.00 0.00 176.54 178.69 1rwh h LEU 107 N 0.35 1.05 -0.15 3.11 3.38 -0.78 -0.45 115.31 121.82 1rwh h LEU 107 Ca 0.10 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1rwh h LEU 107 Cb 0.25 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1rwh h LEU 107 CO -0.00 0.86 0.01 0.00 0.09 0.00 0.00 178.44 179.40 1rwh h ALA 108 N 1.23 0.21 -0.17 1.53 0.00 -0.90 -2.01 119.26 119.15 1rwh h ALA 108 Ca 0.29 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.83 1rwh h ALA 108 Cb 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1rwh h ALA 108 CO -0.04 -0.11 -0.65 -0.44 0.00 0.00 0.00 179.25 178.01 1rwh h ASP 109 N 0.03 0.72 -0.33 0.00 3.32 -0.93 -0.88 116.42 118.36 1rwh h ASP 109 Ca 0.05 -0.43 -0.04 0.00 0.02 0.00 0.00 57.03 56.63 1rwh h ASP 109 Cb 0.34 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1rwh h ASP 109 CO 0.01 1.18 0.09 0.00 -1.72 0.00 0.00 179.24 178.80 1rwh h ALA 110 N 0.82 1.39 0.43 3.45 0.00 -1.04 0.70 119.26 125.01 1rwh h ALA 110 Ca -0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1rwh h ALA 110 Cb 1.23 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1rwh h ALA 110 CO 0.13 0.44 -0.21 -0.97 0.00 0.00 0.00 179.25 178.63 1rwh h ASN 111 N 0.59 -0.49 -0.34 0.00 -0.00 -1.10 -0.35 115.58 113.90 1rwh h ASN 111 Ca 0.14 -0.06 0.03 0.00 -0.00 0.00 0.00 56.30 56.41 1rwh h ASN 111 Cb 0.24 0.13 -0.03 0.00 -0.00 0.00 0.00 38.32 38.66 1rwh h ASN 111 CO -0.00 -0.24 0.15 0.74 -0.00 0.00 0.00 177.43 178.08 1rwh h THR 112 N -0.73 0.96 0.00 -3.57 2.02 -0.86 -3.15 112.91 107.57 1rwh h THR 112 Ca -0.06 -0.11 -0.14 0.00 0.77 0.00 0.00 66.41 66.87 1rwh h THR 112 Cb 0.52 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1rwh h THR 112 CO 0.10 0.06 -0.69 -0.07 0.37 0.00 0.00 175.52 175.29 1rwh h LEU 113 N 0.32 0.00 0.00 2.58 3.38 -0.92 -3.46 115.31 117.21 1rwh h LEU 113 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1rwh h LEU 113 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1rwh h LEU 113 CO -0.12 0.69 0.00 0.00 0.09 0.00 0.00 178.44 179.10 1rwh s TYR 115 N -1.28 3.66 0.27 0.00 5.04 -0.22 -4.71 117.35 120.11 1rwh s TYR 115 Ca 0.00 -2.05 0.01 0.00 -2.44 0.00 0.00 57.07 52.59 1rwh s TYR 115 Cb 0.00 -4.06 -0.03 0.00 0.35 0.00 0.00 41.96 38.22 1rwh s TYR 115 CO 0.00 -1.20 0.26 0.54 -1.34 0.00 0.00 175.55 173.81 1rwh s ASN 116 N 2.49 0.79 0.00 4.32 2.20 -1.25 -4.28 114.94 119.20 1rwh s ASN 116 Ca 0.31 -1.50 0.18 0.00 -0.94 0.00 0.00 52.86 50.91 1rwh s ASN 116 Cb -0.07 0.50 1.08 0.00 -2.00 0.00 0.00 41.25 40.76 1rwh s ASN 116 CO -0.07 -1.01 1.57 -0.90 -2.94 0.00 0.00 177.10 173.75 1rwh n ASP 117 N -0.90 0.00 -0.49 3.54 5.75 -1.26 -2.26 116.55 120.93 1rwh n ASP 117 Ca 0.04 -1.05 0.07 0.00 -0.01 0.00 0.00 54.79 53.83 1rwh n ASP 117 Cb 0.64 0.00 0.05 0.00 -1.03 0.00 0.00 41.12 40.77 1rwh n ASP 117 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1rwh n ARG 118 N -0.85 1.00 -3.42 0.11 1.74 -1.26 -4.95 116.66 109.02 1rwh n ARG 118 Ca 0.14 -1.19 -0.37 0.00 -0.77 0.00 0.00 57.85 55.65 1rwh n ARG 118 Cb 0.06 -1.24 -0.06 0.00 -1.02 0.00 0.00 32.46 30.20 1rwh n ARG 118 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1rwh s LYS 119 N -1.17 4.23 0.29 5.56 2.47 -0.96 -5.06 119.74 125.11 1rwh s LYS 119 Ca 0.15 0.32 -0.26 0.00 -1.56 0.00 0.00 55.97 54.62 1rwh s LYS 119 Cb 0.11 -3.39 -0.09 0.00 -1.46 0.00 0.00 37.83 32.99 1rwh s LYS 119 CO 0.19 0.28 0.90 -2.00 0.16 0.00 0.00 175.35 174.88 1rwh s GLU 120 N 0.27 4.57 0.38 4.03 2.12 -1.26 -4.93 118.70 123.89 1rwh s GLU 120 Ca 0.22 1.27 -0.28 0.00 0.36 0.00 0.00 54.97 56.55 1rwh s GLU 120 Cb -0.15 -2.89 -0.11 0.00 0.26 0.00 0.00 34.13 31.24 1rwh s GLU 120 CO 0.09 0.34 1.49 -1.21 -0.54 0.00 0.00 175.26 175.42 1rwh s GLU 121 N -1.89 4.08 -0.07 4.30 2.02 -1.26 -5.01 118.70 120.86 1rwh s GLU 121 Ca 0.47 2.57 0.00 0.00 0.02 0.00 0.00 54.97 58.04 1rwh s GLU 121 Cb -0.19 -2.95 0.02 0.00 0.10 0.00 0.00 34.13 31.11 1rwh s GLU 121 CO 0.24 -0.56 -0.06 0.08 0.02 0.00 0.00 175.26 174.98 1rwh s VAL 122 N -1.13 0.80 0.00 2.63 1.01 -1.26 -5.08 120.40 117.37 1rwh s VAL 122 Ca 0.53 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.30 1rwh s VAL 122 Cb -0.46 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1rwh s VAL 122 CO 0.63 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.64 1rwh n GLY 123 N 4.45 -0.55 3.65 4.51 0.00 -1.26 -4.70 105.19 111.29 1rwh n GLY 123 Ca -0.18 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.16 1rwh n GLY 123 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rwh s ASN 124 N -4.00 6.45 0.42 1.61 3.84 -1.26 -4.86 114.94 117.14 1rwh s ASN 124 Ca 0.00 2.43 0.16 0.00 0.21 0.00 0.00 52.86 55.66 1rwh s ASN 124 Cb 0.00 -2.53 1.06 0.00 -0.55 0.00 0.00 41.25 39.23 1rwh s ASN 124 CO 0.00 -1.08 1.89 4.11 -2.79 0.00 0.00 177.10 179.23 1rwh h TRP 125 N 10.54 0.52 -0.54 0.43 5.08 -2.00 -1.55 115.95 128.44 1rwh h TRP 125 Ca -0.45 0.02 -0.05 0.00 1.08 0.00 0.00 58.89 59.49 1rwh h TRP 125 Cb 1.21 -0.16 -0.03 0.00 -3.00 0.00 0.00 29.16 27.19 1rwh h TRP 125 CO 0.93 0.17 0.15 2.35 -1.28 0.00 0.00 178.44 180.76 1rwh h TRP 126 N 0.42 0.83 -0.66 0.12 7.01 -1.98 -1.73 115.95 119.97 1rwh h TRP 126 Ca 0.41 -0.07 0.06 0.00 2.11 0.00 0.00 58.89 61.40 1rwh h TRP 126 Cb 0.97 -0.25 -0.05 0.00 -2.10 0.00 0.00 29.16 27.73 1rwh h TRP 126 CO -0.00 0.69 0.37 0.77 -2.79 0.00 0.00 178.44 177.48 1rwh h SER 127 N 0.79 0.54 0.91 2.65 0.02 -1.63 0.77 113.55 117.60 1rwh h SER 127 Ca 0.18 0.03 -0.20 0.00 -0.84 0.00 0.00 61.79 60.96 1rwh h SER 127 Cb 0.26 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 1rwh h SER 127 CO -0.00 0.35 -0.93 -0.50 -1.14 0.00 0.00 176.83 174.60 1rwh h TRP 128 N 0.68 0.02 0.00 3.45 4.06 -1.47 -1.12 115.95 121.57 1rwh h TRP 128 Ca 0.30 -0.01 -0.19 0.00 2.06 0.00 0.00 58.89 61.05 1rwh h TRP 128 Cb 0.19 -0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.31 1rwh h TRP 128 CO -0.08 0.94 -1.89 0.39 -3.56 0.00 0.00 178.44 174.24 1rwh n GLU 129 N -3.45 1.36 0.00 0.49 1.02 -0.72 -4.45 120.64 114.89 1rwh n GLU 129 Ca -0.01 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1rwh n GLU 129 Cb 0.88 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 1rwh n GLU 129 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1rwh n ILE 130 N -2.38 0.00 0.19 -3.67 5.41 0.05 -4.56 119.36 114.39 1rwh n ILE 130 Ca -0.17 0.00 -0.15 0.00 1.00 0.00 0.00 62.75 63.43 1rwh n ILE 130 Cb 0.80 -1.29 -0.08 0.00 -0.71 0.00 0.00 39.64 38.36 1rwh n ILE 130 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1rwh h GLY 131 N 0.00 -0.47 0.39 7.39 0.00 -0.93 -2.57 103.07 106.87 1rwh h GLY 131 Ca 0.00 0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.50 1rwh h GLY 131 CO 0.00 -0.17 -0.01 -2.08 0.00 0.00 0.00 176.54 174.28 1rwh h VAL 132 N -0.58 1.42 -0.79 4.60 2.07 -1.45 -3.26 116.25 118.26 1rwh h VAL 132 Ca -0.05 -1.40 0.08 0.00 0.82 0.00 0.00 66.70 66.15 1rwh h VAL 132 Cb 0.43 2.35 -0.07 0.00 -1.52 0.00 0.00 31.29 32.48 1rwh h VAL 132 CO 0.08 0.36 0.45 -0.65 0.02 0.00 0.00 177.57 177.83 1rwh h PRO 133 N -0.64 0.77 -0.71 1.57 0.11 -1.77 0.15 132.00 131.48 1rwh h PRO 133 Ca -0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1rwh h PRO 133 Cb 0.60 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.50 1rwh h PRO 133 CO 0.00 0.51 0.45 0.00 -0.21 0.00 0.00 178.00 178.76 1rwh h ARG 134 N 0.80 0.95 -0.12 1.05 3.08 -1.58 0.17 114.38 118.73 1rwh h ARG 134 Ca 0.37 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 60.23 1rwh h ARG 134 Cb 0.28 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1rwh h ARG 134 CO -0.22 0.66 -0.38 0.00 -1.07 0.00 0.00 179.97 178.96 1rwh h ALA 135 N 1.24 0.21 -0.55 0.04 0.00 -1.40 -1.88 119.26 116.92 1rwh h ALA 135 Ca 0.26 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1rwh h ALA 135 Cb -0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1rwh h ALA 135 CO -0.05 0.30 -0.00 1.25 0.00 0.00 0.00 179.25 180.74 1rwh h LEU 136 N 0.06 0.93 -0.41 0.00 5.85 -0.65 -0.76 115.31 120.33 1rwh h LEU 136 Ca -0.01 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 1rwh h LEU 136 Cb 1.01 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1rwh h LEU 136 CO 0.08 0.99 0.23 0.00 -0.34 0.00 0.00 178.44 179.40 1rwh h ALA 137 N 1.11 0.52 -0.25 1.25 0.00 -0.99 -0.30 119.26 120.61 1rwh h ALA 137 Ca 0.16 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1rwh h ALA 137 Cb 0.52 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1rwh h ALA 137 CO 0.03 0.04 0.01 -0.44 0.00 0.00 0.00 179.25 178.88 1rwh h ASP 138 N 0.53 -0.08 -0.84 0.00 3.32 -1.13 -1.41 116.42 116.82 1rwh h ASP 138 Ca 0.14 0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.28 1rwh h ASP 138 Cb 0.04 0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.62 1rwh h ASP 138 CO -0.02 -0.01 0.54 0.00 -1.72 0.00 0.00 179.24 178.02 1rwh h ALA 139 N 1.21 1.11 -0.48 3.45 0.00 -0.83 0.56 119.26 124.27 1rwh h ALA 139 Ca 0.12 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1rwh h ALA 139 Cb 0.14 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1rwh h ALA 139 CO -0.19 0.35 0.29 0.52 0.00 0.00 0.00 179.25 180.23 1rwh h MET 140 N 1.03 0.57 -0.24 0.00 2.86 -0.60 -0.38 114.93 118.17 1rwh h MET 140 Ca 0.34 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.89 1rwh h MET 140 Cb 0.03 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 1rwh h MET 140 CO -0.12 0.38 -0.05 0.28 1.06 0.00 0.00 176.91 178.45 1rwh h VAL 141 N 0.59 1.28 -0.92 -2.22 2.07 -0.81 -1.09 116.25 115.15 1rwh h VAL 141 Ca 0.19 -1.05 0.09 0.00 0.82 0.00 0.00 66.70 66.76 1rwh h VAL 141 Cb -0.00 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.17 1rwh h VAL 141 CO -0.08 0.32 0.57 -0.07 0.02 0.00 0.00 177.57 178.33 1rwh h LEU 142 N 0.20 0.85 -3.59 2.57 3.38 -0.78 -2.50 115.31 115.45 1rwh h LEU 142 Ca 0.06 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1rwh h LEU 142 Cb 0.51 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1rwh h LEU 142 CO 0.02 0.49 0.02 0.18 0.09 0.00 0.00 178.44 179.24 1rwh n LEU 143 N -4.64 5.80 -0.29 1.67 4.77 -0.16 -4.70 117.00 119.44 1rwh n LEU 143 Ca 0.15 -2.96 0.02 0.00 -0.03 0.00 0.00 56.01 53.20 1rwh n LEU 143 Cb 0.27 -0.69 0.23 0.00 -2.33 0.00 0.00 43.42 40.89 1rwh n LEU 143 CO 0.29 0.64 1.25 -0.74 -1.33 0.00 0.00 177.39 177.50 1rwh h HIS 144 N 3.93 1.05 0.00 -1.77 2.76 -0.72 0.71 115.15 121.12 1rwh h HIS 144 Ca 0.02 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1rwh h HIS 144 Cb 2.02 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 30.63 1rwh h HIS 144 CO 1.12 0.59 0.00 0.00 -1.30 0.00 0.00 177.93 178.34 1rwh n ALA 145 N -2.40 1.65 -0.03 5.26 0.00 -1.26 -3.91 120.51 119.82 1rwh n ALA 145 Ca 0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 53.44 53.49 1rwh n ALA 145 Cb 0.14 -1.24 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 1rwh n ALA 145 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1rwh n GLU 146 N -1.53 2.77 -2.73 0.00 -0.58 0.12 -5.02 120.64 113.68 1rwh n GLU 146 Ca 0.03 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.43 1rwh n GLU 146 Cb 0.17 -1.15 -0.06 0.00 -0.57 0.00 0.00 31.44 29.83 1rwh n GLU 146 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1rwh s LEU 147 N -4.53 4.06 0.73 -4.62 1.43 -0.49 -5.06 118.68 110.19 1rwh s LEU 147 Ca -0.04 1.82 -0.09 0.00 -1.03 0.00 0.00 54.13 54.80 1rwh s LEU 147 Cb 0.02 -4.35 0.06 0.00 0.03 0.00 0.00 46.19 41.94 1rwh s LEU 147 CO 0.24 -0.37 1.06 -0.94 0.23 0.00 0.00 176.35 176.57 1rwh s SER 148 N -1.91 4.83 0.22 2.29 1.04 -1.26 -4.90 113.70 114.00 1rwh s SER 148 Ca 0.59 0.63 -0.08 0.00 0.48 0.00 0.00 55.95 57.56 1rwh s SER 148 Cb -0.15 -1.27 0.25 0.00 0.10 0.00 0.00 66.02 64.95 1rwh s SER 148 CO 0.19 -1.63 1.84 0.00 0.98 0.00 0.00 173.24 174.62 1rwh h ALA 149 N -0.71 0.99 -0.72 5.32 0.00 -1.97 -1.41 119.26 120.76 1rwh h ALA 149 Ca -0.45 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1rwh h ALA 149 Cb 1.31 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1rwh h ALA 149 CO 0.62 0.20 0.27 0.00 0.00 0.00 0.00 179.25 180.34 1rwh h ALA 150 N 1.34 1.11 -0.42 0.00 0.00 -1.99 0.68 119.26 119.98 1rwh h ALA 150 Ca 0.31 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1rwh h ALA 150 Cb 0.10 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1rwh h ALA 150 CO -0.15 0.63 0.17 0.93 0.00 0.00 0.00 179.25 180.83 1rwh h GLU 151 N 1.05 0.64 -0.55 0.00 5.08 -1.84 -1.57 114.58 117.39 1rwh h GLU 151 Ca 0.24 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1rwh h GLU 151 Cb 0.23 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1rwh h GLU 151 CO -0.02 0.59 0.36 0.00 -1.00 0.00 0.00 179.01 178.94 1rwh h ARG 152 N 0.54 0.71 -0.35 2.33 3.08 -0.85 -0.86 114.38 118.97 1rwh h ARG 152 Ca 0.14 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.20 1rwh h ARG 152 Cb 0.20 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 1rwh h ARG 152 CO -0.01 0.47 0.09 1.15 -1.07 0.00 0.00 179.97 180.59 1rwh h THR 153 N 0.73 0.85 -0.49 2.04 2.02 -0.63 0.63 112.91 118.05 1rwh h THR 153 Ca 0.20 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.29 1rwh h THR 153 Cb -0.07 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 1rwh h THR 153 CO -0.05 0.04 0.23 0.00 0.37 0.00 0.00 175.52 176.10 1rwh h ALA 154 N 1.25 0.63 0.13 6.16 0.00 -0.87 -0.88 119.26 125.69 1rwh h ALA 154 Ca 0.17 -0.13 -0.29 0.00 0.00 0.00 0.00 54.91 54.66 1rwh h ALA 154 Cb 0.18 -0.19 0.02 0.00 0.00 0.00 0.00 17.79 17.79 1rwh h ALA 154 CO -0.20 0.21 -1.24 1.88 0.00 0.00 0.00 179.25 179.90 1rwh h TYR 155 N 0.65 0.77 -0.80 0.00 0.05 -0.90 -1.48 116.97 115.26 1rwh h TYR 155 Ca 0.17 -0.51 0.01 0.00 0.05 0.00 0.00 58.73 58.45 1rwh h TYR 155 Cb 0.14 -0.05 -0.04 0.00 1.01 0.00 0.00 36.73 37.79 1rwh h TYR 155 CO -0.00 1.37 0.53 0.00 -1.05 0.00 0.00 178.16 179.01 1rwh h ALA 157 N 1.30 0.95 0.08 0.00 0.00 -0.99 -0.27 119.26 120.32 1rwh h ALA 157 Ca 0.30 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1rwh h ALA 157 Cb -0.11 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 1rwh h ALA 157 CO -0.07 0.53 -0.05 0.00 0.00 0.00 0.00 179.25 179.66 1rwh h ALA 158 N 1.16 -0.12 -0.15 0.00 0.00 -1.01 -1.10 119.26 118.04 1rwh h ALA 158 Ca 0.25 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1rwh h ALA 158 Cb 0.15 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1rwh h ALA 158 CO -0.03 -0.57 -0.08 0.82 0.00 0.00 0.00 179.25 179.39 1rwh h ILE 159 N -0.13 0.75 -0.11 0.00 2.04 -1.15 -2.48 117.51 116.43 1rwh h ILE 159 Ca -0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1rwh h ILE 159 Cb 0.11 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1rwh h ILE 159 CO 0.00 0.00 -0.11 0.44 0.00 0.00 0.00 178.15 178.48 1rwh h ASP 160 N -0.07 0.16 -0.39 1.72 3.32 -0.96 0.99 116.42 121.19 1rwh h ASP 160 Ca 0.09 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1rwh h ASP 160 Cb 0.20 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1rwh h ASP 160 CO -0.20 0.30 0.19 -0.74 -1.72 0.00 0.00 179.24 177.07 1rwh h HIS 161 N 0.17 0.56 0.00 4.55 -0.00 -0.76 -2.13 115.15 117.54 1rwh h HIS 161 Ca 0.04 -0.03 -0.19 0.00 -0.00 0.00 0.00 60.37 60.19 1rwh h HIS 161 Cb 0.31 -0.17 -0.03 0.00 -0.00 0.00 0.00 27.41 27.52 1rwh h HIS 161 CO 0.00 0.47 -1.05 0.74 -0.00 0.00 0.00 177.93 178.10 1rwh h PHE 162 N 0.49 0.00 -2.21 5.26 -1.00 -1.01 -3.39 116.94 115.08 1rwh h PHE 162 Ca 0.13 0.00 -0.58 0.00 2.81 0.00 0.00 57.97 60.33 1rwh h PHE 162 Cb 0.12 0.00 -0.40 0.00 3.61 0.00 0.00 35.95 39.28 1rwh h PHE 162 CO -0.01 0.80 -0.91 0.28 -1.61 0.00 0.00 178.31 176.85 1rwh n VAL 163 N -3.19 0.17 0.25 -0.55 0.31 0.29 -4.83 118.33 110.77 1rwh n VAL 163 Ca -0.04 -4.28 0.13 0.00 -0.01 0.00 0.00 64.34 60.14 1rwh n VAL 163 Cb 0.89 -1.96 0.60 0.00 -0.91 0.00 0.00 33.84 32.46 1rwh n VAL 163 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1rwh h PRO 164 N 4.47 0.00 -1.95 5.55 0.13 -1.59 -3.41 132.00 135.20 1rwh h PRO 164 Ca 0.15 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.10 1rwh h PRO 164 Cb 0.82 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.65 1rwh h PRO 164 CO 0.56 0.14 -0.50 0.34 -0.23 0.00 0.00 178.00 178.31 1rwh s ASP 165 N -6.02 0.39 0.00 1.44 -1.08 -1.26 -5.03 116.67 105.10 1rwh s ASP 165 Ca -0.00 0.13 0.14 0.00 -0.52 0.00 0.00 52.55 52.30 1rwh s ASP 165 Cb 0.11 1.03 0.66 0.00 -1.46 0.00 0.00 42.92 43.26 1rwh s ASP 165 CO 0.59 -0.31 1.38 -0.81 0.52 0.00 0.00 175.17 176.55 1rwh n PRO 166 N 5.36 0.14 0.00 4.34 -0.04 -1.26 -1.42 135.00 142.11 1rwh n PRO 166 Ca -0.04 0.19 0.11 0.00 -0.04 0.00 0.00 63.50 63.72 1rwh n PRO 166 Cb 0.50 -1.50 0.53 0.00 -0.04 0.00 0.00 33.50 32.99 1rwh n PRO 166 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1rwh n TRP 167 N -1.35 0.00 -4.45 0.54 7.02 -1.26 -4.56 117.44 113.38 1rwh n TRP 167 Ca 0.06 0.00 -0.22 0.00 -1.02 0.00 0.00 57.50 56.31 1rwh n TRP 167 Cb 0.12 -0.37 -0.10 0.00 -2.42 0.00 0.00 31.31 28.54 1rwh n TRP 167 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1rwh s LEU 168 N -2.74 2.49 0.09 -0.99 1.43 -0.51 -1.17 118.68 117.29 1rwh s LEU 168 Ca 0.17 -1.23 -0.10 0.00 -1.03 0.00 0.00 54.13 51.95 1rwh s LEU 168 Cb 0.15 -0.66 0.00 0.00 0.03 0.00 0.00 46.19 45.72 1rwh s LEU 168 CO 0.37 -0.37 0.22 0.00 0.23 0.00 0.00 176.35 176.79 1rwh s GLN 169 N -3.74 0.87 0.00 1.70 -2.07 -0.07 -4.62 119.66 111.74 1rwh s GLN 169 Ca 0.31 -0.93 0.00 0.00 -1.82 0.00 0.00 55.36 52.93 1rwh s GLN 169 Cb 0.05 0.36 0.00 0.00 -1.09 0.00 0.00 33.01 32.33 1rwh s GLN 169 CO 0.13 -0.29 0.00 1.19 -1.32 0.00 0.00 175.29 175.01 1rwh n PHE 170 N -0.08 0.00 -1.66 9.60 0.99 -1.26 -1.71 117.46 123.34 1rwh n PHE 170 Ca -0.15 0.00 -0.31 0.00 -0.00 0.00 0.00 57.45 56.99 1rwh n PHE 170 Cb 0.63 -0.07 0.04 0.00 -1.00 0.00 0.00 39.48 39.07 1rwh n PHE 170 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1rwh s PRO 171 N -3.74 3.13 0.30 -1.08 0.04 -1.26 -4.70 135.00 127.68 1rwh s PRO 171 Ca 0.00 0.90 0.05 0.00 0.04 0.00 0.00 61.00 61.99 1rwh s PRO 171 Cb 0.00 -2.02 0.71 0.00 0.04 0.00 0.00 34.50 33.23 1rwh s PRO 171 CO 0.00 -0.95 1.78 -1.35 0.04 0.00 0.00 177.00 176.52 1rwh h PRO 172 N -0.60 0.73 -0.00 0.56 0.11 -1.96 -1.52 132.00 129.32 1rwh h PRO 172 Ca -0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1rwh h PRO 172 Cb 1.20 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1rwh h PRO 172 CO 0.58 0.49 0.03 0.87 -0.21 0.00 0.00 178.00 179.76 1rwh h LYS 173 N 0.76 0.00 0.00 1.05 1.57 -2.02 -2.25 116.57 115.68 1rwh h LYS 173 Ca 0.56 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 59.18 1rwh h LYS 173 Cb 0.85 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.13 1rwh h LYS 173 CO -0.38 0.00 -1.72 -2.13 -0.57 0.00 0.00 179.45 174.66 1rwh n ARG 174 N -3.13 0.64 -0.10 3.15 0.63 -0.58 -5.07 116.66 112.20 1rwh n ARG 174 Ca -0.03 0.08 0.00 0.00 -0.92 0.00 0.00 57.85 56.98 1rwh n ARG 174 Cb 0.10 -1.69 0.00 0.00 0.45 0.00 0.00 32.46 31.33 1rwh n ARG 174 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rwh n GLY 175 N 1.43 -0.10 3.79 5.14 0.00 -0.85 -5.03 105.19 109.57 1rwh n GLY 175 Ca -0.13 -1.13 -0.38 0.00 0.00 0.00 0.00 46.02 44.38 1rwh n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rwh s LYS 176 N -3.56 4.17 0.33 1.61 1.02 -1.26 -4.82 119.74 117.23 1rwh s LYS 176 Ca 0.00 0.57 0.10 0.00 0.02 0.00 0.00 55.97 56.66 1rwh s LYS 176 Cb 0.00 -3.30 -0.06 0.00 -0.52 0.00 0.00 37.83 33.95 1rwh s LYS 176 CO 0.00 0.49 -0.06 0.96 -0.92 0.00 0.00 175.35 175.82 1rwh s ILE 177 N -0.51 2.55 0.21 2.17 -4.36 -0.69 -4.90 121.20 115.66 1rwh s ILE 177 Ca 0.27 -2.12 -0.32 0.00 -0.26 0.00 0.00 60.65 58.23 1rwh s ILE 177 Cb -0.17 -2.67 -0.12 0.00 1.25 0.00 0.00 42.46 40.75 1rwh s ILE 177 CO 0.15 -0.25 1.70 -0.89 0.24 0.00 0.00 174.94 175.89 1rwh s THR 178 N -2.53 2.08 0.31 8.37 2.01 -1.26 -0.89 115.64 123.74 1rwh s THR 178 Ca 0.33 0.06 -0.27 0.00 0.31 0.00 0.00 61.69 62.12 1rwh s THR 178 Cb -0.01 -3.04 -0.10 0.00 0.01 0.00 0.00 72.50 69.37 1rwh s THR 178 CO 0.18 0.01 0.96 -0.94 -0.69 0.00 0.00 174.62 174.13 1rwh s SER 179 N 1.14 7.36 0.09 3.53 1.04 -0.32 -4.79 113.70 121.75 1rwh s SER 179 Ca 0.74 1.89 0.02 0.00 0.48 0.00 0.00 55.95 59.08 1rwh s SER 179 Cb -0.49 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.00 1rwh s SER 179 CO 0.33 -0.05 -0.08 0.68 0.98 0.00 0.00 173.24 175.10 1rwh s VAL 180 N -1.52 0.73 0.00 5.02 -7.23 -1.26 -4.50 120.40 111.63 1rwh s VAL 180 Ca 0.49 -1.72 0.00 0.00 -1.81 0.00 0.00 61.98 58.94 1rwh s VAL 180 Cb -0.21 -1.42 0.00 0.00 0.56 0.00 0.00 36.38 35.31 1rwh s VAL 180 CO 0.26 -0.72 0.00 0.61 -0.31 0.00 0.00 175.10 174.94 1rwh n GLY 181 N 0.35 3.20 0.34 2.32 0.00 -1.26 -1.63 105.19 108.50 1rwh n GLY 181 Ca -0.15 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.80 1rwh n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh h ALA 182 N -0.82 1.89 -0.34 4.61 0.00 -1.95 -2.21 119.26 120.44 1rwh h ALA 182 Ca 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1rwh h ALA 182 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1rwh h ALA 182 CO 0.00 0.01 -0.09 -0.91 0.00 0.00 0.00 179.25 178.26 1rwh h ASN 183 N 0.51 0.67 -0.65 0.00 2.35 -1.69 -0.92 115.58 115.84 1rwh h ASN 183 Ca 0.25 -0.37 0.02 0.00 -0.55 0.00 0.00 56.30 55.66 1rwh h ASN 183 Cb 0.35 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 1rwh h ASN 183 CO -0.07 0.88 0.41 -0.09 -1.65 0.00 0.00 177.43 176.91 1rwh h ARG 184 N 0.44 0.78 0.06 0.81 9.65 -1.17 -0.49 114.38 124.45 1rwh h ARG 184 Ca 0.08 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 1rwh h ARG 184 Cb 0.60 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 1rwh h ARG 184 CO 0.04 0.51 -0.03 0.28 2.80 0.00 0.00 179.97 183.57 1rwh h VAL 185 N 0.80 0.97 -0.72 0.20 2.07 -1.21 -0.71 116.25 117.64 1rwh h VAL 185 Ca 0.26 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.66 1rwh h VAL 185 Cb -0.00 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1rwh h VAL 185 CO -0.09 0.02 0.28 0.44 0.02 0.00 0.00 177.57 178.24 1rwh h ASP 186 N -0.11 1.00 -0.38 0.57 3.32 -0.98 0.11 116.42 119.95 1rwh h ASP 186 Ca -0.01 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 56.82 1rwh h ASP 186 Cb 0.09 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1rwh h ASP 186 CO 0.01 0.90 0.06 -0.07 -1.72 0.00 0.00 179.24 178.43 1rwh h LEU 187 N 1.04 0.61 -1.09 1.55 3.38 -0.95 -1.93 115.31 117.92 1rwh h LEU 187 Ca 0.24 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1rwh h LEU 187 Cb 0.22 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1rwh h LEU 187 CO -0.02 0.71 0.08 0.00 0.09 0.00 0.00 178.44 179.31 1rwh h GLN 189 N 0.70 -0.20 -0.65 0.00 4.15 -0.57 0.95 115.11 119.49 1rwh h GLN 189 Ca 0.15 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.64 1rwh h GLN 189 Cb 0.31 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.99 1rwh h GLN 189 CO 0.00 -0.12 0.36 0.78 -1.93 0.00 0.00 178.83 177.92 1rwh h GLY 190 N -0.23 0.95 1.08 2.39 0.00 -1.11 -1.19 103.07 104.97 1rwh h GLY 190 Ca -0.02 -0.25 -0.12 0.00 0.00 0.00 0.00 47.33 46.94 1rwh h GLY 190 CO 0.04 0.16 -0.15 -2.22 0.00 0.00 0.00 176.54 174.37 1rwh h ILE 191 N 0.67 1.27 -0.51 2.60 1.08 -1.16 -1.27 117.51 120.19 1rwh h ILE 191 Ca 0.29 -1.30 -0.00 0.00 -0.39 0.00 0.00 64.86 63.46 1rwh h ILE 191 Cb 0.17 1.07 -0.02 0.00 -3.07 0.00 0.00 36.82 34.97 1rwh h ILE 191 CO -0.18 0.45 0.30 0.40 -0.69 0.00 0.00 178.15 178.44 1rwh h ILE 192 N 0.84 1.16 -0.35 -0.67 2.04 -0.34 0.86 117.51 121.04 1rwh h ILE 192 Ca 0.12 -0.36 -0.13 0.00 1.00 0.00 0.00 64.86 65.49 1rwh h ILE 192 Cb 0.72 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1rwh h ILE 192 CO 0.05 0.16 -0.30 0.40 0.00 0.00 0.00 178.15 178.46 1rwh h ILE 193 N 0.68 1.28 -0.55 -0.67 1.08 -1.20 -1.53 117.51 116.60 1rwh h ILE 193 Ca 0.18 -1.47 0.04 0.00 -0.39 0.00 0.00 64.86 63.23 1rwh h ILE 193 Cb -0.01 1.44 -0.03 0.00 -3.07 0.00 0.00 36.82 35.15 1rwh h ILE 193 CO -0.03 0.48 0.37 -0.09 -0.69 0.00 0.00 178.15 178.19 1rwh h ARG 194 N 0.62 0.57 0.00 2.37 1.12 -1.10 -1.84 114.38 116.11 1rwh h ARG 194 Ca 0.06 -0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 58.84 1rwh h ARG 194 Cb 0.88 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.71 1rwh h ARG 194 CO 0.08 0.38 -0.27 0.77 -3.11 0.00 0.00 179.97 177.82 1rwh h SER 195 N 0.59 0.00 -0.25 -3.80 0.02 -0.12 -1.31 113.55 108.69 1rwh h SER 195 Ca 0.23 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 61.06 1rwh h SER 195 Cb 0.17 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 1rwh h SER 195 CO -0.06 0.27 -0.32 -0.07 -1.14 0.00 0.00 176.83 175.50 1rwh h LEU 196 N 0.00 0.71 -0.34 5.07 3.38 -0.50 0.75 115.31 124.39 1rwh h LEU 196 Ca -0.00 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 1rwh h LEU 196 Cb 0.82 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1rwh h LEU 196 CO 0.03 1.07 0.11 0.00 0.09 0.00 0.00 178.44 179.75 1rwh h ALA 197 N 0.66 0.44 -0.01 1.53 0.00 -1.20 -3.17 119.26 117.51 1rwh h ALA 197 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1rwh h ALA 197 Cb 0.91 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1rwh h ALA 197 CO 0.08 0.07 -0.03 0.41 0.00 0.00 0.00 179.25 179.78 1rwh n GLY 198 N -0.66 -0.11 3.50 0.00 0.00 -0.51 -4.99 105.19 102.43 1rwh n GLY 198 Ca -0.01 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 1rwh n GLY 198 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rwh n GLU 199 N 0.04 -1.51 -3.91 1.61 1.02 0.14 -4.97 120.64 113.05 1rwh n GLU 199 Ca 0.18 0.70 -0.31 0.00 -0.02 0.00 0.00 57.16 57.72 1rwh n GLU 199 Cb 0.35 -4.65 -0.13 0.00 -0.02 0.00 0.00 31.44 26.99 1rwh n GLU 199 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1rwh s ASP 200 N -3.36 4.51 0.44 1.62 -1.08 -0.51 -4.96 116.67 113.33 1rwh s ASP 200 Ca 0.39 -3.09 0.18 0.00 -0.52 0.00 0.00 52.55 49.50 1rwh s ASP 200 Cb -0.11 -1.67 1.03 0.00 -1.46 0.00 0.00 42.92 40.70 1rwh s ASP 200 CO 0.82 -0.23 1.95 1.55 0.52 0.00 0.00 175.17 179.78 1rwh h PRO 201 N 6.44 0.00 0.17 4.34 0.13 -1.93 -1.81 132.00 139.35 1rwh h PRO 201 Ca -0.04 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 1rwh h PRO 201 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1rwh h PRO 201 CO 0.70 0.23 -0.08 1.15 -0.23 0.00 0.00 178.00 179.76 1rwh h THR 202 N 0.00 0.94 -0.78 1.56 2.02 -1.99 0.22 112.91 114.88 1rwh h THR 202 Ca -0.00 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.44 1rwh h THR 202 Cb 0.45 1.36 -0.04 0.00 -1.74 0.00 0.00 68.15 68.18 1rwh h THR 202 CO 0.03 0.16 0.34 0.11 0.37 0.00 0.00 175.52 176.52 1rwh h LYS 203 N -0.58 1.15 0.22 6.66 1.57 -1.96 -1.96 116.57 121.67 1rwh h LYS 203 Ca -0.02 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 1rwh h LYS 203 Cb 0.44 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1rwh h LYS 203 CO 0.04 0.91 -0.11 1.25 -0.57 0.00 0.00 179.45 180.98 1rwh h LEU 204 N 1.13 -0.25 -0.78 2.94 6.46 -1.18 -1.16 115.31 122.47 1rwh h LEU 204 Ca 0.26 -0.08 0.08 0.00 -0.12 0.00 0.00 57.88 58.03 1rwh h LEU 204 Cb 0.18 0.07 -0.07 0.00 -0.73 0.00 0.00 40.66 40.11 1rwh h LEU 204 CO -0.03 -0.08 0.44 0.78 -0.62 0.00 0.00 178.44 178.94 1rwh h ASN 205 N -0.41 0.65 -0.56 1.25 2.35 -0.86 -0.69 115.58 117.30 1rwh h ASN 205 Ca -0.03 0.04 -0.11 0.00 -0.55 0.00 0.00 56.30 55.65 1rwh h ASN 205 Cb 0.31 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 1rwh h ASN 205 CO 0.05 0.39 -0.07 -0.74 -1.65 0.00 0.00 177.43 175.41 1rwh h HIS 206 N 0.78 1.15 -0.75 1.19 2.76 -1.16 -1.13 115.15 117.99 1rwh h HIS 206 Ca 0.36 -0.23 -0.06 0.00 -2.20 0.00 0.00 60.37 58.25 1rwh h HIS 206 Cb 0.28 -0.29 -0.03 0.00 1.55 0.00 0.00 27.41 28.92 1rwh h HIS 206 CO -0.06 1.05 0.24 0.00 -1.30 0.00 0.00 177.93 177.85 1rwh h ALA 207 N 0.94 0.98 -0.44 5.26 0.00 -0.73 -1.52 119.26 123.75 1rwh h ALA 207 Ca 0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1rwh h ALA 207 Cb 0.64 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1rwh h ALA 207 CO 0.04 0.65 0.20 0.28 0.00 0.00 0.00 179.25 180.43 1rwh h VAL 208 N 1.10 1.19 -0.12 0.00 2.07 -0.95 -2.00 116.25 117.55 1rwh h VAL 208 Ca 0.24 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1rwh h VAL 208 Cb 0.30 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1rwh h VAL 208 CO -0.01 0.20 0.05 0.00 0.02 0.00 0.00 177.57 177.84 1rwh h ALA 209 N 1.05 1.88 0.00 1.67 0.00 -0.96 -1.82 119.26 121.07 1rwh h ALA 209 Ca 0.15 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1rwh h ALA 209 Cb 0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1rwh h ALA 209 CO -0.02 0.11 -0.08 0.78 0.00 0.00 0.00 179.25 180.04 1rwh h GLY 210 N 0.22 0.00 1.97 0.00 0.00 -0.50 -2.46 103.07 102.31 1rwh h GLY 210 Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.33 1rwh h GLY 210 CO -0.01 0.00 -0.17 1.41 0.00 0.00 0.00 176.54 177.78 1rwh h LEU 211 N 0.00 0.03 -1.59 3.11 3.38 -1.24 -3.25 115.31 115.75 1rwh h LEU 211 Ca -0.00 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1rwh h LEU 211 Cb 0.38 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1rwh h LEU 211 CO 0.01 0.20 0.31 0.28 0.09 0.00 0.00 178.44 179.33 1rwh h SER 212 N 0.03 0.47 0.21 -0.43 0.02 -1.58 -1.73 113.55 110.54 1rwh h SER 212 Ca 0.01 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1rwh h SER 212 Cb 0.32 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 1rwh h SER 212 CO 0.02 0.33 -0.13 -0.61 -1.14 0.00 0.00 176.83 175.30 1rwh h GLN 213 N 0.55 0.00 0.00 3.45 5.75 -1.77 -3.18 115.11 119.91 1rwh h GLN 213 Ca 0.18 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.68 1rwh h GLN 213 Cb 0.05 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.60 1rwh h GLN 213 CO -0.04 0.13 0.00 1.33 -2.65 0.00 0.00 178.83 177.59 1rwh n VAL 214 N -4.04 0.69 -0.48 2.39 0.24 -0.65 -2.45 118.33 114.04 1rwh n VAL 214 Ca -0.02 -0.09 0.06 0.00 -2.04 0.00 0.00 64.34 62.25 1rwh n VAL 214 Cb 0.21 -0.82 0.18 0.00 -1.47 0.00 0.00 33.84 31.95 1rwh n VAL 214 CO 0.00 0.00 0.00 -2.67 -2.14 0.00 0.00 176.83 172.02 1rwh n TRP 215 N -2.29 0.61 -2.67 6.34 2.14 -1.20 -4.59 117.44 115.78 1rwh n TRP 215 Ca 0.04 -0.65 -0.41 0.00 2.07 0.00 0.00 57.50 58.56 1rwh n TRP 215 Cb 0.35 -0.13 -0.05 0.00 -0.81 0.00 0.00 31.31 30.67 1rwh n TRP 215 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 1rwh s GLN 216 N -1.69 4.73 0.36 -2.67 -1.52 -1.02 -4.57 119.66 113.28 1rwh s GLN 216 Ca 0.29 1.55 -0.28 0.00 -1.95 0.00 0.00 55.36 54.97 1rwh s GLN 216 Cb 0.20 -3.31 -0.11 0.00 -0.22 0.00 0.00 33.01 29.57 1rwh s GLN 216 CO 0.12 0.29 1.47 0.71 -0.25 0.00 0.00 175.29 177.63 1rwh s TYR 217 N -0.56 2.67 0.29 0.91 4.12 -1.26 -4.48 117.35 119.04 1rwh s TYR 217 Ca 0.45 1.17 0.11 0.00 0.02 0.00 0.00 57.07 58.82 1rwh s TYR 217 Cb -0.26 -3.97 -0.05 0.00 -1.52 0.00 0.00 41.96 36.15 1rwh s TYR 217 CO 0.33 -2.86 -0.13 0.14 0.02 0.00 0.00 175.55 173.05 1rwh s VAL 218 N -1.02 2.62 -0.48 0.71 -7.23 -0.27 -5.00 120.40 109.73 1rwh s VAL 218 Ca 0.53 -2.25 0.05 0.00 -1.81 0.00 0.00 61.98 58.51 1rwh s VAL 218 Cb -0.45 -2.50 -0.00 0.00 0.56 0.00 0.00 36.38 33.98 1rwh s VAL 218 CO 0.60 -0.34 0.46 0.35 -0.31 0.00 0.00 175.10 175.86 1rwh n THR 219 N -0.73 0.00 -3.88 5.32 -2.24 -1.26 -4.31 114.28 107.18 1rwh n THR 219 Ca -0.05 -0.45 -0.08 0.00 -2.27 0.00 0.00 64.05 61.20 1rwh n THR 219 Cb 0.61 1.06 -0.02 0.00 -2.10 0.00 0.00 70.33 69.88 1rwh n THR 219 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1rwh s SER 220 N -0.94 -0.13 0.68 3.42 1.04 -1.26 -5.14 113.70 111.37 1rwh s SER 220 Ca 0.04 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 55.66 1rwh s SER 220 Cb 0.04 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.89 1rwh s SER 220 CO 0.13 -1.38 0.00 0.61 0.98 0.00 0.00 173.24 173.58 1rwh n GLY 221 N -0.46 0.93 3.88 7.32 0.00 -1.26 -4.80 105.19 110.79 1rwh n GLY 221 Ca -0.04 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 1rwh n GLY 221 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rwh s ASP 222 N -4.00 6.45 0.00 1.61 1.01 -1.26 -4.74 116.67 115.74 1rwh s ASP 222 Ca 0.00 0.53 0.00 0.00 0.71 0.00 0.00 52.55 53.79 1rwh s ASP 222 Cb 0.00 -2.09 0.00 0.00 1.01 0.00 0.00 42.92 41.84 1rwh s ASP 222 CO 0.00 0.39 0.00 0.61 0.21 0.00 0.00 175.17 176.38 1rwh n GLY 223 N 1.90 0.90 3.69 0.21 0.00 -0.27 -4.84 105.19 106.78 1rwh n GLY 223 Ca -0.19 -1.86 -0.38 0.00 0.00 0.00 0.00 46.02 43.60 1rwh n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rwh s ILE 224 N -2.62 5.19 0.33 -0.61 1.01 -1.26 -1.92 121.20 121.32 1rwh s ILE 224 Ca 0.00 0.81 -0.00 0.00 0.00 0.00 0.00 60.65 61.46 1rwh s ILE 224 Cb 0.00 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 1rwh s ILE 224 CO 0.00 0.27 0.53 -0.36 0.00 0.00 0.00 174.94 175.39 1rwh s PHE 225 N 1.09 3.50 0.41 3.97 0.40 -0.26 -1.11 117.98 125.98 1rwh s PHE 225 Ca 0.22 0.37 0.35 0.00 -0.60 0.00 0.00 56.93 57.27 1rwh s PHE 225 Cb -0.15 -1.90 1.77 0.00 0.51 0.00 0.00 43.02 43.25 1rwh s PHE 225 CO 0.08 0.15 2.15 0.00 0.70 0.00 0.00 175.22 178.31 1rwh h ARG 226 N 0.94 0.00 -0.03 0.44 3.08 -1.89 0.46 114.38 117.38 1rwh h ARG 226 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1rwh h ARG 226 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1rwh h ARG 226 CO 0.62 0.04 0.00 -0.40 -1.07 0.00 0.00 179.97 179.16 1rwh n ASP 227 N -3.29 0.51 0.00 7.04 5.68 -1.26 -4.89 116.55 120.34 1rwh n ASP 227 Ca -0.02 -1.33 0.00 0.00 -0.50 0.00 0.00 54.79 52.94 1rwh n ASP 227 Cb 0.20 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.16 1rwh n ASP 227 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rwh n GLY 228 N 0.98 0.97 3.71 6.12 0.00 0.15 -4.80 105.19 112.32 1rwh n GLY 228 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1rwh n GLY 228 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rwh s SER 229 N -2.81 4.03 -0.06 1.61 0.01 -1.26 -4.34 113.70 110.88 1rwh s SER 229 Ca 0.00 2.46 -0.01 0.00 1.31 0.00 0.00 55.95 59.71 1rwh s SER 229 Cb 0.00 -2.60 0.03 0.00 0.21 0.00 0.00 66.02 63.66 1rwh s SER 229 CO 0.00 -2.38 0.01 0.12 0.41 0.00 0.00 173.24 171.39 1rwh s PHE 230 N -1.86 0.56 -0.04 2.43 5.36 -1.26 -1.10 117.98 122.08 1rwh s PHE 230 Ca 0.77 -0.10 0.05 0.00 -0.96 0.00 0.00 56.93 56.69 1rwh s PHE 230 Cb -0.32 -0.71 -0.02 0.00 -0.34 0.00 0.00 43.02 41.63 1rwh s PHE 230 CO 0.46 -0.28 -0.20 0.42 -1.46 0.00 0.00 175.22 174.16 1rwh s ILE 231 N 1.81 2.59 0.05 3.12 1.01 -0.81 -0.90 121.20 128.07 1rwh s ILE 231 Ca 0.02 -0.90 0.05 0.00 0.00 0.00 0.00 60.65 59.82 1rwh s ILE 231 Cb -0.13 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1rwh s ILE 231 CO -0.04 0.58 -0.15 -1.58 0.00 0.00 0.00 174.94 173.76 1rwh s GLN 232 N -0.59 0.92 -1.08 2.79 2.00 -1.21 -1.11 119.66 121.39 1rwh s GLN 232 Ca 0.09 -0.83 0.00 0.00 -2.00 0.00 0.00 55.36 52.62 1rwh s GLN 232 Cb -0.11 -0.94 0.00 0.00 0.80 0.00 0.00 33.01 32.76 1rwh s GLN 232 CO 0.00 0.23 0.00 0.72 -0.50 0.00 0.00 175.29 175.74 1rwh n HIS 233 N 1.70 -0.44 0.00 1.67 8.25 -1.26 -3.77 115.22 121.37 1rwh n HIS 233 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 1rwh n HIS 233 Cb 0.54 -2.60 0.00 0.00 1.12 0.00 0.00 29.99 29.06 1rwh n HIS 233 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1rwh n SER 234 N -0.21 0.00 0.00 0.41 7.64 -1.26 -4.23 113.62 115.97 1rwh n SER 234 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.74 1rwh n SER 234 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1rwh n SER 234 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1rwh n THR 235 N 0.00 0.43 -4.78 0.44 -2.24 -1.26 -4.74 114.28 102.12 1rwh n THR 235 Ca 0.00 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 60.97 1rwh n THR 235 Cb 0.00 0.90 -0.17 0.00 -2.10 0.00 0.00 70.33 68.96 1rwh n THR 235 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rwh s THR 236 N -0.43 1.82 0.09 4.28 2.01 -1.25 -0.99 115.64 121.18 1rwh s THR 236 Ca 0.00 -0.85 -0.31 0.00 0.31 0.00 0.00 61.69 60.84 1rwh s THR 236 Cb 0.00 -1.61 -0.09 0.00 0.01 0.00 0.00 72.50 70.81 1rwh s THR 236 CO 0.00 0.50 1.79 -2.84 -0.69 0.00 0.00 174.62 173.38 1rwh s PRO 237 N 0.69 4.16 -0.00 4.92 0.02 -1.26 -3.30 135.00 140.23 1rwh s PRO 237 Ca -0.12 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.42 1rwh s PRO 237 Cb -0.16 -3.67 0.01 0.00 0.02 0.00 0.00 34.50 30.70 1rwh s PRO 237 CO 0.02 -0.82 0.77 0.66 -0.33 0.00 0.00 177.00 177.30 1rwh n TYR 238 N 5.90 0.00 -0.35 6.54 0.53 -0.08 -4.13 117.16 125.58 1rwh n TYR 238 Ca 0.17 -0.03 0.17 0.00 -1.02 0.00 0.00 57.90 57.19 1rwh n TYR 238 Cb 0.39 -0.03 0.38 0.00 -1.03 0.00 0.00 39.34 39.06 1rwh n TYR 238 CO 0.00 0.00 0.00 1.15 -1.02 0.00 0.00 176.86 176.99 1rwh h THR 239 N 4.84 0.55 0.00 -0.72 2.02 -1.50 -1.06 112.91 117.04 1rwh h THR 239 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1rwh h THR 239 Cb 1.19 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1rwh h THR 239 CO 0.00 0.11 -0.08 0.61 0.37 0.00 0.00 175.52 176.53 1rwh n GLY 240 N -1.31 -1.64 0.86 2.16 0.00 0.42 -2.34 105.19 103.34 1rwh n GLY 240 Ca 0.27 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1rwh n GLY 240 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rwh n SER 241 N -2.11 0.00 -0.13 1.61 3.41 -1.08 -4.55 113.62 110.76 1rwh n SER 241 Ca 0.06 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.69 1rwh n SER 241 Cb 0.42 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.69 1rwh n SER 241 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1rwh h TYR 242 N 0.00 0.77 -0.82 7.33 -1.99 -1.78 -0.66 116.97 119.82 1rwh h TYR 242 Ca 0.00 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.71 1rwh h TYR 242 Cb 0.00 -0.26 -0.04 0.00 2.00 0.00 0.00 36.73 38.43 1rwh h TYR 242 CO 0.00 0.48 0.38 0.78 -0.00 0.00 0.00 178.16 179.80 1rwh h GLY 243 N 0.83 1.28 1.22 3.88 0.00 -1.13 -1.89 103.07 107.26 1rwh h GLY 243 Ca 0.23 -0.65 -0.09 0.00 0.00 0.00 0.00 47.33 46.83 1rwh h GLY 243 CO -0.05 0.61 -0.03 -2.08 0.00 0.00 0.00 176.54 174.99 1rwh h VAL 244 N 1.18 1.26 -0.67 4.60 2.07 -0.84 -0.95 116.25 122.90 1rwh h VAL 244 Ca 0.28 -1.13 0.03 0.00 0.82 0.00 0.00 66.70 66.71 1rwh h VAL 244 Cb 0.14 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1rwh h VAL 244 CO -0.03 0.40 0.41 0.58 0.02 0.00 0.00 177.57 178.95 1rwh h VAL 245 N 0.85 1.07 -0.01 2.57 2.07 -0.72 0.18 116.25 122.26 1rwh h VAL 245 Ca 0.15 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1rwh h VAL 245 Cb 0.54 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1rwh h VAL 245 CO 0.03 0.15 -0.01 0.25 0.02 0.00 0.00 177.57 178.01 1rwh h LEU 246 N 0.80 -0.02 -0.34 2.57 6.46 -1.06 -1.27 115.31 122.44 1rwh h LEU 246 Ca 0.27 0.01 0.03 0.00 -0.12 0.00 0.00 57.88 58.07 1rwh h LEU 246 Cb 0.04 0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 39.95 1rwh h LEU 246 CO -0.12 -0.01 0.15 0.25 -0.62 0.00 0.00 178.44 178.09 1rwh h LEU 247 N -0.01 0.19 0.33 2.25 5.85 -0.79 -1.07 115.31 122.06 1rwh h LEU 247 Ca 0.01 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1rwh h LEU 247 Cb 0.02 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1rwh h LEU 247 CO -0.02 0.15 -0.16 0.74 -0.34 0.00 0.00 178.44 178.81 1rwh h THR 248 N 0.31 0.68 -0.57 1.05 2.02 -0.57 -1.02 112.91 114.81 1rwh h THR 248 Ca 0.15 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1rwh h THR 248 Cb 0.09 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 1rwh h THR 248 CO -0.13 0.00 0.30 1.23 0.37 0.00 0.00 175.52 177.30 1rwh h GLY 249 N -0.45 0.86 1.22 2.16 0.00 -1.05 -1.98 103.07 103.82 1rwh h GLY 249 Ca -0.05 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 1rwh h GLY 249 CO 0.07 0.38 0.09 1.41 0.00 0.00 0.00 176.54 178.50 1rwh h LEU 250 N 0.77 0.92 -0.44 3.11 3.38 -1.17 -1.15 115.31 120.73 1rwh h LEU 250 Ca 0.20 -0.20 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1rwh h LEU 250 Cb 0.06 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.52 1rwh h LEU 250 CO -0.03 0.92 0.16 0.77 0.09 0.00 0.00 178.44 180.35 1rwh h SER 251 N 0.91 0.18 -0.38 -0.43 4.64 -0.77 0.17 113.55 117.87 1rwh h SER 251 Ca 0.19 0.05 -0.14 0.00 -0.47 0.00 0.00 61.79 61.41 1rwh h SER 251 Cb 0.40 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 1rwh h SER 251 CO 0.01 0.14 -0.31 0.11 -0.87 0.00 0.00 176.83 175.91 1rwh h LYS 252 N 0.33 0.88 -0.21 4.77 1.57 -1.10 -2.24 116.57 120.58 1rwh h LYS 252 Ca 0.20 -0.44 -0.21 0.00 -1.87 0.00 0.00 60.65 58.34 1rwh h LYS 252 Cb 0.19 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.51 1rwh h LYS 252 CO -0.20 1.08 -0.68 -0.07 -0.57 0.00 0.00 179.45 179.01 1rwh h LEU 253 N 0.68 0.96 -0.50 2.94 3.38 -1.02 -1.06 115.31 120.69 1rwh h LEU 253 Ca 0.07 -0.59 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 1rwh h LEU 253 Cb 0.89 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1rwh h LEU 253 CO 0.08 1.38 0.30 -0.26 0.09 0.00 0.00 178.44 180.04 1rwh h PHE 254 N 0.59 0.66 -0.33 1.13 0.05 -0.70 -1.58 116.94 116.76 1rwh h PHE 254 Ca -0.03 -0.00 -0.03 0.00 3.82 0.00 0.00 57.97 61.73 1rwh h PHE 254 Cb 1.30 -0.22 -0.01 0.00 2.00 0.00 0.00 35.95 39.02 1rwh h PHE 254 CO 0.08 0.46 0.08 1.03 -0.18 0.00 0.00 178.31 179.78 1rwh h SER 255 N 0.67 0.51 -0.37 2.17 0.87 -1.35 -1.73 113.55 114.32 1rwh h SER 255 Ca 0.18 -0.24 0.07 0.00 -1.23 0.00 0.00 61.79 60.57 1rwh h SER 255 Cb -0.01 -0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 61.75 1rwh h SER 255 CO -0.03 0.61 -0.01 0.25 -0.53 0.00 0.00 176.83 177.11 1rwh h LEU 256 N 0.38 -0.18 0.00 2.23 5.85 -0.99 -3.18 115.31 119.43 1rwh h LEU 256 Ca 0.10 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1rwh h LEU 256 Cb 0.31 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1rwh h LEU 256 CO 0.00 -0.05 -0.66 0.18 -0.34 0.00 0.00 178.44 177.57 1rwh n LEU 257 N -5.20 0.62 -4.75 2.25 4.77 -0.61 -4.90 117.00 109.17 1rwh n LEU 257 Ca 0.02 0.11 -0.41 0.00 -0.03 0.00 0.00 56.01 55.70 1rwh n LEU 257 Cb 0.20 -0.19 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 1rwh n LEU 257 CO 0.20 0.02 1.14 -0.83 -1.33 0.00 0.00 177.39 176.59 1rwh s GLY 258 N -3.44 2.42 0.00 -0.72 0.00 -0.66 -1.78 107.32 103.15 1rwh s GLY 258 Ca 0.07 1.44 0.00 0.00 0.00 0.00 0.00 44.72 46.23 1rwh s GLY 258 CO 0.73 2.33 0.00 0.61 0.00 0.00 0.00 173.10 176.77 1rwh n GLY 259 N 1.76 0.71 3.86 0.20 0.00 -1.26 -4.98 105.19 105.48 1rwh n GLY 259 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 1rwh n GLY 259 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rwh s THR 260 N -2.92 2.09 0.62 2.61 -4.23 -0.73 -4.99 115.64 108.09 1rwh s THR 260 Ca 0.00 -1.50 0.35 0.00 -1.18 0.00 0.00 61.69 59.36 1rwh s THR 260 Cb 0.00 -2.59 0.35 0.00 1.34 0.00 0.00 72.50 71.61 1rwh s THR 260 CO 0.00 0.00 2.08 0.00 -0.54 0.00 0.00 174.62 176.16 1rwh h ALA 261 N 0.99 1.18 -0.48 3.99 0.00 -1.95 -2.45 119.26 120.54 1rwh h ALA 261 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1rwh h ALA 261 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1rwh h ALA 261 CO 0.60 -0.18 0.00 1.19 0.00 0.00 0.00 179.25 180.86 1rwh n PHE 262 N -2.92 0.67 -1.67 0.00 3.01 -1.26 -5.04 117.46 110.25 1rwh n PHE 262 Ca -0.02 -0.51 -0.43 0.00 1.01 0.00 0.00 57.45 57.49 1rwh n PHE 262 Cb 0.24 -0.03 -0.01 0.00 -0.01 0.00 0.00 39.48 39.67 1rwh n PHE 262 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1rwh n GLU 263 N 0.87 1.95 -2.12 -1.08 2.13 -0.93 -4.88 120.64 116.58 1rwh n GLU 263 Ca 0.16 0.68 -0.43 0.00 0.66 0.00 0.00 57.16 58.24 1rwh n GLU 263 Cb 0.52 -2.23 -0.03 0.00 0.27 0.00 0.00 31.44 29.98 1rwh n GLU 263 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1rwh s VAL 264 N -1.09 3.70 -0.29 6.31 1.01 -1.26 -4.84 120.40 123.94 1rwh s VAL 264 Ca 0.56 0.79 0.03 0.00 0.00 0.00 0.00 61.98 63.36 1rwh s VAL 264 Cb -0.59 -3.72 0.04 0.00 0.00 0.00 0.00 36.38 32.10 1rwh s VAL 264 CO 0.62 -0.31 0.75 -1.54 0.00 0.00 0.00 175.10 174.62 1rwh n SER 265 N 8.48 1.56 -4.66 3.32 3.41 -1.26 -5.00 113.62 119.48 1rwh n SER 265 Ca 0.19 -1.42 -0.42 0.00 -0.26 0.00 0.00 58.87 56.96 1rwh n SER 265 Cb 0.45 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 1rwh n SER 265 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1rwh s ASP 266 N -0.49 6.61 0.52 4.04 -1.08 -1.26 -4.86 116.67 120.14 1rwh s ASP 266 Ca 0.04 2.36 0.30 0.00 -0.52 0.00 0.00 52.55 54.73 1rwh s ASP 266 Cb 0.02 -2.53 1.33 0.00 -1.46 0.00 0.00 42.92 40.28 1rwh s ASP 266 CO 0.03 -0.96 1.99 1.55 0.52 0.00 0.00 175.17 178.31 1rwh h PRO 267 N 9.77 0.00 0.00 4.34 0.13 -2.04 -2.37 132.00 141.83 1rwh h PRO 267 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1rwh h PRO 267 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1rwh h PRO 267 CO 0.95 0.11 0.00 0.25 -0.23 0.00 0.00 178.00 179.08 1rwh n THR 268 N -3.35 0.45 0.15 1.56 -2.24 -1.26 -2.50 114.28 107.09 1rwh n THR 268 Ca -0.01 0.11 0.06 0.00 -2.27 0.00 0.00 64.05 61.95 1rwh n THR 268 Cb 0.31 -0.85 0.30 0.00 -2.10 0.00 0.00 70.33 67.99 1rwh n THR 268 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1rwh n ARG 269 N -1.24 0.07 0.03 -0.78 1.85 -0.89 -0.99 116.66 114.71 1rwh n ARG 269 Ca 0.08 0.52 0.21 0.00 -1.00 0.00 0.00 57.85 57.66 1rwh n ARG 269 Cb 0.12 -1.71 0.72 0.00 -1.05 0.00 0.00 32.46 30.53 1rwh n ARG 269 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1rwh h SER 270 N 0.00 0.00 -0.56 2.89 4.64 -1.75 -1.00 113.55 117.77 1rwh h SER 270 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1rwh h SER 270 Cb 0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 1rwh h SER 270 CO 0.00 0.00 0.13 0.40 -0.87 0.00 0.00 176.83 176.49 1rwh h ILE 271 N 0.00 1.25 -0.53 0.95 2.04 -1.35 0.78 117.51 120.65 1rwh h ILE 271 Ca 0.24 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.15 1rwh h ILE 271 Cb 1.03 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1rwh h ILE 271 CO -0.00 0.33 0.18 0.15 0.00 0.00 0.00 178.15 178.81 1rwh h PHE 272 N 0.81 0.84 -0.53 1.37 3.57 -1.39 -1.86 116.94 119.75 1rwh h PHE 272 Ca 0.18 -0.08 -0.07 0.00 3.53 0.00 0.00 57.97 61.53 1rwh h PHE 272 Cb 0.36 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 1rwh h PHE 272 CO 0.03 0.71 0.07 0.74 -2.23 0.00 0.00 178.31 177.63 1rwh h PHE 273 N 0.73 0.90 -0.04 0.41 0.04 -1.01 -1.16 116.94 116.81 1rwh h PHE 273 Ca 0.17 -0.11 0.01 0.00 2.80 0.00 0.00 57.97 60.84 1rwh h PHE 273 Cb 0.26 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 1rwh h PHE 273 CO 0.01 0.79 0.03 -0.44 -0.60 0.00 0.00 178.31 178.10 1rwh h ASP 274 N 0.81 0.00 1.14 2.17 3.32 -0.63 -2.09 116.42 121.14 1rwh h ASP 274 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1rwh h ASP 274 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1rwh h ASP 274 CO 0.01 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.53 1rwh h ALA 275 N 1.98 1.00 0.20 3.45 0.00 -0.36 -0.44 119.26 125.09 1rwh h ALA 275 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1rwh h ALA 275 Cb 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1rwh h ALA 275 CO -0.00 0.00 -0.36 0.28 0.00 0.00 0.00 179.25 179.17 1rwh h VAL 276 N 0.00 0.25 0.00 0.00 2.07 -1.36 0.90 116.25 118.10 1rwh h VAL 276 Ca 0.00 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.33 1rwh h VAL 276 Cb 0.57 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1rwh h VAL 276 CO 0.00 0.00 -1.17 -0.33 0.02 0.00 0.00 177.57 176.09 1rwh h GLU 277 N -0.65 0.00 0.05 1.57 5.08 -1.74 0.35 114.58 119.24 1rwh h GLU 277 Ca 0.01 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.13 1rwh h GLU 277 Cb 0.64 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1rwh h GLU 277 CO -0.16 0.57 -1.11 0.78 -1.00 0.00 0.00 179.01 178.09 1rwh h GLY 278 N 3.43 0.12 0.00 -3.84 0.00 -0.99 -3.39 103.07 98.40 1rwh h GLY 278 Ca -0.12 -0.30 -0.10 0.00 0.00 0.00 0.00 47.33 46.82 1rwh h GLY 278 CO 0.08 0.26 -1.32 1.44 0.00 0.00 0.00 176.54 177.00 1rwh n SER 279 N -3.41 0.41 -0.07 0.19 7.64 0.20 -4.51 113.62 114.06 1rwh n SER 279 Ca -0.04 0.07 -0.18 0.00 1.01 0.00 0.00 58.87 59.73 1rwh n SER 279 Cb 0.97 -0.17 -0.12 0.00 -1.01 0.00 0.00 64.21 63.88 1rwh n SER 279 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1rwh h PHE 280 N -0.21 0.05 -0.92 1.43 -1.00 -1.18 -3.39 116.94 111.73 1rwh h PHE 280 Ca -0.15 -0.04 0.04 0.00 2.81 0.00 0.00 57.97 60.63 1rwh h PHE 280 Cb 1.13 -0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.63 1rwh h PHE 280 CO -0.02 1.26 0.60 0.00 -1.61 0.00 0.00 178.31 178.54 1rwh h ALA 281 N -0.21 1.42 0.00 2.45 0.00 -1.11 -2.44 119.26 119.38 1rwh h ALA 281 Ca -0.18 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1rwh h ALA 281 Cb 1.21 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1rwh h ALA 281 CO -0.08 0.48 -0.10 -1.35 0.00 0.00 0.00 179.25 178.21 1rwh h PRO 282 N 1.14 0.00 -0.55 0.00 0.11 -1.76 -2.25 132.00 128.70 1rwh h PRO 282 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 1rwh h PRO 282 Cb 0.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.14 1rwh h PRO 282 CO -0.11 0.10 0.00 1.33 -0.21 0.00 0.00 178.00 179.10 1rwh n VAL 283 N -3.38 0.72 -3.26 3.15 0.24 -0.93 -4.87 118.33 109.99 1rwh n VAL 283 Ca -0.01 -0.86 -0.39 0.00 -2.04 0.00 0.00 64.34 61.05 1rwh n VAL 283 Cb 0.27 0.78 -0.06 0.00 -1.47 0.00 0.00 33.84 33.36 1rwh n VAL 283 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1rwh s MET 284 N -1.28 4.25 -0.28 7.34 -1.94 -0.85 -0.94 119.30 125.59 1rwh s MET 284 Ca 0.44 0.44 -0.00 0.00 -1.71 0.00 0.00 55.69 54.86 1rwh s MET 284 Cb 0.24 -3.52 0.09 0.00 2.01 0.00 0.00 34.83 33.65 1rwh s MET 284 CO 0.33 -0.04 0.05 0.42 -0.01 0.00 0.00 175.02 175.77 1rwh s ILE 285 N 1.28 1.15 -1.56 2.53 1.01 0.48 -4.80 121.20 121.28 1rwh s ILE 285 Ca 0.25 -1.37 -0.15 0.00 0.00 0.00 0.00 60.65 59.38 1rwh s ILE 285 Cb -0.15 -1.74 0.12 0.00 0.01 0.00 0.00 42.46 40.69 1rwh s ILE 285 CO 0.10 -0.48 0.81 0.59 0.00 0.00 0.00 174.94 175.96 1rwh n ASN 286 N 4.76 -3.99 0.00 3.58 3.02 -1.26 -1.42 115.26 119.95 1rwh n ASN 286 Ca -0.04 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1rwh n ASN 286 Cb 0.43 -3.23 0.00 0.00 -0.61 0.00 0.00 39.78 36.37 1rwh n ASN 286 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rwh n GLY 287 N -1.46 0.59 3.51 7.41 0.00 -1.24 -4.32 105.19 109.68 1rwh n GLY 287 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1rwh n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh s ALA 288 N -2.27 2.76 0.22 4.61 0.00 -0.51 -3.89 121.76 122.69 1rwh s ALA 288 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 51.96 50.71 1rwh s ALA 288 Cb 0.00 -1.06 -0.09 0.00 0.00 0.00 0.00 23.12 21.97 1rwh s ALA 288 CO 0.00 0.55 1.25 -1.64 0.00 0.00 0.00 175.76 175.92 1rwh s MET 289 N -0.71 4.44 0.32 0.00 -1.94 -0.12 -0.39 119.30 120.90 1rwh s MET 289 Ca 0.11 2.00 -0.29 0.00 -1.71 0.00 0.00 55.69 55.80 1rwh s MET 289 Cb -0.11 -3.19 -0.12 0.00 2.01 0.00 0.00 34.83 33.42 1rwh s MET 289 CO 0.01 -0.15 1.49 0.00 -0.01 0.00 0.00 175.02 176.36 1rwh n ALA 290 N 2.18 2.13 -0.16 3.03 0.00 -0.12 -4.57 120.51 123.00 1rwh n ALA 290 Ca 0.04 0.36 0.07 0.00 0.00 0.00 0.00 53.44 53.91 1rwh n ALA 290 Cb 0.43 -2.39 0.37 0.00 0.00 0.00 0.00 19.45 17.86 1rwh n ALA 290 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1rwh h ASP 291 N 3.76 0.63 0.35 0.00 3.32 -1.93 -1.95 116.42 120.60 1rwh h ASP 291 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1rwh h ASP 291 Cb 1.25 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1rwh h ASP 291 CO 0.71 0.41 0.00 0.00 -1.72 0.00 0.00 179.24 178.64 1rwh h ALA 292 N 1.62 1.00 -0.19 3.45 0.00 -1.95 -2.31 119.26 120.87 1rwh h ALA 292 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1rwh h ALA 292 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1rwh h ALA 292 CO -0.10 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.48 1rwh n VAL 293 N -2.53 1.94 -0.59 0.00 0.24 -0.73 -4.59 118.33 112.06 1rwh n VAL 293 Ca -0.00 -1.80 0.04 0.00 -2.04 0.00 0.00 64.34 60.53 1rwh n VAL 293 Cb 0.13 -0.10 0.05 0.00 -1.47 0.00 0.00 33.84 32.45 1rwh n VAL 293 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1rwh n ARG 294 N -0.59 1.95 0.00 7.34 1.85 -0.87 -0.44 116.66 125.91 1rwh n ARG 294 Ca 0.17 -1.79 0.00 0.00 -1.00 0.00 0.00 57.85 55.24 1rwh n ARG 294 Cb 0.73 -1.11 0.00 0.00 -1.05 0.00 0.00 32.46 31.03 1rwh n ARG 294 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rwh n GLY 295 N -0.78 2.68 0.04 2.89 0.00 -1.25 -1.87 105.19 106.89 1rwh n GLY 295 Ca 0.06 -0.15 0.10 0.00 0.00 0.00 0.00 46.02 46.03 1rwh n GLY 295 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1rwh n ARG 296 N 14.00 0.07 0.15 1.61 1.85 -1.26 -3.16 116.66 129.91 1rwh n ARG 296 Ca 0.00 0.25 0.12 0.00 -1.00 0.00 0.00 57.85 57.22 1rwh n ARG 296 Cb 0.00 -1.61 0.53 0.00 -1.05 0.00 0.00 32.46 30.33 1rwh n ARG 296 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1rwh n SER 297 N -1.73 0.63 0.00 2.89 3.41 -0.78 -2.20 113.62 115.83 1rwh n SER 297 Ca 0.04 0.71 0.21 0.00 -0.26 0.00 0.00 58.87 59.56 1rwh n SER 297 Cb 0.23 -0.82 0.70 0.00 -0.26 0.00 0.00 64.21 64.06 1rwh n SER 297 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 1rwh h ILE 298 N 0.00 0.68 0.00 -1.33 3.07 -1.72 -1.22 117.51 116.99 1rwh h ILE 298 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1rwh h ILE 298 Cb 0.21 0.72 0.00 0.00 -0.27 0.00 0.00 36.82 37.48 1rwh h ILE 298 CO 0.00 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.56 1rwh n SER 299 N -4.29 0.00 -4.46 2.16 3.41 -0.93 -4.78 113.62 104.72 1rwh n SER 299 Ca 0.10 -0.89 -0.40 0.00 -0.26 0.00 0.00 58.87 57.43 1rwh n SER 299 Cb 0.63 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.47 1rwh n SER 299 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1rwh s ARG 300 N -2.00 3.32 0.51 4.33 0.52 -0.46 -4.45 118.95 120.71 1rwh s ARG 300 Ca 0.41 -0.75 0.15 0.00 -0.52 0.00 0.00 55.73 55.02 1rwh s ARG 300 Cb 0.19 -3.68 1.24 0.00 0.52 0.00 0.00 34.95 33.21 1rwh s ARG 300 CO 0.31 -0.47 2.14 1.05 0.02 0.00 0.00 175.30 178.35 1rwh h GLU 301 N 8.42 0.04 0.00 3.54 4.11 -1.87 -2.96 114.58 125.85 1rwh h GLU 301 Ca -0.31 -0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.10 1rwh h GLU 301 Cb 1.14 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1rwh h GLU 301 CO 0.63 0.03 -0.48 0.00 0.07 0.00 0.00 179.01 179.26 1rwh n ALA 302 N -2.53 3.32 -3.22 1.06 0.00 -1.26 -4.69 120.51 113.19 1rwh n ALA 302 Ca -0.03 -3.08 -0.23 0.00 0.00 0.00 0.00 53.44 50.10 1rwh n ALA 302 Cb 0.09 -0.39 -0.07 0.00 0.00 0.00 0.00 19.45 19.08 1rwh n ALA 302 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1rwh n ASN 303 N -0.99 -0.55 -4.87 0.00 4.05 -1.12 -5.02 115.26 106.77 1rwh n ASN 303 Ca 0.17 -2.60 -0.21 0.00 0.45 0.00 0.00 54.58 52.38 1rwh n ASN 303 Cb 0.73 -0.29 0.08 0.00 1.23 0.00 0.00 39.78 41.53 1rwh n ASN 303 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1rwh s THR 304 N -0.38 2.12 0.44 -0.44 -4.23 -1.26 -4.62 115.64 107.28 1rwh s THR 304 Ca 0.34 -0.83 0.13 0.00 -1.18 0.00 0.00 61.69 60.15 1rwh s THR 304 Cb 0.11 -2.30 0.20 0.00 1.34 0.00 0.00 72.50 71.85 1rwh s THR 304 CO -0.15 0.00 2.01 1.23 -0.54 0.00 0.00 174.62 177.16 1rwh h GLY 305 N -0.15 0.10 1.56 3.99 0.00 -1.93 -1.08 103.07 105.56 1rwh h GLY 305 Ca -0.32 -0.05 -0.23 0.00 0.00 0.00 0.00 47.33 46.73 1rwh h GLY 305 CO 0.40 0.05 -0.95 -0.97 0.00 0.00 0.00 176.54 175.07 1rwh h TYR 306 N 0.09 0.59 -0.39 5.60 -1.99 -1.87 0.82 116.97 119.81 1rwh h TYR 306 Ca 0.02 -0.32 -0.02 0.00 2.00 0.00 0.00 58.73 60.40 1rwh h TYR 306 Cb 0.25 -0.07 -0.02 0.00 2.00 0.00 0.00 36.73 38.90 1rwh h TYR 306 CO 0.00 1.15 0.16 -0.44 -0.00 0.00 0.00 178.16 179.03 1rwh h ASP 307 N 0.22 0.54 -0.12 3.88 3.32 -1.77 0.16 116.42 122.65 1rwh h ASP 307 Ca -0.08 -0.17 -0.18 0.00 0.02 0.00 0.00 57.03 56.62 1rwh h ASP 307 Cb 1.59 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 41.00 1rwh h ASP 307 CO 0.16 0.56 -0.60 -0.07 -1.72 0.00 0.00 179.24 177.57 1rwh h LEU 308 N 0.49 0.82 -0.83 1.55 3.38 -1.20 -2.11 115.31 117.41 1rwh h LEU 308 Ca 0.13 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.60 1rwh h LEU 308 Cb 0.19 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1rwh h LEU 308 CO -0.01 1.23 0.34 1.23 0.09 0.00 0.00 178.44 181.32 1rwh h GLY 309 N 0.84 1.28 1.02 0.83 0.00 -0.79 -0.67 103.07 105.58 1rwh h GLY 309 Ca -0.00 -0.68 -0.04 0.00 0.00 0.00 0.00 47.33 46.61 1rwh h GLY 309 CO 0.12 0.64 0.28 0.00 0.00 0.00 0.00 176.54 177.58 1rwh h ALA 310 N 1.20 0.89 -0.71 3.60 0.00 -0.86 -0.21 119.26 123.17 1rwh h ALA 310 Ca 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1rwh h ALA 310 Cb 0.19 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1rwh h ALA 310 CO -0.03 0.51 0.33 0.77 0.00 0.00 0.00 179.25 180.83 1rwh h SER 311 N 0.98 0.93 -0.83 0.00 0.02 -1.05 -0.85 113.55 112.76 1rwh h SER 311 Ca 0.23 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1rwh h SER 311 Cb 0.20 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 1rwh h SER 311 CO -0.02 0.82 0.48 0.00 -1.14 0.00 0.00 176.83 176.97 1rwh h ALA 312 N 1.16 1.06 -0.18 3.77 0.00 -0.52 -1.34 119.26 123.21 1rwh h ALA 312 Ca 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1rwh h ALA 312 Cb 0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1rwh h ALA 312 CO -0.03 0.55 0.09 0.82 0.00 0.00 0.00 179.25 180.68 1rwh h ILE 313 N 1.15 1.12 -0.43 0.00 2.04 -0.72 -0.09 117.51 120.58 1rwh h ILE 313 Ca 0.30 -0.34 0.07 0.00 1.00 0.00 0.00 64.86 65.89 1rwh h ILE 313 Cb -0.01 1.01 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 1rwh h ILE 313 CO -0.05 0.11 0.05 -0.08 0.00 0.00 0.00 178.15 178.19 1rwh h GLU 314 N 0.18 0.17 -0.44 2.37 4.81 -0.94 -0.42 114.58 120.31 1rwh h GLU 314 Ca 0.06 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1rwh h GLU 314 Cb 0.10 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 1rwh h GLU 314 CO -0.01 0.11 0.21 0.00 -0.73 0.00 0.00 179.01 178.59 1rwh h ALA 315 N 1.35 0.56 -0.67 2.92 0.00 -0.93 -1.17 119.26 121.33 1rwh h ALA 315 Ca 0.21 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1rwh h ALA 315 Cb 0.29 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1rwh h ALA 315 CO -0.31 0.13 0.34 0.82 0.00 0.00 0.00 179.25 180.23 1rwh h ILE 316 N 0.56 1.22 -0.75 0.00 2.04 -0.74 -0.79 117.51 119.06 1rwh h ILE 316 Ca 0.15 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 1rwh h ILE 316 Cb 0.12 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.54 1rwh h ILE 316 CO -0.02 0.25 0.41 -0.07 0.00 0.00 0.00 178.15 178.72 1rwh h LEU 317 N 0.92 0.94 -0.28 1.44 3.38 -0.92 0.06 115.31 120.85 1rwh h LEU 317 Ca 0.23 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1rwh h LEU 317 Cb 0.08 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1rwh h LEU 317 CO -0.03 0.76 0.05 0.25 0.09 0.00 0.00 178.44 179.56 1rwh h LEU 318 N 1.03 0.45 -1.22 1.67 5.85 -0.90 -2.90 115.31 119.29 1rwh h LEU 318 Ca 0.26 -0.26 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1rwh h LEU 318 Cb 0.04 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1rwh h LEU 318 CO -0.04 0.60 0.08 -0.07 -0.34 0.00 0.00 178.44 178.66 1rwh h LEU 319 N 0.29 0.57 -2.12 2.25 3.38 -0.93 -2.81 115.31 115.95 1rwh h LEU 319 Ca 0.09 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1rwh h LEU 319 Cb 0.34 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1rwh h LEU 319 CO 0.01 0.59 -0.04 0.00 0.09 0.00 0.00 178.44 179.09 1rwh h ALA 320 N 1.49 1.72 -0.02 1.53 0.00 -0.77 -2.32 119.26 120.89 1rwh h ALA 320 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1rwh h ALA 320 Cb 0.26 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1rwh h ALA 320 CO 0.00 0.04 0.02 0.00 0.00 0.00 0.00 179.25 179.32 1rwh h ARG 321 N 0.00 0.00 -0.13 0.00 3.08 -1.49 -2.46 114.38 113.37 1rwh h ARG 321 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1rwh h ARG 321 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1rwh h ARG 321 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 1rwh n ALA 322 N -2.30 2.44 -2.07 0.04 0.00 -0.87 -5.01 120.51 112.73 1rwh n ALA 322 Ca -0.03 -0.77 -0.24 0.00 0.00 0.00 0.00 53.44 52.41 1rwh n ALA 322 Cb 0.10 -0.68 0.04 0.00 0.00 0.00 0.00 19.45 18.91 1rwh n ALA 322 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1rwh s MET 323 N -1.51 2.68 0.73 0.00 -1.94 -0.93 -5.05 119.30 113.28 1rwh s MET 323 Ca 0.26 -0.42 -0.15 0.00 -1.71 0.00 0.00 55.69 53.67 1rwh s MET 323 Cb 0.17 -2.39 0.04 0.00 2.01 0.00 0.00 34.83 34.66 1rwh s MET 323 CO 0.25 -0.72 1.20 0.16 -0.01 0.00 0.00 175.02 175.90 1rwh s ASP 324 N -4.37 4.23 0.19 3.03 -4.77 -1.26 -4.65 116.67 109.07 1rwh s ASP 324 Ca 0.55 2.32 -0.11 0.00 -3.30 0.00 0.00 52.55 52.00 1rwh s ASP 324 Cb -0.10 -2.58 0.20 0.00 -1.09 0.00 0.00 42.92 39.34 1rwh s ASP 324 CO 0.41 -2.24 1.76 -0.65 0.70 0.00 0.00 175.17 175.16 1rwh h PRO 325 N -0.33 0.44 -0.49 2.11 0.11 -1.96 -0.18 132.00 131.69 1rwh h PRO 325 Ca -0.47 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 1rwh h PRO 325 Cb 1.29 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 1rwh h PRO 325 CO 0.50 0.29 0.12 0.00 -0.21 0.00 0.00 178.00 178.69 1rwh h ALA 326 N 1.34 0.64 -0.42 -0.75 0.00 -1.99 -1.46 119.26 116.62 1rwh h ALA 326 Ca 0.26 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1rwh h ALA 326 Cb 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1rwh h ALA 326 CO -0.23 0.34 -0.30 1.15 0.00 0.00 0.00 179.25 180.20 1rwh h THR 327 N 0.66 1.27 -0.42 0.00 2.02 -1.80 -1.49 112.91 113.15 1rwh h THR 327 Ca 0.15 -1.47 0.05 0.00 0.77 0.00 0.00 66.41 65.92 1rwh h THR 327 Cb 0.33 1.27 -0.05 0.00 -1.74 0.00 0.00 68.15 67.96 1rwh h THR 327 CO 0.00 0.50 0.14 0.00 0.37 0.00 0.00 175.52 176.53 1rwh h ALA 328 N 0.86 0.49 -0.36 6.16 0.00 -0.91 -0.52 119.26 124.99 1rwh h ALA 328 Ca 0.08 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 1rwh h ALA 328 Cb 0.88 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1rwh h ALA 328 CO 0.08 -0.25 -0.27 0.00 0.00 0.00 0.00 179.25 178.81 1rwh h ALA 329 N 1.28 0.86 -0.09 0.00 0.00 -1.18 -0.51 119.26 119.60 1rwh h ALA 329 Ca 0.20 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1rwh h ALA 329 Cb 0.19 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1rwh h ALA 329 CO -0.21 0.63 0.05 -0.09 0.00 0.00 0.00 179.25 179.64 1rwh h ARG 330 N 0.63 0.13 -0.64 0.00 9.65 -0.79 0.25 114.38 123.62 1rwh h ARG 330 Ca 0.08 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 58.87 1rwh h ARG 330 Cb 0.78 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.31 1rwh h ARG 330 CO 0.06 0.17 0.13 -1.49 2.80 0.00 0.00 179.97 181.64 1rwh h TRP 331 N 0.05 1.10 -0.86 2.20 4.06 -0.97 -0.88 115.95 120.65 1rwh h TRP 331 Ca 0.03 -0.14 -0.02 0.00 2.06 0.00 0.00 58.89 60.82 1rwh h TRP 331 Cb 0.08 -0.30 -0.04 0.00 -1.00 0.00 0.00 29.16 27.90 1rwh h TRP 331 CO -0.04 0.92 0.47 0.00 -3.56 0.00 0.00 178.44 176.23 1rwh h ARG 332 N 0.95 1.20 -0.58 0.49 3.08 -0.96 -0.85 114.38 117.71 1rwh h ARG 332 Ca 0.20 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 1rwh h ARG 332 Cb 0.40 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1rwh h ARG 332 CO 0.01 0.87 0.17 0.78 -1.07 0.00 0.00 179.97 180.73 1rwh h GLY 333 N 1.22 0.97 0.62 0.04 0.00 -0.43 0.22 103.07 105.70 1rwh h GLY 333 Ca 0.30 -0.58 0.05 0.00 0.00 0.00 0.00 47.33 47.10 1rwh h GLY 333 CO -0.05 0.55 0.15 1.41 0.00 0.00 0.00 176.54 178.60 1rwh h LEU 334 N 0.81 0.16 -0.64 3.11 3.38 -0.92 -1.22 115.31 119.99 1rwh h LEU 334 Ca 0.18 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.09 1rwh h LEU 334 Cb 0.30 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1rwh h LEU 334 CO -0.00 0.12 -0.17 0.00 0.09 0.00 0.00 178.44 178.48 1rwh h ALA 336 N 1.02 1.44 -0.18 0.00 0.00 -0.31 -0.11 119.26 121.11 1rwh h ALA 336 Ca 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1rwh h ALA 336 Cb 0.71 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1rwh h ALA 336 CO 0.05 0.49 -0.05 0.78 0.00 0.00 0.00 179.25 180.53 1rwh h GLY 337 N 0.98 0.37 1.93 0.00 0.00 -0.96 0.25 103.07 105.65 1rwh h GLY 337 Ca 0.25 -0.31 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1rwh h GLY 337 CO -0.05 0.28 -0.10 1.49 0.00 0.00 0.00 176.54 178.16 1rwh h TRP 338 N 0.05 0.09 0.02 5.60 6.55 -0.94 -1.31 115.95 126.01 1rwh h TRP 338 Ca 0.04 -0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.88 1rwh h TRP 338 Cb 0.49 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 28.76 1rwh h TRP 338 CO 0.05 0.19 -0.01 0.82 -1.05 0.00 0.00 178.44 178.45 1rwh h ILE 339 N 0.09 1.45 -0.81 1.49 2.04 -0.94 -3.29 117.51 117.55 1rwh h ILE 339 Ca 0.02 -1.82 -0.03 0.00 1.00 0.00 0.00 64.86 64.03 1rwh h ILE 339 Cb 0.24 2.62 -0.04 0.00 -0.74 0.00 0.00 36.82 38.90 1rwh h ILE 339 CO 0.01 0.44 0.38 0.00 0.00 0.00 0.00 178.15 178.99 1rwh h ALA 340 N 0.01 1.15 0.00 1.87 0.00 -0.73 -2.51 119.26 119.05 1rwh h ALA 340 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1rwh h ALA 340 Cb 0.75 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1rwh h ALA 340 CO 0.00 0.64 0.00 0.54 0.00 0.00 0.00 179.25 180.44 1rwh n ARG 341 N -4.31 0.21 -3.16 0.00 1.74 -0.51 -4.49 116.66 106.14 1rwh n ARG 341 Ca 0.08 0.22 -0.46 0.00 -0.77 0.00 0.00 57.85 56.92 1rwh n ARG 341 Cb 0.15 -1.77 -0.02 0.00 -1.02 0.00 0.00 32.46 29.79 1rwh n ARG 341 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1rwh s ASP 342 N -4.26 6.72 0.00 0.55 2.15 -0.94 -4.78 116.67 116.10 1rwh s ASP 342 Ca 0.10 -2.44 0.27 0.00 0.43 0.00 0.00 52.55 50.91 1rwh s ASP 342 Cb 0.13 -2.29 0.93 0.00 -0.30 0.00 0.00 42.92 41.39 1rwh s ASP 342 CO 0.55 -0.77 1.67 0.35 -0.17 0.00 0.00 175.17 176.80 1rwh n THR 343 N 4.58 0.00 -0.06 1.71 -2.24 -1.26 -3.91 114.28 113.10 1rwh n THR 343 Ca 0.18 -0.19 -0.22 0.00 -2.27 0.00 0.00 64.05 61.55 1rwh n THR 343 Cb 0.48 0.44 -0.13 0.00 -2.10 0.00 0.00 70.33 69.03 1rwh n THR 343 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rwh n TYR 344 N -0.20 0.99 -3.40 4.78 9.36 -1.26 -4.49 117.16 122.95 1rwh n TYR 344 Ca 0.16 0.30 -0.26 0.00 3.32 0.00 0.00 57.90 61.42 1rwh n TYR 344 Cb 0.35 -1.12 -0.08 0.00 -0.63 0.00 0.00 39.34 37.86 1rwh n TYR 344 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1rwh n ARG 345 N -3.89 1.40 -1.61 2.98 5.12 -1.26 -5.07 116.66 114.33 1rwh n ARG 345 Ca -0.35 -3.88 -0.45 0.00 -1.93 0.00 0.00 57.85 51.24 1rwh n ARG 345 Cb 0.89 -1.78 -0.02 0.00 -1.16 0.00 0.00 32.46 30.39 1rwh n ARG 345 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1rwh n PRO 346 N 1.51 1.49 0.23 5.56 -0.02 -1.25 -4.83 135.00 137.69 1rwh n PRO 346 Ca 0.25 0.52 0.06 0.00 -2.02 0.00 0.00 63.50 62.32 1rwh n PRO 346 Cb 0.46 -1.97 0.54 0.00 -0.02 0.00 0.00 33.50 32.51 1rwh n PRO 346 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1rwh h ILE 347 N 2.26 1.05 0.00 4.25 2.10 -1.89 -1.58 117.51 123.71 1rwh h ILE 347 Ca -0.41 -0.59 0.00 0.00 1.08 0.00 0.00 64.86 64.93 1rwh h ILE 347 Cb 1.33 1.33 0.00 0.00 -1.09 0.00 0.00 36.82 38.38 1rwh h ILE 347 CO 0.64 0.17 0.00 -0.07 -1.08 0.00 0.00 178.15 177.80 1rwh h LEU 348 N 0.00 0.00 -9.36 2.19 3.38 -1.98 -3.38 115.31 106.16 1rwh h LEU 348 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 1rwh h LEU 348 Cb 0.31 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1rwh h LEU 348 CO 0.02 0.00 1.00 0.20 0.09 0.00 0.00 178.44 179.75 1rwh s ASN 349 N -5.00 6.68 -0.68 -0.43 -0.87 -0.60 -2.47 114.94 111.57 1rwh s ASN 349 Ca 0.07 2.32 0.00 0.00 -1.57 0.00 0.00 52.86 53.68 1rwh s ASN 349 Cb 0.10 -2.55 0.00 0.00 -0.02 0.00 0.00 41.25 38.77 1rwh s ASN 349 CO 0.56 -0.87 0.00 -1.20 -2.57 0.00 0.00 177.10 173.02 1rwh n SER 350 N 6.15 -5.54 -4.76 -1.22 7.64 -1.26 -4.98 113.62 109.65 1rwh n SER 350 Ca 0.16 0.16 -0.39 0.00 1.01 0.00 0.00 58.87 59.81 1rwh n SER 350 Cb 0.42 -3.60 0.01 0.00 -1.01 0.00 0.00 64.21 60.03 1rwh n SER 350 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rwh s ALA 351 N -1.65 3.08 1.11 -0.43 0.00 -1.03 -5.03 121.76 117.81 1rwh s ALA 351 Ca 0.00 1.27 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 1rwh s ALA 351 Cb 0.00 -3.52 0.25 0.00 0.00 0.00 0.00 23.12 19.85 1rwh s ALA 351 CO 0.00 -1.04 1.05 -1.54 0.00 0.00 0.00 175.76 174.23 1rwh s SER 352 N -0.85 1.53 0.11 0.00 1.04 -1.26 -4.52 113.70 109.74 1rwh s SER 352 Ca 0.63 1.42 -0.19 0.00 0.48 0.00 0.00 55.95 58.29 1rwh s SER 352 Cb -0.39 -2.16 -0.07 0.00 0.10 0.00 0.00 66.02 63.51 1rwh s SER 352 CO 0.48 -3.85 1.66 0.58 0.98 0.00 0.00 173.24 173.09 1rwh h VAL 353 N -2.38 1.16 -0.84 5.02 2.07 -1.86 -0.91 116.25 118.51 1rwh h VAL 353 Ca -0.59 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 66.49 1rwh h VAL 353 Cb 1.33 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 1rwh h VAL 353 CO 0.53 0.16 0.55 -0.65 0.02 0.00 0.00 177.57 178.17 1rwh h PRO 354 N 0.25 1.07 -0.42 1.57 0.11 -1.84 -0.75 132.00 132.00 1rwh h PRO 354 Ca 0.08 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.09 1rwh h PRO 354 Cb 0.15 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 1rwh h PRO 354 CO -0.01 0.71 0.12 -0.09 -0.21 0.00 0.00 178.00 178.52 1rwh h ARG 355 N 1.11 0.65 -0.43 1.05 2.43 -1.89 -1.82 114.38 115.47 1rwh h ARG 355 Ca 0.32 -0.14 0.05 0.00 -0.81 0.00 0.00 59.98 59.40 1rwh h ARG 355 Cb -0.07 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.34 1rwh h ARG 355 CO -0.09 0.65 0.15 1.15 -1.51 0.00 0.00 179.97 180.33 1rwh h THR 356 N 0.53 0.87 -0.65 0.20 2.02 -0.76 -1.53 112.91 113.59 1rwh h THR 356 Ca 0.13 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1rwh h THR 356 Cb 0.27 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 1rwh h THR 356 CO -0.00 0.06 0.36 0.00 0.37 0.00 0.00 175.52 176.30 1rwh h ALA 357 N 1.28 0.83 -0.68 6.16 0.00 -0.88 0.92 119.26 126.89 1rwh h ALA 357 Ca 0.20 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1rwh h ALA 357 Cb 0.19 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1rwh h ALA 357 CO -0.20 0.34 0.16 -0.07 0.00 0.00 0.00 179.25 179.48 1rwh h LEU 358 N 0.88 1.02 -0.38 0.00 3.38 -0.97 -0.35 115.31 118.89 1rwh h LEU 358 Ca 0.23 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1rwh h LEU 358 Cb 0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1rwh h LEU 358 CO -0.04 0.98 -0.16 0.58 0.09 0.00 0.00 178.44 179.89 1rwh h VAL 359 N 1.02 1.28 -0.70 1.22 2.07 -0.94 -1.33 116.25 118.86 1rwh h VAL 359 Ca 0.21 -1.29 -0.06 0.00 0.82 0.00 0.00 66.70 66.39 1rwh h VAL 359 Cb 0.36 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1rwh h VAL 359 CO 0.00 0.43 0.20 0.11 0.02 0.00 0.00 177.57 178.33 1rwh h LYS 360 N 0.58 1.10 -0.56 1.57 1.79 -0.68 -1.43 116.57 118.95 1rwh h LYS 360 Ca 0.09 -0.25 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 1rwh h LYS 360 Cb 0.71 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 1rwh h LYS 360 CO 0.05 0.96 0.36 0.37 -1.08 0.00 0.00 179.45 180.11 1rwh h GLN 361 N 1.04 0.74 0.25 3.15 4.15 -0.92 -1.38 115.11 122.15 1rwh h GLN 361 Ca 0.22 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 1rwh h GLN 361 Cb 0.33 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.85 1rwh h GLN 361 CO -0.00 0.50 -0.12 1.25 -1.93 0.00 0.00 178.83 178.53 1rwh h LEU 362 N 0.76 -0.29 -0.58 -2.39 5.85 -0.94 -1.89 115.31 115.83 1rwh h LEU 362 Ca 0.20 -0.00 0.09 0.00 0.84 0.00 0.00 57.88 59.01 1rwh h LEU 362 Cb -0.07 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 40.93 1rwh h LEU 362 CO -0.04 -0.19 -0.40 -0.33 -0.34 0.00 0.00 178.44 177.13 1rwh h GLU 363 N -0.36 -0.20 0.00 1.25 5.08 -1.07 -2.48 114.58 116.80 1rwh h GLU 363 Ca -0.03 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1rwh h GLU 363 Cb 0.27 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1rwh h GLU 363 CO 0.06 -0.13 -0.01 0.00 -1.00 0.00 0.00 179.01 177.92 1rwh h ALA 364 N 0.74 1.47 0.00 3.43 0.00 -0.62 0.54 119.26 124.82 1rwh h ALA 364 Ca 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1rwh h ALA 364 Cb 0.56 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1rwh h ALA 364 CO -0.69 0.01 -0.02 1.79 0.00 0.00 0.00 179.25 180.35 1rwh h THR 365 N 0.00 0.10 0.00 0.00 1.35 -0.88 -3.47 112.91 110.02 1rwh h THR 365 Ca -0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1rwh h THR 365 Cb 0.03 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1rwh h THR 365 CO 0.00 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 1rwh n GLY 366 N -0.58 0.14 3.70 5.82 0.00 0.18 -4.98 105.19 109.47 1rwh n GLY 366 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1rwh n GLY 366 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rwh s VAL 367 N -1.33 2.39 0.56 1.61 1.01 -1.26 -4.97 120.40 118.41 1rwh s VAL 367 Ca 0.00 0.06 -0.17 0.00 0.00 0.00 0.00 61.98 61.88 1rwh s VAL 367 Cb 0.00 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 1rwh s VAL 367 CO 0.00 0.00 1.04 0.00 0.00 0.00 0.00 175.10 176.15 1rwh s ALA 368 N 2.19 2.81 0.18 5.51 0.00 -1.26 -4.84 121.76 126.35 1rwh s ALA 368 Ca 0.78 0.40 -0.31 0.00 0.00 0.00 0.00 51.96 52.84 1rwh s ALA 368 Cb -0.47 -3.22 -0.09 0.00 0.00 0.00 0.00 23.12 19.34 1rwh s ALA 368 CO 0.35 -0.65 1.38 -1.25 0.00 0.00 0.00 175.76 175.58 1rwh s PRO 369 N -3.94 4.33 -0.19 0.00 0.04 -1.26 -4.46 135.00 129.52 1rwh s PRO 369 Ca 0.64 2.13 -0.10 0.00 0.04 0.00 0.00 61.00 63.71 1rwh s PRO 369 Cb -0.15 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.15 1rwh s PRO 369 CO 0.33 -0.37 0.13 0.08 0.04 0.00 0.00 177.00 177.22 1rwh s VAL 370 N 0.50 5.42 0.62 -0.36 1.01 -0.54 -4.80 120.40 122.25 1rwh s VAL 370 Ca 0.61 0.20 -0.16 0.00 0.00 0.00 0.00 61.98 62.63 1rwh s VAL 370 Cb -0.38 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 1rwh s VAL 370 CO 0.36 0.47 1.09 0.00 0.00 0.00 0.00 175.10 177.02 1rwh s ALA 371 N 0.14 2.59 0.06 5.51 0.00 -1.26 -4.36 121.76 124.42 1rwh s ALA 371 Ca 0.09 0.53 -0.31 0.00 0.00 0.00 0.00 51.96 52.27 1rwh s ALA 371 Cb -0.11 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 1rwh s ALA 371 CO -0.01 -1.06 1.22 -1.21 0.00 0.00 0.00 175.76 174.71 1rwh s GLU 372 N -3.99 4.41 0.34 0.00 2.02 -1.26 -4.97 118.70 115.24 1rwh s GLU 372 Ca 0.66 1.80 -0.28 0.00 0.02 0.00 0.00 54.97 57.18 1rwh s GLU 372 Cb -0.19 -3.36 -0.09 0.00 0.10 0.00 0.00 34.13 30.58 1rwh s GLU 372 CO 0.38 -0.30 1.19 0.00 0.02 0.00 0.00 175.26 176.55 1rwh s ALA 373 N 1.19 3.36 0.85 5.21 0.00 -1.26 -4.99 121.76 126.11 1rwh s ALA 373 Ca 0.59 1.04 -0.10 0.00 0.00 0.00 0.00 51.96 53.49 1rwh s ALA 373 Cb -0.30 -3.40 0.10 0.00 0.00 0.00 0.00 23.12 19.53 1rwh s ALA 373 CO 0.29 -0.44 1.11 0.95 0.00 0.00 0.00 175.76 177.66 1rwh s THR 374 N -1.24 2.78 0.00 0.00 -4.23 -1.26 -4.70 115.64 106.99 1rwh s THR 374 Ca 0.50 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 61.26 1rwh s THR 374 Cb -0.34 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 70.94 1rwh s THR 374 CO 0.44 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 1rwh n GLY 375 N -0.64 -1.05 3.36 3.99 0.00 -0.21 -4.88 105.19 105.76 1rwh n GLY 375 Ca 0.10 -2.10 -0.32 0.00 0.00 0.00 0.00 46.02 43.70 1rwh n GLY 375 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1rwh s HIS 376 N 0.00 2.51 -0.14 1.61 0.09 -1.26 -0.71 115.29 117.38 1rwh s HIS 376 Ca 0.00 -0.41 -0.01 0.00 -0.00 0.00 0.00 55.06 54.64 1rwh s HIS 376 Cb 0.00 -1.58 0.04 0.00 -0.00 0.00 0.00 32.58 31.04 1rwh s HIS 376 CO 0.00 -0.01 -0.03 0.15 -0.00 0.00 0.00 174.74 174.86 1rwh s LYS 377 N -0.51 1.10 -0.05 1.40 -0.14 0.07 -5.02 119.74 116.59 1rwh s LYS 377 Ca 0.07 -0.31 -0.02 0.00 -1.36 0.00 0.00 55.97 54.35 1rwh s LYS 377 Cb -0.11 -1.72 -0.04 0.00 -1.68 0.00 0.00 37.83 34.28 1rwh s LYS 377 CO 0.01 -0.42 0.05 -0.51 -0.76 0.00 0.00 175.35 173.72 1rwh s LEU 378 N 1.77 3.79 -0.53 3.17 1.43 -1.26 -0.83 118.68 126.21 1rwh s LEU 378 Ca 0.02 0.17 0.07 0.00 -1.03 0.00 0.00 54.13 53.36 1rwh s LEU 378 Cb -0.14 -2.03 0.25 0.00 0.03 0.00 0.00 46.19 44.29 1rwh s LEU 378 CO -0.07 0.34 0.63 0.49 0.23 0.00 0.00 176.35 177.97 1rwh n PHE 379 N 1.71 1.82 0.26 0.29 3.01 0.20 -4.95 117.46 119.79 1rwh n PHE 379 Ca -0.16 -3.89 0.10 0.00 1.01 0.00 0.00 57.45 54.50 1rwh n PHE 379 Cb 0.53 -0.45 0.68 0.00 -0.01 0.00 0.00 39.48 40.24 1rwh n PHE 379 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1rwh h PRO 380 N 4.17 0.00 0.00 -1.08 0.11 -1.88 -1.66 132.00 131.67 1rwh h PRO 380 Ca 0.14 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.24 1rwh h PRO 380 Cb 0.76 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.87 1rwh h PRO 380 CO 0.66 0.00 -0.09 0.00 -0.21 0.00 0.00 178.00 178.37 1rwh h ALA 381 N 1.99 1.15 -0.03 -0.75 0.00 -1.94 -2.88 119.26 116.80 1rwh h ALA 381 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1rwh h ALA 381 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1rwh h ALA 381 CO -0.00 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1rwh n MET 382 N -3.40 1.78 -3.71 0.00 0.00 -0.67 -4.98 117.12 106.14 1rwh n MET 382 Ca -0.01 -2.38 -0.24 0.00 0.00 0.00 0.00 57.70 55.07 1rwh n MET 382 Cb 0.24 -1.43 0.05 0.00 0.00 0.00 0.00 33.22 32.09 1rwh n MET 382 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1rwh n ASP 383 N -1.14 -3.66 -4.02 3.17 8.00 -0.90 -4.67 116.55 113.32 1rwh n ASP 383 Ca 0.13 -0.71 -0.15 0.00 0.71 0.00 0.00 54.79 54.76 1rwh n ASP 383 Cb 0.58 -4.38 -0.13 0.00 -0.02 0.00 0.00 41.12 37.16 1rwh n ASP 383 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1rwh s ARG 384 N -6.17 0.54 0.06 -1.24 1.81 -1.09 -3.07 118.95 109.78 1rwh s ARG 384 Ca 0.35 -0.48 0.02 0.00 -1.72 0.00 0.00 55.73 53.90 1rwh s ARG 384 Cb -0.17 -0.45 -0.03 0.00 -0.45 0.00 0.00 34.95 33.86 1rwh s ARG 384 CO 0.79 0.11 -0.07 0.95 -0.68 0.00 0.00 175.30 176.40 1rwh s THR 385 N -0.69 0.52 -0.01 0.02 -4.23 -1.24 -0.63 115.64 109.38 1rwh s THR 385 Ca -0.02 -1.36 0.05 0.00 -1.18 0.00 0.00 61.69 59.18 1rwh s THR 385 Cb -0.06 -0.94 -0.01 0.00 1.34 0.00 0.00 72.50 72.83 1rwh s THR 385 CO 0.00 -0.58 -0.16 -0.04 -0.54 0.00 0.00 174.62 173.30 1rwh s MET 386 N -2.37 1.28 -0.05 3.99 -1.94 -0.01 -2.16 119.30 118.04 1rwh s MET 386 Ca -0.03 -0.59 -0.03 0.00 -1.71 0.00 0.00 55.69 53.33 1rwh s MET 386 Cb -0.04 -1.24 0.03 0.00 2.01 0.00 0.00 34.83 35.58 1rwh s MET 386 CO -0.02 0.34 0.12 -1.01 -0.01 0.00 0.00 175.02 174.44 1rwh s HIS 387 N -0.41 -0.12 0.04 -0.03 3.76 -0.01 -0.75 115.29 117.77 1rwh s HIS 387 Ca 0.06 0.36 0.05 0.00 -0.15 0.00 0.00 55.06 55.38 1rwh s HIS 387 Cb -0.06 -0.05 -0.02 0.00 1.11 0.00 0.00 32.58 33.55 1rwh s HIS 387 CO -0.00 -0.11 -0.14 1.03 -0.85 0.00 0.00 174.74 174.66 1rwh s ARG 388 N 0.71 0.89 0.33 1.40 0.52 0.11 -0.09 118.95 122.83 1rwh s ARG 388 Ca -0.05 -0.78 -0.01 0.00 -0.52 0.00 0.00 55.73 54.37 1rwh s ARG 388 Cb -0.07 -0.89 -0.00 0.00 0.52 0.00 0.00 34.95 34.50 1rwh s ARG 388 CO -0.03 0.22 0.43 0.20 0.02 0.00 0.00 175.30 176.13 1rwh s GLY 389 N -1.24 1.62 -0.14 -3.53 0.00 -0.87 -1.04 107.32 102.12 1rwh s GLY 389 Ca 0.01 -1.61 -0.31 0.00 0.00 0.00 0.00 44.72 42.80 1rwh s GLY 389 CO 0.01 -1.09 2.07 -1.05 0.00 0.00 0.00 173.10 173.05 1rwh n PRO 390 N -0.56 2.13 -0.55 2.90 -0.02 -1.26 -1.51 135.00 136.13 1rwh n PRO 390 Ca 0.02 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1rwh n PRO 390 Cb 0.62 -2.93 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 1rwh n PRO 390 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rwh n GLY 391 N 5.23 0.76 3.33 -1.23 0.00 -1.26 -4.94 105.19 107.08 1rwh n GLY 391 Ca 0.27 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 1rwh n GLY 391 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1rwh s TRP 392 N -2.75 -0.27 -0.04 1.61 1.48 -0.57 -4.02 118.94 114.37 1rwh s TRP 392 Ca 0.00 0.13 -0.01 0.00 -1.06 0.00 0.00 56.10 55.16 1rwh s TRP 392 Cb 0.00 0.26 0.03 0.00 -1.16 0.00 0.00 33.47 32.60 1rwh s TRP 392 CO 0.00 -0.64 0.03 0.00 -4.06 0.00 0.00 176.95 172.27 1rwh s ALA 393 N -3.03 0.36 -0.19 2.67 0.00 -0.29 -2.05 121.76 119.23 1rwh s ALA 393 Ca -0.02 0.11 -0.13 0.00 0.00 0.00 0.00 51.96 51.93 1rwh s ALA 393 Cb 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 1rwh s ALA 393 CO -0.06 -0.33 0.24 -1.17 0.00 0.00 0.00 175.76 174.44 1rwh s LEU 394 N 1.70 4.20 -0.19 0.00 2.96 0.88 -0.43 118.68 127.79 1rwh s LEU 394 Ca -0.00 0.38 -0.00 0.00 -0.22 0.00 0.00 54.13 54.28 1rwh s LEU 394 Cb -0.13 -2.27 0.01 0.00 0.50 0.00 0.00 46.19 44.30 1rwh s LEU 394 CO -0.03 0.09 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.39 1rwh s SER 395 N 0.59 3.45 -0.10 3.68 0.15 -0.38 -0.83 113.70 120.26 1rwh s SER 395 Ca 0.13 -0.58 -0.11 0.00 0.70 0.00 0.00 55.95 56.10 1rwh s SER 395 Cb -0.13 -1.55 -0.05 0.00 -1.71 0.00 0.00 66.02 62.59 1rwh s SER 395 CO 0.03 -0.00 0.24 -0.76 1.20 0.00 0.00 173.24 173.94 1rwh s LEU 396 N 1.33 4.37 -0.28 3.45 1.43 -0.92 -1.48 118.68 126.58 1rwh s LEU 396 Ca 0.05 0.58 0.03 0.00 -1.03 0.00 0.00 54.13 53.76 1rwh s LEU 396 Cb -0.13 -2.27 0.07 0.00 0.03 0.00 0.00 46.19 43.89 1rwh s LEU 396 CO -0.10 0.30 -0.06 0.00 0.23 0.00 0.00 176.35 176.72 1rwh s ALA 397 N -0.61 2.67 0.47 4.21 0.00 -0.69 -3.70 121.76 124.11 1rwh s ALA 397 Ca 0.17 -1.97 0.05 0.00 0.00 0.00 0.00 51.96 50.21 1rwh s ALA 397 Cb -0.13 -1.71 0.05 0.00 0.00 0.00 0.00 23.12 21.33 1rwh s ALA 397 CO 0.06 -1.33 0.44 1.28 0.00 0.00 0.00 175.76 176.20 1rwh n LEU 398 N 4.40 0.00 -3.73 0.00 4.77 -1.18 -1.50 117.00 119.77 1rwh n LEU 398 Ca -0.09 -2.31 -0.10 0.00 -0.03 0.00 0.00 56.01 53.48 1rwh n LEU 398 Cb 0.42 -0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.34 1rwh n LEU 398 CO 0.22 -0.57 0.16 -0.94 -1.33 0.00 0.00 177.39 174.92 1rwh s SER 399 N -3.79 -0.18 0.07 -1.43 1.04 -1.11 -4.75 113.70 103.55 1rwh s SER 399 Ca 0.33 -0.48 -0.07 0.00 0.48 0.00 0.00 55.95 56.21 1rwh s SER 399 Cb -0.03 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.62 1rwh s SER 399 CO 0.21 -0.92 0.34 -1.54 0.98 0.00 0.00 173.24 172.31 1rwh n SER 400 N -0.26 -0.61 0.00 7.02 3.41 -0.42 -4.72 113.62 118.05 1rwh n SER 400 Ca -0.13 -1.33 0.04 0.00 -0.26 0.00 0.00 58.87 57.19 1rwh n SER 400 Cb 0.63 0.99 0.20 0.00 -0.26 0.00 0.00 64.21 65.78 1rwh n SER 400 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1rwh n ASN 401 N -0.85 0.00 -0.01 4.04 0.23 -0.75 -1.77 115.26 116.15 1rwh n ASN 401 Ca -0.01 0.20 0.07 0.00 -0.53 0.00 0.00 54.58 54.32 1rwh n ASN 401 Cb 0.20 -0.31 -0.12 0.00 -2.08 0.00 0.00 39.78 37.47 1rwh n ASN 401 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1rwh n ARG 402 N -1.31 0.51 -4.06 -3.83 1.74 -1.26 -4.93 116.66 103.52 1rwh n ARG 402 Ca 0.04 -0.14 -0.24 0.00 -0.77 0.00 0.00 57.85 56.75 1rwh n ARG 402 Cb 0.07 -1.36 -0.17 0.00 -1.02 0.00 0.00 32.46 29.98 1rwh n ARG 402 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1rwh s ILE 403 N -3.04 0.75 0.60 0.55 -1.09 -0.73 -4.68 121.20 113.56 1rwh s ILE 403 Ca -0.06 -0.17 -0.18 0.00 -2.23 0.00 0.00 60.65 58.01 1rwh s ILE 403 Cb 0.10 -0.78 -0.03 0.00 -1.58 0.00 0.00 42.46 40.16 1rwh s ILE 403 CO 0.64 0.30 1.18 0.00 -1.23 0.00 0.00 174.94 175.83 1rwh s ALA 404 N 1.37 2.54 0.27 9.38 0.00 -0.16 -1.29 121.76 133.87 1rwh s ALA 404 Ca -0.03 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.87 1rwh s ALA 404 Cb -0.14 -3.42 0.60 0.00 0.00 0.00 0.00 23.12 20.16 1rwh s ALA 404 CO -0.03 -1.13 1.73 -1.49 0.00 0.00 0.00 175.76 174.84 1rwh h TRP 405 N 0.82 0.68 -1.83 0.00 6.55 -1.90 -3.45 115.95 116.82 1rwh h TRP 405 Ca -0.50 0.04 0.20 0.00 0.95 0.00 0.00 58.89 59.58 1rwh h TRP 405 Cb 1.29 -0.17 -0.16 0.00 -0.86 0.00 0.00 29.16 29.25 1rwh h TRP 405 CO 0.48 0.08 0.67 1.52 -1.05 0.00 0.00 178.44 180.14 1rwh s TYR 406 N -5.95 -0.20 -0.21 0.49 -0.00 -1.26 -2.39 117.35 107.84 1rwh s TYR 406 Ca -0.12 0.10 -0.06 0.00 -0.00 0.00 0.00 57.07 56.99 1rwh s TYR 406 Cb 0.23 0.53 -0.03 0.00 -0.00 0.00 0.00 41.96 42.69 1rwh s TYR 406 CO 0.78 -0.38 0.04 -2.00 -0.00 0.00 0.00 175.55 173.99 1rwh s GLU 407 N -2.74 3.74 0.22 -3.49 2.12 -1.26 -3.85 118.70 113.44 1rwh s GLU 407 Ca 0.08 -0.45 0.11 0.00 0.36 0.00 0.00 54.97 55.07 1rwh s GLU 407 Cb -0.01 -3.18 -0.05 0.00 0.26 0.00 0.00 34.13 31.16 1rwh s GLU 407 CO -0.06 0.05 -0.22 0.00 -0.54 0.00 0.00 175.26 174.49 1rwh n GLY 409 N -0.05 1.58 2.38 0.00 0.00 -0.83 -0.52 105.19 107.75 1rwh n GLY 409 Ca -0.10 -0.49 -0.15 0.00 0.00 0.00 0.00 46.02 45.28 1rwh n GLY 409 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1rwh n ASN 410 N 0.00 -4.48 0.00 1.61 3.02 -1.26 -0.88 115.26 113.27 1rwh n ASN 410 Ca 0.00 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1rwh n ASN 410 Cb 0.00 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.34 1rwh n ASN 410 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rwh n GLY 411 N -0.77 0.42 3.29 7.41 0.00 -1.26 -4.77 105.19 109.51 1rwh n GLY 411 Ca -0.18 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 1rwh n GLY 411 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rwh s GLU 412 N -1.42 2.83 -1.50 1.61 2.02 -0.06 -1.33 118.70 120.86 1rwh s GLU 412 Ca 0.00 -0.84 0.00 0.00 0.02 0.00 0.00 54.97 54.15 1rwh s GLU 412 Cb 0.00 -2.30 0.00 0.00 0.10 0.00 0.00 34.13 31.93 1rwh s GLU 412 CO 0.00 0.32 0.00 -1.71 0.02 0.00 0.00 175.26 173.89 1rwh n ASN 413 N 3.15 -5.09 0.31 -0.19 5.15 -1.05 -1.96 115.26 115.59 1rwh n ASN 413 Ca -0.18 -0.00 0.21 0.00 -0.60 0.00 0.00 54.58 54.01 1rwh n ASN 413 Cb 0.52 -4.17 1.02 0.00 -0.53 0.00 0.00 39.78 36.62 1rwh n ASN 413 CO 0.00 0.00 0.00 0.78 1.40 0.00 0.00 177.26 179.44 1rwh h ASN 414 N 0.00 0.00 -0.23 1.20 2.35 -1.85 -1.43 115.58 115.61 1rwh h ASN 414 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1rwh h ASN 414 Cb 1.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.67 1rwh h ASN 414 CO 0.49 0.00 0.00 -1.14 -1.65 0.00 0.00 177.43 175.13 1rwh n ARG 415 N -3.07 2.22 -0.08 0.81 0.63 -1.26 -1.27 116.66 114.65 1rwh n ARG 415 Ca -0.02 -1.83 0.00 0.00 -0.92 0.00 0.00 57.85 55.09 1rwh n ARG 415 Cb 0.16 -1.47 0.03 0.00 0.45 0.00 0.00 32.46 31.62 1rwh n ARG 415 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rwh n GLY 416 N 1.36 1.73 0.16 5.14 0.00 -0.54 -4.50 105.19 108.54 1rwh n GLY 416 Ca 0.17 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1rwh n GLY 416 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1rwh h TYR 417 N 0.27 0.00 -0.29 1.61 -0.00 -1.82 -1.97 116.97 114.77 1rwh h TYR 417 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.74 1rwh h TYR 417 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.45 1rwh h TYR 417 CO 0.10 0.00 0.00 0.72 -0.00 0.00 0.00 178.16 178.98 1rwh n HIS 418 N -2.34 0.37 0.52 0.10 8.25 -1.26 -4.53 115.22 116.33 1rwh n HIS 418 Ca 0.01 -0.19 0.10 0.00 -0.26 0.00 0.00 57.72 57.39 1rwh n HIS 418 Cb 0.18 -0.00 0.43 0.00 1.12 0.00 0.00 29.99 31.72 1rwh n HIS 418 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1rwh n THR 419 N 1.44 0.78 -0.99 1.59 -2.24 -0.74 -1.88 114.28 112.24 1rwh n THR 419 Ca 0.18 0.16 0.07 0.00 -2.27 0.00 0.00 64.05 62.18 1rwh n THR 419 Cb 0.60 -0.98 0.31 0.00 -2.10 0.00 0.00 70.33 68.16 1rwh n THR 419 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rwh n GLY 420 N 0.29 3.72 2.14 3.38 0.00 -1.00 -4.49 105.19 109.23 1rwh n GLY 420 Ca 0.03 -1.01 -0.24 0.00 0.00 0.00 0.00 46.02 44.80 1rwh n GLY 420 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rwh n SER 421 N -0.15 4.74 -0.39 1.61 7.64 -0.79 -2.77 113.62 123.52 1rwh n SER 421 Ca 0.25 -3.50 0.00 0.00 1.01 0.00 0.00 58.87 56.63 1rwh n SER 421 Cb 1.04 -0.86 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1rwh n SER 421 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rwh n GLY 422 N -0.89 0.87 3.77 0.23 0.00 -0.56 -3.22 105.19 105.39 1rwh n GLY 422 Ca 0.55 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1rwh n GLY 422 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rwh s MET 423 N -3.00 4.26 -0.54 1.61 -1.94 -0.83 -3.36 119.30 115.51 1rwh s MET 423 Ca 0.00 2.18 -0.03 0.00 -1.71 0.00 0.00 55.69 56.13 1rwh s MET 423 Cb 0.00 -2.99 0.14 0.00 2.01 0.00 0.00 34.83 33.99 1rwh s MET 423 CO 0.00 -0.25 0.34 0.95 -0.01 0.00 0.00 175.02 176.05 1rwh s THR 424 N -1.18 3.54 -0.36 2.05 -4.23 -0.04 -1.70 115.64 113.72 1rwh s THR 424 Ca 0.51 -2.58 -0.25 0.00 -1.18 0.00 0.00 61.69 58.18 1rwh s THR 424 Cb -0.39 -3.36 0.01 0.00 1.34 0.00 0.00 72.50 70.11 1rwh s THR 424 CO 0.51 -0.80 0.90 -0.31 -0.54 0.00 0.00 174.62 174.39 1rwh s TYR 425 N 0.44 3.09 -0.65 3.99 1.51 -0.55 -4.61 117.35 120.58 1rwh s TYR 425 Ca 0.13 0.76 -0.13 0.00 -1.01 0.00 0.00 57.07 56.82 1rwh s TYR 425 Cb -0.21 -3.59 0.17 0.00 -0.11 0.00 0.00 41.96 38.21 1rwh s TYR 425 CO -0.04 -0.80 0.58 -0.06 -1.11 0.00 0.00 175.55 174.12 1rwh s PHE 426 N 3.40 3.50 0.27 2.71 0.40 -1.26 -1.25 117.98 125.75 1rwh s PHE 426 Ca 0.37 -1.79 -0.29 0.00 -0.60 0.00 0.00 56.93 54.62 1rwh s PHE 426 Cb -0.12 -3.71 -0.09 0.00 0.51 0.00 0.00 43.02 39.61 1rwh s PHE 426 CO 0.18 -0.99 1.11 0.71 0.70 0.00 0.00 175.22 176.93 1rwh s TYR 427 N 0.85 3.55 0.00 0.36 1.51 0.42 -4.93 117.35 119.11 1rwh s TYR 427 Ca 0.11 1.67 0.00 0.00 -1.01 0.00 0.00 57.07 57.83 1rwh s TYR 427 Cb -0.21 -3.31 0.00 0.00 -0.11 0.00 0.00 41.96 38.33 1rwh s TYR 427 CO -0.03 -0.64 0.00 0.25 -1.11 0.00 0.00 175.55 174.02 1rwh n THR 428 N 1.30 0.00 0.27 -0.71 -2.24 -1.26 -1.14 114.28 110.50 1rwh n THR 428 Ca -0.01 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1rwh n THR 428 Cb 0.45 0.00 0.30 0.00 -2.10 0.00 0.00 70.33 68.97 1rwh n THR 428 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1rwh n SER 429 N -1.57 0.22 -4.53 3.42 3.41 -1.26 -3.65 113.62 109.67 1rwh n SER 429 Ca 0.00 0.58 -0.37 0.00 -0.26 0.00 0.00 58.87 58.81 1rwh n SER 429 Cb 0.00 -0.62 -0.02 0.00 -0.26 0.00 0.00 64.21 63.31 1rwh n SER 429 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1rwh n ASP 430 N -1.77 4.14 0.22 4.04 4.64 -1.26 -4.79 116.55 121.77 1rwh n ASP 430 Ca 0.01 -2.83 0.05 0.00 -1.38 0.00 0.00 54.79 50.64 1rwh n ASP 430 Cb 0.11 -1.73 0.48 0.00 -1.04 0.00 0.00 41.12 38.94 1rwh n ASP 430 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1rwh h LEU 431 N 14.50 0.00 -0.55 -2.67 3.38 -1.99 -1.65 115.31 126.33 1rwh h LEU 431 Ca 0.36 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1rwh h LEU 431 Cb 0.88 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1rwh h LEU 431 CO 1.39 0.21 0.00 0.61 0.09 0.00 0.00 178.44 180.74 1rwh n GLY 432 N -0.94 -0.34 0.33 0.83 0.00 -1.26 -4.57 105.19 99.24 1rwh n GLY 432 Ca -0.02 -0.23 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 1rwh n GLY 432 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1rwh h GLN 433 N 1.02 -0.18 -0.02 1.61 5.75 -1.66 0.12 115.11 121.75 1rwh h GLN 433 Ca 0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1rwh h GLN 433 Cb 0.23 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.82 1rwh h GLN 433 CO 0.00 -0.12 -0.13 0.66 -2.65 0.00 0.00 178.83 176.60 1rwh n TYR 434 N -5.43 0.00 -0.04 3.99 4.02 -1.26 -4.34 117.16 114.10 1rwh n TYR 434 Ca 0.03 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.91 1rwh n TYR 434 Cb 0.35 -0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.55 1rwh n TYR 434 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1rwh n ASP 435 N 0.83 1.49 -4.05 7.72 -0.08 -0.74 -4.41 116.55 117.31 1rwh n ASP 435 Ca 0.13 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.98 1rwh n ASP 435 Cb 0.53 1.21 0.00 0.00 2.34 0.00 0.00 41.12 45.21 1rwh n ASP 435 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1rwh n ASP 436 N -2.32 5.01 -1.85 1.67 2.03 -0.05 -4.34 116.55 116.70 1rwh n ASP 436 Ca -0.15 -3.04 -0.20 0.00 0.52 0.00 0.00 54.79 51.92 1rwh n ASP 436 Cb 0.72 -1.53 -0.06 0.00 -0.72 0.00 0.00 41.12 39.53 1rwh n ASP 436 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rwh n ALA 437 N 4.78 -0.41 -0.07 -1.67 0.00 -1.26 -4.89 120.51 116.98 1rwh n ALA 437 Ca 0.41 0.27 -0.08 0.00 0.00 0.00 0.00 53.44 54.04 1rwh n ALA 437 Cb 0.39 -2.03 -0.01 0.00 0.00 0.00 0.00 19.45 17.81 1rwh n ALA 437 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1rwh h PHE 438 N 0.00 0.15 0.00 0.00 3.57 -1.77 -2.18 116.94 116.71 1rwh h PHE 438 Ca -0.43 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.09 1rwh h PHE 438 Cb 1.32 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.03 1rwh h PHE 438 CO 0.57 0.06 0.00 0.91 -2.23 0.00 0.00 178.31 177.62 1rwh n TRP 439 N -5.05 0.08 0.08 0.41 7.02 -1.26 -0.46 117.44 118.25 1rwh n TRP 439 Ca -0.01 0.02 0.01 0.00 -1.02 0.00 0.00 57.50 56.51 1rwh n TRP 439 Cb 0.11 -0.54 -0.04 0.00 -2.42 0.00 0.00 31.31 28.42 1rwh n TRP 439 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1rwh h ALA 440 N 2.87 0.65 0.00 6.99 0.00 -1.80 -3.42 119.26 124.55 1rwh h ALA 440 Ca 0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 54.91 54.26 1rwh h ALA 440 Cb 0.47 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1rwh h ALA 440 CO 0.00 0.76 -1.04 0.25 0.00 0.00 0.00 179.25 179.22 1rwh n THR 441 N -3.02 0.01 -1.22 0.00 -2.24 -0.85 -4.03 114.28 102.93 1rwh n THR 441 Ca -0.04 -0.02 -0.33 0.00 -2.27 0.00 0.00 64.05 61.38 1rwh n THR 441 Cb 0.78 0.32 0.11 0.00 -2.10 0.00 0.00 70.33 69.45 1rwh n THR 441 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rwh s ALA 442 N -2.05 1.94 -0.56 6.98 0.00 0.39 -4.60 121.76 123.85 1rwh s ALA 442 Ca -0.00 0.79 -0.28 0.00 0.00 0.00 0.00 51.96 52.47 1rwh s ALA 442 Cb 0.00 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.68 1rwh s ALA 442 CO 0.03 -2.13 1.29 1.21 0.00 0.00 0.00 175.76 176.17 1rwh s ASN 443 N -2.24 6.32 0.00 0.00 3.84 -1.26 -4.88 114.94 116.72 1rwh s ASN 443 Ca 0.72 0.24 0.11 0.00 0.21 0.00 0.00 52.86 54.13 1rwh s ASN 443 Cb -0.27 -2.55 0.48 0.00 -0.55 0.00 0.00 41.25 38.36 1rwh s ASN 443 CO 0.49 -1.56 1.32 -1.22 -2.79 0.00 0.00 177.10 173.34 1rwh n TYR 444 N 8.90 0.00 1.02 0.43 4.02 -1.26 -1.05 117.16 129.22 1rwh n TYR 444 Ca 0.11 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.12 1rwh n TYR 444 Cb 0.49 -0.45 0.11 0.00 -0.02 0.00 0.00 39.34 39.46 1rwh n TYR 444 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1rwh n ASN 445 N -1.45 2.88 -2.72 7.72 3.02 -1.26 -4.50 115.26 118.93 1rwh n ASN 445 Ca 0.03 -1.95 -0.05 0.00 -0.03 0.00 0.00 54.58 52.58 1rwh n ASN 445 Cb 0.12 0.03 0.04 0.00 -0.61 0.00 0.00 39.78 39.36 1rwh n ASN 445 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1rwh n ARG 446 N 1.21 1.71 -2.15 3.52 1.74 -0.22 -4.91 116.66 117.56 1rwh n ARG 446 Ca 0.14 -3.50 -0.36 0.00 -0.77 0.00 0.00 57.85 53.36 1rwh n ARG 446 Cb 0.58 -1.55 0.01 0.00 -1.02 0.00 0.00 32.46 30.48 1rwh n ARG 446 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1rwh s LEU 447 N -3.57 3.86 0.26 0.55 1.43 -1.16 -4.56 118.68 115.49 1rwh s LEU 447 Ca 0.29 2.35 -0.31 0.00 -1.03 0.00 0.00 54.13 55.43 1rwh s LEU 447 Cb 0.37 -4.40 -0.12 0.00 0.03 0.00 0.00 46.19 42.07 1rwh s LEU 447 CO -0.01 -1.20 1.63 -0.81 0.23 0.00 0.00 176.35 176.18 1rwh n PRO 448 N -0.97 2.68 0.00 1.29 -0.04 -1.26 -2.64 135.00 134.06 1rwh n PRO 448 Ca 0.10 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.52 1rwh n PRO 448 Cb 0.49 -2.76 0.00 0.00 -0.04 0.00 0.00 33.50 31.19 1rwh n PRO 448 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rwh n GLY 449 N 2.75 3.06 3.77 0.55 0.00 0.55 -0.86 105.19 115.01 1rwh n GLY 449 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1rwh n GLY 449 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1rwh s ILE 450 N -2.34 3.29 -0.10 -0.61 -4.36 -1.08 -4.58 121.20 111.42 1rwh s ILE 450 Ca 0.00 0.42 -0.03 0.00 -0.26 0.00 0.00 60.65 60.77 1rwh s ILE 450 Cb 0.00 -2.93 -0.04 0.00 1.25 0.00 0.00 42.46 40.75 1rwh s ILE 450 CO 0.00 -0.55 0.04 -0.89 0.24 0.00 0.00 174.94 173.78 1rwh s THR 451 N -2.92 4.60 -0.11 8.37 2.01 -1.20 -0.97 115.64 125.42 1rwh s THR 451 Ca 0.61 -0.13 -0.05 0.00 0.31 0.00 0.00 61.69 62.42 1rwh s THR 451 Cb -0.17 -2.97 0.05 0.00 0.01 0.00 0.00 72.50 69.42 1rwh s THR 451 CO 0.56 0.59 0.25 0.54 -0.69 0.00 0.00 174.62 175.88 1rwh s VAL 452 N -0.77 -0.04 -0.13 3.82 0.11 0.15 -4.94 120.40 118.61 1rwh s VAL 452 Ca 0.12 0.14 -0.29 0.00 -2.93 0.00 0.00 61.98 59.02 1rwh s VAL 452 Cb -0.12 -0.39 -0.01 0.00 -1.53 0.00 0.00 36.38 34.33 1rwh s VAL 452 CO 0.02 0.06 1.09 -0.62 -3.33 0.00 0.00 175.10 172.33 1rwh s ASP 453 N 1.25 7.13 0.00 3.54 -1.08 -1.26 -0.91 116.67 125.33 1rwh s ASP 453 Ca -0.09 1.58 0.16 0.00 -0.52 0.00 0.00 52.55 53.68 1rwh s ASP 453 Cb -0.10 -2.55 0.97 0.00 -1.46 0.00 0.00 42.92 39.78 1rwh s ASP 453 CO -0.09 -0.57 1.44 0.35 0.52 0.00 0.00 175.17 176.83 1rwh n THR 454 N 4.85 0.00 -1.67 1.71 -2.24 -0.36 -4.80 114.28 111.77 1rwh n THR 454 Ca 0.11 0.00 -0.47 0.00 -2.27 0.00 0.00 64.05 61.42 1rwh n THR 454 Cb 0.47 -0.49 -0.04 0.00 -2.10 0.00 0.00 70.33 68.16 1rwh n THR 454 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1rwh n THR 455 N -0.85 0.28 -1.96 4.28 -1.04 -1.26 -4.92 114.28 108.80 1rwh n THR 455 Ca 0.12 -0.05 -0.41 0.00 -2.04 0.00 0.00 64.05 61.67 1rwh n THR 455 Cb 0.06 -1.69 -0.01 0.00 -1.82 0.00 0.00 70.33 66.86 1rwh n THR 455 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1rwh s PRO 456 N 2.41 4.23 0.04 -2.82 0.02 -1.26 -5.01 135.00 132.60 1rwh s PRO 456 Ca 0.85 2.39 0.06 0.00 0.02 0.00 0.00 61.00 64.32 1rwh s PRO 456 Cb -0.69 -3.03 -0.03 0.00 0.02 0.00 0.00 34.50 30.77 1rwh s PRO 456 CO 0.44 -0.38 -0.13 -0.51 -0.33 0.00 0.00 177.00 176.09 1rwh s LEU 457 N -1.63 2.84 0.60 -5.54 1.43 -1.26 -5.11 118.68 110.01 1rwh s LEU 457 Ca 0.53 -0.33 -0.16 0.00 -1.03 0.00 0.00 54.13 53.13 1rwh s LEU 457 Cb -0.43 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.10 1rwh s LEU 457 CO 0.55 0.25 1.08 -2.16 0.23 0.00 0.00 176.35 176.31 1rwh s PRO 458 N -1.54 3.18 0.30 1.29 0.04 -1.26 -4.97 135.00 132.05 1rwh s PRO 458 Ca 0.16 1.32 -0.29 0.00 0.04 0.00 0.00 61.00 62.23 1rwh s PRO 458 Cb -0.11 -2.01 -0.13 0.00 0.04 0.00 0.00 34.50 32.30 1rwh s PRO 458 CO 0.07 -0.94 1.27 -0.25 0.04 0.00 0.00 177.00 177.19 1rwh n ASP 459 N -2.02 2.48 -0.46 6.66 10.43 -1.26 -1.59 116.55 130.79 1rwh n ASP 459 Ca 0.10 1.19 -0.06 0.00 2.57 0.00 0.00 54.79 58.58 1rwh n ASP 459 Cb 0.52 -1.43 -0.03 0.00 1.84 0.00 0.00 41.12 42.03 1rwh n ASP 459 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1rwh n LYS 460 N 0.97 -0.57 -1.68 -1.24 5.02 -0.40 -4.99 118.16 115.27 1rwh n LYS 460 Ca 0.07 0.64 -0.41 0.00 -2.02 0.00 0.00 58.31 56.60 1rwh n LYS 460 Cb 0.34 -4.41 0.01 0.00 -0.02 0.00 0.00 35.03 30.95 1rwh n LYS 460 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1rwh n VAL 461 N -2.75 2.47 -0.77 -0.18 3.14 -0.62 -1.08 118.33 118.54 1rwh n VAL 461 Ca -0.06 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.82 1rwh n VAL 461 Cb 0.24 -1.46 0.00 0.00 -1.06 0.00 0.00 33.84 31.56 1rwh n VAL 461 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1rwh n GLU 462 N 0.13 0.00 0.00 1.45 -0.58 -1.26 -4.85 120.64 115.53 1rwh n GLU 462 Ca 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.81 1rwh n GLU 462 Cb 0.39 -2.82 0.00 0.00 -0.57 0.00 0.00 31.44 28.44 1rwh n GLU 462 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1rwh n GLY 463 N -2.00 -0.43 3.89 0.62 0.00 -0.24 -3.95 105.19 103.07 1rwh n GLY 463 Ca 0.00 -1.69 -0.29 0.00 0.00 0.00 0.00 46.02 44.04 1rwh n GLY 463 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rwh s GLN 464 N -2.50 2.81 -1.60 1.61 -0.21 -1.26 -4.40 119.66 114.11 1rwh s GLN 464 Ca 0.00 0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.73 1rwh s GLN 464 Cb 0.00 -2.06 0.00 0.00 1.00 0.00 0.00 33.01 31.95 1rwh s GLN 464 CO 0.00 -1.01 0.00 0.91 -2.12 0.00 0.00 175.29 173.07 1rwh n TRP 465 N -2.95 -0.74 -2.62 0.91 7.02 0.33 -2.58 117.44 116.81 1rwh n TRP 465 Ca 0.07 0.00 -0.20 0.00 -1.02 0.00 0.00 57.50 56.34 1rwh n TRP 465 Cb 0.58 -3.50 0.00 0.00 -2.42 0.00 0.00 31.31 25.96 1rwh n TRP 465 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1rwh n GLY 466 N -0.98 -0.51 0.23 6.99 0.00 -1.25 -4.86 105.19 104.81 1rwh n GLY 466 Ca -0.21 0.04 0.10 0.00 0.00 0.00 0.00 46.02 45.95 1rwh n GLY 466 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh h ALA 467 N 1.00 1.13 -4.07 4.61 0.00 -1.75 -3.43 119.26 116.75 1rwh h ALA 467 Ca -0.48 -0.21 -0.69 0.00 0.00 0.00 0.00 54.91 53.53 1rwh h ALA 467 Cb 1.35 -0.04 -0.23 0.00 0.00 0.00 0.00 17.79 18.87 1rwh h ALA 467 CO 0.55 0.28 -0.79 0.00 0.00 0.00 0.00 179.25 179.30 1rwh s ALA 468 N -3.86 2.60 0.13 0.00 0.00 -1.25 -5.12 121.76 114.25 1rwh s ALA 468 Ca -0.01 -1.05 0.08 0.00 0.00 0.00 0.00 51.96 50.98 1rwh s ALA 468 Cb 0.12 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1rwh s ALA 468 CO 0.63 0.56 -0.18 0.14 0.00 0.00 0.00 175.76 176.91 1rwh s VAL 469 N -0.78 1.63 0.20 0.00 -7.23 -1.26 -4.18 120.40 108.78 1rwh s VAL 469 Ca 0.12 -1.69 -0.30 0.00 -1.81 0.00 0.00 61.98 58.30 1rwh s VAL 469 Cb -0.11 -1.61 -0.09 0.00 0.56 0.00 0.00 36.38 35.13 1rwh s VAL 469 CO 0.02 -0.23 1.35 -2.16 -0.31 0.00 0.00 175.10 173.77 1rwh s PRO 470 N -2.35 4.35 -1.44 4.82 0.04 -1.23 -4.89 135.00 134.30 1rwh s PRO 470 Ca 0.09 2.12 -0.11 0.00 0.04 0.00 0.00 61.00 63.14 1rwh s PRO 470 Cb -0.08 -3.18 0.05 0.00 0.04 0.00 0.00 34.50 31.34 1rwh s PRO 470 CO 0.05 -0.31 2.32 0.00 0.04 0.00 0.00 177.00 179.09 1rwh n ALA 471 N 2.70 6.08 -1.99 8.56 0.00 -1.26 -1.81 120.51 132.78 1rwh n ALA 471 Ca 0.07 -3.94 -0.20 0.00 0.00 0.00 0.00 53.44 49.36 1rwh n ALA 471 Cb 0.42 -3.28 0.05 0.00 0.00 0.00 0.00 19.45 16.64 1rwh n ALA 471 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1rwh s ASP 472 N 2.07 5.13 -0.05 0.00 -4.77 -1.26 -4.98 116.67 112.81 1rwh s ASP 472 Ca 0.51 -0.31 -0.24 0.00 -3.30 0.00 0.00 52.55 49.21 1rwh s ASP 472 Cb 0.14 -0.46 -0.25 0.00 -1.09 0.00 0.00 42.92 41.27 1rwh s ASP 472 CO -0.06 -1.24 0.99 -0.33 0.70 0.00 0.00 175.17 175.22 1rwh h GLU 473 N 0.09 0.20 -1.61 2.11 5.08 -1.92 -3.42 114.58 115.10 1rwh h GLU 473 Ca -0.38 -0.24 0.21 0.00 -1.00 0.00 0.00 59.36 57.94 1rwh h GLU 473 Cb 1.29 0.07 -0.19 0.00 0.50 0.00 0.00 28.75 30.42 1rwh h GLU 473 CO 0.46 1.00 0.74 1.67 -1.00 0.00 0.00 179.01 181.88 1rwh s TRP 474 N -2.92 -0.19 0.02 4.33 1.48 -1.26 -4.78 118.94 115.62 1rwh s TRP 474 Ca -0.16 0.15 0.03 0.00 -1.06 0.00 0.00 56.10 55.06 1rwh s TRP 474 Cb 0.01 0.51 -0.01 0.00 -1.16 0.00 0.00 33.47 32.82 1rwh s TRP 474 CO 0.76 -0.27 -0.09 -1.12 -4.06 0.00 0.00 176.95 172.17 1rwh s SER 475 N -2.06 0.99 0.00 -2.66 0.01 -1.26 -1.25 113.70 107.46 1rwh s SER 475 Ca 0.07 -0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.02 1rwh s SER 475 Cb -0.01 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.16 1rwh s SER 475 CO -0.05 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.20 1rwh n GLY 476 N 2.30 -1.45 3.48 3.44 0.00 -0.33 -4.79 105.19 107.83 1rwh n GLY 476 Ca -0.17 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.74 1rwh n GLY 476 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh s ALA 477 N -1.40 -1.75 0.25 4.61 0.00 -1.26 -0.87 121.76 121.33 1rwh s ALA 477 Ca 0.00 0.85 -0.04 0.00 0.00 0.00 0.00 51.96 52.77 1rwh s ALA 477 Cb 0.00 0.55 -0.02 0.00 0.00 0.00 0.00 23.12 23.65 1rwh s ALA 477 CO 0.00 -0.70 0.32 -0.08 0.00 0.00 0.00 175.76 175.29 1rwh s THR 478 N -3.26 0.00 -0.21 0.00 -1.32 -0.02 -4.67 115.64 106.16 1rwh s THR 478 Ca 0.03 -1.74 -0.25 0.00 -1.21 0.00 0.00 61.69 58.52 1rwh s THR 478 Cb -0.01 -2.43 0.07 0.00 -1.51 0.00 0.00 72.50 68.61 1rwh s THR 478 CO -0.10 0.00 0.67 0.00 -2.21 0.00 0.00 174.62 172.98 1rwh s ALA 479 N -3.85 -1.67 -0.12 11.08 0.00 -1.26 -1.00 121.76 124.94 1rwh s ALA 479 Ca 0.32 1.75 -0.00 0.00 0.00 0.00 0.00 51.96 54.03 1rwh s ALA 479 Cb 0.03 -0.86 0.03 0.00 0.00 0.00 0.00 23.12 22.32 1rwh s ALA 479 CO 0.14 -0.33 -0.08 -1.17 0.00 0.00 0.00 175.76 174.32 1rwh s LEU 480 N 0.01 1.29 0.00 0.00 2.96 -0.18 -4.76 118.68 117.99 1rwh s LEU 480 Ca -0.03 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 1rwh s LEU 480 Cb -0.04 -0.89 0.00 0.00 0.50 0.00 0.00 46.19 45.77 1rwh s LEU 480 CO 0.03 -0.12 0.00 0.61 -1.32 0.00 0.00 176.35 175.55 1rwh n GLY 481 N 4.92 3.54 0.18 7.98 0.00 -1.26 -1.70 105.19 118.85 1rwh n GLY 481 Ca -0.13 0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.09 1rwh n GLY 481 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1rwh n GLU 482 N 14.00 1.25 -5.01 1.61 0.28 -1.26 -4.73 120.64 126.78 1rwh n GLU 482 Ca 0.00 -0.36 -0.29 0.00 -0.16 0.00 0.00 57.16 56.34 1rwh n GLU 482 Cb 0.00 -1.44 -0.17 0.00 1.43 0.00 0.00 31.44 31.27 1rwh n GLU 482 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1rwh s VAL 483 N -1.97 1.73 0.14 3.84 1.01 -0.69 -3.14 120.40 121.32 1rwh s VAL 483 Ca 0.39 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.60 1rwh s VAL 483 Cb 0.19 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1rwh s VAL 483 CO 0.32 0.49 -0.06 0.00 0.00 0.00 0.00 175.10 175.84 1rwh s ALA 484 N 0.28 3.04 -0.13 5.51 0.00 -0.01 -1.01 121.76 129.44 1rwh s ALA 484 Ca -0.13 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.52 1rwh s ALA 484 Cb -0.16 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.08 1rwh s ALA 484 CO 0.06 0.55 -0.19 0.00 0.00 0.00 0.00 175.76 176.18 1rwh s ALA 485 N -1.50 1.99 -0.02 0.00 0.00 -0.17 -1.06 121.76 121.00 1rwh s ALA 485 Ca 0.24 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.32 1rwh s ALA 485 Cb -0.10 -0.93 -0.01 0.00 0.00 0.00 0.00 23.12 22.09 1rwh s ALA 485 CO 0.16 -0.06 -0.14 0.08 0.00 0.00 0.00 175.76 175.79 1rwh s VAL 486 N 0.91 1.17 0.05 0.00 1.01 0.13 -0.84 120.40 122.84 1rwh s VAL 486 Ca -0.06 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.34 1rwh s VAL 486 Cb -0.15 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 1rwh s VAL 486 CO -0.02 0.34 -0.11 -0.83 0.00 0.00 0.00 175.10 174.48 1rwh s GLY 487 N -0.14 0.65 -0.06 4.51 0.00 -0.05 -0.69 107.32 111.53 1rwh s GLY 487 Ca 0.02 -0.82 -0.03 0.00 0.00 0.00 0.00 44.72 43.89 1rwh s GLY 487 CO 0.00 -0.84 0.12 1.62 0.00 0.00 0.00 173.10 174.00 1rwh s GLN 488 N -1.48 0.00 -0.60 2.90 0.74 0.72 -1.19 119.66 120.76 1rwh s GLN 488 Ca -0.05 0.44 -0.27 0.00 0.05 0.00 0.00 55.36 55.53 1rwh s GLN 488 Cb -0.09 -0.32 0.03 0.00 1.10 0.00 0.00 33.01 33.73 1rwh s GLN 488 CO 0.01 -0.28 1.17 -1.58 -0.55 0.00 0.00 175.29 174.06 1rwh s HIS 489 N 1.95 2.59 -0.12 1.67 5.65 -0.38 -1.28 115.29 125.36 1rwh s HIS 489 Ca 0.00 0.28 -0.25 0.00 0.25 0.00 0.00 55.06 55.34 1rwh s HIS 489 Cb -0.12 -4.47 -0.02 0.00 -1.18 0.00 0.00 32.58 26.79 1rwh s HIS 489 CO -0.05 -1.62 0.79 -1.17 -0.65 0.00 0.00 174.74 172.04 1rwh s LEU 490 N 4.91 4.24 -0.20 8.88 2.96 0.41 -4.67 118.68 135.21 1rwh s LEU 490 Ca 0.40 1.21 -0.03 0.00 -0.22 0.00 0.00 54.13 55.48 1rwh s LEU 490 Cb -0.08 -3.20 -0.01 0.00 0.50 0.00 0.00 46.19 43.40 1rwh s LEU 490 CO 0.23 -0.28 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.22 1rwh s VAL 491 N 1.57 3.21 0.49 1.68 1.01 -1.26 -1.77 120.40 125.33 1rwh s VAL 491 Ca 0.39 -0.56 -0.21 0.00 0.00 0.00 0.00 61.98 61.60 1rwh s VAL 491 Cb -0.17 -2.44 -0.07 0.00 0.00 0.00 0.00 36.38 33.70 1rwh s VAL 491 CO 0.16 0.45 1.09 -0.83 0.00 0.00 0.00 175.10 175.97 1rwh s GLY 492 N 1.27 2.62 0.72 4.51 0.00 -0.28 -4.87 107.32 111.29 1rwh s GLY 492 Ca 0.03 0.75 -0.11 0.00 0.00 0.00 0.00 44.72 45.38 1rwh s GLY 492 CO -0.03 1.11 1.08 2.56 0.00 0.00 0.00 173.10 177.83 1rwh s PRO 493 N -3.08 2.61 0.00 2.90 0.04 -1.26 -4.11 135.00 132.10 1rwh s PRO 493 Ca 0.68 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.85 1rwh s PRO 493 Cb -0.22 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.38 1rwh s PRO 493 CO 0.26 -1.37 0.00 0.41 0.04 0.00 0.00 177.00 176.33 1rwh n GLY 494 N -1.35 0.53 2.41 0.56 0.00 -1.26 -4.15 105.19 101.92 1rwh n GLY 494 Ca 0.09 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.55 1rwh n GLY 494 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rwh n ARG 495 N -2.86 -1.71 0.25 1.61 1.74 -1.26 -4.87 116.66 109.56 1rwh n ARG 495 Ca 0.00 1.00 0.14 0.00 -0.77 0.00 0.00 57.85 58.22 1rwh n ARG 495 Cb 0.00 -5.65 0.47 0.00 -1.02 0.00 0.00 32.46 26.26 1rwh n ARG 495 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 1rwh h THR 496 N 0.00 0.13 0.00 0.55 1.35 -1.80 -3.47 112.91 109.67 1rwh h THR 496 Ca -0.48 -0.83 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 1rwh h THR 496 Cb 1.36 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.51 1rwh h THR 496 CO 0.57 0.06 0.00 0.61 -0.25 0.00 0.00 175.52 176.51 1rwh n GLY 497 N 0.40 0.69 3.71 5.82 0.00 -1.26 -1.60 105.19 112.95 1rwh n GLY 497 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1rwh n GLY 497 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1rwh n LEU 498 N 0.00 3.82 -4.05 0.99 -0.00 -1.26 -3.88 117.00 112.62 1rwh n LEU 498 Ca 0.00 1.10 -0.17 0.00 -0.00 0.00 0.00 56.01 56.94 1rwh n LEU 498 Cb 0.00 -1.53 -0.13 0.00 -0.00 0.00 0.00 43.42 41.75 1rwh n LEU 498 CO 0.00 0.01 -0.42 0.28 -0.00 0.00 0.00 177.39 177.26 1rwh s THR 499 N 0.69 0.68 -0.03 1.96 -1.32 -0.27 -1.13 115.64 116.22 1rwh s THR 499 Ca 0.72 -0.69 -0.23 0.00 -1.21 0.00 0.00 61.69 60.28 1rwh s THR 499 Cb -0.55 -0.63 0.05 0.00 -1.51 0.00 0.00 72.50 69.85 1rwh s THR 499 CO 0.39 -0.04 0.51 0.00 -2.21 0.00 0.00 174.62 173.27 1rwh s ALA 500 N -0.68 -1.31 -0.37 11.08 0.00 -0.73 -2.07 121.76 127.69 1rwh s ALA 500 Ca -0.01 0.86 -0.04 0.00 0.00 0.00 0.00 51.96 52.77 1rwh s ALA 500 Cb -0.06 0.04 0.08 0.00 0.00 0.00 0.00 23.12 23.17 1rwh s ALA 500 CO 0.00 -0.32 0.13 1.03 0.00 0.00 0.00 175.76 176.61 1rwh s ARG 501 N -1.26 2.28 -0.16 0.00 0.52 -0.18 -0.44 118.95 119.72 1rwh s ARG 501 Ca -0.12 -1.52 -0.04 0.00 -0.52 0.00 0.00 55.73 53.53 1rwh s ARG 501 Cb -0.02 -3.46 -0.03 0.00 0.52 0.00 0.00 34.95 31.96 1rwh s ARG 501 CO 0.07 -0.86 -0.03 0.15 0.02 0.00 0.00 175.30 174.65 1rwh s LYS 502 N 1.24 3.69 0.10 3.54 1.02 -0.41 -1.05 119.74 127.88 1rwh s LYS 502 Ca 0.02 -0.51 0.04 0.00 0.02 0.00 0.00 55.97 55.54 1rwh s LYS 502 Cb -0.21 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.13 1rwh s LYS 502 CO -0.02 0.24 -0.11 -1.12 -0.92 0.00 0.00 175.35 173.43 1rwh s SER 503 N 0.37 1.56 -0.04 2.83 0.01 0.16 -0.20 113.70 118.38 1rwh s SER 503 Ca -0.04 -0.83 0.02 0.00 1.31 0.00 0.00 55.95 56.41 1rwh s SER 503 Cb -0.14 -0.00 0.02 0.00 0.21 0.00 0.00 66.02 66.10 1rwh s SER 503 CO 0.03 -0.25 -0.07 0.26 0.41 0.00 0.00 173.24 173.62 1rwh s TRP 504 N -2.45 0.87 -0.23 2.43 0.51 0.14 -1.27 118.94 118.94 1rwh s TRP 504 Ca 0.07 -0.25 0.01 0.00 -2.12 0.00 0.00 56.10 53.81 1rwh s TRP 504 Cb -0.03 -0.71 0.05 0.00 -0.81 0.00 0.00 33.47 31.98 1rwh s TRP 504 CO 0.00 -0.18 -0.08 -0.06 -0.51 0.00 0.00 176.95 176.12 1rwh s PHE 505 N 0.69 2.64 -0.20 -1.98 0.40 0.31 -0.69 117.98 119.14 1rwh s PHE 505 Ca -0.10 -1.86 -0.01 0.00 -0.60 0.00 0.00 56.93 54.36 1rwh s PHE 505 Cb -0.13 -1.69 0.01 0.00 0.51 0.00 0.00 43.02 41.72 1rwh s PHE 505 CO 0.01 -0.79 -0.14 0.08 0.70 0.00 0.00 175.22 175.07 1rwh s VAL 506 N 1.32 2.52 0.00 -0.44 1.01 -0.22 -0.75 120.40 123.84 1rwh s VAL 506 Ca -0.05 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.13 1rwh s VAL 506 Cb -0.18 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1rwh s VAL 506 CO -0.07 0.49 0.00 -1.54 0.00 0.00 0.00 175.10 173.98 1rwh n SER 507 N 4.68 0.00 0.05 3.32 3.41 -0.32 -0.83 113.62 123.93 1rwh n SER 507 Ca -0.20 -0.49 0.10 0.00 -0.26 0.00 0.00 58.87 58.01 1rwh n SER 507 Cb 0.50 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.85 1rwh n SER 507 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rwh n GLY 508 N 5.00 -1.16 0.20 5.00 0.00 -1.19 -4.34 105.19 108.70 1rwh n GLY 508 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1rwh n GLY 508 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rwh n ASP 509 N -1.81 1.35 -4.39 1.61 8.00 -1.26 -4.38 116.55 115.67 1rwh n ASP 509 Ca 0.03 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.25 1rwh n ASP 509 Cb 0.21 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.19 1rwh n ASP 509 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1rwh s VAL 510 N -1.46 2.22 -0.21 2.53 -7.23 -1.26 -4.38 120.40 110.61 1rwh s VAL 510 Ca 0.00 -1.80 -0.02 0.00 -1.81 0.00 0.00 61.98 58.35 1rwh s VAL 510 Cb 0.00 -1.98 0.01 0.00 0.56 0.00 0.00 36.38 34.97 1rwh s VAL 510 CO 0.00 0.02 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.81 1rwh s THR 511 N -1.23 2.78 -0.23 5.32 2.01 -0.47 -1.17 115.64 122.67 1rwh s THR 511 Ca 0.15 -0.75 -0.12 0.00 0.31 0.00 0.00 61.69 61.28 1rwh s THR 511 Cb -0.09 -2.26 -0.05 0.00 0.01 0.00 0.00 72.50 70.11 1rwh s THR 511 CO 0.07 0.44 0.22 -0.69 -0.69 0.00 0.00 174.62 173.96 1rwh s VAL 512 N 1.38 5.32 -0.26 3.82 1.01 0.07 -0.87 120.40 130.88 1rwh s VAL 512 Ca 0.05 0.31 -0.02 0.00 0.00 0.00 0.00 61.98 62.32 1rwh s VAL 512 Cb -0.14 -3.56 0.03 0.00 0.00 0.00 0.00 36.38 32.71 1rwh s VAL 512 CO -0.07 0.33 -0.05 0.00 0.00 0.00 0.00 175.10 175.30 1rwh s LEU 514 N 1.32 2.64 0.02 0.00 1.43 -0.40 -1.32 118.68 122.36 1rwh s LEU 514 Ca -0.01 -0.25 0.02 0.00 -1.03 0.00 0.00 54.13 52.86 1rwh s LEU 514 Cb -0.17 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 1rwh s LEU 514 CO -0.04 0.32 -0.07 -0.83 0.23 0.00 0.00 176.35 175.96 1rwh s GLY 515 N -0.58 0.41 0.18 -3.19 0.00 -0.05 -0.67 107.32 103.42 1rwh s GLY 515 Ca 0.08 -0.49 -0.13 0.00 0.00 0.00 0.00 44.72 44.18 1rwh s GLY 515 CO 0.01 -0.48 0.40 0.00 0.00 0.00 0.00 173.10 173.03 1rwh s ALA 516 N -0.64 -0.49 -1.39 3.20 0.00 -0.21 -1.34 121.76 120.88 1rwh s ALA 516 Ca -0.02 -0.53 -0.08 0.00 0.00 0.00 0.00 51.96 51.33 1rwh s ALA 516 Cb -0.06 0.84 0.01 0.00 0.00 0.00 0.00 23.12 23.91 1rwh s ALA 516 CO 0.00 -0.72 1.07 -3.47 0.00 0.00 0.00 175.76 172.64 1rwh n ASP 517 N -0.27 -6.33 -4.69 0.00 2.03 -0.72 -1.01 116.55 105.56 1rwh n ASP 517 Ca -0.09 -0.49 -0.40 0.00 0.52 0.00 0.00 54.79 54.33 1rwh n ASP 517 Cb 0.63 -5.00 -0.05 0.00 -0.72 0.00 0.00 41.12 35.98 1rwh n ASP 517 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1rwh s ILE 518 N -3.29 5.02 0.28 5.18 1.01 -0.25 -4.34 121.20 124.80 1rwh s ILE 518 Ca 0.53 1.37 -0.18 0.00 0.00 0.00 0.00 60.65 62.38 1rwh s ILE 518 Cb -0.23 -4.02 0.01 0.00 0.01 0.00 0.00 42.46 38.23 1rwh s ILE 518 CO 0.66 0.17 0.64 -0.94 0.00 0.00 0.00 174.94 175.47 1rwh s SER 519 N 0.98 -0.16 0.22 3.58 1.04 -0.88 -0.79 113.70 117.69 1rwh s SER 519 Ca 0.34 -0.77 -0.12 0.00 0.48 0.00 0.00 55.95 55.88 1rwh s SER 519 Cb -0.17 0.69 -0.00 0.00 0.10 0.00 0.00 66.02 66.64 1rwh s SER 519 CO 0.14 -1.30 0.44 0.28 0.98 0.00 0.00 173.24 173.78 1rwh s THR 520 N -3.84 0.02 -1.54 2.02 -1.32 -1.26 -1.11 115.64 108.60 1rwh s THR 520 Ca 0.15 -1.34 0.17 0.00 -1.21 0.00 0.00 61.69 59.46 1rwh s THR 520 Cb -0.04 -2.06 0.00 0.00 -1.51 0.00 0.00 72.50 68.89 1rwh s THR 520 CO 0.08 -0.07 0.88 0.00 -2.21 0.00 0.00 174.62 173.30 1rwh n ALA 521 N -0.34 3.16 0.53 11.08 0.00 -0.63 -4.68 120.51 129.64 1rwh n ALA 521 Ca -0.04 -0.55 0.13 0.00 0.00 0.00 0.00 53.44 52.98 1rwh n ALA 521 Cb 0.62 -0.58 0.31 0.00 0.00 0.00 0.00 19.45 19.80 1rwh n ALA 521 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1rwh h SER 522 N 1.90 0.00 0.00 0.00 4.64 -1.78 -3.47 113.55 114.84 1rwh h SER 522 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1rwh h SER 522 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1rwh h SER 522 CO 0.00 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1rwh n GLY 523 N 1.27 0.94 3.95 -0.77 0.00 -1.26 -5.04 105.19 104.28 1rwh n GLY 523 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 1rwh n GLY 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh s ALA 524 N -3.80 3.74 0.57 4.61 0.00 -1.26 -4.69 121.76 120.93 1rwh s ALA 524 Ca 0.00 -0.97 -0.20 0.00 0.00 0.00 0.00 51.96 50.78 1rwh s ALA 524 Cb 0.00 -2.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 1rwh s ALA 524 CO 0.00 -0.10 1.29 0.15 0.00 0.00 0.00 175.76 177.10 1rwh s LYS 525 N -4.36 3.05 -0.06 0.00 1.02 -1.26 -4.36 119.74 113.78 1rwh s LYS 525 Ca 0.42 2.06 0.05 0.00 0.02 0.00 0.00 55.97 58.52 1rwh s LYS 525 Cb -0.10 -2.12 -0.02 0.00 -0.52 0.00 0.00 37.83 35.08 1rwh s LYS 525 CO 0.36 -1.20 -0.21 0.08 -0.92 0.00 0.00 175.35 173.46 1rwh s VAL 526 N -1.41 2.48 0.23 3.17 1.01 -1.01 -1.22 120.40 123.65 1rwh s VAL 526 Ca 0.74 -0.92 0.12 0.00 0.00 0.00 0.00 61.98 61.92 1rwh s VAL 526 Cb -0.36 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 1rwh s VAL 526 CO 0.41 0.57 -0.22 -1.61 0.00 0.00 0.00 175.10 174.26 1rwh s GLU 527 N -0.35 1.61 -0.06 2.72 2.02 -0.09 -0.45 118.70 124.10 1rwh s GLU 527 Ca 0.03 -1.63 0.03 0.00 0.02 0.00 0.00 54.97 53.41 1rwh s GLU 527 Cb -0.12 -1.82 0.01 0.00 0.10 0.00 0.00 34.13 32.29 1rwh s GLU 527 CO 0.02 0.37 -0.16 0.99 0.02 0.00 0.00 175.26 176.50 1rwh s THR 528 N -2.07 1.36 -0.47 3.63 2.01 -0.39 -0.67 115.64 119.04 1rwh s THR 528 Ca 0.25 -0.64 -0.18 0.00 0.31 0.00 0.00 61.69 61.44 1rwh s THR 528 Cb -0.07 -1.20 0.05 0.00 0.01 0.00 0.00 72.50 71.29 1rwh s THR 528 CO 0.12 0.40 0.53 -0.63 -0.69 0.00 0.00 174.62 174.35 1rwh s ILE 529 N 0.40 5.00 0.09 1.82 -1.09 -0.14 -0.76 121.20 126.51 1rwh s ILE 529 Ca -0.11 -0.54 -0.21 0.00 -2.23 0.00 0.00 60.65 57.56 1rwh s ILE 529 Cb -0.15 -4.19 -0.10 0.00 -1.58 0.00 0.00 42.46 36.45 1rwh s ILE 529 CO 0.04 -0.64 1.63 0.58 -1.23 0.00 0.00 174.94 175.31 1rwh h VAL 530 N 5.80 1.15 -3.06 2.92 2.07 -1.14 0.16 116.25 124.15 1rwh h VAL 530 Ca -0.27 -0.46 -0.04 0.00 0.82 0.00 0.00 66.70 66.75 1rwh h VAL 530 Cb 1.10 1.16 -0.13 0.00 -1.52 0.00 0.00 31.29 31.90 1rwh h VAL 530 CO 0.90 0.14 0.09 -0.62 0.02 0.00 0.00 177.57 178.10 1rwh s ASP 531 N -5.55 -0.44 -0.26 0.57 -1.08 -0.91 -4.37 116.67 104.63 1rwh s ASP 531 Ca -0.14 -0.06 -0.03 0.00 -0.52 0.00 0.00 52.55 51.81 1rwh s ASP 531 Cb 0.07 0.54 0.11 0.00 -1.46 0.00 0.00 42.92 42.17 1rwh s ASP 531 CO 0.70 -0.88 0.20 -2.28 0.52 0.00 0.00 175.17 173.43 1rwh s HIS 532 N -3.48 -0.08 -0.13 -5.34 5.65 -1.25 -0.88 115.29 109.78 1rwh s HIS 532 Ca 0.00 -0.37 0.01 0.00 0.25 0.00 0.00 55.06 54.95 1rwh s HIS 532 Cb 0.00 -0.62 0.02 0.00 -1.18 0.00 0.00 32.58 30.80 1rwh s HIS 532 CO -0.10 -0.79 -0.13 0.50 -0.65 0.00 0.00 174.74 173.57 1rwh s ARG 533 N 2.24 2.08 -0.04 2.88 3.52 0.18 -4.52 118.95 125.29 1rwh s ARG 533 Ca 0.08 -0.49 -0.30 0.00 -0.13 0.00 0.00 55.73 54.90 1rwh s ARG 533 Cb -0.15 -1.90 -0.05 0.00 -1.56 0.00 0.00 34.95 31.29 1rwh s ARG 533 CO -0.28 -0.18 1.46 1.21 -0.81 0.00 0.00 175.30 176.70 1rwh s ASN 534 N 1.36 6.80 0.00 -2.12 2.47 -1.26 -1.11 114.94 121.08 1rwh s ASN 534 Ca 0.01 2.09 0.20 0.00 0.42 0.00 0.00 52.86 55.58 1rwh s ASN 534 Cb -0.13 -2.55 0.34 0.00 -1.45 0.00 0.00 41.25 37.45 1rwh s ASN 534 CO -0.07 -0.80 1.29 0.18 -3.72 0.00 0.00 177.10 173.98 1rwh n LEU 535 N 6.13 3.14 0.00 3.21 4.77 0.14 -4.94 117.00 129.46 1rwh n LEU 535 Ca 0.15 -1.43 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 1rwh n LEU 535 Cb 0.43 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1rwh n LEU 535 CO 0.59 0.66 0.00 1.41 -1.33 0.00 0.00 177.39 178.73 1rwh n HIS 536 N 1.25 0.00 -0.73 -1.77 8.25 -1.22 -0.61 115.22 120.40 1rwh n HIS 536 Ca 0.16 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.70 1rwh n HIS 536 Cb 0.54 0.00 0.31 0.00 1.12 0.00 0.00 29.99 31.97 1rwh n HIS 536 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1rwh n GLN 537 N 13.39 3.65 -1.91 -0.41 1.13 -1.26 -1.05 117.38 130.91 1rwh n GLN 537 Ca 0.00 -2.83 -0.30 0.00 -1.94 0.00 0.00 57.00 51.93 1rwh n GLN 537 Cb 0.00 -1.88 0.03 0.00 0.11 0.00 0.00 30.24 28.50 1rwh n GLN 537 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1rwh s GLY 538 N -1.19 1.64 -0.34 1.08 0.00 0.22 -4.99 107.32 103.74 1rwh s GLY 538 Ca 0.46 -0.26 0.06 0.00 0.00 0.00 0.00 44.72 44.98 1rwh s GLY 538 CO 0.17 0.07 1.38 1.44 0.00 0.00 0.00 173.10 176.16 1rwh n SER 539 N -2.88 4.45 -4.64 1.64 7.64 -1.26 -4.87 113.62 113.71 1rwh n SER 539 Ca 0.06 -3.79 -0.51 0.00 1.01 0.00 0.00 58.87 55.65 1rwh n SER 539 Cb 0.56 -0.52 -0.06 0.00 -1.01 0.00 0.00 64.21 63.18 1rwh n SER 539 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1rwh n ASN 540 N -0.88 2.32 -4.76 6.43 4.13 -1.26 -4.88 115.26 116.36 1rwh n ASN 540 Ca 0.42 1.09 -0.40 0.00 1.68 0.00 0.00 54.58 57.37 1rwh n ASN 540 Cb 0.90 -1.26 -0.03 0.00 -1.54 0.00 0.00 39.78 37.85 1rwh n ASN 540 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1rwh s THR 541 N 1.40 3.21 -0.44 3.41 2.01 -1.26 -4.74 115.64 119.22 1rwh s THR 541 Ca 0.86 1.18 -0.11 0.00 0.31 0.00 0.00 61.69 63.94 1rwh s THR 541 Cb -0.87 -3.74 0.09 0.00 0.01 0.00 0.00 72.50 67.98 1rwh s THR 541 CO 0.48 0.26 0.31 -0.76 -0.69 0.00 0.00 174.62 174.22 1rwh s LEU 542 N -1.72 5.39 0.09 4.42 1.43 -1.26 -0.97 118.68 126.06 1rwh s LEU 542 Ca 0.48 -1.56 -0.17 0.00 -1.03 0.00 0.00 54.13 51.84 1rwh s LEU 542 Cb -0.34 -2.04 -0.07 0.00 0.03 0.00 0.00 46.19 43.77 1rwh s LEU 542 CO 0.44 -0.60 0.55 -0.89 0.23 0.00 0.00 176.35 176.08 1rwh s THR 543 N 1.46 4.80 0.28 5.49 2.01 0.28 -1.21 115.64 128.75 1rwh s THR 543 Ca 0.04 1.07 0.02 0.00 0.31 0.00 0.00 61.69 63.13 1rwh s THR 543 Cb -0.24 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 1rwh s THR 543 CO 0.02 0.47 0.13 0.42 -0.69 0.00 0.00 174.62 174.97 1rwh s THR 544 N -1.21 0.45 0.30 -0.82 -4.23 -0.09 -0.73 115.64 109.31 1rwh s THR 544 Ca 0.31 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.88 1rwh s THR 544 Cb -0.18 -2.57 0.30 0.00 1.34 0.00 0.00 72.50 71.39 1rwh s THR 544 CO 0.18 0.00 1.77 0.00 -0.54 0.00 0.00 174.62 176.03 1rwh h ALA 545 N 2.29 1.69 0.00 3.99 0.00 -1.93 -2.57 119.26 122.72 1rwh h ALA 545 Ca -0.36 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 1rwh h ALA 545 Cb 1.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1rwh h ALA 545 CO 0.56 -0.08 -0.47 0.00 0.00 0.00 0.00 179.25 179.27 1rwh h ALA 546 N 1.66 0.78 0.00 0.00 0.00 -1.96 -3.50 119.26 116.24 1rwh h ALA 546 Ca 0.59 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1rwh h ALA 546 Cb 0.94 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1rwh h ALA 546 CO -0.40 0.25 0.00 0.41 0.00 0.00 0.00 179.25 179.51 1rwh n GLY 547 N 1.18 -0.91 3.25 0.00 0.00 -0.97 -5.13 105.19 102.62 1rwh n GLY 547 Ca 0.01 0.35 -0.14 0.00 0.00 0.00 0.00 46.02 46.24 1rwh n GLY 547 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rwh s THR 548 N 0.00 0.79 0.10 2.61 -4.23 -1.26 -0.91 115.64 112.74 1rwh s THR 548 Ca 0.00 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.54 1rwh s THR 548 Cb 0.00 -2.11 -0.04 0.00 1.34 0.00 0.00 72.50 71.69 1rwh s THR 548 CO 0.00 -0.49 -0.08 -0.51 -0.54 0.00 0.00 174.62 172.99 1rwh s ILE 549 N -3.58 0.83 -1.41 2.99 2.07 -0.35 -4.83 121.20 116.92 1rwh s ILE 549 Ca 0.23 -1.80 -0.06 0.00 -1.41 0.00 0.00 60.65 57.61 1rwh s ILE 549 Cb 0.06 -1.53 0.04 0.00 0.13 0.00 0.00 42.46 41.15 1rwh s ILE 549 CO 0.04 -0.72 0.83 0.00 -1.91 0.00 0.00 174.94 173.18 1rwh n ALA 550 N 0.22 -1.68 0.39 1.50 0.00 -1.26 -4.34 120.51 115.34 1rwh n ALA 550 Ca -0.14 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.44 1rwh n ALA 550 Cb 0.59 -3.12 0.39 0.00 0.00 0.00 0.00 19.45 17.31 1rwh n ALA 550 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rwh h GLY 551 N -1.99 0.00 -6.93 0.00 0.00 -1.91 -3.40 103.07 88.83 1rwh h GLY 551 Ca -0.60 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.07 1rwh h GLY 551 CO 0.61 0.00 -0.70 -1.59 0.00 0.00 0.00 176.54 174.86 1rwh s THR 552 N -3.28 3.54 0.25 4.70 2.01 -1.26 -5.07 115.64 116.53 1rwh s THR 552 Ca 0.07 -0.47 -0.31 0.00 0.31 0.00 0.00 61.69 61.29 1rwh s THR 552 Cb 0.09 -2.64 -0.13 0.00 0.01 0.00 0.00 72.50 69.83 1rwh s THR 552 CO 0.58 0.38 1.44 0.00 -0.69 0.00 0.00 174.62 176.33 1rwh n ALA 553 N 4.82 1.35 -0.22 7.40 0.00 -1.26 -2.73 120.51 129.87 1rwh n ALA 553 Ca -0.18 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1rwh n ALA 553 Cb 0.51 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1rwh n ALA 553 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rwh n GLY 554 N 2.13 0.96 3.15 0.00 0.00 0.60 -4.98 105.19 107.05 1rwh n GLY 554 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1rwh n GLY 554 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rwh s THR 555 N -2.63 2.99 0.29 2.61 2.01 -1.11 -5.04 115.64 114.77 1rwh s THR 555 Ca 0.00 -1.63 -0.29 0.00 0.31 0.00 0.00 61.69 60.08 1rwh s THR 555 Cb 0.00 -2.84 -0.10 0.00 0.01 0.00 0.00 72.50 69.57 1rwh s THR 555 CO 0.00 -0.29 1.25 0.54 -0.69 0.00 0.00 174.62 175.43 1rwh s VAL 556 N 1.20 3.02 0.15 3.82 0.11 -1.26 -4.72 120.40 122.71 1rwh s VAL 556 Ca -0.01 0.99 0.08 0.00 -2.93 0.00 0.00 61.98 60.11 1rwh s VAL 556 Cb -0.20 -3.63 -0.04 0.00 -1.53 0.00 0.00 36.38 30.98 1rwh s VAL 556 CO -0.02 0.22 -0.17 -1.61 -3.33 0.00 0.00 175.10 170.18 1rwh s GLU 557 N -1.37 1.19 -0.17 1.54 2.02 -0.20 -4.96 118.70 116.74 1rwh s GLU 557 Ca 0.49 -1.34 -0.08 0.00 0.02 0.00 0.00 54.97 54.07 1rwh s GLU 557 Cb -0.37 -1.21 -0.04 0.00 0.10 0.00 0.00 34.13 32.60 1rwh s GLU 557 CO 0.47 0.25 0.11 0.08 0.02 0.00 0.00 175.26 176.18 1rwh s VAL 558 N -1.99 5.20 0.20 2.63 1.01 -1.26 -0.37 120.40 125.81 1rwh s VAL 558 Ca 0.13 0.11 -0.32 0.00 0.00 0.00 0.00 61.98 61.90 1rwh s VAL 558 Cb -0.06 -3.33 -0.11 0.00 0.00 0.00 0.00 36.38 32.88 1rwh s VAL 558 CO 0.05 0.50 1.65 -0.22 0.00 0.00 0.00 175.10 177.08 1rwh s LEU 559 N -0.06 4.37 0.00 3.92 2.96 -0.08 -5.00 118.68 124.79 1rwh s LEU 559 Ca 0.09 2.76 0.00 0.00 -0.22 0.00 0.00 54.13 56.76 1rwh s LEU 559 Cb -0.12 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.97 1rwh s LEU 559 CO 0.00 -0.90 0.00 0.61 -1.32 0.00 0.00 176.35 174.74 1rwh n GLY 560 N 3.75 -2.62 0.03 7.98 0.00 -1.26 -4.71 105.19 108.37 1rwh n GLY 560 Ca 0.14 -0.86 0.12 0.00 0.00 0.00 0.00 46.02 45.42 1rwh n GLY 560 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rwh n ASP 561 N 0.00 0.63 0.22 1.61 8.00 -1.26 -4.21 116.55 121.53 1rwh n ASP 561 Ca 0.00 -0.14 0.15 0.00 0.71 0.00 0.00 54.79 55.51 1rwh n ASP 561 Cb 0.00 0.47 0.76 0.00 -0.02 0.00 0.00 41.12 42.33 1rwh n ASP 561 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1rwh h GLY 562 N 4.66 0.00 0.00 0.44 0.00 -1.98 -3.47 103.07 102.72 1rwh h GLY 562 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1rwh h GLY 562 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.08 1rwh n ARG 563 N -2.55 -0.47 -4.24 4.80 1.74 -1.26 -4.96 116.66 109.73 1rwh n ARG 563 Ca -0.01 0.12 -0.20 0.00 -0.77 0.00 0.00 57.85 56.98 1rwh n ARG 563 Cb 0.09 -3.91 -0.12 0.00 -1.02 0.00 0.00 32.46 27.51 1rwh n ARG 563 CO 0.00 0.00 0.00 1.67 -1.52 0.00 0.00 177.63 177.78 1rwh s TRP 564 N -1.88 1.49 -0.00 -1.55 1.48 -1.26 -0.38 118.94 116.84 1rwh s TRP 564 Ca 0.00 -0.47 0.01 0.00 -1.06 0.00 0.00 56.10 54.58 1rwh s TRP 564 Cb 0.00 -0.81 -0.00 0.00 -1.16 0.00 0.00 33.47 31.50 1rwh s TRP 564 CO 0.00 0.14 -0.02 0.54 -4.06 0.00 0.00 176.95 173.55 1rwh s VAL 565 N -1.47 0.19 -0.11 -0.66 0.11 -0.33 -4.33 120.40 113.80 1rwh s VAL 565 Ca 0.04 -0.10 0.01 0.00 -2.93 0.00 0.00 61.98 59.01 1rwh s VAL 565 Cb -0.09 -0.17 -0.02 0.00 -1.53 0.00 0.00 36.38 34.58 1rwh s VAL 565 CO 0.03 0.06 -0.14 -2.28 -3.33 0.00 0.00 175.10 169.44 1rwh s HIS 566 N -0.02 2.77 -0.29 1.54 5.04 0.09 -0.79 115.29 123.62 1rwh s HIS 566 Ca 0.01 -0.58 -0.09 0.00 -1.54 0.00 0.00 55.06 52.86 1rwh s HIS 566 Cb -0.01 -1.79 -0.01 0.00 0.04 0.00 0.00 32.58 30.80 1rwh s HIS 566 CO -0.00 -0.15 0.13 -1.17 -2.34 0.00 0.00 174.74 171.21 1rwh s LEU 567 N 0.14 3.94 0.13 8.88 2.96 0.08 -0.56 118.68 134.25 1rwh s LEU 567 Ca -0.07 -0.42 -0.35 0.00 -0.22 0.00 0.00 54.13 53.07 1rwh s LEU 567 Cb -0.15 -1.99 -0.15 0.00 0.50 0.00 0.00 46.19 44.40 1rwh s LEU 567 CO 0.05 -0.15 1.44 1.21 -1.32 0.00 0.00 176.35 177.59 1rwh n GLU 568 N 4.97 1.65 -0.83 1.98 2.13 -0.14 -1.15 120.64 129.25 1rwh n GLU 568 Ca -0.14 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.27 1rwh n GLU 568 Cb 0.50 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.92 1rwh n GLU 568 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rwh n GLY 569 N 2.88 0.87 1.26 8.31 0.00 -1.26 -4.71 105.19 112.54 1rwh n GLY 569 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1rwh n GLY 569 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1rwh n PHE 570 N -2.12 -0.40 -1.00 1.61 7.35 -0.30 -4.89 117.46 117.71 1rwh n PHE 570 Ca 0.00 0.07 0.00 0.00 -0.76 0.00 0.00 57.45 56.76 1rwh n PHE 570 Cb 0.00 0.14 0.00 0.00 0.35 0.00 0.00 39.48 39.97 1rwh n PHE 570 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1rwh n GLY 571 N 3.02 0.61 3.55 7.13 0.00 -0.82 -0.12 105.19 118.56 1rwh n GLY 571 Ca 0.00 -1.69 -0.25 0.00 0.00 0.00 0.00 46.02 44.08 1rwh n GLY 571 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rwh s GLY 572 N 0.00 1.73 0.02 -0.02 0.00 -0.57 -0.74 107.32 107.75 1rwh s GLY 572 Ca 0.00 -1.61 0.04 0.00 0.00 0.00 0.00 44.72 43.15 1rwh s GLY 572 CO 0.00 -1.65 -0.11 -0.19 0.00 0.00 0.00 173.10 171.15 1rwh s TYR 573 N -1.98 0.96 -0.07 1.90 1.51 0.03 -0.35 117.35 119.34 1rwh s TYR 573 Ca 0.27 -0.29 -0.08 0.00 -1.01 0.00 0.00 57.07 55.96 1rwh s TYR 573 Cb -0.07 -0.59 0.02 0.00 -0.11 0.00 0.00 41.96 41.21 1rwh s TYR 573 CO 0.15 -0.00 0.23 0.00 -1.11 0.00 0.00 175.55 174.82 1rwh s ALA 574 N -0.65 -0.56 0.02 3.71 0.00 -0.55 -1.19 121.76 122.55 1rwh s ALA 574 Ca 0.01 0.53 -0.24 0.00 0.00 0.00 0.00 51.96 52.26 1rwh s ALA 574 Cb -0.06 -0.29 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 1rwh s ALA 574 CO 0.00 -0.13 0.72 -1.64 0.00 0.00 0.00 175.76 174.71 1rwh s MET 575 N -0.17 4.45 -0.01 0.00 -1.94 0.49 -0.48 119.30 121.63 1rwh s MET 575 Ca -0.03 0.97 0.17 0.00 -1.71 0.00 0.00 55.69 55.09 1rwh s MET 575 Cb -0.03 -3.37 0.49 0.00 2.01 0.00 0.00 34.83 33.93 1rwh s MET 575 CO 0.01 0.26 1.41 1.28 -0.01 0.00 0.00 175.02 177.97 1rwh n LEU 576 N 2.95 3.53 0.00 -0.03 4.77 0.12 -4.93 117.00 123.42 1rwh n LEU 576 Ca -0.03 -2.05 -0.10 0.00 -0.03 0.00 0.00 56.01 53.80 1rwh n LEU 576 Cb 0.51 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 1rwh n LEU 576 CO 0.46 0.86 0.02 -0.90 -1.33 0.00 0.00 177.39 176.50 1rwh n ASP 577 N 1.06 -0.61 -1.78 -1.43 5.68 -1.22 -4.89 116.55 113.35 1rwh n ASP 577 Ca 0.19 -2.24 -0.03 0.00 -0.50 0.00 0.00 54.79 52.20 1rwh n ASP 577 Cb 0.55 1.26 0.27 0.00 -1.14 0.00 0.00 41.12 42.06 1rwh n ASP 577 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1rwh n ASP 578 N -2.03 4.44 -4.77 -1.12 5.75 -1.26 -4.97 116.55 112.59 1rwh n ASP 578 Ca 0.03 -2.96 -0.39 0.00 -0.01 0.00 0.00 54.79 51.46 1rwh n ASP 578 Cb 0.36 -0.70 -0.04 0.00 -1.03 0.00 0.00 41.12 39.71 1rwh n ASP 578 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1rwh s SER 579 N -0.72 7.08 0.28 -1.12 0.01 -1.26 -4.97 113.70 113.00 1rwh s SER 579 Ca 0.45 2.18 -0.30 0.00 1.31 0.00 0.00 55.95 59.59 1rwh s SER 579 Cb 0.36 -2.61 -0.11 0.00 0.21 0.00 0.00 66.02 63.87 1rwh s SER 579 CO 0.12 -0.27 1.54 -2.84 0.41 0.00 0.00 173.24 172.20 1rwh s PRO 580 N -1.82 4.17 -0.25 12.44 0.02 -1.26 -5.00 135.00 143.31 1rwh s PRO 580 Ca 0.49 2.48 -0.08 0.00 0.02 0.00 0.00 61.00 63.91 1rwh s PRO 580 Cb -0.28 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.15 1rwh s PRO 580 CO 0.36 -0.56 0.10 -1.17 -0.33 0.00 0.00 177.00 175.41 1rwh s LEU 581 N -0.47 3.66 -0.07 -5.54 2.96 -1.26 -4.51 118.68 113.45 1rwh s LEU 581 Ca 0.62 -0.10 -0.18 0.00 -0.22 0.00 0.00 54.13 54.24 1rwh s LEU 581 Cb -0.46 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.20 1rwh s LEU 581 CO 0.46 -0.00 0.48 -1.00 -1.32 0.00 0.00 176.35 174.97 1rwh s HIS 582 N 1.45 3.60 -0.10 5.38 3.76 0.13 -0.90 115.29 128.60 1rwh s HIS 582 Ca 0.06 0.97 0.01 0.00 -0.15 0.00 0.00 55.06 55.96 1rwh s HIS 582 Cb -0.15 -2.50 0.02 0.00 1.11 0.00 0.00 32.58 31.05 1rwh s HIS 582 CO 0.05 0.31 -0.12 0.08 -0.85 0.00 0.00 174.74 174.21 1rwh s VAL 583 N 0.08 1.27 -0.09 -0.90 1.01 0.50 -0.73 120.40 121.54 1rwh s VAL 583 Ca 0.26 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1rwh s VAL 583 Cb -0.16 -1.19 0.02 0.00 0.00 0.00 0.00 36.38 35.05 1rwh s VAL 583 CO 0.12 0.40 -0.08 -0.22 0.00 0.00 0.00 175.10 175.32 1rwh s LEU 584 N 1.10 1.26 -0.15 3.92 2.96 0.52 -1.04 118.68 127.26 1rwh s LEU 584 Ca -0.05 -0.26 -0.16 0.00 -0.22 0.00 0.00 54.13 53.43 1rwh s LEU 584 Cb -0.14 -0.76 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 1rwh s LEU 584 CO -0.02 -0.08 0.39 -0.60 -1.32 0.00 0.00 176.35 174.72 1rwh s ARG 585 N 1.38 4.28 0.04 1.98 3.52 -1.26 -0.72 118.95 128.16 1rwh s ARG 585 Ca -0.02 0.27 -0.05 0.00 -0.13 0.00 0.00 55.73 55.80 1rwh s ARG 585 Cb -0.14 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 29.79 1rwh s ARG 585 CO -0.04 0.15 0.08 -1.83 -0.81 0.00 0.00 175.30 172.85 1rwh s GLU 586 N 0.70 0.58 -0.17 5.12 -1.05 -0.23 -0.29 118.70 123.37 1rwh s GLU 586 Ca 0.21 -0.79 -0.03 0.00 -0.15 0.00 0.00 54.97 54.21 1rwh s GLU 586 Cb -0.14 0.23 -0.02 0.00 -0.44 0.00 0.00 34.13 33.76 1rwh s GLU 586 CO 0.07 -0.14 -0.06 0.99 0.95 0.00 0.00 175.26 177.07 1rwh s THR 587 N -2.70 3.55 0.08 1.83 2.01 -1.26 -0.38 115.64 118.78 1rwh s THR 587 Ca -0.04 -0.46 0.09 0.00 0.31 0.00 0.00 61.69 61.58 1rwh s THR 587 Cb -0.01 -2.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.91 1rwh s THR 587 CO -0.05 0.48 -0.23 -0.13 -0.69 0.00 0.00 174.62 174.00 1rwh s ARG 588 N 0.71 1.34 0.09 4.92 0.52 0.24 -4.97 118.95 121.80 1rwh s ARG 588 Ca -0.03 -1.12 0.05 0.00 -0.52 0.00 0.00 55.73 54.11 1rwh s ARG 588 Cb -0.15 -1.59 -0.03 0.00 0.52 0.00 0.00 34.95 33.70 1rwh s ARG 588 CO 0.02 0.39 -0.13 -1.12 0.02 0.00 0.00 175.30 174.47 1rwh s SER 589 N -1.63 1.71 0.00 0.23 0.01 -1.26 -0.64 113.70 112.11 1rwh s SER 589 Ca 0.09 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.66 1rwh s SER 589 Cb -0.10 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.09 1rwh s SER 589 CO 0.04 -0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.17 1rwh n GLY 590 N 1.00 0.55 3.71 3.44 0.00 -0.28 -4.84 105.19 108.77 1rwh n GLY 590 Ca -0.19 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 1rwh n GLY 590 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rwh s SER 591 N 0.00 4.91 0.48 1.61 1.04 -1.26 -0.58 113.70 119.91 1rwh s SER 591 Ca 0.00 -0.46 0.22 0.00 0.48 0.00 0.00 55.95 56.19 1rwh s SER 591 Cb 0.00 -1.07 1.23 0.00 0.10 0.00 0.00 66.02 66.28 1rwh s SER 591 CO 0.00 0.01 2.02 -0.50 0.98 0.00 0.00 173.24 175.75 1rwh h TRP 592 N 1.95 0.00 0.00 5.02 4.06 -1.69 -0.99 115.95 124.29 1rwh h TRP 592 Ca -0.46 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.49 1rwh h TRP 592 Cb 1.24 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.39 1rwh h TRP 592 CO 0.63 0.17 -0.02 0.66 -3.56 0.00 0.00 178.44 176.32 1rwh h SER 593 N 0.00 0.00 1.26 -3.49 4.64 -1.11 -1.07 113.55 113.78 1rwh h SER 593 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rwh h SER 593 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1rwh h SER 593 CO 0.02 0.02 0.00 1.23 -0.87 0.00 0.00 176.83 177.23 1rwh h GLY 594 N 0.21 0.00 -0.06 -0.77 0.00 -1.46 -3.31 103.07 97.68 1rwh h GLY 594 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1rwh h GLY 594 CO 0.00 0.00 -0.06 3.33 0.00 0.00 0.00 176.54 179.82 1rwh n VAL 595 N -2.86 0.00 -3.68 4.60 0.24 -0.50 -4.97 118.33 111.17 1rwh n VAL 595 Ca 0.02 -0.47 -0.09 0.00 -2.04 0.00 0.00 64.34 61.76 1rwh n VAL 595 Cb 0.36 1.01 -0.09 0.00 -1.47 0.00 0.00 33.84 33.65 1rwh n VAL 595 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1rwh s ASN 596 N -0.83 -0.66 0.63 -1.34 3.84 -0.66 -2.53 114.94 113.39 1rwh s ASN 596 Ca 0.01 1.11 0.40 0.00 0.21 0.00 0.00 52.86 54.60 1rwh s ASN 596 Cb 0.01 0.99 2.13 0.00 -0.55 0.00 0.00 41.25 43.84 1rwh s ASN 596 CO 0.06 -0.21 2.28 -0.29 -2.79 0.00 0.00 177.10 176.15 1rwh h ILE 597 N 5.29 0.09 -0.02 -5.21 6.09 -1.44 -0.17 117.51 122.15 1rwh h ILE 597 Ca -0.34 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 1rwh h ILE 597 Cb 1.20 1.12 0.00 0.00 0.47 0.00 0.00 36.82 39.60 1rwh h ILE 597 CO 0.24 0.01 -0.13 0.59 -3.07 0.00 0.00 178.15 175.79 1rwh n ASN 598 N -3.20 1.95 -4.79 2.19 3.02 -1.26 -4.99 115.26 108.18 1rwh n ASN 598 Ca -0.02 -1.54 -0.33 0.00 -0.03 0.00 0.00 54.58 52.66 1rwh n ASN 598 Cb 0.12 0.11 0.01 0.00 -0.61 0.00 0.00 39.78 39.41 1rwh n ASN 598 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1rwh s GLY 599 N -2.17 2.29 0.75 7.41 0.00 -0.07 -4.95 107.32 110.58 1rwh s GLY 599 Ca 0.29 0.55 -0.13 0.00 0.00 0.00 0.00 44.72 45.43 1rwh s GLY 599 CO 0.40 0.88 1.13 -1.35 0.00 0.00 0.00 173.10 174.16 1rwh s SER 600 N -2.42 4.35 0.00 1.64 1.04 -1.26 -3.51 113.70 113.54 1rwh s SER 600 Ca 0.67 2.05 0.27 0.00 0.48 0.00 0.00 55.95 59.41 1rwh s SER 600 Cb -0.19 -2.55 0.81 0.00 0.10 0.00 0.00 66.02 64.19 1rwh s SER 600 CO 0.34 -2.15 1.62 0.00 0.98 0.00 0.00 173.24 174.03 1rwh n ALA 601 N -3.15 3.10 -1.65 5.32 0.00 -1.26 -1.01 120.51 121.85 1rwh n ALA 601 Ca 0.11 -0.28 -0.46 0.00 0.00 0.00 0.00 53.44 52.81 1rwh n ALA 601 Cb 0.52 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.70 1rwh n ALA 601 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1rwh n THR 602 N -1.34 0.84 -3.22 0.00 -1.04 -1.26 -4.81 114.28 103.45 1rwh n THR 602 Ca 0.08 -0.21 -0.39 0.00 -2.04 0.00 0.00 64.05 61.48 1rwh n THR 602 Cb 0.33 -1.36 -0.07 0.00 -1.82 0.00 0.00 70.33 67.42 1rwh n THR 602 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1rwh s VAL 603 N 0.01 5.09 -0.09 12.58 1.01 -1.26 -4.17 120.40 133.56 1rwh s VAL 603 Ca 0.70 1.00 -0.06 0.00 0.00 0.00 0.00 61.98 63.63 1rwh s VAL 603 Cb -0.69 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 31.78 1rwh s VAL 603 CO 0.49 0.16 0.15 -1.10 0.00 0.00 0.00 175.10 174.80 1rwh s GLN 604 N 1.70 3.43 -0.08 2.72 -1.52 0.25 -4.92 119.66 121.24 1rwh s GLN 604 Ca 0.25 -0.18 0.03 0.00 -1.95 0.00 0.00 55.36 53.51 1rwh s GLN 604 Cb -0.16 -3.16 0.01 0.00 -0.22 0.00 0.00 33.01 29.48 1rwh s GLN 604 CO 0.10 0.75 -0.17 -1.14 -0.25 0.00 0.00 175.29 174.59 1rwh s GLN 605 N -1.23 2.24 0.01 2.91 0.74 -1.26 -1.13 119.66 121.95 1rwh s GLN 605 Ca 0.18 -0.59 0.00 0.00 0.05 0.00 0.00 55.36 54.99 1rwh s GLN 605 Cb -0.12 -1.79 -0.01 0.00 1.10 0.00 0.00 33.01 32.19 1rwh s GLN 605 CO 0.07 0.06 -0.02 1.03 -0.55 0.00 0.00 175.29 175.88 1rwh s ARG 606 N 0.61 0.22 0.14 1.67 1.81 0.18 -4.91 118.95 118.68 1rwh s ARG 606 Ca -0.15 -0.39 -0.16 0.00 -1.72 0.00 0.00 55.73 53.31 1rwh s ARG 606 Cb -0.16 0.02 -0.07 0.00 -0.45 0.00 0.00 34.95 34.29 1rwh s ARG 606 CO 0.05 -0.02 0.58 -0.80 -0.68 0.00 0.00 175.30 174.43 1rwh s ASN 607 N -0.91 6.91 0.07 0.23 0.01 -0.22 -0.59 114.94 120.45 1rwh s ASN 607 Ca -0.09 1.17 0.05 0.00 -0.71 0.00 0.00 52.86 53.27 1rwh s ASN 607 Cb -0.06 -2.32 -0.03 0.00 0.41 0.00 0.00 41.25 39.25 1rwh s ASN 607 CO -0.01 0.13 -0.13 -0.36 -1.51 0.00 0.00 177.10 175.23 1rwh s PHE 608 N -1.39 1.13 -0.18 2.20 0.40 0.49 0.29 117.98 120.92 1rwh s PHE 608 Ca 0.36 -0.50 -0.07 0.00 -0.60 0.00 0.00 56.93 56.12 1rwh s PHE 608 Cb -0.16 -0.63 -0.04 0.00 0.51 0.00 0.00 43.02 42.70 1rwh s PHE 608 CO 0.19 0.04 0.05 0.00 0.70 0.00 0.00 175.22 176.20 1rwh s ALA 609 N -1.52 3.37 -0.15 5.36 0.00 -0.27 -1.07 121.76 127.49 1rwh s ALA 609 Ca -0.01 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.19 1rwh s ALA 609 Cb -0.09 -1.89 0.04 0.00 0.00 0.00 0.00 23.12 21.18 1rwh s ALA 609 CO 0.02 0.17 -0.05 0.99 0.00 0.00 0.00 175.76 176.89 1rwh s THR 610 N 0.38 1.03 -0.11 0.00 2.01 0.10 -0.64 115.64 118.40 1rwh s THR 610 Ca 0.02 -0.53 0.03 0.00 0.31 0.00 0.00 61.69 61.53 1rwh s THR 610 Cb -0.13 -1.19 -0.00 0.00 0.01 0.00 0.00 72.50 71.19 1rwh s THR 610 CO 0.00 0.16 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.12 1rwh s LEU 611 N 1.68 2.20 0.06 4.42 1.02 -0.06 -0.36 118.68 127.64 1rwh s LEU 611 Ca 0.02 -0.53 -0.16 0.00 0.02 0.00 0.00 54.13 53.48 1rwh s LEU 611 Cb -0.15 -1.45 0.03 0.00 0.02 0.00 0.00 46.19 44.64 1rwh s LEU 611 CO -0.08 0.15 0.37 -0.72 0.02 0.00 0.00 176.35 176.10 1rwh s TYR 612 N 0.42 -0.19 -0.13 0.29 -0.85 0.10 -0.54 117.35 116.45 1rwh s TYR 612 Ca -0.16 0.05 -0.06 0.00 -0.52 0.00 0.00 57.07 56.38 1rwh s TYR 612 Cb -0.17 0.19 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 1rwh s TYR 612 CO 0.07 -0.59 0.11 0.08 -1.52 0.00 0.00 175.55 173.70 1rwh s VAL 613 N -2.87 5.23 -0.34 -3.49 1.01 0.06 -0.69 120.40 119.30 1rwh s VAL 613 Ca -0.03 0.11 -0.10 0.00 0.00 0.00 0.00 61.98 61.96 1rwh s VAL 613 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 36.38 33.11 1rwh s VAL 613 CO -0.05 0.59 0.17 0.21 0.00 0.00 0.00 175.10 176.01 1rwh s ASN 614 N -0.78 5.57 0.00 3.32 3.84 -1.26 -1.26 114.94 124.37 1rwh s ASN 614 Ca 0.13 -0.84 0.29 0.00 0.21 0.00 0.00 52.86 52.66 1rwh s ASN 614 Cb -0.12 -1.99 1.35 0.00 -0.55 0.00 0.00 41.25 39.95 1rwh s ASN 614 CO 0.03 -0.30 1.96 1.41 -2.79 0.00 0.00 177.10 177.41 1rwh n HIS 615 N 4.96 0.00 -2.50 0.43 8.25 0.40 -5.00 115.22 121.77 1rwh n HIS 615 Ca -0.13 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.34 1rwh n HIS 615 Cb 0.47 -0.35 -0.00 0.00 1.12 0.00 0.00 29.99 31.23 1rwh n HIS 615 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rwh n GLY 616 N 1.37 -2.10 3.79 -1.41 0.00 -1.23 -4.43 105.19 101.18 1rwh n GLY 616 Ca 0.11 -1.44 -0.37 0.00 0.00 0.00 0.00 46.02 44.32 1rwh n GLY 616 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rwh s VAL 617 N -0.44 4.31 -1.41 1.61 1.01 -1.26 -2.39 120.40 121.82 1rwh s VAL 617 Ca 0.00 1.69 -0.07 0.00 0.00 0.00 0.00 61.98 63.60 1rwh s VAL 617 Cb 0.00 -4.01 0.04 0.00 0.00 0.00 0.00 36.38 32.41 1rwh s VAL 617 CO 0.00 0.22 0.89 0.61 0.00 0.00 0.00 175.10 176.83 1rwh n GLY 618 N 0.77 -0.41 3.72 4.51 0.00 -1.26 -4.92 105.19 107.60 1rwh n GLY 618 Ca -0.00 0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1rwh n GLY 618 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rwh n PRO 619 N -4.53 2.28 -3.92 1.61 -0.04 -1.26 -4.98 135.00 124.15 1rwh n PRO 619 Ca -0.11 0.80 -0.35 0.00 -0.04 0.00 0.00 63.50 63.80 1rwh n PRO 619 Cb 0.60 -2.43 -0.14 0.00 -0.04 0.00 0.00 33.50 31.49 1rwh n PRO 619 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1rwh s VAL 620 N -1.07 3.04 -1.36 0.52 1.01 -1.26 -4.46 120.40 116.81 1rwh s VAL 620 Ca 0.55 -1.06 -0.00 0.00 0.00 0.00 0.00 61.98 61.46 1rwh s VAL 620 Cb -0.54 -2.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.24 1rwh s VAL 620 CO 0.62 0.11 0.54 0.00 0.00 0.00 0.00 175.10 176.38 1rwh n ALA 621 N 4.68 -2.02 -0.97 5.51 0.00 -1.15 -4.92 120.51 121.64 1rwh n ALA 621 Ca -0.15 -0.23 -0.31 0.00 0.00 0.00 0.00 53.44 52.75 1rwh n ALA 621 Cb 0.46 -1.71 0.14 0.00 0.00 0.00 0.00 19.45 18.35 1rwh n ALA 621 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rwh s GLY 622 N -4.36 1.66 0.19 0.00 0.00 0.03 -4.36 107.32 100.48 1rwh s GLY 622 Ca 0.01 0.32 -0.13 0.00 0.00 0.00 0.00 44.72 44.91 1rwh s GLY 622 CO 0.86 0.74 0.42 -1.35 0.00 0.00 0.00 173.10 173.77 1rwh s SER 623 N -3.04 -0.12 0.15 1.64 1.04 -1.26 -1.09 113.70 111.02 1rwh s SER 623 Ca 0.64 -0.69 -0.10 0.00 0.48 0.00 0.00 55.95 56.28 1rwh s SER 623 Cb -0.20 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1rwh s SER 623 CO 0.58 -1.00 0.30 -0.72 0.98 0.00 0.00 173.24 173.37 1rwh s TYR 624 N -3.93 0.23 -0.29 5.02 -0.85 -0.45 -4.94 117.35 112.15 1rwh s TYR 624 Ca 0.14 -0.61 -0.06 0.00 -0.52 0.00 0.00 57.07 56.02 1rwh s TYR 624 Cb 0.01 0.02 0.15 0.00 0.38 0.00 0.00 41.96 42.51 1rwh s TYR 624 CO -0.00 -0.70 0.59 0.00 -1.52 0.00 0.00 175.55 173.92 1rwh s ALA 625 N -3.92 -1.96 0.29 9.51 0.00 -1.26 -0.87 121.76 123.55 1rwh s ALA 625 Ca 0.12 1.96 -0.10 0.00 0.00 0.00 0.00 51.96 53.94 1rwh s ALA 625 Cb 0.03 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 21.28 1rwh s ALA 625 CO -0.04 -1.09 0.50 1.52 0.00 0.00 0.00 175.76 176.65 1rwh s TYR 626 N 2.83 0.54 0.04 0.00 -0.85 -0.44 -0.70 117.35 118.78 1rwh s TYR 626 Ca 0.06 -0.90 -0.02 0.00 -0.52 0.00 0.00 57.07 55.69 1rwh s TYR 626 Cb -0.13 0.17 -0.03 0.00 0.38 0.00 0.00 41.96 42.35 1rwh s TYR 626 CO -0.19 -1.08 0.01 0.00 -1.52 0.00 0.00 175.55 172.77 1rwh s MET 627 N -3.58 0.54 -0.04 -3.49 0.23 0.36 -0.19 119.30 113.13 1rwh s MET 627 Ca 0.24 -0.93 0.05 0.00 -1.03 0.00 0.00 55.69 54.02 1rwh s MET 627 Cb -0.01 0.20 -0.00 0.00 -1.53 0.00 0.00 34.83 33.48 1rwh s MET 627 CO 0.12 -0.11 -0.18 0.08 -2.03 0.00 0.00 175.02 172.90 1rwh s VAL 628 N -2.95 1.53 -0.59 5.16 1.01 -0.04 -1.48 120.40 123.04 1rwh s VAL 628 Ca -0.02 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.23 1rwh s VAL 628 Cb 0.01 -1.31 0.18 0.00 0.00 0.00 0.00 36.38 35.25 1rwh s VAL 628 CO -0.06 0.44 0.45 0.00 0.00 0.00 0.00 175.10 175.93 1rwh n ALA 629 N 3.10 3.22 -1.76 5.51 0.00 0.52 -1.36 120.51 129.73 1rwh n ALA 629 Ca -0.18 -3.98 -0.41 0.00 0.00 0.00 0.00 53.44 48.87 1rwh n ALA 629 Cb 0.53 -0.91 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 1rwh n ALA 629 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1rwh s PRO 630 N -0.95 4.12 0.00 0.00 0.04 -1.26 -1.50 135.00 135.45 1rwh s PRO 630 Ca 0.29 2.58 0.00 0.00 0.04 0.00 0.00 61.00 63.91 1rwh s PRO 630 Cb 0.00 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1rwh s PRO 630 CO -0.17 -0.63 0.00 0.41 0.04 0.00 0.00 177.00 176.65 1rwh n GLY 631 N 2.07 1.93 3.76 0.56 0.00 0.82 -4.91 105.19 109.41 1rwh n GLY 631 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1rwh n GLY 631 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh s ALA 632 N -3.02 3.50 0.95 4.61 0.00 -0.87 -4.87 121.76 122.06 1rwh s ALA 632 Ca 0.00 1.15 -0.12 0.00 0.00 0.00 0.00 51.96 52.99 1rwh s ALA 632 Cb 0.00 -3.45 0.16 0.00 0.00 0.00 0.00 23.12 19.83 1rwh s ALA 632 CO 0.00 -0.52 1.09 -1.54 0.00 0.00 0.00 175.76 174.79 1rwh s SER 633 N -0.26 3.01 0.25 0.00 1.04 -1.26 -4.16 113.70 112.32 1rwh s SER 633 Ca 0.51 1.30 -0.04 0.00 0.48 0.00 0.00 55.95 58.19 1rwh s SER 633 Cb -0.37 -1.97 0.38 0.00 0.10 0.00 0.00 66.02 64.16 1rwh s SER 633 CO 0.46 -2.91 1.83 0.58 0.98 0.00 0.00 173.24 174.18 1rwh h VAL 634 N -1.74 0.96 -0.44 5.02 2.07 -1.96 -0.22 116.25 119.95 1rwh h VAL 634 Ca -0.52 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 66.61 1rwh h VAL 634 Cb 1.31 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1rwh h VAL 634 CO 0.57 0.16 -0.07 0.44 0.02 0.00 0.00 177.57 178.68 1rwh h ASP 635 N 0.87 0.83 0.14 0.57 3.32 -1.99 -0.05 116.42 120.11 1rwh h ASP 635 Ca 0.40 -0.35 -0.16 0.00 0.02 0.00 0.00 57.03 56.94 1rwh h ASP 635 Cb 0.30 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1rwh h ASP 635 CO -0.22 0.98 -0.57 0.25 -1.72 0.00 0.00 179.24 177.96 1rwh h LEU 636 N 0.67 0.51 -0.26 1.55 5.85 -1.84 -2.94 115.31 118.85 1rwh h LEU 636 Ca 0.12 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 1rwh h LEU 636 Cb 0.60 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1rwh h LEU 636 CO 0.04 0.97 0.09 0.74 -0.34 0.00 0.00 178.44 179.94 1rwh h THR 637 N 0.34 1.18 -0.78 1.05 2.02 -0.50 -2.17 112.91 114.05 1rwh h THR 637 Ca 0.00 -0.57 0.20 0.00 0.77 0.00 0.00 66.41 66.81 1rwh h THR 637 Cb 1.11 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 68.55 1rwh h THR 637 CO 0.10 0.19 0.54 -0.09 0.37 0.00 0.00 175.52 176.63 1rwh h ARG 638 N 0.26 0.18 -0.00 6.66 2.43 -0.97 -2.43 114.38 120.50 1rwh h ARG 638 Ca 0.08 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1rwh h ARG 638 Cb 0.21 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1rwh h ARG 638 CO -0.01 0.12 -0.42 1.63 -1.51 0.00 0.00 179.97 179.79 1rwh n LYS 639 N -4.40 0.36 -0.28 0.20 5.02 -0.87 -4.55 118.16 113.64 1rwh n LYS 639 Ca 0.16 -0.21 0.04 0.00 -2.02 0.00 0.00 58.31 56.28 1rwh n LYS 639 Cb 0.73 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 34.43 1rwh n LYS 639 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1rwh h LEU 640 N 0.52 0.54 -0.52 -0.35 3.38 -0.91 -1.62 115.31 116.35 1rwh h LEU 640 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1rwh h LEU 640 Cb 0.51 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1rwh h LEU 640 CO 0.00 0.27 0.00 0.18 0.09 0.00 0.00 178.44 178.98 1rwh n LEU 641 N -4.84 0.78 -4.90 1.67 4.77 -1.26 -4.59 117.00 108.64 1rwh n LEU 641 Ca 0.14 -0.34 -0.34 0.00 -0.03 0.00 0.00 56.01 55.44 1rwh n LEU 641 Cb 0.35 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.33 1rwh n LEU 641 CO 0.24 0.17 -0.14 -1.61 -1.33 0.00 0.00 177.39 174.71 1rwh s GLU 642 N -1.88 3.46 -0.01 3.23 0.41 -0.61 -4.51 118.70 118.79 1rwh s GLU 642 Ca 0.26 -0.25 0.00 0.00 -0.41 0.00 0.00 54.97 54.57 1rwh s GLU 642 Cb 0.13 -3.11 0.00 0.00 -1.78 0.00 0.00 34.13 29.37 1rwh s GLU 642 CO 0.20 0.69 0.00 0.41 -0.49 0.00 0.00 175.26 176.07 1rwh n GLY 643 N 1.14 0.47 4.00 -1.39 0.00 -1.26 -3.68 105.19 104.47 1rwh n GLY 643 Ca -0.12 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1rwh n GLY 643 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rwh n ASN 644 N 0.28 -2.30 -0.13 1.61 5.15 -1.26 -4.85 115.26 113.75 1rwh n ASN 644 Ca -0.00 -0.94 -0.04 0.00 -0.60 0.00 0.00 54.58 53.01 1rwh n ASN 644 Cb 0.02 -3.26 0.17 0.00 -0.53 0.00 0.00 39.78 36.18 1rwh n ASN 644 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1rwh h LYS 645 N -1.80 0.85 -3.39 1.20 1.57 -1.81 -3.37 116.57 109.81 1rwh h LYS 645 Ca -0.61 -0.19 -0.63 0.00 -1.87 0.00 0.00 60.65 57.35 1rwh h LYS 645 Cb 1.38 -0.12 -0.41 0.00 0.08 0.00 0.00 32.23 33.16 1rwh h LYS 645 CO 0.68 0.78 -0.67 0.71 -0.57 0.00 0.00 179.45 180.37 1rwh s TYR 646 N -5.16 2.82 -0.54 -1.35 1.51 -1.26 -1.25 117.35 112.13 1rwh s TYR 646 Ca -0.10 -2.88 -0.18 0.00 -1.01 0.00 0.00 57.07 52.90 1rwh s TYR 646 Cb 0.15 -2.51 0.09 0.00 -0.11 0.00 0.00 41.96 39.58 1rwh s TYR 646 CO 0.81 -0.78 0.58 0.45 -1.11 0.00 0.00 175.55 175.50 1rwh s SER 647 N 0.08 6.19 0.14 2.29 0.15 -0.34 -4.94 113.70 117.27 1rwh s SER 647 Ca 0.16 -1.39 -0.31 0.00 0.70 0.00 0.00 55.95 55.11 1rwh s SER 647 Cb -0.25 -2.25 -0.09 0.00 -1.71 0.00 0.00 66.02 61.72 1rwh s SER 647 CO -0.02 -0.92 1.53 -0.69 1.20 0.00 0.00 173.24 174.35 1rwh s VAL 648 N 2.21 2.83 -0.26 4.45 1.01 -1.26 -0.79 120.40 128.59 1rwh s VAL 648 Ca 0.09 0.57 -0.14 0.00 0.00 0.00 0.00 61.98 62.49 1rwh s VAL 648 Cb -0.25 -3.37 -0.14 0.00 0.00 0.00 0.00 36.38 32.63 1rwh s VAL 648 CO 0.07 0.04 -0.24 -0.38 0.00 0.00 0.00 175.10 174.58 1rwh n ILE 649 N 4.05 1.53 -3.65 2.22 5.41 0.05 -4.95 119.36 124.03 1rwh n ILE 649 Ca 0.13 -0.34 -0.15 0.00 1.00 0.00 0.00 62.75 63.39 1rwh n ILE 649 Cb 0.40 -1.88 -0.08 0.00 -0.71 0.00 0.00 39.64 37.37 1rwh n ILE 649 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1rwh s ARG 650 N -2.49 0.83 -0.48 0.38 3.52 -1.17 -4.74 118.95 114.80 1rwh s ARG 650 Ca -0.37 0.11 0.06 0.00 -0.13 0.00 0.00 55.73 55.40 1rwh s ARG 650 Cb 0.13 0.39 0.18 0.00 -1.56 0.00 0.00 34.95 34.09 1rwh s ARG 650 CO 0.52 -0.23 0.60 1.21 -0.81 0.00 0.00 175.30 176.58 1rwh s ASN 651 N -1.09 -0.51 0.00 -2.12 2.47 -1.23 -0.88 114.94 111.59 1rwh s ASN 651 Ca -0.11 -2.12 0.00 0.00 0.42 0.00 0.00 52.86 51.05 1rwh s ASN 651 Cb -0.03 1.15 0.00 0.00 -1.45 0.00 0.00 41.25 40.92 1rwh s ASN 651 CO 0.06 -0.09 0.00 -0.90 -3.72 0.00 0.00 177.10 172.45 1rwh n ASP 652 N 2.98 0.00 0.13 -4.21 5.68 -0.68 -4.86 116.55 115.58 1rwh n ASP 652 Ca 0.21 -0.90 0.12 0.00 -0.50 0.00 0.00 54.79 53.72 1rwh n ASP 652 Cb 0.53 0.00 0.49 0.00 -1.14 0.00 0.00 41.12 41.01 1rwh n ASP 652 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rwh n ALA 653 N -3.00 1.60 -0.06 2.12 0.00 -1.26 -2.96 120.51 116.95 1rwh n ALA 653 Ca 0.00 0.09 -0.19 0.00 0.00 0.00 0.00 53.44 53.34 1rwh n ALA 653 Cb 0.00 -1.38 -0.13 0.00 0.00 0.00 0.00 19.45 17.95 1rwh n ALA 653 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1rwh h THR 654 N 0.00 1.22 -2.86 0.00 2.02 -1.95 -3.40 112.91 107.94 1rwh h THR 654 Ca 0.00 -2.29 -0.03 0.00 0.77 0.00 0.00 66.41 64.85 1rwh h THR 654 Cb 0.33 2.72 -0.13 0.00 -1.74 0.00 0.00 68.15 69.32 1rwh h THR 654 CO 0.00 0.51 0.17 0.00 0.37 0.00 0.00 175.52 176.57 1rwh s ALA 655 N -2.35 -1.55 -0.04 6.16 0.00 -1.16 -0.65 121.76 122.18 1rwh s ALA 655 Ca -0.23 0.58 0.02 0.00 0.00 0.00 0.00 51.96 52.32 1rwh s ALA 655 Cb 0.03 0.70 0.02 0.00 0.00 0.00 0.00 23.12 23.86 1rwh s ALA 655 CO 0.67 -0.68 -0.07 -0.65 0.00 0.00 0.00 175.76 175.03 1rwh s GLN 656 N -3.26 1.05 -0.11 0.00 -0.21 -0.17 -1.69 119.66 115.27 1rwh s GLN 656 Ca -0.01 -0.21 -0.21 0.00 0.02 0.00 0.00 55.36 54.95 1rwh s GLN 656 Cb -0.01 -0.97 0.05 0.00 1.00 0.00 0.00 33.01 33.08 1rwh s GLN 656 CO -0.08 -0.02 0.51 0.45 -2.12 0.00 0.00 175.29 174.03 1rwh s SER 657 N 0.71 -0.49 0.01 5.90 0.15 -0.06 -0.70 113.70 119.23 1rwh s SER 657 Ca -0.11 0.74 -0.01 0.00 0.70 0.00 0.00 55.95 57.27 1rwh s SER 657 Cb -0.14 0.75 -0.01 0.00 -1.71 0.00 0.00 66.02 64.92 1rwh s SER 657 CO 0.01 -0.36 0.00 0.54 1.20 0.00 0.00 173.24 174.64 1rwh s VAL 658 N -0.50 0.06 -0.15 4.45 0.11 -0.65 -0.77 120.40 122.96 1rwh s VAL 658 Ca -0.06 -0.52 -0.05 0.00 -2.93 0.00 0.00 61.98 58.42 1rwh s VAL 658 Cb -0.03 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.60 1rwh s VAL 658 CO 0.04 -0.29 0.01 -0.70 -3.33 0.00 0.00 175.10 170.83 1rwh s GLU 659 N -0.85 3.65 -0.49 1.54 2.12 0.03 -1.04 118.70 123.65 1rwh s GLU 659 Ca -0.09 -0.42 -0.20 0.00 0.36 0.00 0.00 54.97 54.61 1rwh s GLU 659 Cb -0.06 -3.01 0.05 0.00 0.26 0.00 0.00 34.13 31.37 1rwh s GLU 659 CO -0.00 0.36 0.66 -0.06 -0.54 0.00 0.00 175.26 175.67 1rwh s PHE 660 N 0.09 3.03 0.08 5.30 0.40 0.17 -1.20 117.98 125.84 1rwh s PHE 660 Ca 0.02 -0.34 -0.26 0.00 -0.60 0.00 0.00 56.93 55.76 1rwh s PHE 660 Cb -0.13 -3.52 -0.16 0.00 0.51 0.00 0.00 43.02 39.71 1rwh s PHE 660 CO 0.02 -1.01 1.68 -0.22 0.70 0.00 0.00 175.22 176.39 1rwh h LYS 661 N 8.99 -0.25 -0.62 0.44 3.64 -1.42 -1.22 116.57 126.14 1rwh h LYS 661 Ca -0.27 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.10 1rwh h LYS 661 Cb 1.09 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 1rwh h LYS 661 CO 0.95 -0.15 0.27 1.15 -2.27 0.00 0.00 179.45 179.41 1rwh h THR 662 N -0.28 1.22 0.00 1.00 2.02 -1.93 -1.98 112.91 112.96 1rwh h THR 662 Ca -0.03 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.49 1rwh h THR 662 Cb 0.21 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1rwh h THR 662 CO 0.04 0.27 0.00 0.00 0.37 0.00 0.00 175.52 176.20 1rwh n ALA 663 N -2.36 2.51 -4.13 6.16 0.00 -1.19 -4.91 120.51 116.60 1rwh n ALA 663 Ca 0.04 -0.15 -0.30 0.00 0.00 0.00 0.00 53.44 53.03 1rwh n ALA 663 Cb 0.15 -1.49 -0.05 0.00 0.00 0.00 0.00 19.45 18.06 1rwh n ALA 663 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1rwh n LYS 664 N -1.23 -2.54 -3.97 0.00 5.02 -0.49 -4.95 118.16 110.00 1rwh n LYS 664 Ca 0.16 0.30 -0.14 0.00 -2.02 0.00 0.00 58.31 56.61 1rwh n LYS 664 Cb 0.21 -4.41 -0.15 0.00 -0.02 0.00 0.00 35.03 30.67 1rwh n LYS 664 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1rwh s THR 665 N -3.90 0.16 -0.02 -0.18 2.01 -1.02 -4.24 115.64 108.45 1rwh s THR 665 Ca 0.19 -0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.19 1rwh s THR 665 Cb -0.10 -0.17 -0.03 0.00 0.01 0.00 0.00 72.50 72.21 1rwh s THR 665 CO 0.93 0.07 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.89 1rwh s THR 666 N 0.20 3.00 0.05 -0.82 2.01 -0.47 -0.65 115.64 118.96 1rwh s THR 666 Ca -0.02 -0.86 0.06 0.00 0.31 0.00 0.00 61.69 61.19 1rwh s THR 666 Cb -0.04 -2.20 -0.02 0.00 0.01 0.00 0.00 72.50 70.25 1rwh s THR 666 CO -0.01 0.51 -0.17 0.00 -0.69 0.00 0.00 174.62 174.26 1rwh s ALA 667 N -0.80 1.47 -0.03 7.40 0.00 -0.21 -0.77 121.76 128.83 1rwh s ALA 667 Ca 0.13 -0.97 -0.18 0.00 0.00 0.00 0.00 51.96 50.94 1rwh s ALA 667 Cb -0.11 -0.25 0.03 0.00 0.00 0.00 0.00 23.12 22.80 1rwh s ALA 667 CO 0.02 0.30 0.38 0.00 0.00 0.00 0.00 175.76 176.47 1rwh s ALA 668 N -0.88 -0.97 -0.01 0.00 0.00 0.44 -1.64 121.76 118.70 1rwh s ALA 668 Ca 0.04 0.54 0.08 0.00 0.00 0.00 0.00 51.96 52.62 1rwh s ALA 668 Cb -0.09 0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1rwh s ALA 668 CO 0.02 -0.28 -0.24 0.95 0.00 0.00 0.00 175.76 176.21 1rwh s THR 669 N -1.25 1.90 -0.13 0.00 -4.23 0.12 -0.88 115.64 111.18 1rwh s THR 669 Ca -0.13 -1.06 0.02 0.00 -1.18 0.00 0.00 61.69 59.34 1rwh s THR 669 Cb -0.04 -1.59 0.00 0.00 1.34 0.00 0.00 72.50 72.22 1rwh s THR 669 CO 0.05 0.50 -0.21 -0.36 -0.54 0.00 0.00 174.62 174.07 1rwh s PHE 670 N -0.59 2.66 -0.18 3.99 0.40 -0.01 -1.00 117.98 123.26 1rwh s PHE 670 Ca 0.09 -1.17 0.12 0.00 -0.60 0.00 0.00 56.93 55.38 1rwh s PHE 670 Cb -0.09 -1.80 -0.23 0.00 0.51 0.00 0.00 43.02 41.41 1rwh s PHE 670 CO -0.01 -0.51 0.15 0.91 0.70 0.00 0.00 175.22 176.46 1rwh n TRP 671 N 3.87 0.28 -4.20 0.36 7.02 0.18 -2.55 117.44 122.40 1rwh n TRP 671 Ca -0.19 0.09 -0.12 0.00 -1.02 0.00 0.00 57.50 56.25 1rwh n TRP 671 Cb 0.52 -1.05 -0.10 0.00 -2.42 0.00 0.00 31.31 28.26 1rwh n TRP 671 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1rwh s LYS 672 N -2.52 0.98 0.33 -0.99 1.02 -1.03 -4.59 119.74 112.94 1rwh s LYS 672 Ca -0.15 -1.44 -0.29 0.00 0.02 0.00 0.00 55.97 54.11 1rwh s LYS 672 Cb 0.07 -0.22 -0.11 0.00 -0.52 0.00 0.00 37.83 37.05 1rwh s LYS 672 CO 0.78 -0.09 1.56 -2.30 -0.92 0.00 0.00 175.35 174.38 1rwh n PRO 673 N -0.15 2.71 -3.91 -1.68 -0.02 -1.26 -4.68 135.00 126.01 1rwh n PRO 673 Ca -0.09 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1rwh n PRO 673 Cb 0.62 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 1rwh n PRO 673 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rwh n GLY 674 N 1.44 -1.71 3.35 -1.23 0.00 -0.77 -4.99 105.19 101.28 1rwh n GLY 674 Ca 0.05 -1.22 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 1rwh n GLY 674 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rwh s MET 675 N -1.86 2.02 -0.30 1.61 -1.94 -1.26 -1.41 119.30 116.16 1rwh s MET 675 Ca 0.00 -0.98 0.02 0.00 -1.71 0.00 0.00 55.69 53.02 1rwh s MET 675 Cb 0.00 -2.06 0.09 0.00 2.01 0.00 0.00 34.83 34.86 1rwh s MET 675 CO 0.00 0.55 0.01 0.00 -0.01 0.00 0.00 175.02 175.57 1rwh s ALA 676 N -0.73 2.41 0.00 3.03 0.00 0.75 -4.89 121.76 122.34 1rwh s ALA 676 Ca 0.11 -2.02 0.00 0.00 0.00 0.00 0.00 51.96 50.05 1rwh s ALA 676 Cb -0.10 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.28 1rwh s ALA 676 CO 0.01 -1.51 0.00 0.41 0.00 0.00 0.00 175.76 174.67 1rwh n GLY 677 N 4.47 2.35 1.48 0.00 0.00 -1.26 -2.04 105.19 110.19 1rwh n GLY 677 Ca -0.03 -0.33 0.10 0.00 0.00 0.00 0.00 46.02 45.76 1rwh n GLY 677 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rwh n ASP 678 N 5.93 4.36 -4.60 1.61 5.75 -1.26 -4.85 116.55 123.48 1rwh n ASP 678 Ca 0.00 -2.26 -0.34 0.00 -0.01 0.00 0.00 54.79 52.17 1rwh n ASP 678 Cb 0.00 -0.54 -0.10 0.00 -1.03 0.00 0.00 41.12 39.45 1rwh n ASP 678 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1rwh s LEU 679 N -1.48 3.71 0.24 -2.12 2.96 -0.87 -3.26 118.68 117.87 1rwh s LEU 679 Ca 0.49 0.04 0.11 0.00 -0.22 0.00 0.00 54.13 54.55 1rwh s LEU 679 Cb 0.29 -1.94 -0.05 0.00 0.50 0.00 0.00 46.19 45.00 1rwh s LEU 679 CO 0.28 0.16 -0.15 -0.83 -1.32 0.00 0.00 176.35 174.49 1rwh s GLY 680 N 0.44 1.78 0.02 7.98 0.00 -0.25 -0.17 107.32 117.11 1rwh s GLY 680 Ca 0.02 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 43.02 1rwh s GLY 680 CO 0.01 -1.78 -0.03 0.00 0.00 0.00 0.00 173.10 171.30 1rwh s ALA 681 N -2.18 0.15 -1.29 3.20 0.00 -0.50 -0.89 121.76 120.25 1rwh s ALA 681 Ca 0.28 -0.45 0.29 0.00 0.00 0.00 0.00 51.96 52.08 1rwh s ALA 681 Cb -0.06 0.09 1.28 0.00 0.00 0.00 0.00 23.12 24.42 1rwh s ALA 681 CO 0.15 -0.09 1.92 -1.13 0.00 0.00 0.00 175.76 176.61 1rwh n SER 682 N 2.01 0.14 -1.77 0.00 3.41 -0.25 -1.84 113.62 115.32 1rwh n SER 682 Ca -0.20 -0.02 0.01 0.00 -0.26 0.00 0.00 58.87 58.39 1rwh n SER 682 Cb 0.56 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 1rwh n SER 682 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rwh n GLY 683 N 1.38 0.60 3.54 5.00 0.00 -1.26 -4.41 105.19 110.03 1rwh n GLY 683 Ca 0.11 -0.91 -0.49 0.00 0.00 0.00 0.00 46.02 44.74 1rwh n GLY 683 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1rwh n PRO 684 N -0.25 0.87 -3.57 1.61 -0.02 -1.26 -4.75 135.00 127.64 1rwh n PRO 684 Ca 0.01 0.31 -0.14 0.00 -2.02 0.00 0.00 63.50 61.66 1rwh n PRO 684 Cb 0.16 -1.68 -0.06 0.00 -0.02 0.00 0.00 33.50 31.90 1rwh n PRO 684 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rwh s ALA 685 N -0.52 -1.86 -0.12 3.55 0.00 -1.06 -4.41 121.76 117.33 1rwh s ALA 685 Ca 0.70 1.55 -0.00 0.00 0.00 0.00 0.00 51.96 54.20 1rwh s ALA 685 Cb -0.87 -0.55 -0.02 0.00 0.00 0.00 0.00 23.12 21.67 1rwh s ALA 685 CO 0.55 -0.33 -0.11 0.00 0.00 0.00 0.00 175.76 175.88 1rwh s VAL 687 N 0.13 0.24 -0.06 0.00 1.01 -0.06 -1.40 120.40 120.26 1rwh s VAL 687 Ca -0.05 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 61.85 1rwh s VAL 687 Cb -0.15 -0.22 0.01 0.00 0.00 0.00 0.00 36.38 36.02 1rwh s VAL 687 CO 0.04 0.08 -0.14 -0.69 0.00 0.00 0.00 175.10 174.39 1rwh s VAL 688 N 0.05 1.24 0.05 2.92 1.01 -0.35 -0.42 120.40 124.89 1rwh s VAL 688 Ca -0.00 -0.57 -0.00 0.00 0.00 0.00 0.00 61.98 61.41 1rwh s VAL 688 Cb -0.03 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1rwh s VAL 688 CO -0.00 0.37 -0.04 0.72 0.00 0.00 0.00 175.10 176.15 1rwh s PHE 689 N 0.39 0.51 -0.22 5.22 -0.12 0.05 -0.48 117.98 123.34 1rwh s PHE 689 Ca -0.10 -0.88 -0.14 0.00 -0.05 0.00 0.00 56.93 55.76 1rwh s PHE 689 Cb -0.14 -0.36 0.06 0.00 -0.63 0.00 0.00 43.02 41.96 1rwh s PHE 689 CO 0.03 -0.28 0.54 0.45 -0.05 0.00 0.00 175.22 175.91 1rwh s SER 690 N -2.49 -0.68 -0.08 1.98 0.15 -0.32 -1.37 113.70 110.90 1rwh s SER 690 Ca 0.01 1.16 -0.12 0.00 0.70 0.00 0.00 55.95 57.70 1rwh s SER 690 Cb 0.02 1.07 -0.05 0.00 -1.71 0.00 0.00 66.02 65.35 1rwh s SER 690 CO -0.06 -0.21 0.28 -0.60 1.20 0.00 0.00 173.24 173.85 1rwh s ARG 691 N 1.19 3.82 -0.32 5.44 3.52 -1.26 -0.86 118.95 130.48 1rwh s ARG 691 Ca -0.07 0.14 0.00 0.00 -0.13 0.00 0.00 55.73 55.68 1rwh s ARG 691 Cb -0.06 -3.26 0.10 0.00 -1.56 0.00 0.00 34.95 30.18 1rwh s ARG 691 CO -0.12 0.62 0.09 -1.01 -0.81 0.00 0.00 175.30 174.08 1rwh s HIS 692 N -0.72 2.19 0.00 5.12 3.76 0.05 -5.00 115.29 120.69 1rwh s HIS 692 Ca 0.19 -2.07 0.00 0.00 -0.15 0.00 0.00 55.06 53.03 1rwh s HIS 692 Cb -0.14 -2.00 0.00 0.00 1.11 0.00 0.00 32.58 31.54 1rwh s HIS 692 CO 0.08 -0.89 0.00 0.41 -0.85 0.00 0.00 174.74 173.49 1rwh n GLY 693 N 4.64 4.33 1.44 -2.22 0.00 -1.26 -1.37 105.19 110.75 1rwh n GLY 693 Ca -0.00 0.13 0.02 0.00 0.00 0.00 0.00 46.02 46.17 1rwh n GLY 693 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rwh n ASN 694 N 8.57 3.99 -4.03 1.61 6.94 -1.26 -4.88 115.26 126.20 1rwh n ASN 694 Ca 0.00 -2.64 -0.23 0.00 -0.02 0.00 0.00 54.58 51.69 1rwh n ASN 694 Cb 0.00 -0.63 -0.16 0.00 -2.36 0.00 0.00 39.78 36.63 1rwh n ASN 694 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1rwh s GLU 695 N -2.13 1.36 -0.19 -3.83 2.02 -0.47 -1.35 118.70 114.10 1rwh s GLU 695 Ca 0.35 -0.39 -0.04 0.00 0.02 0.00 0.00 54.97 54.91 1rwh s GLU 695 Cb 0.27 -1.19 -0.02 0.00 0.10 0.00 0.00 34.13 33.29 1rwh s GLU 695 CO 0.10 0.10 -0.03 -1.17 0.02 0.00 0.00 175.26 174.28 1rwh s LEU 696 N 0.36 3.08 -0.13 1.80 2.96 0.16 -0.77 118.68 126.14 1rwh s LEU 696 Ca -0.08 -0.27 -0.06 0.00 -0.22 0.00 0.00 54.13 53.51 1rwh s LEU 696 Cb -0.12 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1rwh s LEU 696 CO 0.02 0.06 0.11 -0.44 -1.32 0.00 0.00 176.35 174.78 1rwh s SER 697 N 0.99 6.08 0.01 3.68 0.01 -0.04 -0.59 113.70 123.83 1rwh s SER 697 Ca 0.01 0.35 0.01 0.00 1.31 0.00 0.00 55.95 57.63 1rwh s SER 697 Cb -0.15 -1.95 -0.01 0.00 0.21 0.00 0.00 66.02 64.13 1rwh s SER 697 CO 0.01 0.36 -0.05 -0.76 0.41 0.00 0.00 173.24 173.21 1rwh s LEU 698 N -0.75 2.11 -0.07 2.44 1.02 0.16 -1.18 118.68 122.42 1rwh s LEU 698 Ca 0.13 -0.27 0.05 0.00 0.02 0.00 0.00 54.13 54.06 1rwh s LEU 698 Cb -0.12 -0.14 -0.01 0.00 0.02 0.00 0.00 46.19 45.94 1rwh s LEU 698 CO 0.03 -0.08 -0.22 0.00 0.02 0.00 0.00 176.35 176.10 1rwh s ALA 699 N -0.65 2.28 -0.01 4.21 0.00 0.37 -0.93 121.76 127.03 1rwh s ALA 699 Ca -0.04 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1rwh s ALA 699 Cb -0.05 -0.78 0.01 0.00 0.00 0.00 0.00 23.12 22.30 1rwh s ALA 699 CO -0.00 0.41 -0.02 0.08 0.00 0.00 0.00 175.76 176.23 1rwh s VAL 700 N -0.15 0.20 0.18 0.00 1.01 -0.35 -1.22 120.40 120.08 1rwh s VAL 700 Ca -0.03 -0.04 0.08 0.00 0.00 0.00 0.00 61.98 61.98 1rwh s VAL 700 Cb -0.14 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 1rwh s VAL 700 CO 0.04 0.09 -0.15 -0.94 0.00 0.00 0.00 175.10 174.13 1rwh s SER 701 N 0.33 2.49 -0.75 3.32 1.04 -0.50 -0.69 113.70 118.95 1rwh s SER 701 Ca -0.03 -0.93 -0.05 0.00 0.48 0.00 0.00 55.95 55.41 1rwh s SER 701 Cb -0.06 -0.13 0.19 0.00 0.10 0.00 0.00 66.02 66.13 1rwh s SER 701 CO -0.01 -0.13 0.61 -0.70 0.98 0.00 0.00 173.24 174.00 1rwh s GLU 702 N -3.22 3.01 0.11 4.02 -6.30 -1.26 -1.80 118.70 113.27 1rwh s GLU 702 Ca 0.18 -2.73 0.25 0.00 -2.50 0.00 0.00 54.97 50.17 1rwh s GLU 702 Cb -0.03 -3.96 0.96 0.00 0.00 0.00 0.00 34.13 31.10 1rwh s GLU 702 CO 0.06 -1.22 1.77 -0.35 0.02 0.00 0.00 175.26 175.54 1rwh n PRO 703 N 3.27 0.12 0.22 4.30 -0.04 -1.26 -2.51 135.00 139.11 1rwh n PRO 703 Ca 0.13 0.18 0.10 0.00 -0.04 0.00 0.00 63.50 63.86 1rwh n PRO 703 Cb 0.40 -1.67 0.49 0.00 -0.04 0.00 0.00 33.50 32.68 1rwh n PRO 703 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1rwh h THR 704 N 0.00 0.62 -0.05 0.52 1.35 -1.86 -3.40 112.91 110.09 1rwh h THR 704 Ca 0.00 -1.06 -0.02 0.00 -0.55 0.00 0.00 66.41 64.77 1rwh h THR 704 Cb 0.53 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 68.64 1rwh h THR 704 CO 0.00 0.23 -0.02 0.00 -0.25 0.00 0.00 175.52 175.47 1rwh n GLN 705 N -3.48 -0.92 0.00 4.72 6.02 -1.05 -4.83 117.38 117.85 1rwh n GLN 705 Ca -0.00 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 1rwh n GLN 705 Cb 0.40 -4.04 0.00 0.00 1.02 0.00 0.00 30.24 27.62 1rwh n GLN 705 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1rwh n LYS 706 N -1.29 4.57 -3.30 -1.09 5.02 -1.26 -4.70 118.16 116.11 1rwh n LYS 706 Ca -0.01 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.89 1rwh n LYS 706 Cb 0.25 -0.37 -0.06 0.00 -0.02 0.00 0.00 35.03 34.83 1rwh n LYS 706 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rwh s ALA 707 N -0.72 3.59 -0.21 7.82 0.00 -1.26 -4.98 121.76 125.99 1rwh s ALA 707 Ca 0.00 -0.01 0.18 0.00 0.00 0.00 0.00 51.96 52.13 1rwh s ALA 707 Cb 0.00 -2.61 0.23 0.00 0.00 0.00 0.00 23.12 20.73 1rwh s ALA 707 CO 0.00 0.37 1.53 0.00 0.00 0.00 0.00 175.76 177.66 1rwh h ALA 708 N 4.75 0.80 -2.50 0.00 0.00 -1.97 -3.34 119.26 117.00 1rwh h ALA 708 Ca -0.49 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.01 1rwh h ALA 708 Cb 1.21 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.81 1rwh h ALA 708 CO 0.64 0.41 -0.44 0.20 0.00 0.00 0.00 179.25 180.06 1rwh s GLY 709 N -4.37 0.40 -0.19 0.00 0.00 -1.26 -0.95 107.32 100.95 1rwh s GLY 709 Ca 0.05 -0.92 -0.14 0.00 0.00 0.00 0.00 44.72 43.71 1rwh s GLY 709 CO 0.71 -0.98 0.48 -2.27 0.00 0.00 0.00 173.10 171.05 1rwh s LEU 710 N -2.93 -0.04 -0.14 0.66 2.96 -0.83 -4.85 118.68 113.50 1rwh s LEU 710 Ca 0.12 1.00 0.02 0.00 -0.22 0.00 0.00 54.13 55.05 1rwh s LEU 710 Cb 0.05 1.62 0.01 0.00 0.50 0.00 0.00 46.19 48.37 1rwh s LEU 710 CO -0.05 -0.18 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.68 1rwh s THR 711 N 0.78 2.05 0.08 3.68 2.01 -1.26 -0.70 115.64 122.28 1rwh s THR 711 Ca -0.04 -0.97 -0.06 0.00 0.31 0.00 0.00 61.69 60.92 1rwh s THR 711 Cb -0.05 -1.81 -0.05 0.00 0.01 0.00 0.00 72.50 70.59 1rwh s THR 711 CO -0.06 0.55 0.34 -0.76 -0.69 0.00 0.00 174.62 173.99 1rwh s LEU 712 N 0.84 4.33 -0.31 4.42 1.43 0.07 -1.09 118.68 128.37 1rwh s LEU 712 Ca -0.06 0.61 -0.10 0.00 -1.03 0.00 0.00 54.13 53.54 1rwh s LEU 712 Cb -0.15 -3.00 -0.02 0.00 0.03 0.00 0.00 46.19 43.05 1rwh s LEU 712 CO -0.03 0.16 0.17 -0.89 0.23 0.00 0.00 176.35 175.99 1rwh s THR 713 N -1.47 4.85 0.22 5.49 2.01 -0.07 -1.09 115.64 125.58 1rwh s THR 713 Ca 0.34 -0.25 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 1rwh s THR 713 Cb -0.13 -3.43 -0.08 0.00 0.01 0.00 0.00 72.50 68.86 1rwh s THR 713 CO 0.20 0.11 1.02 -0.76 -0.69 0.00 0.00 174.62 174.50 1rwh s LEU 714 N 1.66 4.57 0.88 4.42 1.43 0.13 -1.09 118.68 130.68 1rwh s LEU 714 Ca 0.06 2.05 -0.13 0.00 -1.03 0.00 0.00 54.13 55.08 1rwh s LEU 714 Cb -0.17 -3.61 0.15 0.00 0.03 0.00 0.00 46.19 42.60 1rwh s LEU 714 CO 0.08 -0.04 1.23 -2.16 0.23 0.00 0.00 176.35 175.69 1rwh s PRO 715 N -0.92 1.18 -1.20 1.29 0.04 -1.20 -4.57 135.00 129.62 1rwh s PRO 715 Ca 0.45 -0.35 -0.01 0.00 0.04 0.00 0.00 61.00 61.12 1rwh s PRO 715 Cb -0.28 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1rwh s PRO 715 CO 0.35 -2.03 0.18 0.39 0.04 0.00 0.00 177.00 175.93 1rwh n GLU 716 N -3.49 -2.14 0.00 4.56 -0.58 -1.26 -4.75 120.64 112.97 1rwh n GLU 716 Ca 0.13 0.69 0.00 0.00 -0.42 0.00 0.00 57.16 57.56 1rwh n GLU 716 Cb 0.60 -5.01 0.00 0.00 -0.57 0.00 0.00 31.44 26.46 1rwh n GLU 716 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1rwh n GLY 717 N -1.13 -0.78 3.92 0.62 0.00 -1.26 -4.96 105.19 101.59 1rwh n GLY 717 Ca -0.14 -1.62 -0.25 0.00 0.00 0.00 0.00 46.02 44.02 1rwh n GLY 717 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rwh s THR 718 N 0.00 5.15 -0.03 2.61 -4.23 -1.26 -4.56 115.64 113.32 1rwh s THR 718 Ca 0.00 -0.82 -0.01 0.00 -1.18 0.00 0.00 61.69 59.69 1rwh s THR 718 Cb 0.00 -3.68 0.03 0.00 1.34 0.00 0.00 72.50 70.19 1rwh s THR 718 CO 0.00 -0.14 0.05 0.26 -0.54 0.00 0.00 174.62 174.26 1rwh s TRP 719 N -1.79 0.01 -0.08 3.99 0.52 -1.26 -4.66 118.94 115.67 1rwh s TRP 719 Ca 0.34 0.21 0.02 0.00 0.02 0.00 0.00 56.10 56.69 1rwh s TRP 719 Cb -0.10 -0.27 -0.02 0.00 -1.15 0.00 0.00 33.47 31.93 1rwh s TRP 719 CO 0.28 -0.12 0.07 -1.13 0.02 0.00 0.00 176.95 176.07 1rwh n SER 720 N 4.44 0.38 -3.96 2.95 3.41 -0.73 -4.92 113.62 115.19 1rwh n SER 720 Ca -0.22 -0.51 -0.09 0.00 -0.26 0.00 0.00 58.87 57.79 1rwh n SER 720 Cb 0.50 1.01 -0.08 0.00 -0.26 0.00 0.00 64.21 65.38 1rwh n SER 720 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1rwh s SER 721 N -1.24 0.13 -0.33 4.04 1.04 -1.05 -5.02 113.70 111.27 1rwh s SER 721 Ca 0.01 -0.84 -0.10 0.00 0.48 0.00 0.00 55.95 55.49 1rwh s SER 721 Cb 0.01 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1rwh s SER 721 CO 0.07 -0.80 0.16 -0.69 0.98 0.00 0.00 173.24 172.97 1rwh s VAL 722 N -3.94 4.57 -0.06 5.02 1.01 -1.26 -0.73 120.40 125.01 1rwh s VAL 722 Ca 0.13 -0.55 -0.20 0.00 0.00 0.00 0.00 61.98 61.37 1rwh s VAL 722 Cb 0.05 -3.39 -0.30 0.00 0.00 0.00 0.00 36.38 32.73 1rwh s VAL 722 CO -0.04 -0.01 0.79 -0.07 0.00 0.00 0.00 175.10 175.76 1rwh h LEU 723 N 8.37 0.44 -8.00 3.92 3.38 -0.51 -3.48 115.31 119.43 1rwh h LEU 723 Ca -0.30 -0.92 -0.35 0.00 0.09 0.00 0.00 57.88 56.40 1rwh h LEU 723 Cb 1.13 -0.14 -0.28 0.00 0.09 0.00 0.00 40.66 41.46 1rwh h LEU 723 CO 0.63 1.47 -0.76 -1.61 0.09 0.00 0.00 178.44 178.25 1rwh s GLU 724 N -2.45 0.57 1.01 1.13 2.02 -0.83 -4.96 118.70 115.19 1rwh s GLU 724 Ca -0.16 -0.32 0.00 0.00 0.02 0.00 0.00 54.97 54.51 1rwh s GLU 724 Cb 0.02 -0.53 0.00 0.00 0.10 0.00 0.00 34.13 33.72 1rwh s GLU 724 CO 0.81 0.14 0.00 0.41 0.02 0.00 0.00 175.26 176.64 1rwh n GLY 725 N 2.71 -1.84 3.38 -1.39 0.00 -1.26 -1.01 105.19 105.78 1rwh n GLY 725 Ca -0.14 -1.56 -0.23 0.00 0.00 0.00 0.00 46.02 44.08 1rwh n GLY 725 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwh s ALA 726 N -1.27 2.27 0.00 4.61 0.00 -1.26 -4.99 121.76 121.12 1rwh s ALA 726 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 51.96 50.36 1rwh s ALA 726 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.89 1rwh s ALA 726 CO 0.00 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.46 1rwh n GLY 727 N 0.13 4.04 3.35 0.00 0.00 -1.26 -4.93 105.19 106.51 1rwh n GLY 727 Ca -0.12 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 1rwh n GLY 727 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rwh s THR 728 N -2.00 3.54 0.28 2.61 2.01 -0.16 -4.91 115.64 117.02 1rwh s THR 728 Ca 0.00 -0.44 -0.28 0.00 0.31 0.00 0.00 61.69 61.28 1rwh s THR 728 Cb 0.00 -2.61 -0.09 0.00 0.01 0.00 0.00 72.50 69.80 1rwh s THR 728 CO 0.00 0.42 0.94 -0.76 -0.69 0.00 0.00 174.62 174.53 1rwh s LEU 729 N 1.39 4.48 0.00 4.42 1.43 -1.26 -1.23 118.68 127.91 1rwh s LEU 729 Ca 0.05 1.88 -0.04 0.00 -1.03 0.00 0.00 54.13 54.99 1rwh s LEU 729 Cb -0.14 -3.82 0.02 0.00 0.03 0.00 0.00 46.19 42.27 1rwh s LEU 729 CO -0.01 0.04 0.43 0.61 0.23 0.00 0.00 176.35 177.65 1rwh n GLY 730 N 0.99 2.06 2.97 -3.19 0.00 -0.35 -4.98 105.19 102.70 1rwh n GLY 730 Ca 0.00 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 1rwh n GLY 730 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rwh s THR 731 N -2.62 -0.02 0.66 2.61 2.01 -1.26 -0.82 115.64 116.19 1rwh s THR 731 Ca 0.20 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1rwh s THR 731 Cb -0.02 -0.22 0.09 0.00 0.01 0.00 0.00 72.50 72.37 1rwh s THR 731 CO 0.14 0.03 0.92 1.51 -0.69 0.00 0.00 174.62 176.53 1rwh s ASP 732 N 0.59 4.69 0.59 3.53 1.47 -0.71 -4.94 116.67 121.89 1rwh s ASP 732 Ca -0.04 -0.25 0.29 0.00 1.18 0.00 0.00 52.55 53.72 1rwh s ASP 732 Cb -0.06 -0.30 1.64 0.00 -0.34 0.00 0.00 42.92 43.86 1rwh s ASP 732 CO -0.03 -1.60 2.07 0.00 0.68 0.00 0.00 175.17 176.29 1rwh h ALA 733 N -0.31 1.84 -0.61 2.11 0.00 -2.02 -2.09 119.26 118.18 1rwh h ALA 733 Ca -0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1rwh h ALA 733 Cb 1.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1rwh h ALA 733 CO 0.45 -0.35 0.00 -0.25 0.00 0.00 0.00 179.25 179.10 1rwh n ASP 734 N -3.77 3.49 0.00 0.00 9.92 -1.26 -4.96 116.55 119.97 1rwh n ASP 734 Ca 0.02 -2.08 0.00 0.00 -0.53 0.00 0.00 54.79 52.20 1rwh n ASP 734 Cb 0.37 -0.44 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 1rwh n ASP 734 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1rwh n GLY 735 N 1.38 0.73 3.86 0.44 0.00 -0.79 -5.04 105.19 105.78 1rwh n GLY 735 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1rwh n GLY 735 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rwh s ARG 736 N -0.07 3.90 0.27 1.61 0.52 -1.26 -4.84 118.95 119.08 1rwh s ARG 736 Ca 0.00 0.40 -0.29 0.00 -0.52 0.00 0.00 55.73 55.31 1rwh s ARG 736 Cb 0.00 -2.81 -0.09 0.00 0.52 0.00 0.00 34.95 32.56 1rwh s ARG 736 CO 0.00 0.41 1.04 -1.12 0.02 0.00 0.00 175.30 175.66 1rwh s SER 737 N -1.98 7.37 0.18 0.23 0.01 -1.26 -1.74 113.70 116.51 1rwh s SER 737 Ca 0.42 2.15 0.10 0.00 1.31 0.00 0.00 55.95 59.92 1rwh s SER 737 Cb -0.13 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.43 1rwh s SER 737 CO 0.20 -0.06 -0.16 0.42 0.41 0.00 0.00 173.24 174.05 1rwh s THR 738 N -1.20 2.85 -0.10 1.44 -4.23 0.00 -0.69 115.64 113.71 1rwh s THR 738 Ca 0.44 -1.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1rwh s THR 738 Cb -0.29 -2.38 0.02 0.00 1.34 0.00 0.00 72.50 71.18 1rwh s THR 738 CO 0.37 -0.09 -0.09 -0.22 -0.54 0.00 0.00 174.62 174.05 1rwh s LEU 739 N -2.69 1.35 -0.16 4.79 2.96 -0.25 -1.21 118.68 123.47 1rwh s LEU 739 Ca 0.23 -0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1rwh s LEU 739 Cb -0.09 -0.85 -0.01 0.00 0.50 0.00 0.00 46.19 45.74 1rwh s LEU 739 CO 0.13 -0.07 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.07 1rwh s THR 740 N 1.38 2.90 -0.04 3.68 2.01 -0.37 -0.75 115.64 124.45 1rwh s THR 740 Ca -0.01 -0.69 0.04 0.00 0.31 0.00 0.00 61.69 61.34 1rwh s THR 740 Cb -0.14 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 1rwh s THR 740 CO -0.05 0.50 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.48 1rwh s LEU 741 N 0.76 2.75 -0.37 4.42 1.43 0.13 -0.98 118.68 126.81 1rwh s LEU 741 Ca -0.05 -0.20 -0.22 0.00 -1.03 0.00 0.00 54.13 52.62 1rwh s LEU 741 Cb -0.15 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 44.51 1rwh s LEU 741 CO 0.01 0.34 0.74 -0.62 0.23 0.00 0.00 176.35 177.05 1rwh s ASP 742 N -0.79 6.51 -0.03 2.29 -1.08 -1.26 -1.97 116.67 120.33 1rwh s ASP 742 Ca 0.12 0.26 0.12 0.00 -0.52 0.00 0.00 52.55 52.53 1rwh s ASP 742 Cb -0.11 -2.37 0.37 0.00 -1.46 0.00 0.00 42.92 39.34 1rwh s ASP 742 CO 0.01 -0.70 1.30 0.35 0.52 0.00 0.00 175.17 176.65 1rwh n THR 743 N 5.75 1.24 -1.68 1.71 -2.24 -0.12 -4.98 114.28 113.96 1rwh n THR 743 Ca 0.02 -1.15 -0.45 0.00 -2.27 0.00 0.00 64.05 60.19 1rwh n THR 743 Cb 0.48 0.36 -0.04 0.00 -2.10 0.00 0.00 70.33 69.04 1rwh n THR 743 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1rwh n THR 744 N 0.39 0.53 -1.30 4.28 -1.04 -1.14 -2.17 114.28 113.83 1rwh n THR 744 Ca 0.14 -0.09 -0.10 0.00 -2.04 0.00 0.00 64.05 61.95 1rwh n THR 744 Cb 0.52 -2.01 -0.04 0.00 -1.82 0.00 0.00 70.33 66.98 1rwh n THR 744 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1rwh n GLY 745 N 4.30 1.15 0.00 3.41 0.00 -1.26 -4.90 105.19 107.90 1rwh n GLY 745 Ca 0.20 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.99 1rwh n GLY 745 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rwh n LEU 746 N -1.19 0.00 -3.46 0.99 4.77 -0.92 -4.89 117.00 112.30 1rwh n LEU 746 Ca -0.10 0.45 -0.25 0.00 -0.03 0.00 0.00 56.01 56.07 1rwh n LEU 746 Cb 0.40 -0.45 0.02 0.00 -2.33 0.00 0.00 43.42 41.05 1rwh n LEU 746 CO 0.16 -0.06 0.03 -1.20 -1.33 0.00 0.00 177.39 174.99 1rwh n SER 747 N -1.45 -4.82 0.00 -1.43 7.64 -1.26 -1.18 113.62 111.12 1rwh n SER 747 Ca 0.08 -0.49 0.00 0.00 1.01 0.00 0.00 58.87 59.47 1rwh n SER 747 Cb 0.28 -3.90 0.00 0.00 -1.01 0.00 0.00 64.21 59.58 1rwh n SER 747 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rwh n GLY 748 N -1.46 0.90 3.81 0.23 0.00 -1.26 -4.49 105.19 102.92 1rwh n GLY 748 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1rwh n GLY 748 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rwh s LYS 749 N -0.01 3.05 0.06 1.61 1.02 -0.33 -4.71 119.74 120.43 1rwh s LYS 749 Ca 0.00 1.09 -0.23 0.00 0.02 0.00 0.00 55.97 56.86 1rwh s LYS 749 Cb 0.00 -2.00 -0.06 0.00 -0.52 0.00 0.00 37.83 35.25 1rwh s LYS 749 CO 0.00 -1.01 0.68 0.99 -0.92 0.00 0.00 175.35 175.08 1rwh s THR 750 N -2.76 4.72 -0.20 2.17 2.01 -1.26 -4.51 115.64 115.81 1rwh s THR 750 Ca 0.61 1.44 -0.08 0.00 0.31 0.00 0.00 61.69 63.97 1rwh s THR 750 Cb -0.15 -4.02 -0.04 0.00 0.01 0.00 0.00 72.50 68.30 1rwh s THR 750 CO 0.47 0.45 0.09 -0.54 -0.69 0.00 0.00 174.62 174.40 1rwh s LYS 751 N -0.52 3.98 -0.18 4.92 -0.14 0.13 -4.95 119.74 122.99 1rwh s LYS 751 Ca 0.34 -0.33 -0.09 0.00 -1.36 0.00 0.00 55.97 54.53 1rwh s LYS 751 Cb -0.20 -3.31 -0.05 0.00 -1.68 0.00 0.00 37.83 32.59 1rwh s LYS 751 CO 0.21 0.18 0.11 -0.51 -0.76 0.00 0.00 175.35 174.58 1rwh s LEU 752 N 0.64 4.13 -0.00 3.17 1.43 -1.26 -1.21 118.68 125.57 1rwh s LEU 752 Ca 0.05 0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.40 1rwh s LEU 752 Cb -0.13 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.04 1rwh s LEU 752 CO 0.01 0.22 -0.07 -0.63 0.23 0.00 0.00 176.35 176.11 1rwh s ILE 753 N 0.13 0.58 -0.07 -0.59 1.09 -0.11 -4.28 121.20 117.95 1rwh s ILE 753 Ca 0.08 -0.38 0.02 0.00 -1.10 0.00 0.00 60.65 59.27 1rwh s ILE 753 Cb -0.11 -0.50 0.01 0.00 -1.06 0.00 0.00 42.46 40.80 1rwh s ILE 753 CO -0.01 0.12 -0.12 -0.75 -0.10 0.00 0.00 174.94 174.09 1rwh s LYS 754 N -0.29 1.64 0.18 2.79 2.20 -0.18 -0.66 119.74 125.40 1rwh s LYS 754 Ca 0.02 -0.39 0.08 0.00 -0.36 0.00 0.00 55.97 55.32 1rwh s LYS 754 Cb -0.03 -1.37 -0.04 0.00 -1.51 0.00 0.00 37.83 34.87 1rwh s LYS 754 CO -0.00 0.01 -0.06 -0.51 -0.36 0.00 0.00 175.35 174.43 1rwh s LEU 755 N 0.72 3.09 -0.01 5.43 1.43 0.24 0.25 118.68 129.82 1rwh s LEU 755 Ca -0.14 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 52.52 1rwh s LEU 755 Cb -0.16 -1.77 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1rwh s LEU 755 CO 0.03 0.10 -0.20 -0.75 0.23 0.00 0.00 176.35 175.76 1rwh s LYS 756 N -2.85 2.23 0.00 1.70 2.20 0.10 -0.67 119.74 122.45 1rwh s LYS 756 Ca 0.26 -0.86 0.00 0.00 -0.36 0.00 0.00 55.97 55.01 1rwh s LYS 756 Cb -0.09 -2.20 0.00 0.00 -1.51 0.00 0.00 37.83 34.03 1rwh s LYS 756 CO 0.16 0.58 0.32 -2.13 -0.36 0.00 0.00 175.35 173.92