#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p4h s ILE 13 N 0.00 4.36 0.16 -0.39 -4.36 -1.26 -5.05 121.20 114.65 1p4h s ILE 13 Ca 0.00 -0.78 -0.17 0.00 -0.26 0.00 0.00 60.65 59.43 1p4h s ILE 13 Cb 0.00 -3.07 0.06 0.00 1.25 0.00 0.00 42.46 40.70 1p4h s ILE 13 CO 0.00 0.17 1.69 0.77 0.24 0.00 0.00 174.94 177.81 1p4h h SER 14 N 3.52 -0.26 0.00 4.36 4.64 -1.97 -2.25 113.55 121.58 1p4h h SER 14 Ca -0.47 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1p4h h SER 14 Cb 1.17 0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 1p4h h SER 14 CO 0.63 -0.09 0.02 1.33 -0.87 0.00 0.00 176.83 177.85 1p4h n VAL 15 N -5.25 1.72 0.67 0.95 0.24 -1.26 -1.85 118.33 113.55 1p4h n VAL 15 Ca 0.01 0.55 0.06 0.00 -2.04 0.00 0.00 64.34 62.93 1p4h n VAL 15 Cb 0.20 -1.55 0.18 0.00 -1.47 0.00 0.00 33.84 31.19 1p4h n VAL 15 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1p4h n ARG 16 N -1.64 2.03 0.00 7.34 1.74 -0.85 -5.05 116.66 120.24 1p4h n ARG 16 Ca -0.00 -1.45 0.00 0.00 -0.77 0.00 0.00 57.85 55.62 1p4h n ARG 16 Cb 0.03 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 1p4h n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p4h n GLY 17 N 1.06 -1.15 3.85 -0.13 0.00 -0.77 -0.99 105.19 107.06 1p4h n GLY 17 Ca 0.13 -1.61 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 1p4h n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p4h s LEU 18 N -2.46 4.17 -0.82 0.99 2.01 -1.26 -4.60 118.68 116.71 1p4h s LEU 18 Ca 0.00 1.21 0.02 0.00 0.01 0.00 0.00 54.13 55.37 1p4h s LEU 18 Cb 0.00 -3.81 0.31 0.00 0.01 0.00 0.00 46.19 42.70 1p4h s LEU 18 CO 0.00 -0.10 1.27 0.00 1.01 0.00 0.00 176.35 178.54 1p4h n ALA 19 N 0.03 5.09 -1.31 4.21 0.00 -1.26 -3.78 120.51 123.48 1p4h n ALA 19 Ca 0.01 -4.71 -0.36 0.00 0.00 0.00 0.00 53.44 48.38 1p4h n ALA 19 Cb 0.52 -1.49 0.08 0.00 0.00 0.00 0.00 19.45 18.57 1p4h n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p4h n GLY 20 N 0.29 -0.82 0.18 0.00 0.00 -1.26 -4.82 105.19 98.76 1p4h n GLY 20 Ca 0.35 -0.36 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 1p4h n GLY 20 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1p4h h VAL 21 N -0.32 0.75 -0.54 1.61 2.07 -2.00 -1.89 116.25 115.94 1p4h h VAL 21 Ca -0.47 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 1p4h h VAL 21 Cb 1.34 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 1p4h h VAL 21 CO 0.45 0.07 0.31 -0.33 0.02 0.00 0.00 177.57 178.10 1p4h h GLU 22 N -0.57 0.75 -0.48 1.57 3.07 -2.00 -2.67 114.58 114.26 1p4h h GLU 22 Ca -0.04 -0.08 -0.11 0.00 -0.50 0.00 0.00 59.36 58.63 1p4h h GLU 22 Cb 0.41 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 1p4h h GLU 22 CO 0.06 0.56 -0.16 -0.91 -1.40 0.00 0.00 179.01 177.17 1p4h h ASN 23 N 0.73 0.93 -0.70 1.42 4.21 -1.94 -1.06 115.58 119.17 1p4h h ASN 23 Ca 0.19 -0.32 -0.06 0.00 1.21 0.00 0.00 56.30 57.33 1p4h h ASN 23 Cb 0.01 -0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 36.93 1p4h h ASN 23 CO -0.03 1.07 0.21 0.58 -1.29 0.00 0.00 177.43 177.96 1p4h h VAL 24 N 0.81 1.26 -0.27 2.81 2.07 -1.29 0.76 116.25 122.41 1p4h h VAL 24 Ca 0.12 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 1p4h h VAL 24 Cb 0.70 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1p4h h VAL 24 CO 0.05 0.35 0.06 0.74 0.02 0.00 0.00 177.57 178.80 1p4h h THR 25 N 1.06 1.22 -0.55 2.57 2.02 -1.30 -1.74 112.91 116.19 1p4h h THR 25 Ca 0.23 -0.71 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 1p4h h THR 25 Cb 0.32 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 1p4h h THR 25 CO -0.00 0.23 0.28 -0.08 0.37 0.00 0.00 175.52 176.32 1p4h h GLU 26 N 0.26 0.77 -0.60 6.66 4.57 -0.94 -2.27 114.58 123.04 1p4h h GLU 26 Ca 0.08 -0.10 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1p4h h GLU 26 Cb 0.29 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.70 1p4h h GLU 26 CO 0.00 0.62 0.39 -0.07 -1.18 0.00 0.00 179.01 178.76 1p4h h LEU 27 N 0.73 0.65 -0.31 1.64 4.07 -0.71 -1.83 115.31 119.55 1p4h h LEU 27 Ca 0.19 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.13 1p4h h LEU 27 Cb 0.08 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.65 1p4h h LEU 27 CO -0.03 0.47 0.16 0.11 -1.08 0.00 0.00 178.44 178.07 1p4h h LYS 28 N 0.78 0.43 -0.44 1.13 1.57 -1.06 0.64 116.57 119.62 1p4h h LYS 28 Ca 0.23 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.86 1p4h h LYS 28 Cb -0.05 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1p4h h LYS 28 CO -0.07 0.38 -0.11 1.57 -0.57 0.00 0.00 179.45 180.65 1p4h h LYS 29 N 0.37 0.80 -0.04 3.15 2.10 -1.24 -1.03 116.57 120.68 1p4h h LYS 29 Ca 0.11 -0.27 -0.11 0.00 -2.00 0.00 0.00 60.65 58.37 1p4h h LYS 29 Cb 0.08 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.33 1p4h h LYS 29 CO -0.02 0.88 -0.50 -0.91 -2.00 0.00 0.00 179.45 176.91 1p4h h ASN 30 N 0.72 0.12 -0.32 7.07 2.35 -1.16 0.17 115.58 124.53 1p4h h ASN 30 Ca 0.12 -0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1p4h h ASN 30 Cb 0.60 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1p4h h ASN 30 CO 0.04 0.60 0.08 0.15 -1.65 0.00 0.00 177.43 176.65 1p4h h PHE 31 N 0.09 0.54 -0.19 1.19 3.57 -0.36 -1.24 116.94 120.54 1p4h h PHE 31 Ca 0.00 -0.06 -0.12 0.00 3.53 0.00 0.00 57.97 61.32 1p4h h PHE 31 Cb 0.91 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 1p4h h PHE 31 CO 0.01 0.56 -0.38 -0.91 -2.23 0.00 0.00 178.31 175.36 1p4h h ASN 32 N 0.36 0.45 -0.19 0.41 2.35 -0.84 -1.68 115.58 116.44 1p4h h ASN 32 Ca 0.10 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 1p4h h ASN 32 Cb 0.29 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1p4h h ASN 32 CO 0.00 0.79 0.09 -0.09 -1.65 0.00 0.00 177.43 176.56 1p4h h ARG 33 N 0.36 0.27 -0.66 0.81 2.43 -0.41 -2.04 114.38 115.14 1p4h h ARG 33 Ca 0.04 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1p4h h ARG 33 Cb 0.83 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 1p4h h ARG 33 CO 0.07 0.31 0.07 0.45 -1.51 0.00 0.00 179.97 179.35 1p4h h HIS 34 N 0.17 1.19 -0.74 2.20 3.86 -1.13 0.30 115.15 121.01 1p4h h HIS 34 Ca 0.06 -0.18 0.01 0.00 -1.16 0.00 0.00 60.37 59.10 1p4h h HIS 34 Cb 0.13 -0.32 -0.04 0.00 1.06 0.00 0.00 27.41 28.24 1p4h h HIS 34 CO -0.02 1.01 0.48 1.25 0.86 0.00 0.00 177.93 181.51 1p4h h LEU 35 N 1.03 0.85 0.01 2.43 5.85 -1.19 0.21 115.31 124.50 1p4h h LEU 35 Ca 0.19 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1p4h h LEU 35 Cb 0.49 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1p4h h LEU 35 CO 0.02 0.62 -0.00 -0.74 -0.34 0.00 0.00 178.44 178.00 1p4h h HIS 36 N 1.00 -0.01 -0.04 1.25 2.76 -0.97 -1.85 115.15 117.29 1p4h h HIS 36 Ca 0.27 -0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 58.24 1p4h h HIS 36 Cb -0.11 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 28.85 1p4h h HIS 36 CO 0.00 -0.01 -0.83 0.74 -1.30 0.00 0.00 177.93 176.54 1p4h h PHE 37 N -0.43 0.56 0.07 5.26 0.04 -0.48 -1.89 116.94 120.07 1p4h h PHE 37 Ca -0.00 -0.27 -0.26 0.00 2.80 0.00 0.00 57.97 60.24 1p4h h PHE 37 Cb 0.01 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 1p4h h PHE 37 CO 0.00 1.06 -1.37 1.15 -0.60 0.00 0.00 178.31 178.55 1p4h h THR 38 N 0.25 0.97 0.00 -1.55 2.02 -0.81 -3.38 112.91 110.41 1p4h h THR 38 Ca -0.05 -2.31 0.00 0.00 0.77 0.00 0.00 66.41 64.82 1p4h h THR 38 Cb 1.43 2.55 0.00 0.00 -1.74 0.00 0.00 68.15 70.40 1p4h h THR 38 CO 0.14 0.60 -0.65 0.18 0.37 0.00 0.00 175.52 176.16 1p4h n LEU 39 N -4.07 0.63 -3.66 2.58 4.32 0.26 -4.98 117.00 112.08 1p4h n LEU 39 Ca -0.28 -0.12 -0.27 0.00 -0.02 0.00 0.00 56.01 55.32 1p4h n LEU 39 Cb 0.82 -0.18 0.04 0.00 -1.62 0.00 0.00 43.42 42.48 1p4h n LEU 39 CO 0.33 0.15 -0.08 0.52 -1.22 0.00 0.00 177.39 177.10 1p4h n VAL 40 N -1.52 -5.78 -4.05 4.08 0.31 -0.71 -4.98 118.33 105.68 1p4h n VAL 40 Ca 0.05 -0.90 -0.08 0.00 -0.01 0.00 0.00 64.34 63.40 1p4h n VAL 40 Cb 0.34 -4.35 -0.09 0.00 -0.91 0.00 0.00 33.84 28.82 1p4h n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1p4h s LYS 41 N -5.85 0.76 0.30 5.55 -0.14 -0.71 -5.03 119.74 114.62 1p4h s LYS 41 Ca 0.36 -1.21 0.11 0.00 -1.36 0.00 0.00 55.97 53.87 1p4h s LYS 41 Cb -0.12 0.25 -0.05 0.00 -1.68 0.00 0.00 37.83 36.24 1p4h s LYS 41 CO 0.84 -0.19 -0.16 0.16 -0.76 0.00 0.00 175.35 175.24 1p4h s ASP 42 N -2.94 3.69 0.63 2.83 1.47 -1.26 -3.93 116.67 117.17 1p4h s ASP 42 Ca 0.11 -1.05 0.33 0.00 1.18 0.00 0.00 52.55 53.12 1p4h s ASP 42 Cb 0.07 -0.35 1.83 0.00 -0.34 0.00 0.00 42.92 44.13 1p4h s ASP 42 CO -0.07 -0.03 2.10 0.03 0.68 0.00 0.00 175.17 177.88 1p4h h ARG 43 N 2.17 0.00 0.00 2.11 2.47 -1.96 -1.99 114.38 117.19 1p4h h ARG 43 Ca -0.41 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.23 1p4h h ARG 43 Cb 1.26 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.56 1p4h h ARG 43 CO 0.63 0.00 -0.41 -0.91 0.56 0.00 0.00 179.97 179.84 1p4h h ASN 44 N 0.00 0.00 -0.00 7.04 2.35 -2.05 -3.29 115.58 119.63 1p4h h ASN 44 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1p4h h ASN 44 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1p4h h ASN 44 CO -0.00 0.41 0.00 1.33 -1.65 0.00 0.00 177.43 177.52 1p4h n VAL 45 N -3.52 0.32 -2.31 2.81 0.24 -0.80 -5.05 118.33 110.03 1p4h n VAL 45 Ca -0.00 -0.66 -0.41 0.00 -2.04 0.00 0.00 64.34 61.23 1p4h n VAL 45 Cb 0.54 0.85 -0.03 0.00 -1.47 0.00 0.00 33.84 33.73 1p4h n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1p4h s ALA 46 N -0.34 3.47 0.38 2.33 0.00 -0.91 -4.95 121.76 121.73 1p4h s ALA 46 Ca 0.01 1.03 0.08 0.00 0.00 0.00 0.00 51.96 53.07 1p4h s ALA 46 Cb 0.00 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 1p4h s ALA 46 CO 0.01 -0.42 0.31 0.95 0.00 0.00 0.00 175.76 176.61 1p4h s THR 47 N -0.34 3.00 0.45 0.00 -4.23 -1.26 -4.97 115.64 108.29 1p4h s THR 47 Ca 0.52 -1.40 0.20 0.00 -1.18 0.00 0.00 61.69 59.83 1p4h s THR 47 Cb -0.35 -3.07 0.39 0.00 1.34 0.00 0.00 72.50 70.82 1p4h s THR 47 CO 0.40 -0.08 1.89 -0.65 -0.54 0.00 0.00 174.62 175.64 1p4h h PRO 48 N 1.18 0.30 -0.64 3.99 0.11 -1.99 0.98 132.00 135.92 1p4h h PRO 48 Ca -0.43 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 1p4h h PRO 48 Cb 1.26 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1p4h h PRO 48 CO 0.59 0.20 0.16 -0.09 -0.21 0.00 0.00 178.00 178.64 1p4h h ARG 49 N 0.31 1.03 -0.76 1.05 2.43 -1.96 0.03 114.38 116.51 1p4h h ARG 49 Ca 0.42 -0.25 -0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1p4h h ARG 49 Cb 1.16 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.54 1p4h h ARG 49 CO -0.12 0.93 0.39 -0.44 -1.51 0.00 0.00 179.97 179.22 1p4h h ASP 50 N 0.95 0.97 -0.58 -3.80 3.45 -1.22 -1.18 116.42 115.02 1p4h h ASP 50 Ca 0.20 -0.12 -0.07 0.00 0.43 0.00 0.00 57.03 57.48 1p4h h ASP 50 Cb 0.36 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.86 1p4h h ASP 50 CO 0.00 0.81 0.12 1.88 -1.57 0.00 0.00 179.24 180.48 1p4h h TYR 51 N 1.06 1.03 -0.36 4.55 0.05 -0.86 -0.31 116.97 122.13 1p4h h TYR 51 Ca 0.26 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 58.92 1p4h h TYR 51 Cb 0.08 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 37.51 1p4h h TYR 51 CO 0.01 0.86 0.20 -0.92 -1.05 0.00 0.00 178.16 177.26 1p4h h TYR 52 N 0.93 0.48 -0.40 4.88 3.20 -0.46 -1.76 116.97 123.85 1p4h h TYR 52 Ca 0.19 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.97 1p4h h TYR 52 Cb 0.38 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 1p4h h TYR 52 CO 0.03 0.38 -0.08 0.74 -1.64 0.00 0.00 178.16 177.58 1p4h h PHE 53 N 0.45 0.74 -0.58 -3.82 -1.00 -0.82 0.37 116.94 112.28 1p4h h PHE 53 Ca 0.13 -0.12 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 1p4h h PHE 53 Cb 0.05 -0.20 -0.03 0.00 3.61 0.00 0.00 35.95 39.38 1p4h h PHE 53 CO -0.03 0.74 0.27 0.00 -1.61 0.00 0.00 178.31 177.68 1p4h h ALA 54 N 1.29 0.75 -0.34 2.45 0.00 -0.79 -0.64 119.26 121.98 1p4h h ALA 54 Ca 0.12 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1p4h h ALA 54 Cb 0.51 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1p4h h ALA 54 CO 0.03 0.32 0.03 1.25 0.00 0.00 0.00 179.25 180.89 1p4h h LEU 55 N 0.79 0.56 -0.43 0.00 5.85 -0.99 -1.57 115.31 119.52 1p4h h LEU 55 Ca 0.20 -0.28 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1p4h h LEU 55 Cb 0.14 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1p4h h LEU 55 CO -0.02 0.70 0.21 0.00 -0.34 0.00 0.00 178.44 178.99 1p4h h ALA 56 N 0.88 0.53 -0.25 1.25 0.00 -0.61 0.32 119.26 121.39 1p4h h ALA 56 Ca 0.10 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1p4h h ALA 56 Cb 0.39 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1p4h h ALA 56 CO 0.01 -0.14 -0.12 0.45 0.00 0.00 0.00 179.25 179.44 1p4h h HIS 57 N 0.43 0.43 -0.31 0.00 3.86 -1.03 0.14 115.15 118.67 1p4h h HIS 57 Ca 0.18 -0.06 -0.06 0.00 -1.16 0.00 0.00 60.37 59.27 1p4h h HIS 57 Cb 0.09 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 1p4h h HIS 57 CO -0.10 0.53 -0.06 1.15 0.86 0.00 0.00 177.93 180.31 1p4h h THR 58 N 0.38 1.28 -0.35 2.45 2.02 -0.39 -1.84 112.91 116.45 1p4h h THR 58 Ca 0.07 -1.08 -0.11 0.00 0.77 0.00 0.00 66.41 66.07 1p4h h THR 58 Cb 0.45 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1p4h h THR 58 CO 0.03 0.35 -0.20 0.58 0.37 0.00 0.00 175.52 176.64 1p4h h VAL 59 N 0.37 1.29 -0.92 3.16 2.07 -0.71 -3.02 116.25 118.49 1p4h h VAL 59 Ca 0.08 -1.33 0.12 0.00 0.82 0.00 0.00 66.70 66.38 1p4h h VAL 59 Cb 0.54 1.40 -0.08 0.00 -1.52 0.00 0.00 31.29 31.62 1p4h h VAL 59 CO 0.03 0.44 0.55 -0.09 0.02 0.00 0.00 177.57 178.51 1p4h h ARG 60 N 0.53 0.84 -0.95 1.57 2.43 -0.65 -1.29 114.38 116.86 1p4h h ARG 60 Ca 0.07 -0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.35 1p4h h ARG 60 Cb 0.75 -0.19 -0.08 0.00 -0.42 0.00 0.00 29.97 30.03 1p4h h ARG 60 CO 0.06 0.56 0.60 -0.44 -1.51 0.00 0.00 179.97 179.24 1p4h h ASP 61 N 0.87 0.73 0.67 -3.80 3.45 -1.20 0.67 116.42 117.81 1p4h h ASP 61 Ca 0.46 0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.98 1p4h h ASP 61 Cb 0.47 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1p4h h ASP 61 CO -0.27 0.34 0.00 0.45 -1.57 0.00 0.00 179.24 178.18 1p4h h HIS 62 N 0.75 0.00 0.14 4.55 3.86 -1.31 -3.18 115.15 119.96 1p4h h HIS 62 Ca 0.50 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 59.41 1p4h h HIS 62 Cb 0.77 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.24 1p4h h HIS 62 CO -0.00 0.00 -1.53 -0.07 0.86 0.00 0.00 177.93 177.19 1p4h h LEU 63 N 0.00 0.45 -0.64 2.43 3.38 -0.89 -3.40 115.31 116.64 1p4h h LEU 63 Ca 0.00 -0.88 0.13 0.00 0.09 0.00 0.00 57.88 57.22 1p4h h LEU 63 Cb 0.34 -0.15 -0.11 0.00 0.09 0.00 0.00 40.66 40.83 1p4h h LEU 63 CO 0.00 1.68 -0.04 -0.37 0.09 0.00 0.00 178.44 179.80 1p4h h VAL 64 N -0.17 0.44 -0.21 1.22 -1.51 -1.50 0.27 116.25 114.79 1p4h h VAL 64 Ca -0.32 -0.03 0.05 0.00 -1.23 0.00 0.00 66.70 65.17 1p4h h VAL 64 Cb 1.87 0.35 -0.05 0.00 -2.13 0.00 0.00 31.29 31.33 1p4h h VAL 64 CO 0.10 0.02 -0.11 1.23 -1.23 0.00 0.00 177.57 177.57 1p4h h GLY 65 N 0.08 0.06 1.58 5.19 0.00 -1.78 0.72 103.07 108.93 1p4h h GLY 65 Ca 0.33 0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.70 1p4h h GLY 65 CO -0.58 -0.13 -0.27 3.21 0.00 0.00 0.00 176.54 178.77 1p4h h ARG 66 N -0.09 0.49 -0.20 4.80 3.08 -1.54 -2.42 114.38 118.50 1p4h h ARG 66 Ca 0.12 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1p4h h ARG 66 Cb 0.27 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1p4h h ARG 66 CO -0.27 0.72 0.09 2.35 -1.07 0.00 0.00 179.97 181.79 1p4h h TRP 67 N 0.43 0.29 -0.40 3.04 7.01 0.24 -0.17 115.95 126.39 1p4h h TRP 67 Ca 0.06 -0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.01 1p4h h TRP 67 Cb 0.70 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.65 1p4h h TRP 67 CO 0.02 0.33 0.12 0.82 -2.79 0.00 0.00 178.44 176.94 1p4h h ILE 68 N 0.18 1.22 0.00 2.65 2.04 -0.78 -2.45 117.51 120.36 1p4h h ILE 68 Ca 0.07 -0.74 -0.11 0.00 1.00 0.00 0.00 64.86 65.08 1p4h h ILE 68 Cb 0.15 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1p4h h ILE 68 CO -0.01 0.26 -0.52 0.08 0.00 0.00 0.00 178.15 177.96 1p4h h ARG 69 N 0.50 0.00 0.03 2.37 0.11 -1.36 -0.95 114.38 115.08 1p4h h ARG 69 Ca 0.13 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.21 1p4h h ARG 69 Cb 0.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.36 1p4h h ARG 69 CO -0.00 0.52 -0.01 1.15 0.10 0.00 0.00 179.97 181.73 1p4h h THR 70 N 0.00 1.13 -0.74 0.08 2.02 -0.90 0.30 112.91 114.81 1p4h h THR 70 Ca -0.01 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 66.63 1p4h h THR 70 Cb 1.11 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.94 1p4h h THR 70 CO 0.07 0.12 0.23 1.56 0.37 0.00 0.00 175.52 177.87 1p4h h GLN 71 N -0.25 1.14 -0.39 6.66 1.08 -1.40 -1.44 115.11 120.51 1p4h h GLN 71 Ca -0.00 -0.24 -0.07 0.00 -1.45 0.00 0.00 58.65 56.89 1p4h h GLN 71 Cb 0.23 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1p4h h GLN 71 CO 0.01 0.96 -0.03 0.37 -0.95 0.00 0.00 178.83 179.19 1p4h h GLN 72 N 1.09 0.64 -0.11 1.46 5.75 -1.02 -2.40 115.11 120.51 1p4h h GLN 72 Ca 0.24 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.57 1p4h h GLN 72 Cb 0.30 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 1p4h h GLN 72 CO -0.01 0.68 0.07 1.25 -2.65 0.00 0.00 178.83 178.17 1p4h h HIS 73 N 0.60 0.14 -0.09 3.99 2.76 0.47 -1.75 115.15 121.26 1p4h h HIS 73 Ca 0.12 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.27 1p4h h HIS 73 Cb 0.43 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.33 1p4h h HIS 73 CO 0.02 0.12 -0.05 1.88 -1.30 0.00 0.00 177.93 178.60 1p4h h TYR 74 N 0.12 0.13 -0.41 5.26 0.05 -1.05 -0.61 116.97 120.46 1p4h h TYR 74 Ca 0.04 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.71 1p4h h TYR 74 Cb 0.02 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 1p4h h TYR 74 CO -0.06 0.18 -0.16 -0.92 -1.05 0.00 0.00 178.16 176.15 1p4h h TYR 75 N 0.13 0.95 0.13 4.88 3.20 -0.92 0.21 116.97 125.55 1p4h h TYR 75 Ca 0.03 -0.22 -0.01 0.00 3.14 0.00 0.00 58.73 61.67 1p4h h TYR 75 Cb 0.17 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.22 1p4h h TYR 75 CO 0.00 0.98 -0.06 0.93 -1.64 0.00 0.00 178.16 178.37 1p4h h GLU 76 N 0.65 -0.17 0.00 1.82 4.39 -0.62 -3.30 114.58 117.35 1p4h h GLU 76 Ca 0.10 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1p4h h GLU 76 Cb 0.71 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.40 1p4h h GLU 76 CO 0.05 0.28 0.00 0.87 -1.16 0.00 0.00 179.01 179.05 1p4h h LYS 77 N -0.71 0.00 -6.57 2.33 1.79 -1.22 -3.48 116.57 108.71 1p4h h LYS 77 Ca -0.02 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.94 1p4h h LYS 77 Cb 0.52 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.18 1p4h h LYS 77 CO 0.03 0.00 -0.96 -3.47 -1.08 0.00 0.00 179.45 173.97 1p4h n ASP 78 N -3.06 -3.55 -4.30 0.86 2.03 0.75 -4.97 116.55 104.30 1p4h n ASP 78 Ca 0.04 -1.13 -0.30 0.00 0.52 0.00 0.00 54.79 53.93 1p4h n ASP 78 Cb 0.50 -2.65 0.17 0.00 -0.72 0.00 0.00 41.12 38.43 1p4h n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1p4h s PRO 79 N -6.65 0.60 0.21 -0.67 0.04 -1.26 -4.98 135.00 122.29 1p4h s PRO 79 Ca 0.36 -0.15 -0.30 0.00 0.04 0.00 0.00 61.00 60.95 1p4h s PRO 79 Cb -0.16 -1.82 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 1p4h s PRO 79 CO 0.91 -2.48 1.31 0.21 0.04 0.00 0.00 177.00 176.99 1p4h s LYS 80 N -5.66 4.39 -0.10 4.56 2.20 -1.26 -4.95 119.74 118.92 1p4h s LYS 80 Ca 0.70 2.06 -0.10 0.00 -0.36 0.00 0.00 55.97 58.27 1p4h s LYS 80 Cb -0.08 -3.19 -0.05 0.00 -1.51 0.00 0.00 37.83 33.01 1p4h s LYS 80 CO 0.53 -0.24 0.21 1.03 -0.36 0.00 0.00 175.35 176.52 1p4h s ARG 81 N -0.22 3.68 -0.23 4.03 1.81 -0.10 -4.52 118.95 123.39 1p4h s ARG 81 Ca 0.56 0.01 -0.08 0.00 -1.72 0.00 0.00 55.73 54.50 1p4h s ARG 81 Cb -0.37 -3.23 -0.04 0.00 -0.45 0.00 0.00 34.95 30.86 1p4h s ARG 81 CO 0.39 0.68 0.09 0.42 -0.68 0.00 0.00 175.30 176.19 1p4h s ILE 82 N -0.81 4.66 -0.29 1.52 -1.09 -0.14 -1.59 121.20 123.45 1p4h s ILE 82 Ca 0.17 -0.06 -0.03 0.00 -2.23 0.00 0.00 60.65 58.49 1p4h s ILE 82 Cb -0.13 -3.15 0.04 0.00 -1.58 0.00 0.00 42.46 37.63 1p4h s ILE 82 CO 0.06 0.37 0.01 -0.31 -1.23 0.00 0.00 174.94 173.84 1p4h s TYR 83 N 1.13 3.21 -0.53 3.97 2.02 0.59 -0.47 117.35 127.27 1p4h s TYR 83 Ca 0.05 -1.65 -0.17 0.00 -0.37 0.00 0.00 57.07 54.93 1p4h s TYR 83 Cb -0.14 -2.14 0.09 0.00 -0.40 0.00 0.00 41.96 39.37 1p4h s TYR 83 CO 0.04 -0.75 0.57 -0.47 -1.57 0.00 0.00 175.55 173.36 1p4h s TYR 84 N 1.32 3.12 -0.16 2.71 5.04 -0.31 -0.78 117.35 128.28 1p4h s TYR 84 Ca -0.03 -0.95 -0.20 0.00 -2.44 0.00 0.00 57.07 53.46 1p4h s TYR 84 Cb -0.19 -3.68 -0.03 0.00 0.35 0.00 0.00 41.96 38.41 1p4h s TYR 84 CO -0.01 -1.06 0.58 -0.51 -1.34 0.00 0.00 175.55 173.21 1p4h s LEU 85 N 2.18 4.20 -0.14 6.97 1.02 -0.60 -1.59 118.68 130.72 1p4h s LEU 85 Ca 0.09 0.85 -0.19 0.00 0.02 0.00 0.00 54.13 54.89 1p4h s LEU 85 Cb -0.25 -2.84 0.05 0.00 0.02 0.00 0.00 46.19 43.17 1p4h s LEU 85 CO 0.07 -0.17 0.51 -0.55 0.02 0.00 0.00 176.35 176.22 1p4h s SER 86 N 1.00 -0.50 0.00 2.29 0.15 -0.91 -1.76 113.70 113.97 1p4h s SER 86 Ca 0.29 0.83 0.28 0.00 0.70 0.00 0.00 55.95 58.04 1p4h s SER 86 Cb -0.16 0.85 1.23 0.00 -1.71 0.00 0.00 66.02 66.23 1p4h s SER 86 CO 0.11 -0.29 1.84 0.18 1.20 0.00 0.00 173.24 176.28 1p4h n LEU 87 N 2.24 1.07 -3.80 3.45 4.32 -1.26 -4.06 117.00 118.96 1p4h n LEU 87 Ca -0.16 -0.37 -0.14 0.00 -0.02 0.00 0.00 56.01 55.32 1p4h n LEU 87 Cb 0.56 -0.01 -0.15 0.00 -1.62 0.00 0.00 43.42 42.20 1p4h n LEU 87 CO 0.14 0.19 -0.30 -1.61 -1.22 0.00 0.00 177.39 174.59 1p4h s GLU 88 N -1.97 0.03 -0.31 3.23 2.02 -1.26 -4.66 118.70 115.78 1p4h s GLU 88 Ca 0.39 0.19 -0.02 0.00 0.02 0.00 0.00 54.97 55.55 1p4h s GLU 88 Cb 0.20 -0.12 0.11 0.00 0.10 0.00 0.00 34.13 34.42 1p4h s GLU 88 CO 0.33 -0.11 0.15 -0.06 0.02 0.00 0.00 175.26 175.59 1p4h s PHE 89 N 0.70 0.66 -1.27 1.61 0.40 -0.18 -4.58 117.98 115.32 1p4h s PHE 89 Ca -0.06 -1.22 -0.15 0.00 -0.60 0.00 0.00 56.93 54.91 1p4h s PHE 89 Cb -0.08 -1.05 0.13 0.00 0.51 0.00 0.00 43.02 42.53 1p4h s PHE 89 CO -0.03 -0.83 1.64 0.98 0.70 0.00 0.00 175.22 177.68 1p4h n TYR 90 N 4.86 4.58 0.07 0.36 4.19 -0.44 -3.59 117.16 127.20 1p4h n TYR 90 Ca -0.01 -3.09 -0.10 0.00 3.31 0.00 0.00 57.90 58.01 1p4h n TYR 90 Cb 0.41 -2.36 0.01 0.00 0.49 0.00 0.00 39.34 37.89 1p4h n TYR 90 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 1p4h h MET 91 N 7.09 0.32 0.00 2.98 2.86 -1.82 -3.41 114.93 122.96 1p4h h MET 91 Ca 0.39 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1p4h h MET 91 Cb 0.83 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.57 1p4h h MET 91 CO 1.40 0.97 0.00 0.41 1.06 0.00 0.00 176.91 180.76 1p4h n GLY 92 N 0.72 -0.10 3.82 8.32 0.00 -0.80 -4.80 105.19 112.36 1p4h n GLY 92 Ca -0.04 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.66 1p4h n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p4h s ARG 93 N 0.00 3.96 -0.07 1.61 0.52 -1.26 -1.95 118.95 121.75 1p4h s ARG 93 Ca 0.00 1.13 0.10 0.00 -0.52 0.00 0.00 55.73 56.45 1p4h s ARG 93 Cb 0.00 -2.13 -0.15 0.00 0.52 0.00 0.00 34.95 33.19 1p4h s ARG 93 CO 0.00 -0.27 0.12 2.41 0.02 0.00 0.00 175.30 177.58 1p4h n THR 94 N -1.13 0.47 0.19 0.02 -1.04 -1.26 -4.65 114.28 106.87 1p4h n THR 94 Ca 0.08 -0.38 -0.14 0.00 -2.04 0.00 0.00 64.05 61.56 1p4h n THR 94 Cb 0.54 -0.37 -0.08 0.00 -1.82 0.00 0.00 70.33 68.60 1p4h n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1p4h h LEU 95 N 0.00 -1.12 -0.67 -4.42 5.85 -1.96 -1.28 115.31 111.71 1p4h h LEU 95 Ca -0.18 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1p4h h LEU 95 Cb 1.25 0.38 -0.03 0.00 0.37 0.00 0.00 40.66 42.63 1p4h h LEU 95 CO 0.01 -0.49 0.37 -0.61 -0.34 0.00 0.00 178.44 177.38 1p4h h GLN 96 N -0.73 0.93 -0.96 1.25 4.15 -1.96 -1.96 115.11 115.83 1p4h h GLN 96 Ca -0.04 -0.11 0.07 0.00 0.77 0.00 0.00 58.65 59.34 1p4h h GLN 96 Cb 0.65 -0.18 -0.06 0.00 0.21 0.00 0.00 27.48 28.10 1p4h h GLN 96 CO -0.10 0.70 0.62 -0.97 -1.93 0.00 0.00 178.83 177.15 1p4h h ASN 97 N 0.91 0.98 -0.46 -0.69 -0.73 -1.81 0.76 115.58 114.55 1p4h h ASN 97 Ca 0.24 0.01 -0.09 0.00 1.87 0.00 0.00 56.30 58.32 1p4h h ASN 97 Cb 0.03 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.41 1p4h h ASN 97 CO -0.04 0.63 -0.07 0.74 -0.37 0.00 0.00 177.43 178.32 1p4h h THR 98 N 1.11 1.27 -0.62 -3.57 2.02 -0.76 -1.94 112.91 110.42 1p4h h THR 98 Ca 0.42 -1.17 -0.04 0.00 0.77 0.00 0.00 66.41 66.38 1p4h h THR 98 Cb 0.18 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1p4h h THR 98 CO -0.16 0.40 0.23 0.24 0.37 0.00 0.00 175.52 176.60 1p4h h MET 99 N 0.69 0.94 0.15 6.66 2.86 -0.56 -1.95 114.93 123.72 1p4h h MET 99 Ca 0.12 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1p4h h MET 99 Cb 0.60 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1p4h h MET 99 CO 0.04 0.81 -0.12 0.28 1.06 0.00 0.00 176.91 178.98 1p4h h VAL 100 N 0.88 0.73 0.00 -2.22 2.07 -0.72 0.94 116.25 117.93 1p4h h VAL 100 Ca 0.20 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.72 1p4h h VAL 100 Cb 0.23 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1p4h h VAL 100 CO -0.01 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.36 1p4h h ASN 101 N -0.28 0.00 -0.10 0.57 4.21 -1.25 -2.47 115.58 116.26 1p4h h ASN 101 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1p4h h ASN 101 Cb 0.25 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.45 1p4h h ASN 101 CO -0.01 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.31 1p4h n LEU 102 N -2.56 2.49 -3.48 1.61 4.32 -0.74 -0.55 117.00 118.09 1p4h n LEU 102 Ca 0.01 -1.18 -0.24 0.00 -0.02 0.00 0.00 56.01 54.58 1p4h n LEU 102 Cb 0.23 -0.06 0.06 0.00 -1.62 0.00 0.00 43.42 42.03 1p4h n LEU 102 CO 0.21 0.49 0.17 0.00 -1.22 0.00 0.00 177.39 177.04 1p4h n ALA 103 N 0.90 -1.22 0.59 -1.18 0.00 0.05 -4.89 120.51 114.75 1p4h n ALA 103 Ca 0.10 0.35 0.06 0.00 0.00 0.00 0.00 53.44 53.96 1p4h n ALA 103 Cb 0.41 -4.99 -0.02 0.00 0.00 0.00 0.00 19.45 14.86 1p4h n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1p4h n LEU 104 N -4.72 1.20 -0.10 0.00 4.32 0.11 -4.49 117.00 113.31 1p4h n LEU 104 Ca -0.02 -0.69 -0.05 0.00 -0.02 0.00 0.00 56.01 55.22 1p4h n LEU 104 Cb 0.57 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.39 1p4h n LEU 104 CO 0.61 0.24 0.83 -0.08 -1.22 0.00 0.00 177.39 177.77 1p4h h GLU 105 N 1.07 0.05 -0.38 3.23 4.81 -1.64 0.34 114.58 122.06 1p4h h GLU 105 Ca 0.00 -0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 1p4h h GLU 105 Cb 0.41 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1p4h h GLU 105 CO 0.00 0.03 -0.26 -0.91 -0.73 0.00 0.00 179.01 177.14 1p4h h ASN 106 N 0.05 0.89 -0.25 1.04 2.35 -1.31 -0.38 115.58 117.97 1p4h h ASN 106 Ca 0.18 -0.43 0.02 0.00 -0.55 0.00 0.00 56.30 55.51 1p4h h ASN 106 Cb 0.26 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1p4h h ASN 106 CO -0.33 1.13 0.11 0.00 -1.65 0.00 0.00 177.43 176.69 1p4h h ALA 107 N 0.78 0.29 -0.27 -0.83 0.00 -1.58 0.19 119.26 117.84 1p4h h ALA 107 Ca 0.07 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1p4h h ALA 107 Cb 0.84 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1p4h h ALA 107 CO 0.07 -0.30 -0.23 0.00 0.00 0.00 0.00 179.25 178.79 1p4h h ASP 109 N 0.45 0.50 0.24 0.00 1.82 -0.42 -1.09 116.42 117.92 1p4h h ASP 109 Ca 0.07 -0.20 -0.01 0.00 -0.39 0.00 0.00 57.03 56.50 1p4h h ASP 109 Cb 0.64 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.52 1p4h h ASP 109 CO 0.05 0.56 -0.12 -0.08 -1.61 0.00 0.00 179.24 178.04 1p4h h GLU 110 N 0.41 -0.31 -0.44 0.28 4.57 -0.32 -1.58 114.58 117.19 1p4h h GLU 110 Ca 0.11 0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.40 1p4h h GLU 110 Cb 0.24 0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.82 1p4h h GLU 110 CO -0.01 -0.03 -0.01 0.00 -1.18 0.00 0.00 179.01 177.78 1p4h h ALA 111 N 0.09 0.40 -0.08 2.92 0.00 -0.55 0.22 119.26 122.26 1p4h h ALA 111 Ca -0.03 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1p4h h ALA 111 Cb 0.43 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1p4h h ALA 111 CO 0.05 -0.40 -0.35 1.79 0.00 0.00 0.00 179.25 180.35 1p4h h THR 112 N 0.10 1.28 -0.17 0.00 1.35 -1.22 -2.01 112.91 112.24 1p4h h THR 112 Ca 0.22 -1.33 -0.00 0.00 -0.55 0.00 0.00 66.41 64.75 1p4h h THR 112 Cb 0.32 1.61 -0.01 0.00 -1.73 0.00 0.00 68.15 68.35 1p4h h THR 112 CO -0.37 0.39 0.09 0.22 -0.25 0.00 0.00 175.52 175.60 1p4h h TYR 113 N 0.14 0.23 -0.00 4.73 3.20 -0.07 0.45 116.97 125.64 1p4h h TYR 113 Ca 0.02 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 1p4h h TYR 113 Cb 0.69 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.89 1p4h h TYR 113 CO 0.01 0.22 -0.14 1.96 -1.64 0.00 0.00 178.16 178.57 1p4h h GLN 114 N 0.17 0.00 -0.01 1.82 4.20 -0.70 0.26 115.11 120.86 1p4h h GLN 114 Ca 0.06 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1p4h h GLN 114 Cb 0.06 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1p4h h GLN 114 CO -0.01 0.14 0.00 1.28 -0.67 0.00 0.00 178.83 179.57 1p4h n LEU 115 N -4.38 0.12 -0.82 1.46 4.32 -0.78 -4.87 117.00 112.04 1p4h n LEU 115 Ca -0.03 -0.05 -0.06 0.00 -0.02 0.00 0.00 56.01 55.86 1p4h n LEU 115 Cb 0.21 -0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.00 1p4h n LEU 115 CO 0.36 0.02 -0.05 0.61 -1.22 0.00 0.00 177.39 177.11 1p4h n GLY 116 N 0.89 0.20 3.30 -0.72 0.00 0.91 -5.05 105.19 104.72 1p4h n GLY 116 Ca 0.18 -0.59 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 1p4h n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p4h s LEU 117 N -1.94 2.28 -0.46 0.99 1.43 0.15 -5.00 118.68 116.14 1p4h s LEU 117 Ca 0.03 -0.68 -0.17 0.00 -1.03 0.00 0.00 54.13 52.28 1p4h s LEU 117 Cb -0.01 -0.98 0.04 0.00 0.03 0.00 0.00 46.19 45.27 1p4h s LEU 117 CO 0.04 0.10 0.47 -0.62 0.23 0.00 0.00 176.35 176.58 1p4h s ASP 118 N -1.83 6.19 0.38 2.29 3.68 -1.26 -3.32 116.67 122.81 1p4h s ASP 118 Ca 0.08 -0.92 0.08 0.00 2.13 0.00 0.00 52.55 53.92 1p4h s ASP 118 Cb -0.10 -2.23 0.82 0.00 -1.45 0.00 0.00 42.92 39.96 1p4h s ASP 118 CO 0.04 -0.68 1.97 -0.03 0.13 0.00 0.00 175.17 176.60 1p4h h MET 119 N 8.81 0.64 -0.05 4.34 1.85 -1.90 -1.28 114.93 127.34 1p4h h MET 119 Ca -0.27 -0.04 -0.05 0.00 -0.61 0.00 0.00 59.70 58.73 1p4h h MET 119 Cb 1.11 -0.14 -0.01 0.00 0.43 0.00 0.00 31.60 32.98 1p4h h MET 119 CO 0.86 0.42 -0.20 0.93 -0.40 0.00 0.00 176.91 178.52 1p4h h GLU 120 N 0.66 0.08 -0.33 0.39 5.08 -1.99 -1.08 114.58 117.39 1p4h h GLU 120 Ca 0.29 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.46 1p4h h GLU 120 Cb 0.30 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1p4h h GLU 120 CO -0.09 0.28 -0.49 1.49 -1.00 0.00 0.00 179.01 179.20 1p4h h GLU 121 N 0.08 0.90 -0.25 2.33 4.81 -1.66 -3.04 114.58 117.74 1p4h h GLU 121 Ca 0.01 -0.53 -0.13 0.00 -0.13 0.00 0.00 59.36 58.58 1p4h h GLU 121 Cb 0.41 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1p4h h GLU 121 CO 0.03 1.17 -0.39 -0.07 -0.73 0.00 0.00 179.01 179.02 1p4h h LEU 122 N 0.71 0.62 -1.41 1.64 4.07 -1.13 -3.03 115.31 116.77 1p4h h LEU 122 Ca 0.03 -0.27 -0.04 0.00 0.08 0.00 0.00 57.88 57.68 1p4h h LEU 122 Cb 1.09 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.64 1p4h h LEU 122 CO 0.11 0.94 -0.05 -0.33 -1.08 0.00 0.00 178.44 178.04 1p4h h GLU 123 N 0.49 0.33 0.00 1.13 5.08 -1.16 -1.94 114.58 118.51 1p4h h GLU 123 Ca 0.04 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1p4h h GLU 123 Cb 0.89 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1p4h h GLU 123 CO 0.08 0.40 0.00 0.39 -1.00 0.00 0.00 179.01 178.88 1p4h n GLU 124 N -4.31 0.12 0.12 2.33 -0.58 -1.15 -2.45 120.64 114.71 1p4h n GLU 124 Ca 0.00 0.38 0.01 0.00 -0.42 0.00 0.00 57.16 57.14 1p4h n GLU 124 Cb 0.23 -1.74 -0.00 0.00 -0.57 0.00 0.00 31.44 29.36 1p4h n GLU 124 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1p4h h ILE 125 N 0.00 0.86 -3.41 -3.67 2.04 -1.43 -3.46 117.51 108.44 1p4h h ILE 125 Ca 0.00 -2.26 -0.53 0.00 1.00 0.00 0.00 64.86 63.07 1p4h h ILE 125 Cb 0.29 2.39 0.07 0.00 -0.74 0.00 0.00 36.82 38.82 1p4h h ILE 125 CO 0.00 0.49 0.79 -0.70 0.00 0.00 0.00 178.15 178.73 1p4h s GLU 126 N -2.94 4.22 0.26 2.37 2.12 -1.03 -4.98 118.70 118.73 1p4h s GLU 126 Ca 0.03 2.40 -0.28 0.00 0.36 0.00 0.00 54.97 57.47 1p4h s GLU 126 Cb 0.08 -3.07 -0.09 0.00 0.26 0.00 0.00 34.13 31.30 1p4h s GLU 126 CO 0.76 -0.48 0.93 -2.00 -0.54 0.00 0.00 175.26 173.93 1p4h s GLU 127 N -0.55 4.75 0.32 4.30 2.56 -1.26 -4.96 118.70 123.85 1p4h s GLU 127 Ca 0.60 1.41 -0.28 0.00 0.00 0.00 0.00 54.97 56.69 1p4h s GLU 127 Cb -0.44 -3.13 -0.10 0.00 2.00 0.00 0.00 34.13 32.46 1p4h s GLU 127 CO 0.46 0.45 1.17 -0.51 -0.56 0.00 0.00 175.26 176.28 1p4h s ASP 128 N -1.31 7.00 -0.87 -1.70 -0.00 -1.26 -4.59 116.67 113.93 1p4h s ASP 128 Ca 0.43 2.41 -0.20 0.00 -0.00 0.00 0.00 52.55 55.19 1p4h s ASP 128 Cb -0.24 -2.63 0.12 0.00 -0.00 0.00 0.00 42.92 40.17 1p4h s ASP 128 CO 0.29 -0.35 1.09 0.00 -0.00 0.00 0.00 175.17 176.20 1p4h s ALA 129 N -1.20 3.30 -1.02 5.23 0.00 -0.82 -4.88 121.76 122.35 1p4h s ALA 129 Ca 0.48 -2.55 -0.04 0.00 0.00 0.00 0.00 51.96 49.85 1p4h s ALA 129 Cb -0.34 -4.01 0.16 0.00 0.00 0.00 0.00 23.12 18.93 1p4h s ALA 129 CO 0.44 -2.94 2.36 0.41 0.00 0.00 0.00 175.76 176.03 1p4h n GLY 130 N 5.50 5.19 1.75 0.00 0.00 -1.26 -1.90 105.19 114.48 1p4h n GLY 130 Ca 0.18 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.94 1p4h n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p4h n LEU 131 N 1.02 5.99 -3.84 0.99 4.77 -1.24 -0.33 117.00 124.37 1p4h n LEU 131 Ca 0.56 -2.98 -0.09 0.00 -0.03 0.00 0.00 56.01 53.47 1p4h n LEU 131 Cb 0.32 -1.03 -0.03 0.00 -2.33 0.00 0.00 43.42 40.34 1p4h n LEU 131 CO 0.55 1.12 0.33 -0.83 -1.33 0.00 0.00 177.39 177.24 1p4h s GLY 132 N 0.64 0.05 -0.24 -0.72 0.00 -1.26 -1.01 107.32 104.78 1p4h s GLY 132 Ca 0.22 -0.40 0.02 0.00 0.00 0.00 0.00 44.72 44.56 1p4h s GLY 132 CO 0.00 -0.27 -0.14 0.70 0.00 0.00 0.00 173.10 173.39 1p4h n ASN 133 N -0.40 1.88 0.00 1.64 3.02 -1.26 -4.42 115.26 115.72 1p4h n ASN 133 Ca -0.06 -0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.40 1p4h n ASN 133 Cb 0.61 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 1p4h n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p4h n GLY 134 N 2.20 0.62 0.18 7.41 0.00 -1.26 -4.91 105.19 109.43 1p4h n GLY 134 Ca -0.43 0.42 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 1p4h n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1p4h h GLY 135 N 0.00 0.34 0.99 -0.02 0.00 -1.98 -0.16 103.07 102.23 1p4h h GLY 135 Ca 0.00 0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 1p4h h GLY 135 CO 0.00 -0.15 0.29 -2.00 0.00 0.00 0.00 176.54 174.68 1p4h h LEU 136 N 0.02 0.73 -0.40 3.11 6.46 -1.98 0.93 115.31 124.18 1p4h h LEU 136 Ca 0.21 -0.11 -0.13 0.00 -0.12 0.00 0.00 57.88 57.72 1p4h h LEU 136 Cb 0.32 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.05 1p4h h LEU 136 CO -0.43 0.64 -0.28 1.23 -0.62 0.00 0.00 178.44 178.98 1p4h h GLY 137 N 0.77 0.97 1.33 3.75 0.00 -1.74 -2.75 103.07 105.40 1p4h h GLY 137 Ca 0.20 -0.93 -0.10 0.00 0.00 0.00 0.00 47.33 46.50 1p4h h GLY 137 CO -0.03 0.84 -0.14 -0.09 0.00 0.00 0.00 176.54 177.13 1p4h h ARG 138 N 0.71 0.79 -0.62 4.80 1.12 -0.79 -1.07 114.38 119.32 1p4h h ARG 138 Ca 0.08 -0.28 0.03 0.00 -1.11 0.00 0.00 59.98 58.70 1p4h h ARG 138 Cb 0.86 -0.06 -0.04 0.00 -0.01 0.00 0.00 29.97 30.72 1p4h h ARG 138 CO 0.08 0.88 0.38 1.25 -3.11 0.00 0.00 179.97 179.45 1p4h h LEU 139 N 0.71 0.61 -1.06 3.80 5.85 -0.75 0.40 115.31 124.87 1p4h h LEU 139 Ca 0.11 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1p4h h LEU 139 Cb 0.63 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1p4h h LEU 139 CO 0.04 0.43 0.51 0.00 -0.34 0.00 0.00 178.44 179.08 1p4h h ALA 140 N 1.27 1.30 -0.32 1.25 0.00 -1.25 0.12 119.26 121.63 1p4h h ALA 140 Ca 0.25 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1p4h h ALA 140 Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1p4h h ALA 140 CO -0.10 0.60 -0.00 0.00 0.00 0.00 0.00 179.25 179.75 1p4h h ALA 141 N 1.39 0.43 -0.69 0.00 0.00 -0.77 -1.95 119.26 117.68 1p4h h ALA 141 Ca 0.31 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1p4h h ALA 141 Cb -0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1p4h h ALA 141 CO -0.06 0.19 0.21 0.00 0.00 0.00 0.00 179.25 179.58 1p4h h PHE 143 N 1.01 0.62 -0.52 0.00 -1.00 -0.63 -0.90 116.94 115.53 1p4h h PHE 143 Ca 0.22 0.02 0.03 0.00 2.81 0.00 0.00 57.97 61.05 1p4h h PHE 143 Cb 0.31 -0.21 -0.04 0.00 3.61 0.00 0.00 35.95 39.63 1p4h h PHE 143 CO 0.02 0.37 0.29 -0.07 -1.61 0.00 0.00 178.31 177.31 1p4h h LEU 144 N 0.67 0.45 -0.45 1.54 4.07 -1.14 0.13 115.31 120.57 1p4h h LEU 144 Ca 0.21 0.02 0.02 0.00 0.08 0.00 0.00 57.88 58.20 1p4h h LEU 144 Cb -0.02 -0.08 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 1p4h h LEU 144 CO -0.08 0.31 0.27 -0.78 -1.08 0.00 0.00 178.44 177.08 1p4h h ASP 145 N 0.57 0.43 -0.40 -0.43 3.58 -1.11 -2.15 116.42 116.91 1p4h h ASP 145 Ca 0.22 0.01 -0.12 0.00 0.42 0.00 0.00 57.03 57.55 1p4h h ASP 145 Cb 0.08 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.03 1p4h h ASP 145 CO -0.12 0.31 -0.22 0.28 -2.88 0.00 0.00 179.24 176.60 1p4h h SER 146 N 0.54 0.92 -0.20 2.28 0.02 -0.56 -1.55 113.55 115.00 1p4h h SER 146 Ca 0.18 -0.34 -0.05 0.00 -0.84 0.00 0.00 61.79 60.74 1p4h h SER 146 Cb 0.02 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.29 1p4h h SER 146 CO -0.09 1.10 -0.03 0.24 -1.14 0.00 0.00 176.83 176.92 1p4h h MET 147 N 0.78 0.50 -0.14 3.45 2.86 -0.53 0.13 114.93 121.98 1p4h h MET 147 Ca 0.10 -0.11 -0.16 0.00 -2.06 0.00 0.00 59.70 57.47 1p4h h MET 147 Cb 0.77 -0.07 0.01 0.00 0.06 0.00 0.00 31.60 32.36 1p4h h MET 147 CO 0.06 0.55 -0.54 0.00 1.06 0.00 0.00 176.91 178.04 1p4h h ALA 148 N 1.50 0.25 0.00 6.32 0.00 -1.27 -0.29 119.26 125.77 1p4h h ALA 148 Ca 0.10 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 54.45 1p4h h ALA 148 Cb 0.35 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1p4h h ALA 148 CO 0.01 0.45 -0.21 1.15 0.00 0.00 0.00 179.25 180.66 1p4h h THR 149 N 0.25 1.02 -0.57 0.00 2.02 -0.83 -2.03 112.91 112.78 1p4h h THR 149 Ca -0.03 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1p4h h THR 149 Cb 1.17 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.99 1p4h h THR 149 CO 0.11 0.20 0.00 0.18 0.37 0.00 0.00 175.52 176.39 1p4h n LEU 150 N -4.10 3.48 -2.87 2.58 4.77 0.41 -4.74 117.00 116.53 1p4h n LEU 150 Ca -0.02 -1.74 -0.22 0.00 -0.03 0.00 0.00 56.01 54.00 1p4h n LEU 150 Cb 0.28 -0.44 0.03 0.00 -2.33 0.00 0.00 43.42 40.95 1p4h n LEU 150 CO 0.35 0.74 -0.03 0.61 -1.33 0.00 0.00 177.39 177.74 1p4h n GLY 151 N 1.26 -0.49 3.84 -0.72 0.00 -0.76 0.11 105.19 108.43 1p4h n GLY 151 Ca 0.20 0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 1p4h n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p4h s LEU 152 N -6.44 4.42 -1.31 0.99 1.43 -0.15 -4.65 118.68 112.97 1p4h s LEU 152 Ca 0.26 1.02 -0.18 0.00 -1.03 0.00 0.00 54.13 54.20 1p4h s LEU 152 Cb -0.12 -2.93 0.05 0.00 0.03 0.00 0.00 46.19 43.23 1p4h s LEU 152 CO 0.33 0.22 1.82 0.00 0.23 0.00 0.00 176.35 178.95 1p4h n ALA 153 N 1.31 3.69 -2.62 4.21 0.00 -1.26 -4.64 120.51 121.18 1p4h n ALA 153 Ca -0.09 -3.78 -0.30 0.00 0.00 0.00 0.00 53.44 49.26 1p4h n ALA 153 Cb 0.52 -3.59 -0.09 0.00 0.00 0.00 0.00 19.45 16.29 1p4h n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p4h s ALA 154 N 4.62 3.10 -0.06 0.00 0.00 -1.26 -0.97 121.76 127.18 1p4h s ALA 154 Ca 0.54 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 51.36 1p4h s ALA 154 Cb 0.05 -1.05 0.02 0.00 0.00 0.00 0.00 23.12 22.14 1p4h s ALA 154 CO 0.06 0.66 -0.08 0.71 0.00 0.00 0.00 175.76 177.12 1p4h s TYR 155 N -1.22 1.11 -0.15 0.00 2.02 0.39 -3.97 117.35 115.53 1p4h s TYR 155 Ca 0.22 -0.40 -0.16 0.00 -0.37 0.00 0.00 57.07 56.37 1p4h s TYR 155 Cb -0.11 -0.90 -0.04 0.00 -0.40 0.00 0.00 41.96 40.51 1p4h s TYR 155 CO 0.14 -0.27 0.37 0.20 -1.57 0.00 0.00 175.55 174.42 1p4h s GLY 156 N 0.97 2.27 -0.11 0.71 0.00 -0.75 -1.17 107.32 109.24 1p4h s GLY 156 Ca -0.10 -0.36 0.02 0.00 0.00 0.00 0.00 44.72 44.28 1p4h s GLY 156 CO 0.00 0.58 -0.18 -0.19 0.00 0.00 0.00 173.10 173.32 1p4h s TYR 157 N 0.59 2.16 0.00 1.90 2.02 -0.62 0.29 117.35 123.69 1p4h s TYR 157 Ca 0.20 -1.01 0.00 0.00 -0.37 0.00 0.00 57.07 55.90 1p4h s TYR 157 Cb -0.14 -1.52 0.00 0.00 -0.40 0.00 0.00 41.96 39.90 1p4h s TYR 157 CO 0.06 -0.48 0.00 0.41 -1.57 0.00 0.00 175.55 173.97 1p4h n GLY 158 N 4.05 3.52 3.45 0.71 0.00 -0.87 -2.13 105.19 113.92 1p4h n GLY 158 Ca -0.20 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 1p4h n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p4h s ILE 159 N -1.63 2.96 -0.86 -0.61 1.01 -1.26 -0.90 121.20 119.91 1p4h s ILE 159 Ca 0.00 -0.75 -0.19 0.00 0.00 0.00 0.00 60.65 59.71 1p4h s ILE 159 Cb 0.00 -2.16 0.13 0.00 0.01 0.00 0.00 42.46 40.44 1p4h s ILE 159 CO 0.00 0.58 1.03 -0.60 0.00 0.00 0.00 174.94 175.96 1p4h s ARG 160 N -0.60 3.49 0.19 2.79 3.52 0.09 -4.74 118.95 123.69 1p4h s ARG 160 Ca 0.09 -1.67 -0.30 0.00 -0.13 0.00 0.00 55.73 53.71 1p4h s ARG 160 Cb -0.11 -4.72 -0.08 0.00 -1.56 0.00 0.00 34.95 28.48 1p4h s ARG 160 CO 0.01 -1.71 1.09 0.71 -0.81 0.00 0.00 175.30 174.59 1p4h s TYR 161 N 2.61 3.61 0.27 5.12 2.02 -1.26 -4.74 117.35 124.98 1p4h s TYR 161 Ca 0.28 1.63 0.03 0.00 -0.37 0.00 0.00 57.07 58.64 1p4h s TYR 161 Cb -0.09 -3.26 0.36 0.00 -0.40 0.00 0.00 41.96 38.58 1p4h s TYR 161 CO -0.06 -0.54 1.67 0.93 -1.57 0.00 0.00 175.55 175.99 1p4h h GLU 162 N 4.93 0.41 -4.69 -0.62 5.08 -0.78 -3.40 114.58 115.51 1p4h h GLU 162 Ca -0.45 -0.19 -0.61 0.00 -1.00 0.00 0.00 59.36 57.12 1p4h h GLU 162 Cb 1.21 -0.01 -0.36 0.00 0.50 0.00 0.00 28.75 30.10 1p4h h GLU 162 CO 0.72 0.72 -0.83 -0.06 -1.00 0.00 0.00 179.01 178.55 1p4h s PHE 163 N -4.28 2.19 0.00 4.33 0.40 0.08 -4.30 117.98 116.41 1p4h s PHE 163 Ca -0.06 -1.23 0.00 0.00 -0.60 0.00 0.00 56.93 55.04 1p4h s PHE 163 Cb 0.13 -1.61 0.00 0.00 0.51 0.00 0.00 43.02 42.06 1p4h s PHE 163 CO 0.79 -0.67 0.00 0.41 0.70 0.00 0.00 175.22 176.46 1p4h n GLY 164 N 4.74 0.90 3.74 4.36 0.00 -1.22 -2.00 105.19 115.70 1p4h n GLY 164 Ca -0.17 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 1p4h n GLY 164 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1p4h n ILE 165 N 0.00 0.99 -1.68 -0.61 0.13 0.55 -4.57 119.36 114.17 1p4h n ILE 165 Ca 0.00 -0.25 -0.37 0.00 -1.10 0.00 0.00 62.75 61.03 1p4h n ILE 165 Cb 0.00 -1.91 0.07 0.00 -0.84 0.00 0.00 39.64 36.95 1p4h n ILE 165 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 1p4h n PHE 166 N 2.17 1.53 -2.85 9.51 1.16 -1.26 -4.55 117.46 123.18 1p4h n PHE 166 Ca 0.09 0.42 -0.41 0.00 -1.87 0.00 0.00 57.45 55.68 1p4h n PHE 166 Cb 0.36 -2.22 -0.04 0.00 -1.61 0.00 0.00 39.48 35.98 1p4h n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 1p4h s ASN 167 N -1.36 7.20 -0.12 5.98 0.01 -0.37 -4.88 114.94 121.39 1p4h s ASN 167 Ca 0.81 1.45 -0.19 0.00 -0.71 0.00 0.00 52.86 54.22 1p4h s ASN 167 Cb -0.39 -2.50 -0.04 0.00 0.41 0.00 0.00 41.25 38.73 1p4h s ASN 167 CO 0.42 -0.21 0.53 -1.58 -1.51 0.00 0.00 177.10 174.75 1p4h s GLN 168 N 0.99 4.33 0.02 -0.60 0.74 -1.26 -2.13 119.66 121.75 1p4h s GLN 168 Ca 0.46 0.53 0.08 0.00 0.05 0.00 0.00 55.36 56.48 1p4h s GLN 168 Cb -0.19 -3.46 -0.03 0.00 1.10 0.00 0.00 33.01 30.42 1p4h s GLN 168 CO 0.23 0.07 -0.24 0.15 -0.55 0.00 0.00 175.29 174.95 1p4h s LYS 169 N 0.87 1.96 -0.29 1.67 -0.14 0.06 -3.80 119.74 120.07 1p4h s LYS 169 Ca 0.28 -1.02 -0.06 0.00 -1.36 0.00 0.00 55.97 53.81 1p4h s LYS 169 Cb -0.16 -2.05 0.02 0.00 -1.68 0.00 0.00 37.83 33.96 1p4h s LYS 169 CO 0.12 0.53 0.05 0.42 -0.76 0.00 0.00 175.35 175.72 1p4h s ILE 170 N -0.77 3.73 -0.15 2.17 -1.09 -1.26 0.73 121.20 124.56 1p4h s ILE 170 Ca 0.12 -0.81 0.02 0.00 -2.23 0.00 0.00 60.65 57.75 1p4h s ILE 170 Cb -0.10 -2.94 0.01 0.00 -1.58 0.00 0.00 42.46 37.85 1p4h s ILE 170 CO 0.02 0.07 -0.21 0.00 -1.23 0.00 0.00 174.94 173.59 1p4h n GLY 172 N 4.23 0.25 2.33 0.00 0.00 -1.26 -0.05 105.19 110.69 1p4h n GLY 172 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1p4h n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p4h n GLY 173 N -0.78 1.16 3.85 -0.02 0.00 -1.26 -5.03 105.19 103.12 1p4h n GLY 173 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 1p4h n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1p4h s TRP 174 N -3.40 3.38 0.10 1.61 0.52 0.93 -3.88 118.94 118.18 1p4h s TRP 174 Ca 0.00 0.18 -0.30 0.00 0.02 0.00 0.00 56.10 56.00 1p4h s TRP 174 Cb 0.00 -1.71 -0.06 0.00 -1.15 0.00 0.00 33.47 30.56 1p4h s TRP 174 CO 0.00 0.56 1.06 -1.14 0.02 0.00 0.00 176.95 177.45 1p4h s GLN 175 N -2.39 4.58 -0.04 4.98 0.74 -1.26 0.07 119.66 126.35 1p4h s GLN 175 Ca 0.32 1.60 0.06 0.00 0.05 0.00 0.00 55.36 57.38 1p4h s GLN 175 Cb -0.13 -3.35 -0.01 0.00 1.10 0.00 0.00 33.01 30.62 1p4h s GLN 175 CO 0.24 0.02 -0.22 -1.64 -0.55 0.00 0.00 175.29 173.15 1p4h s MET 176 N 0.28 2.08 -0.00 1.67 -1.94 0.22 -4.90 119.30 116.71 1p4h s MET 176 Ca 0.51 -0.78 -0.01 0.00 -1.71 0.00 0.00 55.69 53.70 1p4h s MET 176 Cb -0.26 -1.85 -0.04 0.00 2.01 0.00 0.00 34.83 34.69 1p4h s MET 176 CO 0.31 0.37 0.10 -1.21 -0.01 0.00 0.00 175.02 174.59 1p4h s GLU 177 N -0.22 3.13 -0.08 2.03 8.01 -1.26 -0.76 118.70 129.54 1p4h s GLU 177 Ca 0.00 -0.46 -0.08 0.00 0.01 0.00 0.00 54.97 54.45 1p4h s GLU 177 Cb -0.11 -2.90 0.02 0.00 -4.31 0.00 0.00 34.13 26.82 1p4h s GLU 177 CO 0.02 0.65 0.22 -1.83 0.01 0.00 0.00 175.26 174.32 1p4h s GLU 178 N -1.80 0.25 0.11 1.61 -1.05 -0.91 -4.98 118.70 111.94 1p4h s GLU 178 Ca 0.24 0.30 -0.35 0.00 -0.15 0.00 0.00 54.97 55.01 1p4h s GLU 178 Cb -0.12 0.12 -0.17 0.00 -0.44 0.00 0.00 34.13 33.52 1p4h s GLU 178 CO 0.15 -0.03 1.11 0.00 0.95 0.00 0.00 175.26 177.44 1p4h n ALA 179 N 2.96 -1.85 -3.09 -0.84 0.00 -1.26 -1.24 120.51 115.19 1p4h n ALA 179 Ca -0.13 0.51 -0.44 0.00 0.00 0.00 0.00 53.44 53.38 1p4h n ALA 179 Cb 0.58 -1.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.12 1p4h n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1p4h s ASP 180 N 0.00 7.16 -1.53 0.00 3.68 -1.26 -4.66 116.67 120.06 1p4h s ASP 180 Ca 0.80 -3.21 -0.12 0.00 2.13 0.00 0.00 52.55 52.15 1p4h s ASP 180 Cb -1.00 -2.33 -0.01 0.00 -1.45 0.00 0.00 42.92 38.12 1p4h s ASP 180 CO 0.53 -0.58 2.57 -0.67 0.13 0.00 0.00 175.17 177.14 1p4h n ASP 181 N 4.59 6.34 0.17 -0.34 2.03 -1.26 -3.38 116.55 124.69 1p4h n ASP 181 Ca 0.32 -2.73 0.13 0.00 0.52 0.00 0.00 54.79 53.02 1p4h n ASP 181 Cb 0.41 -1.60 0.59 0.00 -0.72 0.00 0.00 41.12 39.81 1p4h n ASP 181 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1p4h h TRP 182 N 5.48 0.00 -0.02 -0.67 5.08 -1.91 -2.60 115.95 121.31 1p4h h TRP 182 Ca 0.71 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.68 1p4h h TRP 182 Cb 0.46 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.62 1p4h h TRP 182 CO 1.66 0.00 -0.12 1.28 -1.28 0.00 0.00 178.44 179.97 1p4h n LEU 183 N -2.38 2.16 -0.40 0.11 4.77 -1.26 -4.60 117.00 115.39 1p4h n LEU 183 Ca 0.00 -0.72 -0.10 0.00 -0.03 0.00 0.00 56.01 55.15 1p4h n LEU 183 Cb 0.16 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.14 1p4h n LEU 183 CO 0.17 0.37 0.46 -1.14 -1.33 0.00 0.00 177.39 175.92 1p4h n ARG 184 N 0.51 -0.42 -0.09 3.23 0.63 -0.98 -0.58 116.66 118.96 1p4h n ARG 184 Ca 0.14 1.45 0.08 0.00 -0.92 0.00 0.00 57.85 58.60 1p4h n ARG 184 Cb 0.48 -2.13 0.30 0.00 0.45 0.00 0.00 32.46 31.56 1p4h n ARG 184 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1p4h n TYR 185 N -5.19 0.24 0.00 -0.14 4.01 -1.26 -5.03 117.16 109.79 1p4h n TYR 185 Ca 0.02 -0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1p4h n TYR 185 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.28 1p4h n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1p4h n GLY 186 N 0.99 0.21 3.05 2.72 0.00 0.25 -4.96 105.19 107.45 1p4h n GLY 186 Ca 0.13 -1.64 -0.32 0.00 0.00 0.00 0.00 46.02 44.20 1p4h n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1p4h s ASN 187 N -1.42 4.60 0.31 1.61 2.47 -1.26 -4.90 114.94 116.35 1p4h s ASN 187 Ca 0.00 -1.76 0.26 0.00 0.42 0.00 0.00 52.86 51.78 1p4h s ASN 187 Cb 0.00 -1.59 1.03 0.00 -1.45 0.00 0.00 41.25 39.25 1p4h s ASN 187 CO 0.00 -0.28 1.76 1.55 -3.72 0.00 0.00 177.10 176.41 1p4h h PRO 188 N 7.70 0.00 0.00 0.43 0.13 -1.99 -3.21 132.00 135.06 1p4h h PRO 188 Ca -0.12 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.91 1p4h h PRO 188 Cb 1.03 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 1p4h h PRO 188 CO 0.49 0.00 -0.70 -1.49 -0.23 0.00 0.00 178.00 176.06 1p4h h TRP 189 N 0.00 0.00 -3.39 1.56 4.06 -1.95 -3.47 115.95 112.75 1p4h h TRP 189 Ca 0.00 0.00 -0.53 0.00 2.06 0.00 0.00 58.89 60.42 1p4h h TRP 189 Cb 0.42 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.56 1p4h h TRP 189 CO 0.00 0.44 -0.11 -1.83 -3.56 0.00 0.00 178.44 173.38 1p4h s GLU 190 N -3.00 3.76 -0.22 0.49 -1.05 -1.21 -4.25 118.70 113.22 1p4h s GLU 190 Ca 0.02 0.22 0.00 0.00 -0.15 0.00 0.00 54.97 55.07 1p4h s GLU 190 Cb 0.08 -2.63 0.05 0.00 -0.44 0.00 0.00 34.13 31.19 1p4h s GLU 190 CO 0.76 0.27 -0.06 0.21 0.95 0.00 0.00 175.26 177.39 1p4h s LYS 191 N -3.04 1.66 0.34 -4.83 2.47 0.67 -4.94 119.74 112.07 1p4h s LYS 191 Ca 0.47 -0.87 -0.29 0.00 -1.56 0.00 0.00 55.97 53.72 1p4h s LYS 191 Cb -0.11 -2.45 -0.10 0.00 -1.46 0.00 0.00 37.83 33.70 1p4h s LYS 191 CO 0.24 -0.54 1.35 0.00 0.16 0.00 0.00 175.35 176.56 1p4h s ALA 192 N 1.44 3.52 -0.48 3.13 0.00 -1.26 -0.92 121.76 127.19 1p4h s ALA 192 Ca -0.04 1.33 0.08 0.00 0.00 0.00 0.00 51.96 53.33 1p4h s ALA 192 Cb -0.18 -3.51 0.37 0.00 0.00 0.00 0.00 23.12 19.81 1p4h s ALA 192 CO -0.07 -0.73 0.93 0.54 0.00 0.00 0.00 175.76 176.44 1p4h n ARG 193 N 0.77 2.56 0.05 0.00 5.12 0.12 -4.91 116.66 120.37 1p4h n ARG 193 Ca 0.00 -4.30 0.21 0.00 -1.93 0.00 0.00 57.85 51.84 1p4h n ARG 193 Cb 0.41 -2.02 0.66 0.00 -1.16 0.00 0.00 32.46 30.35 1p4h n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1p4h h PRO 194 N 2.90 0.00 0.00 5.56 0.13 -1.93 0.16 132.00 138.82 1p4h h PRO 194 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1p4h h PRO 194 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1p4h h PRO 194 CO 0.72 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.54 1p4h h GLU 195 N 0.00 0.00 -0.50 0.86 9.09 -1.94 -2.66 114.58 119.43 1p4h h GLU 195 Ca 0.24 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.41 1p4h h GLU 195 Cb 1.53 0.00 -0.15 0.00 -1.65 0.00 0.00 28.75 28.49 1p4h h GLU 195 CO -0.00 0.00 0.10 1.19 0.05 0.00 0.00 179.01 180.34 1p4h n PHE 196 N -2.43 1.56 -2.11 2.06 0.99 0.56 -5.01 117.46 113.08 1p4h n PHE 196 Ca 0.01 -1.59 -0.41 0.00 -0.00 0.00 0.00 57.45 55.45 1p4h n PHE 196 Cb 0.20 -0.59 -0.02 0.00 -1.00 0.00 0.00 39.48 38.06 1p4h n PHE 196 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1p4h s THR 197 N -3.22 2.83 0.09 4.37 2.01 -1.01 -4.61 115.64 116.09 1p4h s THR 197 Ca 0.48 0.74 0.08 0.00 0.31 0.00 0.00 61.69 63.29 1p4h s THR 197 Cb 0.42 -3.47 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 1p4h s THR 197 CO 0.03 0.14 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.14 1p4h s LEU 198 N -0.82 2.27 0.08 4.42 1.02 -0.47 -4.93 118.68 120.25 1p4h s LEU 198 Ca 0.55 -0.64 -0.20 0.00 0.02 0.00 0.00 54.13 53.86 1p4h s LEU 198 Cb -0.40 -0.87 -0.07 0.00 0.02 0.00 0.00 46.19 44.88 1p4h s LEU 198 CO 0.45 0.07 0.58 -2.16 0.02 0.00 0.00 176.35 175.32 1p4h s PRO 199 N -1.72 4.22 -0.05 1.29 0.04 -1.26 0.75 135.00 138.27 1p4h s PRO 199 Ca 0.06 0.77 0.05 0.00 0.04 0.00 0.00 61.00 61.92 1p4h s PRO 199 Cb -0.10 -3.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.20 1p4h s PRO 199 CO 0.04 0.63 -0.21 0.08 0.04 0.00 0.00 177.00 177.58 1p4h s VAL 200 N -1.12 1.76 0.00 -0.36 1.01 0.74 -4.86 120.40 117.57 1p4h s VAL 200 Ca 0.30 -0.90 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 1p4h s VAL 200 Cb -0.20 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 1p4h s VAL 200 CO 0.20 0.50 0.10 -1.00 0.00 0.00 0.00 175.10 174.89 1p4h s HIS 201 N -0.06 3.32 0.06 5.22 3.76 -1.26 -0.83 115.29 125.50 1p4h s HIS 201 Ca -0.04 0.22 0.00 0.00 -0.15 0.00 0.00 55.06 55.09 1p4h s HIS 201 Cb -0.13 -1.74 -0.04 0.00 1.11 0.00 0.00 32.58 31.79 1p4h s HIS 201 CO 0.03 0.56 -0.05 -0.06 -0.85 0.00 0.00 174.74 174.38 1p4h s PHE 202 N -1.24 0.62 0.00 1.40 0.40 -0.19 -4.95 117.98 114.02 1p4h s PHE 202 Ca 0.24 -0.89 0.00 0.00 -0.60 0.00 0.00 56.93 55.68 1p4h s PHE 202 Cb -0.12 -0.41 0.00 0.00 0.51 0.00 0.00 43.02 43.00 1p4h s PHE 202 CO 0.16 -0.25 0.00 0.66 0.70 0.00 0.00 175.22 176.49 1p4h n TYR 203 N 0.40 0.00 -4.14 0.36 4.01 0.78 -0.67 117.16 117.89 1p4h n TYR 203 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1p4h n TYR 203 Cb 0.59 0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.66 1p4h n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1p4h n GLY 204 N 0.00 -1.31 3.55 2.72 0.00 -1.20 -4.56 105.19 104.38 1p4h n GLY 204 Ca 0.00 -1.27 -0.09 0.00 0.00 0.00 0.00 46.02 44.66 1p4h n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1p4h s ARG 205 N 0.00 1.49 -0.19 1.61 1.70 -0.18 -4.86 118.95 118.52 1p4h s ARG 205 Ca 0.00 -1.23 -0.05 0.00 -0.47 0.00 0.00 55.73 53.98 1p4h s ARG 205 Cb 0.00 0.46 -0.03 0.00 -0.57 0.00 0.00 34.95 34.81 1p4h s ARG 205 CO 0.00 -0.61 0.01 0.08 -1.08 0.00 0.00 175.30 173.70 1p4h s VAL 206 N -4.01 4.14 -0.15 4.99 1.01 -1.26 -1.04 120.40 124.08 1p4h s VAL 206 Ca 0.21 -0.25 -0.05 0.00 0.00 0.00 0.00 61.98 61.90 1p4h s VAL 206 Cb -0.00 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 1p4h s VAL 206 CO 0.07 0.44 -0.00 -1.61 0.00 0.00 0.00 175.10 174.00 1p4h s GLU 207 N 0.82 3.68 -0.50 2.72 2.02 0.17 -4.94 118.70 122.68 1p4h s GLU 207 Ca 0.01 -0.45 -0.10 0.00 0.02 0.00 0.00 54.97 54.45 1p4h s GLU 207 Cb -0.14 -2.99 0.13 0.00 0.10 0.00 0.00 34.13 31.23 1p4h s GLU 207 CO 0.02 0.31 0.39 -1.01 0.02 0.00 0.00 175.26 174.99 1p4h s HIS 208 N 0.20 3.42 0.61 1.61 3.76 -1.26 0.47 115.29 124.10 1p4h s HIS 208 Ca 0.00 -1.86 0.04 0.00 -0.15 0.00 0.00 55.06 53.09 1p4h s HIS 208 Cb -0.13 -3.54 0.11 0.00 1.11 0.00 0.00 32.58 30.14 1p4h s HIS 208 CO 0.02 -0.99 0.84 0.25 -0.85 0.00 0.00 174.74 174.01 1p4h n THR 209 N 4.83 0.00 0.11 1.30 -2.24 -0.67 -5.00 114.28 112.60 1p4h n THR 209 Ca -0.07 -1.58 -0.08 0.00 -2.27 0.00 0.00 64.05 60.05 1p4h n THR 209 Cb 0.41 -0.78 -0.05 0.00 -2.10 0.00 0.00 70.33 67.81 1p4h n THR 209 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1p4h h SER 210 N -0.29 -0.69 -2.17 3.42 0.87 -2.03 -3.28 113.55 109.39 1p4h h SER 210 Ca -0.28 0.06 -0.78 0.00 -1.23 0.00 0.00 61.79 59.57 1p4h h SER 210 Cb 1.13 0.24 -0.21 0.00 -0.44 0.00 0.00 62.40 63.12 1p4h h SER 210 CO 0.34 -0.29 1.40 0.00 -0.53 0.00 0.00 176.83 177.75 1p4h n GLN 211 N -3.81 3.86 0.00 2.24 3.00 -1.26 -4.96 117.38 116.45 1p4h n GLN 211 Ca -0.05 -3.98 0.00 0.00 -0.01 0.00 0.00 57.00 52.96 1p4h n GLN 211 Cb 0.21 -2.77 0.00 0.00 0.00 0.00 0.00 30.24 27.67 1p4h n GLN 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1p4h n GLY 212 N 2.48 2.04 3.87 1.08 0.00 -1.24 -5.04 105.19 108.39 1p4h n GLY 212 Ca 0.34 -1.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.05 1p4h n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p4h s ALA 213 N -2.59 3.75 0.00 4.61 0.00 -1.26 -1.68 121.76 124.60 1p4h s ALA 213 Ca 0.00 -0.42 0.06 0.00 0.00 0.00 0.00 51.96 51.60 1p4h s ALA 213 Cb 0.00 -2.23 -0.02 0.00 0.00 0.00 0.00 23.12 20.88 1p4h s ALA 213 CO 0.00 0.58 -0.19 0.15 0.00 0.00 0.00 175.76 176.30 1p4h s LYS 214 N -1.84 1.45 -0.41 0.00 1.02 0.18 -4.87 119.74 115.26 1p4h s LYS 214 Ca 0.31 -0.73 -0.13 0.00 0.02 0.00 0.00 55.97 55.44 1p4h s LYS 214 Cb -0.14 -1.44 0.03 0.00 -0.52 0.00 0.00 37.83 35.77 1p4h s LYS 214 CO 0.17 0.39 0.28 -0.46 -0.92 0.00 0.00 175.35 174.81 1p4h s TRP 215 N -0.54 3.25 0.45 3.18 -0.00 -1.26 0.44 118.94 124.45 1p4h s TRP 215 Ca 0.07 -0.80 0.04 0.00 -0.00 0.00 0.00 56.10 55.40 1p4h s TRP 215 Cb -0.08 -2.63 -0.04 0.00 -0.00 0.00 0.00 33.47 30.73 1p4h s TRP 215 CO -0.00 -0.65 0.02 0.14 -0.00 0.00 0.00 176.95 176.46 1p4h s VAL 216 N 1.62 1.39 -1.52 5.86 -7.23 -0.20 -4.80 120.40 115.52 1p4h s VAL 216 Ca 0.04 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.10 1p4h s VAL 216 Cb -0.20 -2.51 0.08 0.00 0.56 0.00 0.00 36.38 34.31 1p4h s VAL 216 CO 0.08 0.00 0.83 0.47 -0.31 0.00 0.00 175.10 176.18 1p4h n ASP 217 N -1.12 -3.42 -4.94 4.85 8.00 -1.26 -1.01 116.55 117.65 1p4h n ASP 217 Ca -0.12 -0.86 -0.25 0.00 0.71 0.00 0.00 54.79 54.28 1p4h n ASP 217 Cb 0.67 -3.57 0.00 0.00 -0.02 0.00 0.00 41.12 38.20 1p4h n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1p4h s THR 218 N -3.43 4.47 -0.11 -3.53 -4.23 -1.26 -3.27 115.64 104.27 1p4h s THR 218 Ca 0.50 -0.28 -0.14 0.00 -1.18 0.00 0.00 61.69 60.60 1p4h s THR 218 Cb -0.26 -3.67 -0.05 0.00 1.34 0.00 0.00 72.50 69.87 1p4h s THR 218 CO 0.86 -0.53 0.32 -1.58 -0.54 0.00 0.00 174.62 173.15 1p4h s GLN 219 N -4.58 4.09 -0.15 3.99 0.74 0.15 -4.89 119.66 119.00 1p4h s GLN 219 Ca 0.46 0.19 -0.05 0.00 0.05 0.00 0.00 55.36 56.01 1p4h s GLN 219 Cb -0.10 -3.35 -0.04 0.00 1.10 0.00 0.00 33.01 30.62 1p4h s GLN 219 CO 0.40 0.40 0.03 0.08 -0.55 0.00 0.00 175.29 175.65 1p4h s VAL 220 N -0.06 4.50 -0.06 1.34 1.01 -1.26 -1.02 120.40 124.84 1p4h s VAL 220 Ca 0.19 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1p4h s VAL 220 Cb -0.14 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1p4h s VAL 220 CO 0.07 0.50 -0.18 -0.69 0.00 0.00 0.00 175.10 174.80 1p4h s VAL 221 N 0.06 1.58 0.22 2.92 1.01 -0.01 -4.48 120.40 121.69 1p4h s VAL 221 Ca 0.04 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 61.05 1p4h s VAL 221 Cb -0.13 -1.37 -0.08 0.00 0.00 0.00 0.00 36.38 34.81 1p4h s VAL 221 CO 0.01 0.45 0.71 -0.76 0.00 0.00 0.00 175.10 175.52 1p4h s LEU 222 N 0.21 4.34 -0.31 3.92 1.43 0.12 -0.19 118.68 128.21 1p4h s LEU 222 Ca -0.09 1.40 -0.04 0.00 -1.03 0.00 0.00 54.13 54.36 1p4h s LEU 222 Cb -0.14 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.55 1p4h s LEU 222 CO 0.04 0.04 0.04 0.00 0.23 0.00 0.00 176.35 176.69 1p4h s ALA 223 N -1.52 2.90 -0.26 4.21 0.00 0.23 -0.48 121.76 126.84 1p4h s ALA 223 Ca 0.43 -1.68 -0.11 0.00 0.00 0.00 0.00 51.96 50.60 1p4h s ALA 223 Cb -0.17 -2.04 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 1p4h s ALA 223 CO 0.21 -1.19 0.17 1.41 0.00 0.00 0.00 175.76 176.36 1p4h s MET 224 N 1.34 4.01 0.22 0.00 1.75 0.80 -1.37 119.30 126.04 1p4h s MET 224 Ca -0.02 -0.30 -0.18 0.00 -1.25 0.00 0.00 55.69 53.94 1p4h s MET 224 Cb -0.19 -3.59 -0.08 0.00 2.84 0.00 0.00 34.83 33.81 1p4h s MET 224 CO 0.00 -0.06 0.68 -1.25 -0.65 0.00 0.00 175.02 173.74 1p4h s PRO 225 N 1.40 4.15 -0.12 4.11 0.04 -1.26 -0.11 135.00 143.21 1p4h s PRO 225 Ca 0.07 0.75 0.01 0.00 0.04 0.00 0.00 61.00 61.87 1p4h s PRO 225 Cb -0.15 -2.84 0.02 0.00 0.04 0.00 0.00 34.50 31.57 1p4h s PRO 225 CO 0.08 0.39 -0.14 0.71 0.04 0.00 0.00 177.00 178.07 1p4h s TYR 226 N -1.56 2.01 -0.16 0.56 1.51 0.02 -0.70 117.35 119.03 1p4h s TYR 226 Ca 0.43 -1.02 -0.09 0.00 -1.01 0.00 0.00 57.07 55.38 1p4h s TYR 226 Cb -0.15 -1.47 -0.05 0.00 -0.11 0.00 0.00 41.96 40.18 1p4h s TYR 226 CO 0.20 -0.55 0.14 -0.51 -1.11 0.00 0.00 175.55 173.72 1p4h s ASP 227 N 1.21 6.30 -0.09 2.29 -0.00 -0.10 -1.19 116.67 125.10 1p4h s ASP 227 Ca -0.02 0.35 0.04 0.00 -0.00 0.00 0.00 52.55 52.92 1p4h s ASP 227 Cb -0.14 -2.09 -0.00 0.00 -0.00 0.00 0.00 42.92 40.69 1p4h s ASP 227 CO -0.05 0.27 -0.23 -0.89 -0.00 0.00 0.00 175.17 174.27 1p4h s THR 228 N -0.23 1.95 0.35 -1.27 2.01 -0.03 -0.24 115.64 118.18 1p4h s THR 228 Ca 0.11 -0.96 -0.27 0.00 0.31 0.00 0.00 61.69 60.88 1p4h s THR 228 Cb -0.12 -1.68 -0.09 0.00 0.01 0.00 0.00 72.50 70.62 1p4h s THR 228 CO 0.01 0.54 1.13 -2.16 -0.69 0.00 0.00 174.62 173.44 1p4h s PRO 229 N 0.29 4.34 -0.40 4.92 0.04 -1.26 -1.05 135.00 141.87 1p4h s PRO 229 Ca -0.16 1.78 0.02 0.00 0.04 0.00 0.00 61.00 62.69 1p4h s PRO 229 Cb -0.17 -2.88 0.12 0.00 0.04 0.00 0.00 34.50 31.60 1p4h s PRO 229 CO 0.07 -0.06 0.16 0.08 0.04 0.00 0.00 177.00 177.30 1p4h s VAL 230 N -1.34 1.80 0.16 -0.36 1.01 0.72 -4.89 120.40 117.50 1p4h s VAL 230 Ca 0.52 -2.43 -0.30 0.00 0.00 0.00 0.00 61.98 59.77 1p4h s VAL 230 Cb -0.30 -2.29 -0.07 0.00 0.00 0.00 0.00 36.38 33.71 1p4h s VAL 230 CO 0.38 -0.75 1.08 -2.16 0.00 0.00 0.00 175.10 173.66 1p4h s PRO 231 N 0.62 4.60 0.83 2.72 0.04 -1.26 -0.15 135.00 142.40 1p4h s PRO 231 Ca 0.14 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.74 1p4h s PRO 231 Cb -0.22 -3.30 0.09 0.00 0.04 0.00 0.00 34.50 31.11 1p4h s PRO 231 CO -0.07 0.08 1.16 0.20 0.04 0.00 0.00 177.00 178.40 1p4h s GLY 232 N -0.03 1.59 -0.54 0.56 0.00 0.14 -4.76 107.32 104.28 1p4h s GLY 232 Ca 0.49 -0.57 -0.28 0.00 0.00 0.00 0.00 44.72 44.36 1p4h s GLY 232 CO 0.34 -0.08 1.31 -0.47 0.00 0.00 0.00 173.10 174.21 1p4h s TYR 233 N -3.46 2.45 -1.12 1.90 6.14 -1.26 -4.18 117.35 117.82 1p4h s TYR 233 Ca 0.62 0.50 -0.11 0.00 0.64 0.00 0.00 57.07 58.72 1p4h s TYR 233 Cb -0.12 -4.43 0.10 0.00 0.42 0.00 0.00 41.96 37.92 1p4h s TYR 233 CO 0.51 -1.79 0.38 0.54 0.64 0.00 0.00 175.55 175.83 1p4h n ARG 234 N 8.45 -2.55 -0.02 4.97 1.74 0.29 -4.80 116.66 124.74 1p4h n ARG 234 Ca 0.12 0.27 0.01 0.00 -0.77 0.00 0.00 57.85 57.47 1p4h n ARG 234 Cb 0.49 -4.89 0.02 0.00 -1.02 0.00 0.00 32.46 27.06 1p4h n ARG 234 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1p4h n ASN 235 N -2.13 1.83 -0.64 0.55 2.04 -1.26 -4.94 115.26 110.71 1p4h n ASN 235 Ca 0.02 -1.71 -0.08 0.00 -0.44 0.00 0.00 54.58 52.37 1p4h n ASN 235 Cb 0.51 -0.02 -0.04 0.00 -2.53 0.00 0.00 39.78 37.70 1p4h n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1p4h n ASN 236 N -0.21 -5.04 -4.80 0.53 3.02 -1.26 -0.86 115.26 106.64 1p4h n ASN 236 Ca 0.02 0.21 -0.37 0.00 -0.03 0.00 0.00 54.58 54.40 1p4h n ASN 236 Cb 0.20 -3.28 -0.06 0.00 -0.61 0.00 0.00 39.78 36.03 1p4h n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1p4h s VAL 237 N -1.97 5.19 -0.23 2.41 1.01 -1.26 -4.74 120.40 120.81 1p4h s VAL 237 Ca 0.00 0.68 -0.03 0.00 0.00 0.00 0.00 61.98 62.63 1p4h s VAL 237 Cb 0.00 -3.66 0.08 0.00 0.00 0.00 0.00 36.38 32.80 1p4h s VAL 237 CO 0.00 0.50 0.08 -0.69 0.00 0.00 0.00 175.10 174.99 1p4h s VAL 238 N -0.43 0.35 0.71 2.92 1.01 -1.26 0.23 120.40 123.93 1p4h s VAL 238 Ca 0.21 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 1p4h s VAL 238 Cb -0.15 -1.05 0.15 0.00 0.00 0.00 0.00 36.38 35.33 1p4h s VAL 238 CO 0.09 -0.41 0.97 0.59 0.00 0.00 0.00 175.10 176.34 1p4h n ASN 239 N 5.10 0.81 -4.24 3.32 3.02 0.79 -4.65 115.26 119.40 1p4h n ASN 239 Ca -0.07 -1.80 -0.29 0.00 -0.03 0.00 0.00 54.58 52.40 1p4h n ASN 239 Cb 0.46 -0.67 -0.16 0.00 -0.61 0.00 0.00 39.78 38.80 1p4h n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1p4h s THR 240 N -2.95 1.79 -0.26 3.41 2.01 -1.25 -0.20 115.64 118.18 1p4h s THR 240 Ca 0.60 -0.95 -0.03 0.00 0.31 0.00 0.00 61.69 61.62 1p4h s THR 240 Cb -0.03 -1.49 0.02 0.00 0.01 0.00 0.00 72.50 71.01 1p4h s THR 240 CO 0.41 0.50 -0.03 -0.32 -0.69 0.00 0.00 174.62 174.49 1p4h s MET 241 N -0.40 2.87 -0.30 4.92 1.75 -0.21 -1.82 119.30 126.11 1p4h s MET 241 Ca 0.05 -0.96 -0.08 0.00 -1.25 0.00 0.00 55.69 53.45 1p4h s MET 241 Cb -0.10 -3.07 -0.00 0.00 2.84 0.00 0.00 34.83 34.50 1p4h s MET 241 CO 0.00 -0.42 0.11 0.50 -0.65 0.00 0.00 175.02 174.56 1p4h s ARG 242 N 1.36 3.24 -0.17 4.11 3.52 0.15 -0.85 118.95 130.31 1p4h s ARG 242 Ca 0.00 -0.77 -0.05 0.00 -0.13 0.00 0.00 55.73 54.79 1p4h s ARG 242 Cb -0.17 -3.44 -0.03 0.00 -1.56 0.00 0.00 34.95 29.75 1p4h s ARG 242 CO -0.03 -0.41 0.00 -0.51 -0.81 0.00 0.00 175.30 173.55 1p4h s LEU 243 N 1.55 3.46 0.09 -0.88 1.02 -0.33 -2.05 118.68 121.55 1p4h s LEU 243 Ca 0.04 -0.06 -0.19 0.00 0.02 0.00 0.00 54.13 53.94 1p4h s LEU 243 Cb -0.17 -1.86 -0.07 0.00 0.02 0.00 0.00 46.19 44.12 1p4h s LEU 243 CO 0.04 0.16 0.57 0.26 0.02 0.00 0.00 176.35 177.40 1p4h s TRP 244 N 0.44 3.77 -0.06 0.29 0.52 -0.08 -0.80 118.94 123.03 1p4h s TRP 244 Ca -0.01 1.25 0.06 0.00 0.02 0.00 0.00 56.10 57.42 1p4h s TRP 244 Cb -0.14 -2.48 -0.01 0.00 -1.15 0.00 0.00 33.47 29.69 1p4h s TRP 244 CO 0.02 0.55 -0.25 0.45 0.02 0.00 0.00 176.95 177.74 1p4h s SER 245 N -1.23 3.02 0.01 2.95 0.15 0.84 -0.73 113.70 118.72 1p4h s SER 245 Ca 0.31 -0.50 -0.30 0.00 0.70 0.00 0.00 55.95 56.16 1p4h s SER 245 Cb -0.19 -0.81 -0.03 0.00 -1.71 0.00 0.00 66.02 63.27 1p4h s SER 245 CO 0.19 0.24 0.96 0.00 1.20 0.00 0.00 173.24 175.83 1p4h s ALA 246 N -0.17 3.19 -0.01 5.45 0.00 -1.26 -0.14 121.76 128.81 1p4h s ALA 246 Ca -0.03 0.52 0.02 0.00 0.00 0.00 0.00 51.96 52.47 1p4h s ALA 246 Cb -0.14 -3.30 -0.00 0.00 0.00 0.00 0.00 23.12 19.68 1p4h s ALA 246 CO 0.03 -0.19 -0.08 0.15 0.00 0.00 0.00 175.76 175.68 1p4h s LYS 247 N 0.84 0.69 0.21 0.00 -0.14 0.36 -4.60 119.74 117.10 1p4h s LYS 247 Ca 0.50 -0.28 -0.22 0.00 -1.36 0.00 0.00 55.97 54.62 1p4h s LYS 247 Cb -0.21 -0.67 -0.08 0.00 -1.68 0.00 0.00 37.83 35.19 1p4h s LYS 247 CO 0.28 0.15 0.75 0.00 -0.76 0.00 0.00 175.35 175.77 1p4h s ALA 248 N -0.09 3.41 0.77 5.17 0.00 -1.26 0.14 121.76 129.89 1p4h s ALA 248 Ca 0.02 0.24 -0.12 0.00 0.00 0.00 0.00 51.96 52.10 1p4h s ALA 248 Cb -0.04 -2.88 0.06 0.00 0.00 0.00 0.00 23.12 20.26 1p4h s ALA 248 CO -0.00 0.31 1.12 -1.25 0.00 0.00 0.00 175.76 175.94 1p4h s PRO 249 N -1.76 2.10 0.41 0.00 0.04 -1.26 -4.87 135.00 129.66 1p4h s PRO 249 Ca 0.42 1.37 0.28 0.00 0.04 0.00 0.00 61.00 63.10 1p4h s PRO 249 Cb -0.18 -1.87 0.99 0.00 0.04 0.00 0.00 34.50 33.48 1p4h s PRO 249 CO 0.22 -1.79 1.81 -0.91 0.04 0.00 0.00 177.00 176.38 1p4h h ASN 250 N -0.93 0.00 -0.68 6.66 2.35 -1.99 -2.63 115.58 118.36 1p4h h ASN 250 Ca -0.45 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.16 1p4h h ASN 250 Cb 1.25 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.53 1p4h h ASN 250 CO 0.50 0.00 0.19 -0.90 -1.65 0.00 0.00 177.43 175.56 1p4h n ASP 251 N -2.77 5.04 -4.71 5.81 5.75 -1.26 -4.82 116.55 119.58 1p4h n ASP 251 Ca 0.02 -3.09 -0.42 0.00 -0.01 0.00 0.00 54.79 51.29 1p4h n ASP 251 Cb 0.35 -0.72 -0.03 0.00 -1.03 0.00 0.00 41.12 39.68 1p4h n ASP 251 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1p4h s PHE 252 N -2.84 3.27 0.00 2.11 5.36 -0.99 -2.01 117.98 122.88 1p4h s PHE 252 Ca 0.53 1.03 0.00 0.00 -0.96 0.00 0.00 56.93 57.53 1p4h s PHE 252 Cb 0.42 -3.62 0.00 0.00 -0.34 0.00 0.00 43.02 39.48 1p4h s PHE 252 CO 0.14 -2.13 0.00 0.09 -1.46 0.00 0.00 175.22 171.86 1p4h n ASN 253 N 4.01 0.00 -4.06 6.13 3.02 -1.26 -4.79 115.26 118.31 1p4h n ASN 253 Ca 0.11 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.34 1p4h n ASN 253 Cb 0.43 -2.06 -0.15 0.00 -0.61 0.00 0.00 39.78 37.39 1p4h n ASN 253 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1p4h s LEU 254 N 0.00 3.06 0.00 3.41 1.43 -0.85 -4.86 118.68 120.87 1p4h s LEU 254 Ca 0.00 -1.22 0.00 0.00 -1.03 0.00 0.00 54.13 51.88 1p4h s LEU 254 Cb 0.00 -1.48 0.00 0.00 0.03 0.00 0.00 46.19 44.74 1p4h s LEU 254 CO 0.00 -0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.03 1p4h n GLY 261 N 4.50 -1.00 0.17 -3.19 0.00 -1.26 -5.01 105.19 99.40 1p4h n GLY 261 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 1p4h n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1p4h h TYR 262 N 0.00 -0.32 -0.25 1.61 3.20 -1.99 -1.31 116.97 117.90 1p4h h TYR 262 Ca 0.00 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.93 1p4h h TYR 262 Cb 0.00 0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 1p4h h TYR 262 CO 0.00 -0.19 -0.05 0.82 -1.64 0.00 0.00 178.16 177.10 1p4h h ILE 263 N -0.21 0.77 -0.82 1.81 1.08 -2.02 -2.23 117.51 115.90 1p4h h ILE 263 Ca 0.05 -0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 1p4h h ILE 263 Cb 0.27 0.75 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 1p4h h ILE 263 CO -0.14 0.00 0.52 1.56 -0.69 0.00 0.00 178.15 179.40 1p4h h GLN 264 N 0.01 0.98 -0.78 2.37 1.08 -1.95 -0.99 115.11 115.83 1p4h h GLN 264 Ca 0.12 -0.06 0.01 0.00 -1.45 0.00 0.00 58.65 57.27 1p4h h GLN 264 Cb 0.18 -0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 27.34 1p4h h GLN 264 CO -0.24 0.65 0.52 0.00 -0.95 0.00 0.00 178.83 178.80 1p4h h ALA 265 N 1.34 1.00 -0.49 3.87 0.00 -0.82 0.11 119.26 124.28 1p4h h ALA 265 Ca 0.33 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 1p4h h ALA 265 Cb 0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1p4h h ALA 265 CO -0.12 0.39 -0.02 0.28 0.00 0.00 0.00 179.25 179.79 1p4h h VAL 266 N 1.05 1.26 -0.05 0.00 2.07 -0.81 -2.94 116.25 116.83 1p4h h VAL 266 Ca 0.29 -1.10 -0.10 0.00 0.82 0.00 0.00 66.70 66.62 1p4h h VAL 266 Cb -0.11 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1p4h h VAL 266 CO -0.07 0.38 -0.41 -0.07 0.02 0.00 0.00 177.57 177.43 1p4h h LEU 267 N 0.73 0.12 0.00 2.57 3.38 -0.70 -2.70 115.31 118.70 1p4h h LEU 267 Ca 0.14 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1p4h h LEU 267 Cb 0.54 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1p4h h LEU 267 CO 0.03 0.52 0.00 0.47 0.09 0.00 0.00 178.44 179.54 1p4h n ASP 268 N -4.04 0.00 0.25 -0.43 8.00 0.35 -2.75 116.55 117.93 1p4h n ASP 268 Ca -0.02 -0.41 0.07 0.00 0.71 0.00 0.00 54.79 55.15 1p4h n ASP 268 Cb 0.46 -0.11 0.60 0.00 -0.02 0.00 0.00 41.12 42.05 1p4h n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1p4h h ARG 269 N 0.00 0.00 -0.05 -1.24 3.08 -1.48 -1.69 114.38 112.99 1p4h h ARG 269 Ca 0.00 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.07 1p4h h ARG 269 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1p4h h ARG 269 CO 0.00 0.07 0.07 -0.91 -1.07 0.00 0.00 179.97 178.13 1p4h h ASN 270 N 0.00 0.00 -0.61 7.04 2.35 -1.75 -1.57 115.58 121.04 1p4h h ASN 270 Ca -0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1p4h h ASN 270 Cb 0.14 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.48 1p4h h ASN 270 CO 0.01 0.00 0.37 -0.07 -1.65 0.00 0.00 177.43 176.09 1p4h h LEU 271 N 0.00 0.74 -0.27 1.61 4.07 -1.56 -0.88 115.31 119.03 1p4h h LEU 271 Ca 0.02 -0.06 -0.21 0.00 0.08 0.00 0.00 57.88 57.71 1p4h h LEU 271 Cb 0.16 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.71 1p4h h LEU 271 CO -0.00 0.59 -0.77 0.00 -1.08 0.00 0.00 178.44 177.17 1p4h h ALA 272 N 1.19 0.44 0.00 1.53 0.00 -1.46 -3.19 119.26 117.77 1p4h h ALA 272 Ca 0.22 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1p4h h ALA 272 Cb -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1p4h h ALA 272 CO -0.04 0.73 0.00 0.39 0.00 0.00 0.00 179.25 180.33 1p4h n GLU 273 N -3.88 0.12 0.28 0.00 1.02 -1.05 -3.15 120.64 113.99 1p4h n GLU 273 Ca -0.06 0.04 0.18 0.00 -0.02 0.00 0.00 57.16 57.30 1p4h n GLU 273 Cb 0.74 -1.50 0.82 0.00 -0.02 0.00 0.00 31.44 31.48 1p4h n GLU 273 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1p4h h ASN 274 N 0.00 0.00 -0.96 1.62 2.35 -1.14 -3.09 115.58 114.36 1p4h h ASN 274 Ca 0.00 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 55.88 1p4h h ASN 274 Cb 0.39 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.67 1p4h h ASN 274 CO 0.00 0.00 0.58 0.40 -1.65 0.00 0.00 177.43 176.76 1p4h h ILE 275 N 0.00 0.86 -0.42 2.81 2.04 -1.75 -1.66 117.51 119.38 1p4h h ILE 275 Ca 0.00 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 1p4h h ILE 275 Cb 0.33 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1p4h h ILE 275 CO 0.00 0.16 0.01 -1.54 0.00 0.00 0.00 178.15 176.78 1p4h n SER 276 N -4.70 4.72 -0.04 1.72 3.41 -1.17 -4.65 113.62 112.92 1p4h n SER 276 Ca 0.19 -3.01 -0.14 0.00 -0.26 0.00 0.00 58.87 55.65 1p4h n SER 276 Cb 0.39 -0.62 -0.09 0.00 -0.26 0.00 0.00 64.21 63.63 1p4h n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1p4h h ARG 277 N 2.78 0.32 -3.35 4.33 9.65 -1.38 -1.94 114.38 124.78 1p4h h ARG 277 Ca 0.01 -0.23 -0.15 0.00 -1.10 0.00 0.00 59.98 58.52 1p4h h ARG 277 Cb 1.73 0.04 -0.22 0.00 -1.39 0.00 0.00 29.97 30.12 1p4h h ARG 277 CO 0.37 0.84 -0.45 0.54 2.80 0.00 0.00 179.97 184.07 1p4h s VAL 278 N -3.82 0.05 0.07 0.20 0.11 -1.26 -0.74 120.40 115.01 1p4h s VAL 278 Ca -0.14 -0.45 -0.30 0.00 -2.93 0.00 0.00 61.98 58.15 1p4h s VAL 278 Cb 0.04 -0.42 -0.05 0.00 -1.53 0.00 0.00 36.38 34.42 1p4h s VAL 278 CO 0.76 -0.25 0.97 -0.22 -3.33 0.00 0.00 175.10 173.03 1p4h s LEU 279 N -0.94 4.45 -0.06 2.54 2.96 -0.85 -4.99 118.68 121.79 1p4h s LEU 279 Ca -0.10 1.74 -0.30 0.00 -0.22 0.00 0.00 54.13 55.25 1p4h s LEU 279 Cb -0.05 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 1p4h s LEU 279 CO 0.02 -0.14 1.49 -0.31 -1.32 0.00 0.00 176.35 176.09 1p4h s TYR 280 N 0.39 2.44 -0.24 5.38 1.51 -1.26 -4.85 117.35 120.72 1p4h s TYR 280 Ca 0.49 0.56 0.00 0.00 -1.01 0.00 0.00 57.07 57.11 1p4h s TYR 280 Cb -0.22 -3.75 0.00 0.00 -0.11 0.00 0.00 41.96 37.87 1p4h s TYR 280 CO 0.29 -2.97 0.78 -0.35 -1.11 0.00 0.00 175.55 172.19 1p4h n PRO 281 N 6.46 0.89 -3.58 -1.71 -0.04 -1.26 -4.88 135.00 130.88 1p4h n PRO 281 Ca 0.15 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.25 1p4h n PRO 281 Cb 0.43 -1.15 -0.07 0.00 -0.04 0.00 0.00 33.50 32.67 1p4h n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1p4h s ASN 282 N 0.73 6.40 -0.26 3.54 0.01 -1.26 -4.44 114.94 119.66 1p4h s ASN 282 Ca 0.00 0.46 -0.05 0.00 -0.71 0.00 0.00 52.86 52.56 1p4h s ASN 282 Cb 0.00 -2.16 0.00 0.00 0.41 0.00 0.00 41.25 39.50 1p4h s ASN 282 CO 0.00 0.13 0.01 -0.62 -1.51 0.00 0.00 177.10 175.11 1p4h s ASP 283 N 0.38 4.71 -1.34 -1.22 2.15 -1.26 -4.62 116.67 115.46 1p4h s ASP 283 Ca 0.15 -0.56 -0.06 0.00 0.43 0.00 0.00 52.55 52.51 1p4h s ASP 283 Cb -0.13 -1.80 0.02 0.00 -0.30 0.00 0.00 42.92 40.71 1p4h s ASP 283 CO 0.03 -0.10 1.05 -3.20 -0.17 0.00 0.00 175.17 172.77 1p4h n ASN 284 N 4.82 -4.36 -3.69 -0.34 2.85 -1.26 -4.99 115.26 108.28 1p4h n ASN 284 Ca -0.16 -0.64 -0.11 0.00 -0.11 0.00 0.00 54.58 53.56 1p4h n ASN 284 Cb 0.49 -4.74 -0.10 0.00 1.24 0.00 0.00 39.78 36.67 1p4h n ASN 284 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 1p4h s PHE 285 N -3.37 -0.65 -0.19 1.20 5.36 -1.26 -4.25 117.98 114.81 1p4h s PHE 285 Ca 0.38 1.44 -0.11 0.00 -0.96 0.00 0.00 56.93 57.68 1p4h s PHE 285 Cb -0.17 0.29 -0.05 0.00 -0.34 0.00 0.00 43.02 42.75 1p4h s PHE 285 CO 0.76 -0.34 0.17 0.12 -1.46 0.00 0.00 175.22 174.47 1p4h s PHE 286 N 0.96 3.42 -0.24 10.12 5.99 0.18 -4.87 117.98 133.54 1p4h s PHE 286 Ca -0.06 0.39 0.01 0.00 0.00 0.00 0.00 56.93 57.28 1p4h s PHE 286 Cb -0.06 -2.21 0.06 0.00 0.00 0.00 0.00 43.02 40.81 1p4h s PHE 286 CO -0.08 0.26 -0.07 -2.00 -0.00 0.00 0.00 175.22 173.33 1p4h s GLU 287 N 0.44 1.82 -1.37 10.12 2.12 -1.26 -4.95 118.70 125.63 1p4h s GLU 287 Ca 0.10 -1.06 -0.11 0.00 0.36 0.00 0.00 54.97 54.26 1p4h s GLU 287 Cb -0.12 -2.64 -0.06 0.00 0.26 0.00 0.00 34.13 31.58 1p4h s GLU 287 CO -0.00 -0.57 2.51 0.41 -0.54 0.00 0.00 175.26 177.07 1p4h n GLY 288 N 4.61 3.92 3.87 -1.50 0.00 -1.26 -4.93 105.19 109.91 1p4h n GLY 288 Ca -0.13 -1.38 -0.36 0.00 0.00 0.00 0.00 46.02 44.15 1p4h n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p4h s LYS 289 N 2.95 3.60 0.20 1.61 -0.14 -1.26 -5.00 119.74 121.70 1p4h s LYS 289 Ca 0.57 -0.00 -0.10 0.00 -1.36 0.00 0.00 55.97 55.07 1p4h s LYS 289 Cb 0.15 -3.13 0.25 0.00 -1.68 0.00 0.00 37.83 33.41 1p4h s LYS 289 CO -0.05 0.69 1.75 1.49 -0.76 0.00 0.00 175.35 178.48 1p4h h GLU 290 N 4.40 0.42 -1.00 1.68 4.81 -2.00 -1.88 114.58 121.01 1p4h h GLU 290 Ca -0.52 -0.03 0.13 0.00 -0.13 0.00 0.00 59.36 58.81 1p4h h GLU 290 Cb 1.21 -0.10 -0.09 0.00 0.63 0.00 0.00 28.75 30.41 1p4h h GLU 290 CO 0.63 0.28 0.63 1.25 -0.73 0.00 0.00 179.01 181.07 1p4h h LEU 291 N 0.44 0.91 -0.55 1.64 5.85 -1.98 0.32 115.31 121.93 1p4h h LEU 291 Ca 0.29 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.98 1p4h h LEU 291 Cb 0.32 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1p4h h LEU 291 CO -0.27 0.47 0.04 -0.09 -0.34 0.00 0.00 178.44 178.25 1p4h h ARG 292 N 0.97 0.94 -0.62 1.25 9.65 -1.72 -1.21 114.38 123.63 1p4h h ARG 292 Ca 0.50 -0.28 -0.05 0.00 -1.10 0.00 0.00 59.98 59.05 1p4h h ARG 292 Cb 0.53 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.98 1p4h h ARG 292 CO -0.27 0.93 0.17 1.25 2.80 0.00 0.00 179.97 184.85 1p4h h LEU 293 N 0.82 0.90 -0.71 3.80 5.85 -0.76 -1.26 115.31 123.95 1p4h h LEU 293 Ca 0.16 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1p4h h LEU 293 Cb 0.48 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1p4h h LEU 293 CO 0.02 0.86 0.29 0.11 -0.34 0.00 0.00 178.44 179.38 1p4h h LYS 294 N 0.93 1.05 -0.65 1.25 1.57 -0.62 -1.58 116.57 118.52 1p4h h LYS 294 Ca 0.20 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1p4h h LYS 294 Cb 0.30 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1p4h h LYS 294 CO -0.00 0.86 0.34 1.96 -0.57 0.00 0.00 179.45 182.04 1p4h h GLN 295 N 1.01 0.93 -0.53 3.15 4.20 -0.63 0.79 115.11 124.03 1p4h h GLN 295 Ca 0.24 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 1p4h h GLN 295 Cb 0.20 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1p4h h GLN 295 CO -0.02 0.72 0.22 0.93 -0.67 0.00 0.00 178.83 180.01 1p4h h GLU 296 N 0.90 0.78 -0.10 1.46 5.08 -0.87 -2.04 114.58 119.79 1p4h h GLU 296 Ca 0.23 -0.14 -0.18 0.00 -1.00 0.00 0.00 59.36 58.27 1p4h h GLU 296 Cb 0.08 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 1p4h h GLU 296 CO -0.03 0.68 -0.71 -0.92 -1.00 0.00 0.00 179.01 177.02 1p4h h TYR 297 N 0.71 0.61 0.07 4.33 3.20 -1.10 -2.83 116.97 121.95 1p4h h TYR 297 Ca 0.18 -0.26 0.02 0.00 3.14 0.00 0.00 58.73 61.81 1p4h h TYR 297 Cb 0.18 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 1p4h h TYR 297 CO 0.00 1.02 -0.22 0.35 -1.64 0.00 0.00 178.16 177.67 1p4h h PHE 298 N 0.31 -0.60 -0.73 -3.82 3.57 -0.62 0.39 116.94 115.45 1p4h h PHE 298 Ca -0.03 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.43 1p4h h PHE 298 Cb 1.29 0.26 -0.03 0.00 2.79 0.00 0.00 35.95 40.25 1p4h h PHE 298 CO 0.05 -0.32 0.24 -0.24 -2.23 0.00 0.00 178.31 175.81 1p4h h VAL 299 N -0.39 1.26 -0.05 1.41 3.04 -1.42 -2.41 116.25 117.69 1p4h h VAL 299 Ca 0.04 -0.89 -0.01 0.00 -1.01 0.00 0.00 66.70 64.84 1p4h h VAL 299 Cb 0.44 0.44 -0.00 0.00 -2.01 0.00 0.00 31.29 30.16 1p4h h VAL 299 CO -0.16 0.35 -0.00 0.58 -1.01 0.00 0.00 177.57 177.33 1p4h h VAL 300 N 1.09 1.27 -0.18 1.51 2.07 -1.20 -1.92 116.25 118.89 1p4h h VAL 300 Ca 0.24 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1p4h h VAL 300 Cb 0.29 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1p4h h VAL 300 CO -0.01 0.22 0.09 0.00 0.02 0.00 0.00 177.57 177.90 1p4h h ALA 301 N 0.69 0.23 -0.31 1.67 0.00 -0.21 -1.49 119.26 119.83 1p4h h ALA 301 Ca 0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1p4h h ALA 301 Cb 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1p4h h ALA 301 CO 0.00 -0.23 0.06 0.00 0.00 0.00 0.00 179.25 179.09 1p4h h ALA 302 N 0.98 0.41 -0.16 0.00 0.00 -1.50 -2.97 119.26 116.02 1p4h h ALA 302 Ca 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1p4h h ALA 302 Cb 0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1p4h h ALA 302 CO -0.01 0.09 0.10 1.15 0.00 0.00 0.00 179.25 180.59 1p4h h THR 303 N 0.34 1.03 -0.88 0.00 2.02 -1.28 -2.57 112.91 111.58 1p4h h THR 303 Ca 0.10 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.21 1p4h h THR 303 Cb 0.33 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 1p4h h THR 303 CO 0.00 0.04 0.58 -0.07 0.37 0.00 0.00 175.52 176.44 1p4h h LEU 304 N 0.21 1.01 -0.81 2.58 3.38 -1.28 0.11 115.31 120.50 1p4h h LEU 304 Ca 0.06 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1p4h h LEU 304 Cb -0.02 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 1p4h h LEU 304 CO -0.02 0.73 0.31 1.56 0.09 0.00 0.00 178.44 181.11 1p4h h GLN 305 N 1.19 1.18 -0.52 1.13 4.20 -1.37 -0.02 115.11 120.90 1p4h h GLN 305 Ca 0.32 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.77 1p4h h GLN 305 Cb -0.13 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.44 1p4h h GLN 305 CO -0.07 0.96 0.15 0.22 -0.67 0.00 0.00 178.83 179.42 1p4h h ASP 306 N 1.15 0.77 -0.06 1.46 -0.00 -0.90 0.06 116.42 118.91 1p4h h ASP 306 Ca 0.26 -0.22 -0.00 0.00 -0.00 0.00 0.00 57.03 57.07 1p4h h ASP 306 Cb 0.23 -0.20 -0.00 0.00 -0.00 0.00 0.00 39.33 39.35 1p4h h ASP 306 CO -0.02 0.79 0.03 0.40 -0.00 0.00 0.00 179.24 180.44 1p4h h ILE 307 N 0.72 1.11 -0.62 2.25 2.04 -0.30 -1.62 117.51 121.09 1p4h h ILE 307 Ca 0.17 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.66 1p4h h ILE 307 Cb 0.30 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 1p4h h ILE 307 CO -0.00 0.09 0.17 0.40 0.00 0.00 0.00 178.15 178.81 1p4h h ILE 308 N -0.02 1.25 -0.05 -0.67 2.04 -0.92 -0.76 117.51 118.39 1p4h h ILE 308 Ca 0.02 -0.89 0.03 0.00 1.00 0.00 0.00 64.86 65.03 1p4h h ILE 308 Cb 0.12 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.80 1p4h h ILE 308 CO -0.00 0.34 -0.17 -0.09 0.00 0.00 0.00 178.15 178.22 1p4h h ARG 309 N 0.90 -0.25 -0.48 2.37 2.43 -0.86 0.19 114.38 118.68 1p4h h ARG 309 Ca 0.20 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1p4h h ARG 309 Cb 0.33 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1p4h h ARG 309 CO -0.00 -0.17 0.31 -0.09 -1.51 0.00 0.00 179.97 178.51 1p4h h ARG 310 N -0.26 0.63 -0.15 0.20 2.43 -1.05 -2.26 114.38 113.93 1p4h h ARG 310 Ca 0.07 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 1p4h h ARG 310 Cb 0.36 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1p4h h ARG 310 CO -0.20 0.43 -0.08 0.35 -1.51 0.00 0.00 179.97 178.95 1p4h h PHE 311 N 0.65 0.37 0.00 2.20 3.57 0.12 -2.95 116.94 120.90 1p4h h PHE 311 Ca 0.18 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.58 1p4h h PHE 311 Cb -0.06 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1p4h h PHE 311 CO 0.00 0.66 0.00 0.87 -2.23 0.00 0.00 178.31 177.61 1p4h h LYS 312 N -0.02 0.00 -0.63 1.11 1.57 -0.30 -1.46 116.57 116.84 1p4h h LYS 312 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1p4h h LYS 312 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1p4h h LYS 312 CO 0.02 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.33 1p4h n SER 313 N -2.94 3.83 0.40 0.86 7.64 -0.89 -5.10 113.62 117.42 1p4h n SER 313 Ca -0.01 -2.23 -0.16 0.00 1.01 0.00 0.00 58.87 57.47 1p4h n SER 313 Cb 0.18 -0.49 -0.08 0.00 -1.01 0.00 0.00 64.21 62.81 1p4h n SER 313 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1p4h h SER 314 N 3.56 -0.87 -2.79 6.43 0.02 -1.19 -3.50 113.55 115.20 1p4h h SER 314 Ca 0.00 0.02 -0.61 0.00 -0.84 0.00 0.00 61.79 60.37 1p4h h SER 314 Cb 1.11 0.23 -0.40 0.00 0.14 0.00 0.00 62.40 63.47 1p4h h SER 314 CO 0.12 -0.51 -0.75 -0.89 -1.14 0.00 0.00 176.83 173.66 1p4h s THR 324 N -5.03 1.73 -0.49 -2.27 2.01 -1.26 -5.08 115.64 105.24 1p4h s THR 324 Ca -0.16 -3.51 -0.27 0.00 0.31 0.00 0.00 61.69 58.06 1p4h s THR 324 Cb 0.02 -2.15 0.03 0.00 0.01 0.00 0.00 72.50 70.40 1p4h s THR 324 CO 0.48 -1.10 1.01 0.20 -0.69 0.00 0.00 174.62 174.52 1p4h s ASN 325 N -0.74 6.51 0.00 3.53 0.02 -1.26 -4.88 114.94 118.13 1p4h s ASN 325 Ca 0.28 0.15 0.13 0.00 -1.02 0.00 0.00 52.86 52.40 1p4h s ASN 325 Cb -0.01 -2.49 0.79 0.00 0.02 0.00 0.00 41.25 39.56 1p4h s ASN 325 CO -0.18 -1.18 1.43 0.49 0.02 0.00 0.00 177.10 177.68 1p4h n PHE 326 N 7.53 0.00 0.24 2.20 3.72 -1.26 -3.46 117.46 126.43 1p4h n PHE 326 Ca 0.07 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.57 1p4h n PHE 326 Cb 0.49 0.00 0.62 0.00 -0.94 0.00 0.00 39.48 39.65 1p4h n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1p4h h ASP 327 N 0.00 0.00 0.21 4.37 3.32 -1.98 -1.04 116.42 121.30 1p4h h ASP 327 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1p4h h ASP 327 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1p4h h ASP 327 CO 0.00 0.16 -0.22 0.00 -1.72 0.00 0.00 179.24 177.46 1p4h n ALA 328 N -2.38 3.00 -0.11 3.45 0.00 -1.22 -4.35 120.51 118.90 1p4h n ALA 328 Ca -0.02 -0.41 -0.06 0.00 0.00 0.00 0.00 53.44 52.96 1p4h n ALA 328 Cb 0.25 -1.14 0.01 0.00 0.00 0.00 0.00 19.45 18.56 1p4h n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1p4h h PHE 329 N 1.34 -0.49 0.00 0.00 3.04 -1.41 -0.09 116.94 119.33 1p4h h PHE 329 Ca 0.00 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.99 1p4h h PHE 329 Cb 0.50 0.27 0.00 0.00 2.56 0.00 0.00 35.95 39.29 1p4h h PHE 329 CO 0.00 -0.27 0.00 -1.35 -2.02 0.00 0.00 178.31 174.67 1p4h h PRO 330 N -0.13 0.00 0.00 6.41 0.11 -1.77 0.24 132.00 136.86 1p4h h PRO 330 Ca 0.19 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.27 1p4h h PRO 330 Cb 0.42 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 1p4h h PRO 330 CO -0.46 0.00 -0.43 -0.44 -0.21 0.00 0.00 178.00 176.46 1p4h h ASP 331 N 0.00 0.00 -0.00 -2.05 3.32 -1.30 -3.33 116.42 113.06 1p4h h ASP 331 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1p4h h ASP 331 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1p4h h ASP 331 CO 0.00 0.13 -0.43 0.29 -1.72 0.00 0.00 179.24 177.50 1p4h n LYS 332 N -3.00 3.68 -4.13 3.56 4.76 -0.57 -4.55 118.16 117.90 1p4h n LYS 332 Ca 0.02 -0.05 -0.17 0.00 -2.87 0.00 0.00 58.31 55.24 1p4h n LYS 332 Cb 0.59 -0.97 -0.15 0.00 -1.84 0.00 0.00 35.03 32.67 1p4h n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1p4h s VAL 333 N -1.86 0.40 -0.05 -0.18 1.01 0.73 -0.93 120.40 119.52 1p4h s VAL 333 Ca 0.04 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1p4h s VAL 333 Cb 0.07 -0.37 0.02 0.00 0.00 0.00 0.00 36.38 36.10 1p4h s VAL 333 CO 0.38 0.14 -0.05 0.00 0.00 0.00 0.00 175.10 175.58 1p4h s ALA 334 N 0.23 0.76 -0.22 5.51 0.00 -0.62 -4.49 121.76 122.93 1p4h s ALA 334 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.82 1p4h s ALA 334 Cb -0.06 -0.50 0.03 0.00 0.00 0.00 0.00 23.12 22.58 1p4h s ALA 334 CO -0.00 -0.09 -0.13 0.42 0.00 0.00 0.00 175.76 175.96 1p4h s ILE 335 N 1.08 2.42 -0.26 0.00 1.01 -0.00 -0.30 121.20 125.16 1p4h s ILE 335 Ca -0.08 -1.09 -0.09 0.00 0.00 0.00 0.00 60.65 59.38 1p4h s ILE 335 Cb -0.14 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 1p4h s ILE 335 CO -0.01 0.30 0.14 -1.58 0.00 0.00 0.00 174.94 173.79 1p4h s GLN 336 N 1.27 3.88 -0.40 2.79 2.00 0.04 -1.45 119.66 127.78 1p4h s GLN 336 Ca 0.00 -0.37 -0.21 0.00 -2.00 0.00 0.00 55.36 52.79 1p4h s GLN 336 Cb -0.16 -3.50 0.01 0.00 0.80 0.00 0.00 33.01 30.17 1p4h s GLN 336 CO -0.08 -0.11 0.66 -0.51 -0.50 0.00 0.00 175.29 174.75 1p4h s LEU 337 N 1.49 4.36 -0.94 3.68 1.02 0.38 -1.55 118.68 127.12 1p4h s LEU 337 Ca 0.06 -0.10 -0.24 0.00 0.02 0.00 0.00 54.13 53.87 1p4h s LEU 337 Cb -0.15 -2.78 0.05 0.00 0.02 0.00 0.00 46.19 43.33 1p4h s LEU 337 CO 0.07 -0.71 1.40 0.21 0.02 0.00 0.00 176.35 177.33 1p4h s ASN 338 N 1.93 6.41 0.35 2.29 2.47 -0.72 -1.92 114.94 125.75 1p4h s ASN 338 Ca 0.24 -1.21 0.00 0.00 0.42 0.00 0.00 52.86 52.31 1p4h s ASN 338 Cb -0.14 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.10 1p4h s ASN 338 CO 0.18 -1.58 0.00 -0.67 -3.72 0.00 0.00 177.10 171.30 1p4h n ASP 339 N 8.95 -1.84 -0.17 -4.21 -0.08 -0.43 -4.16 116.55 114.60 1p4h n ASP 339 Ca 0.25 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.66 1p4h n ASP 339 Cb 0.50 0.00 0.49 0.00 2.34 0.00 0.00 41.12 44.46 1p4h n ASP 339 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1p4h n THR 340 N -0.52 0.00 -0.34 5.18 -2.24 -1.26 -4.35 114.28 110.75 1p4h n THR 340 Ca 0.00 -0.09 0.17 0.00 -2.27 0.00 0.00 64.05 61.87 1p4h n THR 340 Cb 0.00 0.13 0.38 0.00 -2.10 0.00 0.00 70.33 68.74 1p4h n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1p4h h HIS 341 N 0.82 0.93 -0.68 4.78 3.86 -1.96 0.26 115.15 123.16 1p4h h HIS 341 Ca 0.00 0.04 -0.32 0.00 -1.16 0.00 0.00 60.37 58.93 1p4h h HIS 341 Cb 0.43 -0.26 -0.19 0.00 1.06 0.00 0.00 27.41 28.46 1p4h h HIS 341 CO 0.00 0.01 0.29 -0.35 0.86 0.00 0.00 177.93 178.74 1p4h n PRO 342 N -4.94 2.35 0.32 2.45 -0.04 -1.26 -4.65 135.00 129.23 1p4h n PRO 342 Ca 0.26 -3.08 0.20 0.00 -0.04 0.00 0.00 63.50 60.84 1p4h n PRO 342 Cb 0.75 -2.03 1.09 0.00 -0.04 0.00 0.00 33.50 33.27 1p4h n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1p4h h SER 343 N 1.29 0.00 0.22 3.54 4.64 -0.73 -1.89 113.55 120.62 1p4h h SER 343 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1p4h h SER 343 Cb 2.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.36 1p4h h SER 343 CO 0.74 0.01 0.00 0.18 -0.87 0.00 0.00 176.83 176.88 1p4h n LEU 344 N -3.35 0.00 0.02 5.97 4.77 -1.26 -2.12 117.00 121.03 1p4h n LEU 344 Ca -0.03 0.37 0.03 0.00 -0.03 0.00 0.00 56.01 56.35 1p4h n LEU 344 Cb 0.09 -0.37 0.40 0.00 -2.33 0.00 0.00 43.42 41.21 1p4h n LEU 344 CO 0.23 -0.26 1.08 0.00 -1.33 0.00 0.00 177.39 177.11 1p4h h ALA 345 N 2.38 1.62 0.43 -1.18 0.00 -1.71 -0.22 119.26 120.59 1p4h h ALA 345 Ca 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1p4h h ALA 345 Cb 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1p4h h ALA 345 CO 0.00 0.31 -0.21 0.82 0.00 0.00 0.00 179.25 180.17 1p4h h ILE 346 N 0.49 0.55 0.00 0.00 2.04 -1.68 0.17 117.51 119.08 1p4h h ILE 346 Ca 0.12 -0.28 -0.06 0.00 1.00 0.00 0.00 64.86 65.64 1p4h h ILE 346 Cb 0.07 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1p4h h ILE 346 CO -0.02 0.05 -0.28 1.55 0.00 0.00 0.00 178.15 179.46 1p4h h PRO 347 N -0.75 0.00 -0.22 2.37 0.13 -1.72 -2.46 132.00 129.35 1p4h h PRO 347 Ca -0.06 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.88 1p4h h PRO 347 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 1p4h h PRO 347 CO 0.10 0.28 -0.63 1.49 -0.23 0.00 0.00 178.00 179.00 1p4h h GLU 348 N 0.00 0.77 -0.67 0.86 4.57 -0.96 0.97 114.58 120.12 1p4h h GLU 348 Ca -0.00 -0.54 -0.07 0.00 -1.18 0.00 0.00 59.36 57.57 1p4h h GLU 348 Cb 0.90 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.54 1p4h h GLU 348 CO 0.04 1.16 0.15 1.25 -1.18 0.00 0.00 179.01 180.43 1p4h h LEU 349 N 0.57 1.02 -0.34 1.64 5.85 -0.54 -1.46 115.31 122.06 1p4h h LEU 349 Ca -0.01 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1p4h h LEU 349 Cb 1.23 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 1p4h h LEU 349 CO 0.13 1.00 0.12 0.24 -0.34 0.00 0.00 178.44 179.59 1p4h h MET 350 N 1.01 0.51 -0.33 1.25 2.86 -1.27 -1.33 114.93 117.61 1p4h h MET 350 Ca 0.21 -0.10 0.06 0.00 -2.06 0.00 0.00 59.70 57.81 1p4h h MET 350 Cb 0.38 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.91 1p4h h MET 350 CO 0.00 0.52 0.01 -0.09 1.06 0.00 0.00 176.91 178.41 1p4h h ARG 351 N 0.39 0.10 0.09 1.72 2.43 -0.49 0.21 114.38 118.84 1p4h h ARG 351 Ca 0.11 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1p4h h ARG 351 Cb 0.21 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1p4h h ARG 351 CO -0.01 0.07 -0.04 0.28 -1.51 0.00 0.00 179.97 178.76 1p4h h VAL 352 N 0.11 1.01 -0.64 0.20 2.07 -1.15 0.27 116.25 118.11 1p4h h VAL 352 Ca 0.16 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 1p4h h VAL 352 Cb 0.21 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1p4h h VAL 352 CO -0.26 0.08 0.29 -0.07 0.02 0.00 0.00 177.57 177.63 1p4h h LEU 353 N -0.27 0.86 0.01 2.57 3.38 -0.98 0.37 115.31 121.24 1p4h h LEU 353 Ca -0.01 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1p4h h LEU 353 Cb 0.23 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1p4h h LEU 353 CO 0.02 0.77 -0.00 0.58 0.09 0.00 0.00 178.44 179.89 1p4h h VAL 354 N 0.89 0.43 -0.22 1.22 2.07 -0.57 0.70 116.25 120.77 1p4h h VAL 354 Ca 0.22 -1.31 -0.11 0.00 0.82 0.00 0.00 66.70 66.31 1p4h h VAL 354 Cb 0.15 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1p4h h VAL 354 CO -0.02 0.15 -0.29 0.44 0.02 0.00 0.00 177.57 177.86 1p4h h ASP 355 N -1.00 0.64 0.04 0.57 3.45 -0.57 -2.79 116.42 116.75 1p4h h ASP 355 Ca -0.00 -0.50 -0.32 0.00 0.43 0.00 0.00 57.03 56.63 1p4h h ASP 355 Cb 0.25 -0.18 -0.04 0.00 -0.56 0.00 0.00 39.33 38.80 1p4h h ASP 355 CO 0.00 1.02 -1.80 0.18 -1.57 0.00 0.00 179.24 177.07 1p4h n LEU 356 N -4.32 2.21 0.02 1.55 4.77 -0.54 -4.41 117.00 116.27 1p4h n LEU 356 Ca -0.05 0.29 0.12 0.00 -0.03 0.00 0.00 56.01 56.35 1p4h n LEU 356 Cb 0.47 -0.99 0.31 0.00 -2.33 0.00 0.00 43.42 40.88 1p4h n LEU 356 CO 0.44 0.56 0.54 -0.62 -1.33 0.00 0.00 177.39 176.97 1p4h n GLU 357 N -4.01 0.07 -2.74 3.23 -0.58 0.01 -4.97 120.64 111.65 1p4h n GLU 357 Ca -0.37 0.03 -0.18 0.00 -0.42 0.00 0.00 57.16 56.21 1p4h n GLU 357 Cb 0.85 -1.55 0.02 0.00 -0.57 0.00 0.00 31.44 30.19 1p4h n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1p4h n ARG 358 N -1.66 -3.37 -2.36 3.49 1.74 -0.59 -4.95 116.66 108.96 1p4h n ARG 358 Ca 0.05 0.78 -0.32 0.00 -0.77 0.00 0.00 57.85 57.59 1p4h n ARG 358 Cb 0.36 -5.29 -0.03 0.00 -1.02 0.00 0.00 32.46 26.48 1p4h n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1p4h s LEU 359 N -5.44 3.58 0.60 0.55 1.02 0.14 -4.97 118.68 114.15 1p4h s LEU 359 Ca 0.19 1.48 -0.16 0.00 0.02 0.00 0.00 54.13 55.66 1p4h s LEU 359 Cb -0.08 -4.43 -0.03 0.00 0.02 0.00 0.00 46.19 41.66 1p4h s LEU 359 CO 0.23 -0.62 1.06 1.51 0.02 0.00 0.00 176.35 178.56 1p4h s ASP 360 N -3.30 5.71 0.14 2.29 -4.77 -1.26 -4.41 116.67 111.07 1p4h s ASP 360 Ca 0.57 1.84 -0.28 0.00 -3.30 0.00 0.00 52.55 51.38 1p4h s ASP 360 Cb -0.10 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.16 1p4h s ASP 360 CO 0.36 -1.21 1.58 -0.25 0.70 0.00 0.00 175.17 176.34 1p4h h TRP 361 N 0.41 -1.24 -0.98 2.11 2.91 -1.97 -1.24 115.95 115.94 1p4h h TRP 361 Ca -0.47 0.06 0.10 0.00 1.13 0.00 0.00 58.89 59.71 1p4h h TRP 361 Cb 1.22 0.58 -0.08 0.00 -0.51 0.00 0.00 29.16 30.38 1p4h h TRP 361 CO 0.58 -0.46 0.63 -0.44 -1.03 0.00 0.00 178.44 177.72 1p4h h ASP 362 N -0.40 0.93 -0.20 2.65 3.45 -1.99 0.12 116.42 120.98 1p4h h ASP 362 Ca 0.11 0.03 -0.06 0.00 0.43 0.00 0.00 57.03 57.54 1p4h h ASP 362 Cb 0.60 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 1p4h h ASP 362 CO -0.49 0.53 -0.10 0.50 -1.57 0.00 0.00 179.24 178.10 1p4h h LYS 363 N 1.01 0.43 -0.43 3.56 3.11 -1.84 -2.15 116.57 120.26 1p4h h LYS 363 Ca 0.46 -0.19 0.03 0.00 -2.81 0.00 0.00 60.65 58.15 1p4h h LYS 363 Cb 0.40 -0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 31.58 1p4h h LYS 363 CO -0.22 0.72 0.23 0.00 -2.81 0.00 0.00 179.45 177.36 1p4h h ALA 364 N 0.70 0.54 -0.78 5.00 0.00 -0.47 -2.03 119.26 122.22 1p4h h ALA 364 Ca 0.05 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1p4h h ALA 364 Cb 0.59 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1p4h h ALA 364 CO 0.03 -0.12 0.43 2.35 0.00 0.00 0.00 179.25 181.94 1p4h h TRP 365 N 0.46 1.07 -0.35 0.00 2.91 -0.73 -0.67 115.95 118.63 1p4h h TRP 365 Ca 0.18 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.17 1p4h h TRP 365 Cb 0.07 -0.34 -0.02 0.00 -0.51 0.00 0.00 29.16 28.36 1p4h h TRP 365 CO -0.09 0.74 0.17 1.49 -1.03 0.00 0.00 178.44 179.72 1p4h h GLU 366 N 1.09 0.49 -0.25 2.65 4.81 -0.91 -1.13 114.58 121.34 1p4h h GLU 366 Ca 0.28 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1p4h h GLU 366 Cb 0.02 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1p4h h GLU 366 CO -0.05 0.44 0.13 0.28 -0.73 0.00 0.00 179.01 179.08 1p4h h VAL 367 N 0.43 1.13 -0.13 0.32 2.07 -0.98 -2.34 116.25 116.74 1p4h h VAL 367 Ca 0.12 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.29 1p4h h VAL 367 Cb 0.10 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1p4h h VAL 367 CO -0.02 0.13 0.04 0.74 0.02 0.00 0.00 177.57 178.48 1p4h h THR 368 N 0.28 0.96 -0.54 2.57 2.02 -0.88 -1.40 112.91 115.92 1p4h h THR 368 Ca 0.09 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 1p4h h THR 368 Cb 0.09 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 1p4h h THR 368 CO -0.01 0.02 0.31 0.58 0.37 0.00 0.00 175.52 176.78 1p4h h VAL 369 N 0.10 1.18 0.00 3.16 2.07 -1.19 -0.99 116.25 120.57 1p4h h VAL 369 Ca 0.06 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1p4h h VAL 369 Cb 0.04 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1p4h h VAL 369 CO -0.07 0.19 0.00 0.11 0.02 0.00 0.00 177.57 177.82 1p4h h LYS 370 N 0.72 0.00 0.07 1.57 1.57 -1.23 -2.01 116.57 117.27 1p4h h LYS 370 Ca 0.19 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.61 1p4h h LYS 370 Cb 0.03 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 1p4h h LYS 370 CO -0.03 0.00 -2.10 2.41 -0.57 0.00 0.00 179.45 179.16 1p4h n THR 371 N -2.59 1.67 -3.56 -0.16 -1.04 -0.54 -4.88 114.28 103.17 1p4h n THR 371 Ca 0.01 -0.67 -0.36 0.00 -2.04 0.00 0.00 64.05 60.99 1p4h n THR 371 Cb 0.25 -1.48 -0.06 0.00 -1.82 0.00 0.00 70.33 67.22 1p4h n THR 371 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1p4h s ALA 373 N -1.23 0.35 -0.07 0.00 0.00 -0.53 -1.48 121.76 118.81 1p4h s ALA 373 Ca 0.28 -0.23 0.05 0.00 0.00 0.00 0.00 51.96 52.05 1p4h s ALA 373 Cb -0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 1p4h s ALA 373 CO 0.15 0.07 -0.24 -0.47 0.00 0.00 0.00 175.76 175.27 1p4h s TYR 374 N -0.23 2.49 -0.20 0.00 6.14 0.13 -0.47 117.35 125.22 1p4h s TYR 374 Ca 0.00 -0.81 -0.04 0.00 0.64 0.00 0.00 57.07 56.86 1p4h s TYR 374 Cb -0.02 -1.64 -0.01 0.00 0.42 0.00 0.00 41.96 40.70 1p4h s TYR 374 CO -0.00 -0.27 -0.05 0.99 0.64 0.00 0.00 175.55 176.86 1p4h s THR 375 N -0.00 3.46 -0.04 4.34 2.01 -0.81 -1.48 115.64 123.12 1p4h s THR 375 Ca -0.08 -0.48 -0.16 0.00 0.31 0.00 0.00 61.69 61.28 1p4h s THR 375 Cb -0.15 -2.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.75 1p4h s THR 375 CO 0.05 0.44 0.42 0.21 -0.69 0.00 0.00 174.62 175.06 1p4h s ASN 376 N 1.20 6.77 0.00 3.53 3.84 -0.22 -1.32 114.94 128.73 1p4h s ASN 376 Ca 0.02 0.91 0.04 0.00 0.21 0.00 0.00 52.86 54.04 1p4h s ASN 376 Cb -0.14 -2.26 0.10 0.00 -0.55 0.00 0.00 41.25 38.40 1p4h s ASN 376 CO -0.01 0.23 1.03 1.41 -2.79 0.00 0.00 177.10 176.98 1p4h n HIS 377 N 2.36 0.14 -3.59 0.43 8.25 -1.26 -4.04 115.22 117.52 1p4h n HIS 377 Ca -0.12 -0.44 -0.05 0.00 -0.26 0.00 0.00 57.72 56.85 1p4h n HIS 377 Cb 0.52 -0.04 -0.02 0.00 1.12 0.00 0.00 29.99 31.57 1p4h n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1p4h s THR 378 N -0.92 0.00 -0.10 1.59 -1.32 -1.26 -4.61 115.64 109.02 1p4h s THR 378 Ca 0.08 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.57 1p4h s THR 378 Cb 0.04 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.03 1p4h s THR 378 CO 0.06 0.00 0.38 1.33 -2.21 0.00 0.00 174.62 174.17 1p4h n VAL 379 N 0.02 0.00 -2.20 5.08 0.24 -1.26 -4.99 118.33 115.21 1p4h n VAL 379 Ca -0.02 -0.49 -0.42 0.00 -2.04 0.00 0.00 64.34 61.37 1p4h n VAL 379 Cb 0.59 1.01 -0.03 0.00 -1.47 0.00 0.00 33.84 33.94 1p4h n VAL 379 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1p4h s ILE 380 N -0.40 3.67 0.34 1.34 -4.36 -1.26 -4.90 121.20 115.62 1p4h s ILE 380 Ca 0.01 1.05 0.11 0.00 -0.26 0.00 0.00 60.65 61.56 1p4h s ILE 380 Cb 0.01 -3.67 0.34 0.00 1.25 0.00 0.00 42.46 40.38 1p4h s ILE 380 CO 0.02 -0.01 1.77 1.55 0.24 0.00 0.00 174.94 178.51 1p4h h PRO 381 N 7.90 0.56 0.00 0.37 0.13 -1.97 -1.71 132.00 137.28 1p4h h PRO 381 Ca -0.38 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1p4h h PRO 381 Cb 1.18 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1p4h h PRO 381 CO 0.91 0.37 0.00 -0.85 -0.23 0.00 0.00 178.00 178.20 1p4h n GLU 382 N -4.74 0.20 0.02 0.86 0.00 -1.26 -2.57 120.64 113.15 1p4h n GLU 382 Ca 0.25 0.45 0.11 0.00 0.00 0.00 0.00 57.16 57.96 1p4h n GLU 382 Cb 0.72 -1.89 0.02 0.00 0.00 0.00 0.00 31.44 30.28 1p4h n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1p4h n ALA 383 N -1.78 3.51 -2.13 -1.84 0.00 -0.64 -0.64 120.51 116.98 1p4h n ALA 383 Ca 0.02 -0.42 -0.42 0.00 0.00 0.00 0.00 53.44 52.61 1p4h n ALA 383 Cb 0.21 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1p4h n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1p4h s LEU 384 N -3.81 4.35 -0.26 0.00 2.01 -1.06 -4.29 118.68 115.61 1p4h s LEU 384 Ca 0.04 2.31 -0.29 0.00 0.01 0.00 0.00 54.13 56.20 1p4h s LEU 384 Cb 0.15 -3.58 0.01 0.00 0.01 0.00 0.00 46.19 42.78 1p4h s LEU 384 CO 0.81 -0.73 1.08 -1.61 1.01 0.00 0.00 176.35 176.91 1p4h s GLU 385 N 1.75 4.16 -0.30 1.70 2.02 -1.26 -4.80 118.70 121.97 1p4h s GLU 385 Ca 0.66 1.26 -0.01 0.00 0.02 0.00 0.00 54.97 56.91 1p4h s GLU 385 Cb -0.36 -3.70 0.10 0.00 0.10 0.00 0.00 34.13 30.26 1p4h s GLU 385 CO 0.30 -0.77 0.09 1.03 0.02 0.00 0.00 175.26 175.93 1p4h s ARG 386 N 3.46 0.70 -0.00 1.61 0.52 -1.26 -2.19 118.95 121.79 1p4h s ARG 386 Ca 0.46 -1.03 -0.23 0.00 -0.52 0.00 0.00 55.73 54.41 1p4h s ARG 386 Cb -0.14 -1.97 -0.05 0.00 0.52 0.00 0.00 34.95 33.31 1p4h s ARG 386 CO 0.11 -0.97 0.68 -1.58 0.02 0.00 0.00 175.30 173.56 1p4h s TRP 387 N 1.64 3.68 0.25 -0.53 0.52 -0.75 -4.74 118.94 119.01 1p4h s TRP 387 Ca 0.09 1.30 -0.31 0.00 0.02 0.00 0.00 56.10 57.21 1p4h s TRP 387 Cb -0.17 -2.73 -0.11 0.00 -1.15 0.00 0.00 33.47 29.31 1p4h s TRP 387 CO -0.25 0.26 1.60 -2.14 0.02 0.00 0.00 176.95 176.44 1p4h s PRO 388 N 0.09 4.15 0.29 4.98 0.02 -1.26 -0.12 135.00 143.14 1p4h s PRO 388 Ca 0.35 2.52 -0.01 0.00 0.02 0.00 0.00 61.00 63.89 1p4h s PRO 388 Cb -0.19 -3.06 0.48 0.00 0.02 0.00 0.00 34.50 31.75 1p4h s PRO 388 CO 0.19 -0.63 1.90 0.28 -0.33 0.00 0.00 177.00 178.41 1p4h h VAL 389 N 3.57 1.08 -0.03 3.83 2.07 -1.51 -1.81 116.25 123.46 1p4h h VAL 389 Ca -0.45 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 66.70 1p4h h VAL 389 Cb 1.21 -0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1p4h h VAL 389 CO 0.84 0.20 0.02 1.12 0.02 0.00 0.00 177.57 179.77 1p4h h HIS 390 N 1.09 0.00 -0.03 1.57 2.07 -1.90 0.25 115.15 118.20 1p4h h HIS 390 Ca 0.41 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.89 1p4h h HIS 390 Cb 0.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.17 1p4h h HIS 390 CO -0.00 0.00 -0.13 -0.07 -3.07 0.00 0.00 177.93 174.66 1p4h h LEU 391 N 0.00 0.17 -1.17 6.12 3.38 -1.70 -2.63 115.31 119.48 1p4h h LEU 391 Ca 0.01 -0.65 -0.06 0.00 0.09 0.00 0.00 57.88 57.27 1p4h h LEU 391 Cb 0.06 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1p4h h LEU 391 CO -0.00 0.79 -0.11 -0.07 0.09 0.00 0.00 178.44 179.14 1p4h h LEU 392 N -0.44 0.43 -0.52 1.67 3.38 -1.31 0.03 115.31 118.55 1p4h h LEU 392 Ca -0.01 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1p4h h LEU 392 Cb 0.78 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1p4h h LEU 392 CO 0.03 0.58 0.30 -0.08 0.09 0.00 0.00 178.44 179.35 1p4h h GLU 393 N 0.42 0.57 0.07 1.13 4.81 -0.51 0.17 114.58 121.24 1p4h h GLU 393 Ca 0.08 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.18 1p4h h GLU 393 Cb 0.45 -0.13 0.01 0.00 0.63 0.00 0.00 28.75 29.71 1p4h h GLU 393 CO 0.03 0.38 -0.42 1.15 -0.73 0.00 0.00 179.01 179.41 1p4h h THR 394 N 0.59 1.64 -0.02 0.32 2.02 -1.16 -3.28 112.91 113.01 1p4h h THR 394 Ca 0.21 -2.43 -0.14 0.00 0.77 0.00 0.00 66.41 64.82 1p4h h THR 394 Cb 0.05 3.27 0.01 0.00 -1.74 0.00 0.00 68.15 69.74 1p4h h THR 394 CO -0.11 0.65 -0.54 0.25 0.37 0.00 0.00 175.52 176.14 1p4h h LEU 395 N -0.71 0.52 -6.04 2.58 5.85 -0.99 -3.37 115.31 113.15 1p4h h LEU 395 Ca -0.08 -0.73 -0.57 0.00 0.84 0.00 0.00 57.88 57.34 1p4h h LEU 395 Cb 1.31 -0.16 -0.40 0.00 0.37 0.00 0.00 40.66 41.78 1p4h h LEU 395 CO 0.06 1.18 -0.99 0.18 -0.34 0.00 0.00 178.44 178.53 1p4h n LEU 396 N -4.25 1.00 -0.27 2.25 4.77 0.57 -0.16 117.00 120.91 1p4h n LEU 396 Ca -0.10 -4.87 0.04 0.00 -0.03 0.00 0.00 56.01 51.06 1p4h n LEU 396 Cb 0.64 0.35 0.18 0.00 -2.33 0.00 0.00 43.42 42.26 1p4h n LEU 396 CO 0.46 2.07 1.07 1.55 -1.33 0.00 0.00 177.39 181.21 1p4h h PRO 397 N 4.02 0.56 -0.54 3.23 0.13 -1.58 -2.22 132.00 135.60 1p4h h PRO 397 Ca 0.10 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.11 1p4h h PRO 397 Cb 0.83 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.82 1p4h h PRO 397 CO 0.55 0.37 -0.01 -0.09 -0.23 0.00 0.00 178.00 178.59 1p4h h ARG 398 N 0.58 0.95 -0.24 0.86 9.65 -1.91 -2.77 114.38 121.50 1p4h h ARG 398 Ca 0.41 -0.31 -0.04 0.00 -1.10 0.00 0.00 59.98 58.94 1p4h h ARG 398 Cb 0.53 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 1p4h h ARG 398 CO -0.34 0.97 -0.02 0.45 2.80 0.00 0.00 179.97 183.84 1p4h h HIS 399 N 0.83 0.37 -0.49 2.20 3.86 -1.80 -1.50 115.15 118.62 1p4h h HIS 399 Ca 0.15 -0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.22 1p4h h HIS 399 Cb 0.55 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.89 1p4h h HIS 399 CO 0.04 0.39 -0.13 1.25 0.86 0.00 0.00 177.93 180.34 1p4h h LEU 400 N 0.35 0.94 -0.36 2.43 6.46 -1.19 -0.65 115.31 123.28 1p4h h LEU 400 Ca 0.08 -0.31 -0.04 0.00 -0.12 0.00 0.00 57.88 57.49 1p4h h LEU 400 Cb 0.27 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1p4h h LEU 400 CO 0.01 1.07 0.07 1.56 -0.62 0.00 0.00 178.44 180.53 1p4h h GLN 401 N 0.83 0.60 -0.75 1.25 4.20 -1.11 -1.24 115.11 118.88 1p4h h GLN 401 Ca 0.13 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1p4h h GLN 401 Cb 0.68 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 1p4h h GLN 401 CO 0.05 0.66 0.39 0.82 -0.67 0.00 0.00 178.83 180.07 1p4h h ILE 402 N 0.44 1.23 -0.43 2.54 2.04 -1.14 -1.32 117.51 120.87 1p4h h ILE 402 Ca 0.11 -0.61 -0.10 0.00 1.00 0.00 0.00 64.86 65.26 1p4h h ILE 402 Cb 0.34 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 1p4h h ILE 402 CO 0.01 0.27 -0.13 0.40 0.00 0.00 0.00 178.15 178.69 1p4h h ILE 403 N 1.06 1.26 -0.47 -0.67 2.04 -0.75 0.22 117.51 120.21 1p4h h ILE 403 Ca 0.26 -1.21 -0.08 0.00 1.00 0.00 0.00 64.86 64.84 1p4h h ILE 403 Cb 0.07 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 1p4h h ILE 403 CO -0.04 0.41 -0.01 1.88 0.00 0.00 0.00 178.15 180.40 1p4h h TYR 404 N 0.71 0.91 -0.67 1.37 0.05 -0.75 -0.55 116.97 118.05 1p4h h TYR 404 Ca 0.12 -0.16 -0.04 0.00 0.05 0.00 0.00 58.73 58.70 1p4h h TYR 404 Cb 0.62 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 38.10 1p4h h TYR 404 CO 0.03 0.87 0.28 1.49 -1.05 0.00 0.00 178.16 179.79 1p4h h GLU 405 N 0.69 1.00 -0.23 4.88 4.57 -0.97 0.63 114.58 125.15 1p4h h GLU 405 Ca 0.13 -0.17 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 1p4h h GLU 405 Cb 0.51 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1p4h h GLU 405 CO 0.03 0.83 0.08 0.82 -1.18 0.00 0.00 179.01 179.58 1p4h h ILE 406 N 0.95 1.18 -0.55 2.32 2.04 -0.79 -1.97 117.51 120.69 1p4h h ILE 406 Ca 0.23 -0.57 0.03 0.00 1.00 0.00 0.00 64.86 65.55 1p4h h ILE 406 Cb 0.19 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 1p4h h ILE 406 CO -0.02 0.18 0.32 -1.13 0.00 0.00 0.00 178.15 177.50 1p4h h ASN 407 N 0.21 0.50 0.24 1.72 -1.24 -0.72 0.81 115.58 117.09 1p4h h ASN 407 Ca 0.08 0.01 0.01 0.00 0.71 0.00 0.00 56.30 57.10 1p4h h ASN 407 Cb 0.21 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 39.14 1p4h h ASN 407 CO -0.00 0.35 -0.30 -0.61 -1.29 0.00 0.00 177.43 175.57 1p4h h GLN 408 N 0.62 -0.57 -0.24 6.67 4.15 -0.69 0.73 115.11 125.78 1p4h h GLN 408 Ca 0.23 0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.62 1p4h h GLN 408 Cb 0.06 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 1p4h h GLN 408 CO -0.12 -0.38 -0.14 0.00 -1.93 0.00 0.00 178.83 176.26 1p4h h ARG 409 N -0.59 0.40 -0.14 1.69 3.08 -1.13 -2.15 114.38 115.53 1p4h h ARG 409 Ca 0.00 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 1p4h h ARG 409 Cb 0.57 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 1p4h h ARG 409 CO -0.10 0.54 -0.02 0.35 -1.07 0.00 0.00 179.97 179.67 1p4h h PHE 410 N 0.37 0.30 0.00 3.04 3.57 -0.38 -2.85 116.94 120.99 1p4h h PHE 410 Ca 0.07 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1p4h h PHE 410 Cb 0.46 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1p4h h PHE 410 CO 0.01 0.52 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.36 1p4h h LEU 411 N -0.02 0.00 -1.13 0.59 3.38 -0.72 -1.16 115.31 116.25 1p4h h LEU 411 Ca 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1p4h h LEU 411 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1p4h h LEU 411 CO 0.01 0.18 -0.28 0.78 0.09 0.00 0.00 178.44 179.22 1p4h h ASN 412 N 0.00 0.25 -0.22 -0.43 -0.26 -1.19 0.19 115.58 113.92 1p4h h ASN 412 Ca -0.00 -0.08 -0.21 0.00 -0.56 0.00 0.00 56.30 55.45 1p4h h ASN 412 Cb 0.40 -0.07 0.01 0.00 -1.06 0.00 0.00 38.32 37.60 1p4h h ASN 412 CO 0.02 0.53 -0.67 0.03 -1.06 0.00 0.00 177.43 176.28 1p4h h ARG 413 N 0.22 0.84 -0.11 0.81 3.08 -1.01 -2.29 114.38 115.93 1p4h h ARG 413 Ca 0.03 -0.61 -0.01 0.00 0.07 0.00 0.00 59.98 59.46 1p4h h ARG 413 Cb 0.62 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.77 1p4h h ARG 413 CO 0.05 1.23 0.04 0.28 -1.07 0.00 0.00 179.97 180.49 1p4h h VAL 414 N 0.61 1.17 -0.85 2.04 2.07 -0.87 -1.45 116.25 118.97 1p4h h VAL 414 Ca -0.02 -0.51 0.09 0.00 0.82 0.00 0.00 66.70 67.08 1p4h h VAL 414 Cb 1.30 1.31 -0.06 0.00 -1.52 0.00 0.00 31.29 32.31 1p4h h VAL 414 CO 0.14 0.15 0.55 0.00 0.02 0.00 0.00 177.57 178.43 1p4h h ALA 415 N 0.86 1.68 0.00 1.67 0.00 -0.64 0.16 119.26 122.98 1p4h h ALA 415 Ca 0.03 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1p4h h ALA 415 Cb 0.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1p4h h ALA 415 CO -0.00 0.16 -0.45 0.00 0.00 0.00 0.00 179.25 178.96 1p4h h ALA 416 N 1.57 0.81 0.00 0.00 0.00 -1.15 -2.68 119.26 117.80 1p4h h ALA 416 Ca 0.39 -0.41 -0.24 0.00 0.00 0.00 0.00 54.91 54.65 1p4h h ALA 416 Cb 0.39 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1p4h h ALA 416 CO -0.16 0.56 -1.44 0.00 0.00 0.00 0.00 179.25 178.22 1p4h h ALA 417 N 1.55 0.67 -2.13 0.00 0.00 -0.09 -3.40 119.26 115.86 1p4h h ALA 417 Ca -0.00 -1.17 -0.58 0.00 0.00 0.00 0.00 54.91 53.17 1p4h h ALA 417 Cb 1.16 0.29 -0.40 0.00 0.00 0.00 0.00 17.79 18.85 1p4h h ALA 417 CO 0.06 1.32 -0.95 1.19 0.00 0.00 0.00 179.25 180.87 1p4h n PHE 418 N -3.08 0.67 -1.64 0.00 3.72 0.43 -5.09 117.46 112.48 1p4h n PHE 418 Ca -0.11 -3.70 -0.48 0.00 -0.05 0.00 0.00 57.45 53.11 1p4h n PHE 418 Cb 0.96 -0.34 -0.05 0.00 -0.94 0.00 0.00 39.48 39.11 1p4h n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1p4h n PRO 419 N 1.45 1.81 0.00 -1.08 -0.02 -1.01 -1.94 135.00 134.22 1p4h n PRO 419 Ca 0.24 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 1p4h n PRO 419 Cb 0.49 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1p4h n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p4h n GLY 420 N 3.05 2.98 3.35 -1.23 0.00 -1.26 -4.93 105.19 107.14 1p4h n GLY 420 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1p4h n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p4h n ASP 421 N 0.00 4.57 -0.00 1.61 4.64 -0.82 -4.77 116.55 121.78 1p4h n ASP 421 Ca 0.00 -2.89 0.00 0.00 -1.38 0.00 0.00 54.79 50.52 1p4h n ASP 421 Cb 0.00 -1.72 0.30 0.00 -1.04 0.00 0.00 41.12 38.67 1p4h n ASP 421 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 1p4h h VAL 422 N 5.15 1.19 -0.18 5.18 -1.51 -1.92 -2.78 116.25 121.38 1p4h h VAL 422 Ca 0.48 -0.74 -0.12 0.00 -1.23 0.00 0.00 66.70 65.09 1p4h h VAL 422 Cb 0.81 0.91 -0.01 0.00 -2.13 0.00 0.00 31.29 30.86 1p4h h VAL 422 CO 1.58 0.26 -0.40 -0.78 -1.23 0.00 0.00 177.57 176.99 1p4h h ASP 423 N 0.51 0.43 -0.78 4.19 3.58 -2.00 -2.64 116.42 119.72 1p4h h ASP 423 Ca 0.11 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.37 1p4h h ASP 423 Cb 0.30 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 41.19 1p4h h ASP 423 CO 0.01 0.79 0.45 -0.09 -2.88 0.00 0.00 179.24 177.52 1p4h h ARG 424 N 0.34 1.07 -0.43 0.28 2.43 -1.90 -0.39 114.38 115.78 1p4h h ARG 424 Ca 0.03 -0.11 0.05 0.00 -0.81 0.00 0.00 59.98 59.14 1p4h h ARG 424 Cb 0.86 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.14 1p4h h ARG 424 CO 0.07 0.77 0.16 -0.07 -1.51 0.00 0.00 179.97 179.40 1p4h h LEU 425 N 1.07 0.19 -0.86 3.80 3.38 -1.33 0.55 115.31 122.11 1p4h h LEU 425 Ca 0.28 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.18 1p4h h LEU 425 Cb -0.01 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1p4h h LEU 425 CO -0.05 0.14 -0.54 0.08 0.09 0.00 0.00 178.44 178.16 1p4h h ARG 426 N 0.34 0.00 -0.10 1.13 -0.00 -1.20 -2.01 114.38 112.54 1p4h h ARG 426 Ca 0.20 0.00 -0.17 0.00 -0.00 0.00 0.00 59.98 60.00 1p4h h ARG 426 Cb 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.13 1p4h h ARG 426 CO -0.19 0.54 -0.68 0.00 -0.00 0.00 0.00 179.97 179.65 1p4h h ARG 427 N 0.00 0.40 0.00 0.08 3.08 -0.30 -3.26 114.38 114.38 1p4h h ARG 427 Ca -0.01 -0.31 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1p4h h ARG 427 Cb 1.00 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.11 1p4h h ARG 427 CO 0.07 0.93 -0.64 -1.33 -1.07 0.00 0.00 179.97 177.93 1p4h n MET 428 N -3.87 0.24 -1.58 0.04 2.81 0.11 -4.95 117.12 109.92 1p4h n MET 428 Ca -0.04 0.06 -0.42 0.00 -1.81 0.00 0.00 57.70 55.50 1p4h n MET 428 Cb 0.67 -1.64 0.01 0.00 -0.71 0.00 0.00 33.22 31.55 1p4h n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1p4h n SER 429 N -1.99 0.92 0.22 7.83 2.88 -0.76 -4.85 113.62 117.86 1p4h n SER 429 Ca 0.03 1.02 0.13 0.00 -1.33 0.00 0.00 58.87 58.73 1p4h n SER 429 Cb 0.42 -1.31 0.26 0.00 -0.75 0.00 0.00 64.21 62.84 1p4h n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1p4h h LEU 430 N 1.43 0.00 -8.87 2.46 3.38 -1.91 -3.43 115.31 108.37 1p4h h LEU 430 Ca -0.43 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 56.89 1p4h h LEU 430 Cb 1.35 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.92 1p4h h LEU 430 CO 0.56 0.00 -0.52 -0.69 0.09 0.00 0.00 178.44 177.88 1p4h s VAL 431 N -3.27 5.24 -0.20 1.22 1.01 -1.26 0.14 120.40 123.28 1p4h s VAL 431 Ca 0.06 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.05 1p4h s VAL 431 Cb 0.06 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 1p4h s VAL 431 CO 0.64 0.24 0.21 -1.61 0.00 0.00 0.00 175.10 174.58 1p4h s GLU 432 N 1.75 4.16 0.67 2.72 2.02 0.57 -4.96 118.70 125.64 1p4h s GLU 432 Ca 0.07 -0.12 -0.06 0.00 0.02 0.00 0.00 54.97 54.88 1p4h s GLU 432 Cb -0.16 -3.47 0.05 0.00 0.10 0.00 0.00 34.13 30.64 1p4h s GLU 432 CO 0.10 0.17 0.98 -1.21 0.02 0.00 0.00 175.26 175.33 1p4h s GLU 433 N 0.72 2.37 0.00 1.61 0.41 -1.26 -1.75 118.70 120.81 1p4h s GLU 433 Ca 0.11 -0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.46 1p4h s GLU 433 Cb -0.13 -2.20 0.00 0.00 -1.78 0.00 0.00 34.13 30.02 1p4h s GLU 433 CO 0.02 -1.10 0.00 0.41 -0.49 0.00 0.00 175.26 174.10 1p4h n GLY 434 N -2.83 0.83 0.17 -1.39 0.00 -1.26 -4.88 105.19 95.82 1p4h n GLY 434 Ca 0.07 -1.89 -0.04 0.00 0.00 0.00 0.00 46.02 44.16 1p4h n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p4h n ALA 435 N -1.00 -0.25 -2.84 4.61 0.00 -1.26 -4.27 120.51 115.50 1p4h n ALA 435 Ca 0.00 0.34 -0.26 0.00 0.00 0.00 0.00 53.44 53.52 1p4h n ALA 435 Cb 0.00 0.19 -0.16 0.00 0.00 0.00 0.00 19.45 19.48 1p4h n ALA 435 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1p4h s VAL 436 N -4.08 1.43 0.42 0.00 -7.23 -1.26 -5.11 120.40 104.56 1p4h s VAL 436 Ca -0.05 -0.72 -0.25 0.00 -1.81 0.00 0.00 61.98 59.15 1p4h s VAL 436 Cb 0.04 -1.22 -0.08 0.00 0.56 0.00 0.00 36.38 35.68 1p4h s VAL 436 CO 0.25 0.41 1.23 -0.54 -0.31 0.00 0.00 175.10 176.13 1p4h s LYS 437 N -0.03 3.93 0.11 4.82 1.02 -1.26 -4.84 119.74 123.49 1p4h s LYS 437 Ca -0.02 1.97 0.01 0.00 0.02 0.00 0.00 55.97 57.95 1p4h s LYS 437 Cb -0.11 -2.65 -0.04 0.00 -0.52 0.00 0.00 37.83 34.51 1p4h s LYS 437 CO 0.02 -0.46 -0.05 1.03 -0.92 0.00 0.00 175.35 174.96 1p4h s ARG 438 N -2.36 0.87 -0.21 1.68 0.52 -0.71 -1.26 118.95 117.48 1p4h s ARG 438 Ca 0.59 -1.36 -0.06 0.00 -0.52 0.00 0.00 55.73 54.38 1p4h s ARG 438 Cb -0.34 -0.18 -0.03 0.00 0.52 0.00 0.00 34.95 34.93 1p4h s ARG 438 CO 0.42 -0.05 0.02 0.42 0.02 0.00 0.00 175.30 176.13 1p4h s ILE 439 N -3.66 4.12 -0.55 1.52 -1.09 0.82 -0.32 121.20 122.04 1p4h s ILE 439 Ca 0.14 -0.25 -0.25 0.00 -2.23 0.00 0.00 60.65 58.06 1p4h s ILE 439 Cb 0.06 -2.87 0.04 0.00 -1.58 0.00 0.00 42.46 38.10 1p4h s ILE 439 CO -0.03 0.42 0.98 0.21 -1.23 0.00 0.00 174.94 175.28 1p4h s ASN 440 N 1.02 6.36 0.40 3.58 3.84 0.12 -1.81 114.94 128.45 1p4h s ASN 440 Ca 0.02 -0.27 0.12 0.00 0.21 0.00 0.00 52.86 52.94 1p4h s ASN 440 Cb -0.14 -2.45 0.83 0.00 -0.55 0.00 0.00 41.25 38.94 1p4h s ASN 440 CO 0.02 -1.26 1.91 0.24 -2.79 0.00 0.00 177.10 175.21 1p4h h MET 441 N 9.34 0.06 -0.60 0.43 2.86 -1.74 -2.35 114.93 122.93 1p4h h MET 441 Ca -0.26 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.27 1p4h h MET 441 Cb 1.07 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 1p4h h MET 441 CO 1.10 0.31 0.03 0.00 1.06 0.00 0.00 176.91 179.41 1p4h h ALA 442 N 1.70 0.90 -0.39 6.32 0.00 -1.91 -0.35 119.26 125.54 1p4h h ALA 442 Ca 0.01 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 1p4h h ALA 442 Cb 0.47 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1p4h h ALA 442 CO 0.03 0.66 -0.18 0.45 0.00 0.00 0.00 179.25 180.21 1p4h h HIS 443 N 0.96 0.81 -0.33 0.00 3.86 -1.84 -1.84 115.15 116.77 1p4h h HIS 443 Ca 0.18 -0.17 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1p4h h HIS 443 Cb 0.51 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 1p4h h HIS 443 CO 0.04 0.85 0.21 1.25 0.86 0.00 0.00 177.93 181.13 1p4h h LEU 444 N 0.65 0.39 -0.89 2.43 6.46 -0.93 -1.99 115.31 121.43 1p4h h LEU 444 Ca 0.10 -0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.78 1p4h h LEU 444 Cb 0.66 -0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 40.46 1p4h h LEU 444 CO 0.05 0.31 0.30 0.00 -0.62 0.00 0.00 178.44 178.48 1p4h h ILE 446 N 1.08 1.27 -0.72 0.00 2.04 -1.15 -2.34 117.51 117.70 1p4h h ILE 446 Ca 0.25 -1.09 -0.05 0.00 1.00 0.00 0.00 64.86 64.98 1p4h h ILE 446 Cb 0.20 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1p4h h ILE 446 CO -0.02 0.35 0.27 0.00 0.00 0.00 0.00 178.15 178.75 1p4h h ALA 447 N 0.81 0.94 -0.50 1.87 0.00 -1.19 -3.12 119.26 118.07 1p4h h ALA 447 Ca 0.08 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1p4h h ALA 447 Cb 0.54 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1p4h h ALA 447 CO 0.03 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.27 1p4h n GLY 448 N -0.82 2.10 3.31 0.00 0.00 -0.56 -4.93 105.19 104.30 1p4h n GLY 448 Ca 0.06 -0.65 -0.26 0.00 0.00 0.00 0.00 46.02 45.17 1p4h n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p4h s SER 449 N -0.79 2.79 0.00 1.61 0.01 -0.88 -3.89 113.70 112.54 1p4h s SER 449 Ca 0.39 -0.68 0.26 0.00 1.31 0.00 0.00 55.95 57.24 1p4h s SER 449 Cb 0.25 -0.18 0.68 0.00 0.21 0.00 0.00 66.02 66.98 1p4h s SER 449 CO 0.19 0.12 1.52 0.00 0.41 0.00 0.00 173.24 175.48 1p4h n HIS 450 N 1.19 0.00 -3.73 2.43 1.44 -0.55 -4.85 115.22 111.15 1p4h n HIS 450 Ca -0.19 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.40 1p4h n HIS 450 Cb 0.53 -0.19 -0.10 0.00 0.12 0.00 0.00 29.99 30.35 1p4h n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1p4h s ALA 451 N -2.72 -0.96 -0.06 1.59 0.00 -1.26 -4.52 121.76 113.82 1p4h s ALA 451 Ca 0.19 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.34 1p4h s ALA 451 Cb 0.19 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.63 1p4h s ALA 451 CO 0.59 -0.20 -0.08 0.08 0.00 0.00 0.00 175.76 176.16 1p4h s VAL 452 N 0.50 0.85 0.08 0.00 1.01 0.35 -0.69 120.40 122.50 1p4h s VAL 452 Ca -0.02 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.71 1p4h s VAL 452 Cb -0.04 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 1p4h s VAL 452 CO -0.03 0.30 -0.10 0.54 0.00 0.00 0.00 175.10 175.81 1p4h s ASN 453 N 0.99 1.35 0.63 3.32 4.22 -0.55 -0.69 114.94 124.21 1p4h s ASN 453 Ca -0.09 -0.70 0.04 0.00 -2.14 0.00 0.00 52.86 49.96 1p4h s ASN 453 Cb -0.15 0.00 0.09 0.00 1.28 0.00 0.00 41.25 42.48 1p4h s ASN 453 CO 0.00 -0.20 0.87 -0.83 -2.04 0.00 0.00 177.10 174.90 1p4h s GLY 454 N -2.05 1.77 -0.02 0.45 0.00 -1.05 -1.06 107.32 105.36 1p4h s GLY 454 Ca -0.00 -1.82 0.12 0.00 0.00 0.00 0.00 44.72 43.02 1p4h s GLY 454 CO 0.01 -1.35 1.30 3.33 0.00 0.00 0.00 173.10 176.39 1p4h n VAL 455 N -2.51 1.16 -3.58 1.40 0.24 -1.26 -2.45 118.33 111.34 1p4h n VAL 455 Ca 0.14 -1.10 -0.11 0.00 -2.04 0.00 0.00 64.34 61.23 1p4h n VAL 455 Cb 0.61 0.41 -0.06 0.00 -1.47 0.00 0.00 33.84 33.33 1p4h n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1p4h s ALA 456 N -1.22 -1.92 0.19 2.33 0.00 -1.26 -0.61 121.76 119.27 1p4h s ALA 456 Ca 0.28 1.61 -0.17 0.00 0.00 0.00 0.00 51.96 53.68 1p4h s ALA 456 Cb 0.16 -0.76 0.16 0.00 0.00 0.00 0.00 23.12 22.69 1p4h s ALA 456 CO 0.17 -0.30 1.62 -0.09 0.00 0.00 0.00 175.76 177.16 1p4h h ARG 457 N 2.90 -0.07 -0.41 0.00 2.43 -1.90 0.95 114.38 118.27 1p4h h ARG 457 Ca -0.21 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.91 1p4h h ARG 457 Cb 1.16 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 1p4h h ARG 457 CO 0.28 -0.05 0.01 0.97 -1.51 0.00 0.00 179.97 179.68 1p4h h ILE 458 N -0.07 1.22 -0.09 1.20 2.10 -1.91 -1.19 117.51 118.77 1p4h h ILE 458 Ca 0.25 -0.87 -0.02 0.00 1.08 0.00 0.00 64.86 65.30 1p4h h ILE 458 Cb 0.46 0.89 -0.00 0.00 -1.09 0.00 0.00 36.82 37.07 1p4h h ILE 458 CO -0.58 0.30 -0.01 -0.74 -1.08 0.00 0.00 178.15 176.04 1p4h h HIS 459 N 0.62 0.19 -0.67 2.19 2.76 -1.45 -1.15 115.15 117.64 1p4h h HIS 459 Ca 0.13 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1p4h h HIS 459 Cb 0.37 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.25 1p4h h HIS 459 CO 0.02 0.45 0.43 0.77 -1.30 0.00 0.00 177.93 178.30 1p4h h SER 460 N -0.14 0.77 -0.36 3.26 0.02 -0.63 -0.69 113.55 115.79 1p4h h SER 460 Ca 0.02 -0.03 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 1p4h h SER 460 Cb 0.39 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1p4h h SER 460 CO 0.01 0.57 -0.24 -0.33 -1.14 0.00 0.00 176.83 175.70 1p4h h GLU 461 N 0.91 0.80 -0.45 3.45 4.39 -1.08 -2.71 114.58 119.89 1p4h h GLU 461 Ca 0.24 -0.38 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 1p4h h GLU 461 Cb -0.09 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 1p4h h GLU 461 CO -0.05 1.00 0.26 0.82 -1.16 0.00 0.00 179.01 179.88 1p4h h ILE 462 N 0.59 1.13 -0.54 3.13 2.04 -0.47 -0.47 117.51 122.91 1p4h h ILE 462 Ca 0.07 -0.32 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 1p4h h ILE 462 Cb 0.80 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1p4h h ILE 462 CO 0.07 0.14 0.18 -0.07 0.00 0.00 0.00 178.15 178.47 1p4h h LEU 463 N 0.61 0.79 -0.56 1.44 3.38 -0.85 0.47 115.31 120.59 1p4h h LEU 463 Ca 0.16 -0.20 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 1p4h h LEU 463 Cb -0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1p4h h LEU 463 CO -0.03 0.78 -0.72 0.11 0.09 0.00 0.00 178.44 178.67 1p4h h LYS 464 N 0.75 0.05 0.00 1.13 1.57 -1.12 0.15 116.57 119.11 1p4h h LYS 464 Ca 0.18 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.80 1p4h h LYS 464 Cb 0.27 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1p4h h LYS 464 CO -0.01 0.74 -1.03 0.87 -0.57 0.00 0.00 179.45 179.45 1p4h h LYS 465 N 0.03 0.00 0.00 3.15 1.57 -0.95 -3.31 116.57 117.06 1p4h h LYS 465 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1p4h h LYS 465 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1p4h h LYS 465 CO 0.10 0.26 0.00 0.25 -0.57 0.00 0.00 179.45 179.49 1p4h n THR 466 N -2.94 0.00 -0.34 -0.16 -2.24 0.14 -4.75 114.28 103.99 1p4h n THR 466 Ca -0.04 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 61.91 1p4h n THR 466 Cb 0.74 0.00 0.33 0.00 -2.10 0.00 0.00 70.33 69.29 1p4h n THR 466 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p4h n ILE 467 N 0.00 -0.42 -1.31 2.28 0.13 -1.25 -1.61 119.36 117.19 1p4h n ILE 467 Ca 0.00 2.17 0.06 0.00 -1.10 0.00 0.00 62.75 63.88 1p4h n ILE 467 Cb 0.00 -3.21 0.19 0.00 -0.84 0.00 0.00 39.64 35.78 1p4h n ILE 467 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 1p4h n PHE 468 N -5.47 0.36 -0.16 9.51 0.99 0.04 -4.81 117.46 117.92 1p4h n PHE 468 Ca 0.25 -1.27 -0.02 0.00 -0.00 0.00 0.00 57.45 56.41 1p4h n PHE 468 Cb 0.82 -0.28 0.05 0.00 -1.00 0.00 0.00 39.48 39.08 1p4h n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1p4h h LYS 469 N 0.79 0.06 -0.96 -1.08 3.64 -1.28 -0.38 116.57 117.35 1p4h h LYS 469 Ca 0.05 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.48 1p4h h LYS 469 Cb 1.20 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.95 1p4h h LYS 469 CO 0.11 0.04 0.62 -0.44 -2.27 0.00 0.00 179.45 177.51 1p4h h ASP 470 N 0.06 1.01 -0.38 4.20 3.32 -1.87 -1.20 116.42 121.56 1p4h h ASP 470 Ca 0.25 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.17 1p4h h ASP 470 Cb 0.39 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1p4h h ASP 470 CO -0.48 0.66 -0.29 -0.26 -1.72 0.00 0.00 179.24 177.16 1p4h h PHE 471 N 1.16 1.02 -0.56 4.55 0.04 -1.68 -2.47 116.94 118.99 1p4h h PHE 471 Ca 0.40 -0.28 -0.03 0.00 2.80 0.00 0.00 57.97 60.86 1p4h h PHE 471 Cb 0.10 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.00 1p4h h PHE 471 CO -0.01 1.08 0.21 -0.92 -0.60 0.00 0.00 178.31 178.07 1p4h h TYR 472 N 0.67 0.82 -0.36 -0.55 3.20 -0.66 -0.34 116.97 119.75 1p4h h TYR 472 Ca 0.07 -0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.80 1p4h h TYR 472 Cb 0.86 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1p4h h TYR 472 CO 0.06 0.65 -0.15 0.93 -1.64 0.00 0.00 178.16 178.00 1p4h h GLU 473 N 0.81 0.66 0.00 1.82 5.08 -1.06 -0.66 114.58 121.24 1p4h h GLU 473 Ca 0.19 -0.22 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 1p4h h GLU 473 Cb 0.18 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.39 1p4h h GLU 473 CO -0.02 0.79 -0.67 1.25 -1.00 0.00 0.00 179.01 179.36 1p4h h LEU 474 N 0.60 0.58 -6.16 1.33 5.85 -0.96 -3.41 115.31 113.14 1p4h h LEU 474 Ca 0.10 -0.76 -0.57 0.00 0.84 0.00 0.00 57.88 57.48 1p4h h LEU 474 Cb 0.60 -0.18 -0.39 0.00 0.37 0.00 0.00 40.66 41.06 1p4h h LEU 474 CO 0.04 1.27 -1.01 -0.62 -0.34 0.00 0.00 178.44 177.78 1p4h n GLU 475 N -4.16 0.74 0.05 1.25 1.02 -0.18 -4.98 120.64 114.37 1p4h n GLU 475 Ca -0.11 -3.37 0.15 0.00 -0.02 0.00 0.00 57.16 53.82 1p4h n GLU 475 Cb 0.71 -1.47 0.63 0.00 -0.02 0.00 0.00 31.44 31.29 1p4h n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1p4h h PRO 476 N 4.55 0.09 0.00 3.49 0.13 -1.32 -2.29 132.00 136.65 1p4h h PRO 476 Ca 0.14 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.25 1p4h h PRO 476 Cb 0.87 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 1p4h h PRO 476 CO 0.47 0.06 -0.09 1.12 -0.23 0.00 0.00 178.00 179.33 1p4h h HIS 477 N 0.10 0.00 0.00 1.56 2.07 -1.94 -2.94 115.15 114.01 1p4h h HIS 477 Ca 0.19 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.61 1p4h h HIS 477 Cb 0.63 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.59 1p4h h HIS 477 CO -0.00 0.09 -0.49 0.87 -3.07 0.00 0.00 177.93 175.33 1p4h h LYS 478 N 0.00 0.00 -6.10 5.12 1.57 -1.64 -3.45 116.57 112.07 1p4h h LYS 478 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1p4h h LYS 478 Cb 0.22 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.47 1p4h h LYS 478 CO 0.01 0.49 0.46 -0.06 -0.57 0.00 0.00 179.45 179.79 1p4h s PHE 479 N -3.90 3.47 0.33 -1.35 0.08 -1.11 -0.49 117.98 115.00 1p4h s PHE 479 Ca -0.02 1.42 0.05 0.00 0.12 0.00 0.00 56.93 58.49 1p4h s PHE 479 Cb 0.14 -3.09 -0.03 0.00 -0.57 0.00 0.00 43.02 39.47 1p4h s PHE 479 CO 0.74 -0.22 0.19 -0.65 -0.10 0.00 0.00 175.22 175.19 1p4h s GLN 480 N 2.03 1.71 0.05 0.44 -0.21 0.14 -4.96 119.66 118.85 1p4h s GLN 480 Ca 0.43 -2.00 0.06 0.00 0.02 0.00 0.00 55.36 53.87 1p4h s GLN 480 Cb -0.17 -0.05 -0.02 0.00 1.00 0.00 0.00 33.01 33.76 1p4h s GLN 480 CO 0.15 -0.52 -0.17 1.21 -2.12 0.00 0.00 175.29 173.84 1p4h s ASN 481 N -3.42 2.01 -0.41 5.90 3.84 -1.26 -2.52 114.94 119.07 1p4h s ASN 481 Ca 0.35 -0.51 0.04 0.00 0.21 0.00 0.00 52.86 52.95 1p4h s ASN 481 Cb 0.04 -0.14 0.17 0.00 -0.55 0.00 0.00 41.25 40.76 1p4h s ASN 481 CO 0.20 0.07 0.44 -0.54 -2.79 0.00 0.00 177.10 174.48 1p4h s LYS 482 N -1.26 0.80 0.24 0.43 -0.14 -1.03 -4.92 119.74 113.87 1p4h s LYS 482 Ca 0.04 -1.24 -0.31 0.00 -1.36 0.00 0.00 55.97 53.09 1p4h s LYS 482 Cb -0.08 -0.77 -0.13 0.00 -1.68 0.00 0.00 37.83 35.16 1p4h s LYS 482 CO 0.02 -1.28 1.46 2.41 -0.76 0.00 0.00 175.35 177.20 1p4h n THR 483 N 3.60 0.82 -0.45 2.17 -1.04 -1.26 -4.29 114.28 113.83 1p4h n THR 483 Ca 0.18 -0.20 -0.29 0.00 -2.04 0.00 0.00 64.05 61.70 1p4h n THR 483 Cb 0.48 -1.55 0.26 0.00 -1.82 0.00 0.00 70.33 67.70 1p4h n THR 483 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1p4h n ASN 484 N 2.35 -2.20 -3.17 8.00 5.03 0.22 -4.67 115.26 120.82 1p4h n ASN 484 Ca 0.12 -0.28 -0.09 0.00 0.87 0.00 0.00 54.58 55.20 1p4h n ASN 484 Cb 0.32 -1.19 0.01 0.00 -1.02 0.00 0.00 39.78 37.89 1p4h n ASN 484 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1p4h s GLY 485 N -2.40 0.30 0.07 7.41 0.00 -1.26 -4.82 107.32 106.62 1p4h s GLY 485 Ca 0.68 -0.67 0.02 0.00 0.00 0.00 0.00 44.72 44.75 1p4h s GLY 485 CO 0.65 -0.29 -0.08 -0.26 0.00 0.00 0.00 173.10 173.13 1p4h s ILE 486 N -2.74 0.67 -0.18 0.90 -4.36 -0.03 -4.51 121.20 110.95 1p4h s ILE 486 Ca 0.15 -1.47 -0.27 0.00 -0.26 0.00 0.00 60.65 58.79 1p4h s ILE 486 Cb -0.05 -1.11 -0.00 0.00 1.25 0.00 0.00 42.46 42.54 1p4h s ILE 486 CO 0.11 -0.58 0.94 0.28 0.24 0.00 0.00 174.94 175.93 1p4h s THR 487 N -2.33 4.79 -0.80 8.37 -1.32 -1.26 -0.44 115.64 122.65 1p4h s THR 487 Ca 0.00 1.86 0.15 0.00 -1.21 0.00 0.00 61.69 62.49 1p4h s THR 487 Cb -0.04 -4.24 0.14 0.00 -1.51 0.00 0.00 72.50 66.86 1p4h s THR 487 CO -0.01 -0.06 1.46 -0.81 -2.21 0.00 0.00 174.62 172.99 1p4h n PRO 488 N 5.61 0.06 0.14 7.08 -0.04 -1.26 -1.54 135.00 145.05 1p4h n PRO 488 Ca 0.08 0.37 -0.06 0.00 -0.04 0.00 0.00 63.50 63.85 1p4h n PRO 488 Cb 0.48 -1.63 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 1p4h n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1p4h h ARG 489 N 0.00 -0.40 -0.46 0.54 -0.00 -1.91 -2.59 114.38 109.56 1p4h h ARG 489 Ca 0.00 0.03 -0.13 0.00 -0.50 0.00 0.00 59.98 59.38 1p4h h ARG 489 Cb 0.21 0.09 -0.01 0.00 0.00 0.00 0.00 29.97 30.26 1p4h h ARG 489 CO 0.00 -0.27 -0.23 -0.09 0.00 0.00 0.00 179.97 179.38 1p4h h ARG 490 N -0.86 0.96 -0.56 0.04 2.43 -1.96 0.67 114.38 115.10 1p4h h ARG 490 Ca -0.04 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1p4h h ARG 490 Cb 0.32 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1p4h h ARG 490 CO 0.07 1.09 0.00 0.91 -1.51 0.00 0.00 179.97 180.53 1p4h n TRP 491 N -4.13 0.64 0.00 2.20 7.02 -0.59 -2.74 117.44 119.83 1p4h n TRP 491 Ca -0.01 -0.25 0.00 0.00 -1.02 0.00 0.00 57.50 56.22 1p4h n TRP 491 Cb 0.46 -0.13 0.00 0.00 -2.42 0.00 0.00 31.31 29.22 1p4h n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1p4h n LEU 492 N 0.33 0.00 -0.20 -0.99 7.94 -1.03 -4.76 117.00 118.30 1p4h n LEU 492 Ca 0.11 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 55.01 1p4h n LEU 492 Cb 0.45 0.11 0.10 0.00 0.53 0.00 0.00 43.42 44.61 1p4h n LEU 492 CO 0.10 -0.25 0.98 0.58 -1.11 0.00 0.00 177.39 177.69 1p4h h VAL 493 N 0.00 0.76 -0.01 1.96 2.07 -1.24 0.51 116.25 120.31 1p4h h VAL 493 Ca 0.00 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.33 1p4h h VAL 493 Cb 0.00 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1p4h h VAL 493 CO 0.00 0.07 -0.20 0.25 0.02 0.00 0.00 177.57 177.71 1p4h h LEU 494 N 0.38 0.19 0.00 2.57 6.46 -1.00 -3.20 115.31 120.72 1p4h h LEU 494 Ca 0.30 -0.75 0.00 0.00 -0.12 0.00 0.00 57.88 57.31 1p4h h LEU 494 Cb 0.38 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1p4h h LEU 494 CO -0.31 0.92 -0.76 0.00 -0.62 0.00 0.00 178.44 177.67 1p4h n ASN 496 N -2.30 0.71 -0.15 0.00 2.85 0.18 -4.85 115.26 111.69 1p4h n ASN 496 Ca 0.02 -2.91 0.05 0.00 -0.11 0.00 0.00 54.58 51.63 1p4h n ASN 496 Cb 0.48 -0.63 0.34 0.00 1.24 0.00 0.00 39.78 41.21 1p4h n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1p4h h PRO 497 N 3.42 0.75 -0.86 1.20 0.13 -1.63 -1.92 132.00 133.09 1p4h h PRO 497 Ca 0.09 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 65.22 1p4h h PRO 497 Cb 0.92 -0.17 -0.06 0.00 0.13 0.00 0.00 31.00 31.82 1p4h h PRO 497 CO 0.50 0.50 0.55 0.78 -0.23 0.00 0.00 178.00 180.09 1p4h h GLY 498 N 0.77 1.28 1.36 1.56 0.00 -1.91 0.36 103.07 106.49 1p4h h GLY 498 Ca 0.27 -0.41 -0.24 0.00 0.00 0.00 0.00 47.33 46.95 1p4h h GLY 498 CO -0.08 0.32 -0.94 -2.00 0.00 0.00 0.00 176.54 173.84 1p4h h LEU 499 N 1.04 0.75 -1.22 3.11 5.85 -1.78 -2.88 115.31 120.18 1p4h h LEU 499 Ca 0.36 -0.57 -0.03 0.00 0.84 0.00 0.00 57.88 58.47 1p4h h LEU 499 Cb 0.08 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1p4h h LEU 499 CO -0.14 1.37 0.17 0.00 -0.34 0.00 0.00 178.44 179.49 1p4h h ALA 500 N 0.59 1.38 0.33 1.25 0.00 -0.93 -2.35 119.26 119.52 1p4h h ALA 500 Ca -0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1p4h h ALA 500 Cb 1.58 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1p4h h ALA 500 CO 0.18 0.46 -0.16 1.49 0.00 0.00 0.00 179.25 181.22 1p4h h GLU 501 N 0.70 -0.43 0.00 0.00 4.57 -0.89 -0.43 114.58 118.09 1p4h h GLU 501 Ca 0.16 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.36 1p4h h GLU 501 Cb 0.18 0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.87 1p4h h GLU 501 CO -0.01 -0.13 -0.08 -0.84 -1.18 0.00 0.00 179.01 176.78 1p4h h ILE 502 N -0.74 0.69 -0.01 2.32 3.07 -1.47 0.12 117.51 121.50 1p4h h ILE 502 Ca -0.05 -0.30 -0.12 0.00 1.55 0.00 0.00 64.86 65.94 1p4h h ILE 502 Cb 0.50 1.18 0.01 0.00 -0.27 0.00 0.00 36.82 38.24 1p4h h ILE 502 CO 0.07 0.07 -0.46 0.40 -1.05 0.00 0.00 178.15 177.19 1p4h h ILE 503 N 0.00 1.47 -0.60 0.16 2.04 -1.33 -3.23 117.51 116.01 1p4h h ILE 503 Ca -0.00 -2.00 -0.01 0.00 1.00 0.00 0.00 64.86 63.85 1p4h h ILE 503 Cb 0.18 2.62 -0.03 0.00 -0.74 0.00 0.00 36.82 38.85 1p4h h ILE 503 CO 0.01 0.57 0.34 0.00 0.00 0.00 0.00 178.15 179.07 1p4h h ALA 504 N 0.31 1.46 -0.09 1.87 0.00 -0.23 -1.48 119.26 121.10 1p4h h ALA 504 Ca -0.05 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.79 1p4h h ALA 504 Cb 1.18 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1p4h h ALA 504 CO 0.09 0.45 0.10 0.93 0.00 0.00 0.00 179.25 180.82 1p4h h GLU 505 N 0.83 0.00 0.00 0.00 5.08 -0.82 0.20 114.58 119.87 1p4h h GLU 505 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1p4h h GLU 505 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1p4h h GLU 505 CO -0.04 0.00 -1.44 0.54 -1.00 0.00 0.00 179.01 177.07 1p4h n ARG 506 N -3.93 0.71 0.00 2.33 1.74 -0.69 -4.74 116.66 112.08 1p4h n ARG 506 Ca -0.01 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 1p4h n ARG 506 Cb 0.20 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 1p4h n ARG 506 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1p4h n ILE 507 N -1.85 0.11 -1.52 0.55 -5.35 -0.64 -5.08 119.36 105.57 1p4h n ILE 507 Ca -0.02 -0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.30 1p4h n ILE 507 Cb 0.31 1.35 0.00 0.00 -1.74 0.00 0.00 39.64 39.55 1p4h n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1p4h n GLY 508 N -0.05 -2.23 0.09 3.28 0.00 0.68 -4.65 105.19 102.31 1p4h n GLY 508 Ca 0.00 -1.77 0.09 0.00 0.00 0.00 0.00 46.02 44.35 1p4h n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1p4h n GLU 509 N -0.12 0.82 0.18 1.61 1.02 -1.26 -4.02 120.64 118.87 1p4h n GLU 509 Ca 0.00 -0.19 0.18 0.00 -0.02 0.00 0.00 57.16 57.13 1p4h n GLU 509 Cb 0.00 -1.40 0.81 0.00 -0.02 0.00 0.00 31.44 30.82 1p4h n GLU 509 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1p4h h GLU 510 N 0.45 0.00 0.00 3.49 3.07 -1.96 -2.41 114.58 117.22 1p4h h GLU 510 Ca 0.00 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 1p4h h GLU 510 Cb 0.50 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1p4h h GLU 510 CO 0.00 0.00 -0.12 0.10 -1.40 0.00 0.00 179.01 177.59 1p4h h TYR 511 N 0.00 0.00 -0.65 4.33 -0.00 -1.80 -2.82 116.97 116.03 1p4h h TYR 511 Ca 0.11 0.00 0.19 0.00 -0.00 0.00 0.00 58.73 59.03 1p4h h TYR 511 Cb 0.59 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 37.30 1p4h h TYR 511 CO 0.00 0.12 0.51 0.82 -0.00 0.00 0.00 178.16 179.61 1p4h h ILE 512 N 0.00 0.56 0.00 -0.90 2.04 -1.78 0.18 117.51 117.60 1p4h h ILE 512 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1p4h h ILE 512 Cb 0.22 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1p4h h ILE 512 CO 0.02 0.00 -0.05 -1.54 0.00 0.00 0.00 178.15 176.57 1p4h n SER 513 N -4.14 2.03 -2.78 1.72 3.41 -1.09 -4.64 113.62 108.13 1p4h n SER 513 Ca 0.13 -2.84 -0.08 0.00 -0.26 0.00 0.00 58.87 55.82 1p4h n SER 513 Cb 0.76 -0.36 0.04 0.00 -0.26 0.00 0.00 64.21 64.39 1p4h n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1p4h n ASP 514 N -1.17 -2.84 0.31 4.04 4.64 0.49 -5.03 116.55 116.99 1p4h n ASP 514 Ca 0.12 -3.20 0.21 0.00 -1.38 0.00 0.00 54.79 50.55 1p4h n ASP 514 Cb 0.61 1.68 1.12 0.00 -1.04 0.00 0.00 41.12 43.48 1p4h n ASP 514 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 1p4h h LEU 515 N 4.20 0.00 -2.59 -2.67 5.85 -1.48 -2.03 115.31 116.58 1p4h h LEU 515 Ca -0.10 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 1p4h h LEU 515 Cb 1.04 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 1p4h h LEU 515 CO 0.28 0.00 -0.01 0.44 -0.34 0.00 0.00 178.44 178.81 1p4h h ASP 516 N 0.00 0.00 0.41 1.25 3.32 -1.85 -1.68 116.42 117.88 1p4h h ASP 516 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1p4h h ASP 516 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1p4h h ASP 516 CO 0.00 0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.53 1p4h n GLN 517 N -3.57 0.13 0.24 3.56 6.02 -0.76 -2.06 117.38 120.95 1p4h n GLN 517 Ca -0.03 0.47 0.17 0.00 -0.01 0.00 0.00 57.00 57.60 1p4h n GLN 517 Cb 0.09 -1.81 0.85 0.00 1.02 0.00 0.00 30.24 30.39 1p4h n GLN 517 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1p4h h LEU 518 N 0.00 0.00 -0.94 1.08 3.38 -1.54 -1.51 115.31 115.78 1p4h h LEU 518 Ca 0.00 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.13 1p4h h LEU 518 Cb 0.21 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.86 1p4h h LEU 518 CO 0.00 0.00 0.54 0.03 0.09 0.00 0.00 178.44 179.10 1p4h h ARG 519 N 0.00 0.71 -0.29 1.13 2.47 -1.03 0.80 114.38 118.18 1p4h h ARG 519 Ca 0.00 -0.04 0.08 0.00 -1.26 0.00 0.00 59.98 58.76 1p4h h ARG 519 Cb 0.09 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.23 1p4h h ARG 519 CO 0.00 0.47 0.44 0.87 0.56 0.00 0.00 179.97 182.31 1p4h h LYS 520 N 0.74 0.00 0.00 0.04 1.57 -1.52 0.22 116.57 117.61 1p4h h LYS 520 Ca 0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.30 1p4h h LYS 520 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1p4h h LYS 520 CO -0.36 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 179.80 1p4h n LEU 521 N -3.41 0.51 0.24 2.94 4.77 0.28 -2.47 117.00 119.86 1p4h n LEU 521 Ca 0.05 0.65 0.07 0.00 -0.03 0.00 0.00 56.01 56.75 1p4h n LEU 521 Cb 0.58 -0.61 0.60 0.00 -2.33 0.00 0.00 43.42 41.65 1p4h n LEU 521 CO 0.22 -0.59 0.98 -0.07 -1.33 0.00 0.00 177.39 176.60 1p4h h LEU 522 N 0.00 0.00 -0.36 2.23 4.07 -0.73 -1.35 115.31 119.18 1p4h h LEU 522 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1p4h h LEU 522 Cb 0.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.99 1p4h h LEU 522 CO 0.00 0.11 0.00 -1.54 -1.08 0.00 0.00 178.44 175.93 1p4h n SER 523 N -4.30 0.53 -0.12 -0.43 3.41 -1.03 -2.89 113.62 108.79 1p4h n SER 523 Ca -0.03 -1.85 0.01 0.00 -0.26 0.00 0.00 58.87 56.74 1p4h n SER 523 Cb 0.18 -0.06 0.02 0.00 -0.26 0.00 0.00 64.21 64.09 1p4h n SER 523 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1p4h n TYR 524 N -0.28 0.04 0.31 7.33 4.01 -0.51 -4.67 117.16 123.39 1p4h n TYR 524 Ca 0.07 -0.20 0.17 0.00 -0.16 0.00 0.00 57.90 57.78 1p4h n TYR 524 Cb 0.10 -0.02 0.99 0.00 -0.31 0.00 0.00 39.34 40.10 1p4h n TYR 524 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 1p4h h VAL 525 N 0.47 0.39 -0.28 -0.72 3.04 -1.54 0.34 116.25 117.95 1p4h h VAL 525 Ca 0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1p4h h VAL 525 Cb 0.28 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.59 1p4h h VAL 525 CO 0.00 0.01 0.00 0.47 -1.01 0.00 0.00 177.57 177.04 1p4h n ASP 526 N -3.63 2.77 -4.63 3.17 10.43 -1.26 -4.88 116.55 118.52 1p4h n ASP 526 Ca -0.03 -1.85 -0.43 0.00 2.57 0.00 0.00 54.79 55.05 1p4h n ASP 526 Cb 0.09 -0.18 -0.02 0.00 1.84 0.00 0.00 41.12 42.84 1p4h n ASP 526 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1p4h s ASP 527 N -1.03 6.85 0.21 -2.24 3.68 0.11 -4.92 116.67 119.33 1p4h s ASP 527 Ca 0.23 0.90 -0.10 0.00 2.13 0.00 0.00 52.55 55.71 1p4h s ASP 527 Cb 0.13 -2.55 0.18 0.00 -1.45 0.00 0.00 42.92 39.24 1p4h s ASP 527 CO 0.18 -0.98 1.86 -0.08 0.13 0.00 0.00 175.17 176.28 1p4h h GLU 528 N 8.39 0.88 -0.25 4.34 4.57 -1.92 -1.14 114.58 129.46 1p4h h GLU 528 Ca -0.21 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 57.91 1p4h h GLU 528 Cb 1.06 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.44 1p4h h GLU 528 CO 1.06 0.58 0.12 0.00 -1.18 0.00 0.00 179.01 179.59 1p4h h ALA 529 N 1.30 0.32 -0.04 2.92 0.00 -1.95 -1.88 119.26 119.93 1p4h h ALA 529 Ca 0.28 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1p4h h ALA 529 Cb -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1p4h h ALA 529 CO -0.10 -0.12 0.02 0.35 0.00 0.00 0.00 179.25 179.40 1p4h h PHE 530 N 0.27 0.06 -0.74 0.00 -0.00 -1.82 -0.70 116.94 114.01 1p4h h PHE 530 Ca 0.08 -0.00 0.14 0.00 -0.00 0.00 0.00 57.97 58.19 1p4h h PHE 530 Cb 0.12 -0.02 -0.10 0.00 -0.00 0.00 0.00 35.95 35.95 1p4h h PHE 530 CO -0.02 0.14 0.28 0.82 -0.00 0.00 0.00 178.31 179.53 1p4h h ILE 531 N -0.03 0.65 -0.62 1.41 2.04 -1.16 0.13 117.51 119.92 1p4h h ILE 531 Ca 0.02 -0.14 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 1p4h h ILE 531 Cb 0.10 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.35 1p4h h ILE 531 CO -0.00 0.08 0.11 -0.09 0.00 0.00 0.00 178.15 178.24 1p4h h ARG 532 N 0.42 1.01 -0.14 2.37 2.43 -0.92 -2.07 114.38 117.47 1p4h h ARG 532 Ca 0.41 -0.25 -0.11 0.00 -0.81 0.00 0.00 59.98 59.21 1p4h h ARG 532 Cb 0.62 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1p4h h ARG 532 CO -0.41 0.92 -0.35 -0.44 -1.51 0.00 0.00 179.97 178.19 1p4h h ASP 533 N 0.95 0.55 -0.40 -3.80 3.32 0.42 -1.01 116.42 116.44 1p4h h ASP 533 Ca 0.19 -0.58 0.06 0.00 0.02 0.00 0.00 57.03 56.72 1p4h h ASP 533 Cb 0.40 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.74 1p4h h ASP 533 CO 0.01 1.03 0.10 0.58 -1.72 0.00 0.00 179.24 179.24 1p4h h VAL 534 N 0.10 0.83 -0.38 -1.35 2.07 -0.76 0.10 116.25 116.86 1p4h h VAL 534 Ca -0.00 -0.08 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 1p4h h VAL 534 Cb 0.95 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1p4h h VAL 534 CO 0.08 0.04 -0.06 0.00 0.02 0.00 0.00 177.57 177.65 1p4h h ALA 535 N 1.28 1.20 -0.32 1.67 0.00 -1.36 -2.54 119.26 119.19 1p4h h ALA 535 Ca 0.19 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1p4h h ALA 535 Cb 0.21 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1p4h h ALA 535 CO -0.23 0.52 0.01 -0.22 0.00 0.00 0.00 179.25 179.34 1p4h h LYS 536 N 0.58 0.56 -0.58 0.00 3.64 -0.07 -1.54 116.57 119.16 1p4h h LYS 536 Ca 0.11 -0.17 0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1p4h h LYS 536 Cb 0.46 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.19 1p4h h LYS 536 CO 0.02 0.68 0.35 0.28 -2.27 0.00 0.00 179.45 178.52 1p4h h VAL 537 N 0.36 1.07 -0.43 2.00 2.07 -0.67 -0.34 116.25 120.32 1p4h h VAL 537 Ca 0.09 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 1p4h h VAL 537 Cb 0.42 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1p4h h VAL 537 CO 0.01 0.13 0.24 0.50 0.02 0.00 0.00 177.57 178.47 1p4h h LYS 538 N 0.70 0.60 -0.81 1.57 1.63 -1.34 -0.34 116.57 118.59 1p4h h LYS 538 Ca 0.23 -0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1p4h h LYS 538 Cb 0.01 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.48 1p4h h LYS 538 CO -0.09 0.48 0.49 0.37 -3.45 0.00 0.00 179.45 177.24 1p4h h GLN 539 N 0.56 1.09 -0.47 1.90 5.75 -0.78 -0.01 115.11 123.15 1p4h h GLN 539 Ca 0.15 -0.10 -0.05 0.00 -0.15 0.00 0.00 58.65 58.50 1p4h h GLN 539 Cb 0.05 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.35 1p4h h GLN 539 CO -0.02 0.77 0.09 0.93 -2.65 0.00 0.00 178.83 177.94 1p4h h GLU 540 N 1.10 0.77 -0.97 1.69 5.08 -0.73 -1.19 114.58 120.33 1p4h h GLU 540 Ca 0.29 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1p4h h GLU 540 Cb -0.05 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 1p4h h GLU 540 CO -0.05 0.77 0.65 -0.91 -1.00 0.00 0.00 179.01 178.46 1p4h h ASN 541 N 0.64 1.12 -0.60 1.42 2.35 -0.51 0.31 115.58 120.31 1p4h h ASN 541 Ca 0.14 -0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 1p4h h ASN 541 Cb 0.37 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 1p4h h ASN 541 CO 0.01 0.81 0.01 0.11 -1.65 0.00 0.00 177.43 176.72 1p4h h LYS 542 N 1.32 1.05 -0.49 0.81 1.57 -0.70 -0.44 116.57 119.68 1p4h h LYS 542 Ca 0.36 -0.33 -0.08 0.00 -1.87 0.00 0.00 60.65 58.73 1p4h h LYS 542 Cb -0.15 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 1p4h h LYS 542 CO -0.08 1.03 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.75 1p4h h LEU 543 N 0.95 0.86 -0.92 2.94 3.38 -0.74 0.22 115.31 122.00 1p4h h LEU 543 Ca 0.17 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1p4h h LEU 543 Cb 0.55 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1p4h h LEU 543 CO 0.03 0.97 0.44 0.50 0.09 0.00 0.00 178.44 180.47 1p4h h LYS 544 N 0.74 1.21 0.13 1.13 3.11 -0.73 -0.71 116.57 121.44 1p4h h LYS 544 Ca 0.14 -0.16 -0.30 0.00 -2.81 0.00 0.00 60.65 57.52 1p4h h LYS 544 Cb 0.53 -0.23 0.03 0.00 -1.00 0.00 0.00 32.23 31.56 1p4h h LYS 544 CO 0.03 0.91 -1.27 0.35 -2.81 0.00 0.00 179.45 176.65 1p4h h PHE 545 N 1.21 1.01 -0.17 1.91 3.57 -0.83 -2.11 116.94 121.53 1p4h h PHE 545 Ca 0.30 -0.64 -0.00 0.00 3.53 0.00 0.00 57.97 61.15 1p4h h PHE 545 Cb 0.07 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 1p4h h PHE 545 CO 0.01 1.48 0.09 0.00 -2.23 0.00 0.00 178.31 177.67 1p4h h ALA 546 N 0.29 1.84 0.13 2.41 0.00 -0.37 -0.08 119.26 123.48 1p4h h ALA 546 Ca -0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1p4h h ALA 546 Cb 1.94 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1p4h h ALA 546 CO 0.24 0.14 -0.06 0.00 0.00 0.00 0.00 179.25 179.57 1p4h h ALA 547 N 1.87 -0.18 -1.01 0.00 0.00 -1.10 -3.16 119.26 115.68 1p4h h ALA 547 Ca 0.06 -0.24 0.22 0.00 0.00 0.00 0.00 54.91 54.95 1p4h h ALA 547 Cb 0.01 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 17.76 1p4h h ALA 547 CO -0.01 -0.27 0.61 -0.92 0.00 0.00 0.00 179.25 178.66 1p4h h TYR 548 N -0.84 0.96 -0.77 0.00 5.03 -0.90 0.10 116.97 120.56 1p4h h TYR 548 Ca -0.02 0.03 0.06 0.00 2.58 0.00 0.00 58.73 61.38 1p4h h TYR 548 Cb 0.54 -0.28 -0.06 0.00 1.55 0.00 0.00 36.73 38.48 1p4h h TYR 548 CO 0.10 0.14 0.47 1.25 -1.32 0.00 0.00 178.16 178.79 1p4h h LEU 549 N 0.62 0.72 -0.23 2.82 5.85 -1.03 -1.88 115.31 122.19 1p4h h LEU 549 Ca 0.60 0.02 -0.21 0.00 0.84 0.00 0.00 57.88 59.13 1p4h h LEU 549 Cb 1.13 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 1p4h h LEU 549 CO -0.39 0.47 -0.90 -0.33 -0.34 0.00 0.00 178.44 176.95 1p4h h GLU 550 N 0.86 0.36 0.70 1.25 5.08 -0.82 -2.05 114.58 119.97 1p4h h GLU 550 Ca 0.34 -0.37 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1p4h h GLU 550 Cb 0.16 0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.52 1p4h h GLU 550 CO -0.17 1.05 -0.34 0.00 -1.00 0.00 0.00 179.01 178.55 1p4h h ARG 551 N 0.21 -0.91 -0.00 2.33 3.08 -0.84 -2.20 114.38 116.04 1p4h h ARG 551 Ca -0.06 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1p4h h ARG 551 Cb 1.52 0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.78 1p4h h ARG 551 CO 0.15 -0.58 -0.32 0.39 -1.07 0.00 0.00 179.97 178.54 1p4h n GLU 552 N -5.42 0.52 -0.44 0.04 -0.58 -0.74 -4.45 120.64 109.57 1p4h n GLU 552 Ca -0.13 -0.29 0.00 0.00 -0.42 0.00 0.00 57.16 56.32 1p4h n GLU 552 Cb 0.39 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.76 1p4h n GLU 552 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1p4h n TYR 553 N -0.98 0.00 -3.78 -0.32 4.01 -0.78 -5.06 117.16 110.25 1p4h n TYR 553 Ca 0.10 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.56 1p4h n TYR 553 Cb 0.34 0.03 0.01 0.00 -0.31 0.00 0.00 39.34 39.41 1p4h n TYR 553 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1p4h n LYS 554 N 0.00 -0.72 -3.70 -0.72 4.76 -0.83 -4.86 118.16 112.09 1p4h n LYS 554 Ca 0.00 0.17 -0.20 0.00 -2.87 0.00 0.00 58.31 55.41 1p4h n LYS 554 Cb 0.63 -1.58 -0.18 0.00 -1.84 0.00 0.00 35.03 32.06 1p4h n LYS 554 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1p4h s VAL 555 N -3.42 -0.04 -0.08 -0.18 -7.23 -1.20 -4.96 120.40 103.29 1p4h s VAL 555 Ca 0.22 0.36 -0.13 0.00 -1.81 0.00 0.00 61.98 60.62 1p4h s VAL 555 Cb -0.12 -0.19 -0.05 0.00 0.56 0.00 0.00 36.38 36.58 1p4h s VAL 555 CO 0.70 0.18 0.31 -2.28 -0.31 0.00 0.00 175.10 173.70 1p4h s HIS 556 N 1.99 3.61 0.05 2.82 2.46 -1.26 -3.28 115.29 121.67 1p4h s HIS 556 Ca 0.03 0.76 -0.01 0.00 0.47 0.00 0.00 55.06 56.31 1p4h s HIS 556 Cb -0.12 -2.24 -0.04 0.00 -0.13 0.00 0.00 32.58 30.06 1p4h s HIS 556 CO -0.03 0.52 -0.02 0.96 -2.47 0.00 0.00 174.74 173.69 1p4h s ILE 557 N -0.50 0.20 -0.51 0.89 -4.36 -1.26 -5.12 121.20 110.54 1p4h s ILE 557 Ca 0.19 -1.66 -0.22 0.00 -0.26 0.00 0.00 60.65 58.71 1p4h s ILE 557 Cb -0.14 -1.33 0.04 0.00 1.25 0.00 0.00 42.46 42.28 1p4h s ILE 557 CO 0.08 -0.92 0.78 0.21 0.24 0.00 0.00 174.94 175.33 1p4h s ASN 558 N -2.70 6.30 0.17 4.36 2.47 -1.26 -4.92 114.94 119.36 1p4h s ASN 558 Ca 0.03 -0.54 0.10 0.00 0.42 0.00 0.00 52.86 52.87 1p4h s ASN 558 Cb 0.05 -2.36 0.56 0.00 -1.45 0.00 0.00 41.25 38.05 1p4h s ASN 558 CO -0.09 -1.03 1.29 -2.65 -3.72 0.00 0.00 177.10 170.90 1p4h n PRO 559 N 6.78 0.07 0.00 0.43 -0.02 -1.26 -1.29 135.00 139.71 1p4h n PRO 559 Ca -0.02 0.55 0.12 0.00 -2.02 0.00 0.00 63.50 62.12 1p4h n PRO 559 Cb 0.47 -1.77 0.18 0.00 -0.02 0.00 0.00 33.50 32.35 1p4h n PRO 559 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1p4h n ASN 560 N -1.85 0.71 -4.84 2.55 3.02 -1.26 -4.88 115.26 108.70 1p4h n ASN 560 Ca -0.01 -0.52 -0.30 0.00 -0.03 0.00 0.00 54.58 53.73 1p4h n ASN 560 Cb 0.07 0.40 0.07 0.00 -0.61 0.00 0.00 39.78 39.71 1p4h n ASN 560 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1p4h s SER 561 N -2.93 4.92 -0.05 6.41 1.04 -0.41 -4.93 113.70 117.75 1p4h s SER 561 Ca 0.12 1.20 -0.30 0.00 0.48 0.00 0.00 55.95 57.45 1p4h s SER 561 Cb 0.17 -1.95 -0.03 0.00 0.10 0.00 0.00 66.02 64.32 1p4h s SER 561 CO 0.71 -1.69 1.07 -0.22 0.98 0.00 0.00 173.24 174.10 1p4h s LEU 562 N -5.58 4.30 -0.68 2.42 0.20 0.26 -4.80 118.68 114.80 1p4h s LEU 562 Ca 0.60 1.69 -0.23 0.00 0.69 0.00 0.00 54.13 56.88 1p4h s LEU 562 Cb -0.13 -3.56 0.07 0.00 -0.43 0.00 0.00 46.19 42.14 1p4h s LEU 562 CO 0.53 -0.44 1.01 -0.36 -0.29 0.00 0.00 176.35 176.81 1p4h s PHE 563 N 1.69 2.65 -0.50 5.38 2.99 -1.26 -0.75 117.98 128.17 1p4h s PHE 563 Ca 0.52 -0.54 -0.19 0.00 0.00 0.00 0.00 56.93 56.73 1p4h s PHE 563 Cb -0.22 -4.34 0.06 0.00 0.00 0.00 0.00 43.02 38.53 1p4h s PHE 563 CO 0.23 -1.70 0.60 0.34 -0.00 0.00 0.00 175.22 174.69 1p4h s ASP 564 N 3.71 6.21 -0.01 1.36 3.68 -0.16 -1.48 116.67 129.97 1p4h s ASP 564 Ca 0.24 -0.98 0.05 0.00 2.13 0.00 0.00 52.55 53.99 1p4h s ASP 564 Cb -0.15 -2.28 -0.01 0.00 -1.45 0.00 0.00 42.92 39.03 1p4h s ASP 564 CO 0.10 -0.86 -0.17 0.54 0.13 0.00 0.00 175.17 174.91 1p4h s VAL 565 N 2.49 1.33 -0.31 1.11 0.11 -0.63 0.55 120.40 125.05 1p4h s VAL 565 Ca 0.13 -0.71 0.00 0.00 -2.93 0.00 0.00 61.98 58.47 1p4h s VAL 565 Cb -0.20 -1.11 0.10 0.00 -1.53 0.00 0.00 36.38 33.64 1p4h s VAL 565 CO 0.11 0.38 0.09 -1.58 -3.33 0.00 0.00 175.10 170.76 1p4h s GLN 566 N -0.37 0.88 -0.13 1.54 0.74 0.50 -1.95 119.66 120.87 1p4h s GLN 566 Ca 0.06 -1.23 0.02 0.00 0.05 0.00 0.00 55.36 54.27 1p4h s GLN 566 Cb -0.07 -2.24 0.01 0.00 1.10 0.00 0.00 33.01 31.81 1p4h s GLN 566 CO -0.00 -0.97 -0.20 0.14 -0.55 0.00 0.00 175.29 173.70 1p4h s VAL 567 N 1.47 1.92 0.00 1.34 -7.23 -1.26 -1.61 120.40 115.03 1p4h s VAL 567 Ca 0.10 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 59.37 1p4h s VAL 567 Cb -0.18 -1.70 0.00 0.00 0.56 0.00 0.00 36.38 35.06 1p4h s VAL 567 CO -0.21 0.52 0.00 2.29 -0.31 0.00 0.00 175.10 177.39 1p4h n LYS 568 N 4.08 0.00 -1.72 4.82 2.85 -0.87 -4.99 118.16 122.33 1p4h n LYS 568 Ca -0.20 0.00 -0.39 0.00 -1.05 0.00 0.00 58.31 56.67 1p4h n LYS 568 Cb 0.51 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.92 1p4h n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1p4h n ARG 569 N -0.33 1.82 -2.41 -1.58 5.12 -1.26 -3.96 116.66 114.06 1p4h n ARG 569 Ca 0.00 0.66 -0.43 0.00 -1.93 0.00 0.00 57.85 56.15 1p4h n ARG 569 Cb 0.00 -2.50 -0.02 0.00 -1.16 0.00 0.00 32.46 28.78 1p4h n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1p4h s ILE 570 N -1.26 4.24 -0.01 0.55 -1.09 -0.52 -4.90 121.20 118.21 1p4h s ILE 570 Ca 0.67 1.51 -0.14 0.00 -2.23 0.00 0.00 60.65 60.46 1p4h s ILE 570 Cb -0.45 -3.98 0.02 0.00 -1.58 0.00 0.00 42.46 36.47 1p4h s ILE 570 CO 0.53 -0.12 0.29 -1.00 -1.23 0.00 0.00 174.94 173.41 1p4h s HIS 571 N 3.37 -0.15 0.24 3.97 3.76 -1.26 -4.72 115.29 120.50 1p4h s HIS 571 Ca 0.56 0.21 -0.01 0.00 -0.15 0.00 0.00 55.06 55.67 1p4h s HIS 571 Cb -0.23 0.08 0.28 0.00 1.11 0.00 0.00 32.58 33.82 1p4h s HIS 571 CO 0.16 -0.38 1.65 0.93 -0.85 0.00 0.00 174.74 176.26 1p4h h GLU 572 N 3.90 0.61 0.00 1.40 5.08 -1.97 -2.78 114.58 120.83 1p4h h GLU 572 Ca -0.30 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 57.79 1p4h h GLU 572 Cb 1.18 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 1p4h h GLU 572 CO 0.40 0.83 -0.10 0.10 -1.00 0.00 0.00 179.01 179.24 1p4h h TYR 573 N 0.53 0.00 0.00 4.33 -0.00 -1.97 -1.59 116.97 118.27 1p4h h TYR 573 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.79 1p4h h TYR 573 Cb 0.75 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.48 1p4h h TYR 573 CO 0.03 0.10 -0.04 0.87 -0.00 0.00 0.00 178.16 179.12 1p4h h LYS 574 N 0.00 0.00 -5.77 0.10 1.79 -1.84 -3.06 116.57 107.79 1p4h h LYS 574 Ca -0.00 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.11 1p4h h LYS 574 Cb 0.53 0.00 0.14 0.00 -1.58 0.00 0.00 32.23 31.31 1p4h h LYS 574 CO 0.01 0.04 -0.77 0.54 -1.08 0.00 0.00 179.45 178.19 1p4h n ARG 575 N -3.12 -6.46 0.28 3.15 1.74 -0.60 -3.97 116.66 107.68 1p4h n ARG 575 Ca 0.03 0.80 0.12 0.00 -0.77 0.00 0.00 57.85 58.02 1p4h n ARG 575 Cb 0.47 -5.74 0.78 0.00 -1.02 0.00 0.00 32.46 26.95 1p4h n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1p4h h GLN 576 N -2.00 0.00 -0.58 5.56 7.50 -1.83 -0.67 115.11 123.09 1p4h h GLN 576 Ca -0.59 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 58.55 1p4h h GLN 576 Cb 1.35 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.85 1p4h h GLN 576 CO 0.52 0.00 0.30 -0.07 -1.50 0.00 0.00 178.83 178.09 1p4h h LEU 577 N 0.00 0.71 -0.85 1.46 3.38 -1.89 -0.17 115.31 117.94 1p4h h LEU 577 Ca -0.00 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1p4h h LEU 577 Cb 0.00 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1p4h h LEU 577 CO 0.00 0.59 0.03 0.25 0.09 0.00 0.00 178.44 179.39 1p4h h LEU 578 N 0.80 0.85 -0.42 1.67 5.85 -1.49 -0.77 115.31 121.80 1p4h h LEU 578 Ca 0.20 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1p4h h LEU 578 Cb 0.04 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 1p4h h LEU 578 CO -0.03 0.89 0.15 -1.13 -0.34 0.00 0.00 178.44 177.98 1p4h h ASN 579 N 0.82 0.60 -0.73 1.25 -0.00 -1.19 -2.46 115.58 113.88 1p4h h ASN 579 Ca 0.16 -0.19 0.05 0.00 -0.00 0.00 0.00 56.30 56.32 1p4h h ASN 579 Cb 0.45 -0.16 -0.05 0.00 -0.00 0.00 0.00 38.32 38.56 1p4h h ASN 579 CO 0.02 0.63 0.44 0.00 -0.00 0.00 0.00 177.43 178.52 1p4h h LEU 581 N 0.82 1.02 -0.17 0.00 3.38 -0.86 -0.83 115.31 118.66 1p4h h LEU 581 Ca 0.31 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 1p4h h LEU 581 Cb 0.13 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1p4h h LEU 581 CO -0.16 0.73 -0.01 -0.74 0.09 0.00 0.00 178.44 178.35 1p4h h HIS 582 N 1.20 0.35 -0.62 1.13 2.76 -0.89 -1.11 115.15 117.97 1p4h h HIS 582 Ca 0.34 -0.06 0.08 0.00 -2.20 0.00 0.00 60.37 58.52 1p4h h HIS 582 Cb -0.10 -0.09 -0.06 0.00 1.55 0.00 0.00 27.41 28.70 1p4h h HIS 582 CO -0.00 0.54 0.29 0.28 -1.30 0.00 0.00 177.93 177.74 1p4h h VAL 583 N 0.05 0.86 -0.18 5.26 2.07 -0.76 0.59 116.25 124.15 1p4h h VAL 583 Ca 0.05 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 67.31 1p4h h VAL 583 Cb 0.41 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1p4h h VAL 583 CO 0.01 0.09 -0.23 0.40 0.02 0.00 0.00 177.57 177.87 1p4h h ILE 584 N 0.52 1.24 -0.23 4.57 2.04 -1.07 -1.43 117.51 123.15 1p4h h ILE 584 Ca 0.30 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.02 1p4h h ILE 584 Cb 0.29 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1p4h h ILE 584 CO -0.24 0.35 0.05 0.74 0.00 0.00 0.00 178.15 179.04 1p4h h THR 585 N 0.29 1.22 -0.62 -0.27 2.02 0.23 -0.22 112.91 115.57 1p4h h THR 585 Ca 0.05 -0.72 0.03 0.00 0.77 0.00 0.00 66.41 66.53 1p4h h THR 585 Cb 0.57 1.26 -0.04 0.00 -1.74 0.00 0.00 68.15 68.20 1p4h h THR 585 CO 0.04 0.23 0.38 -0.07 0.37 0.00 0.00 175.52 176.46 1p4h h LEU 586 N 0.18 0.61 -0.07 2.58 4.07 -0.65 -0.86 115.31 121.17 1p4h h LEU 586 Ca 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 1p4h h LEU 586 Cb 0.30 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 41.91 1p4h h LEU 586 CO 0.00 0.43 0.04 0.22 -1.08 0.00 0.00 178.44 178.05 1p4h h TYR 587 N 0.74 0.10 -0.64 1.13 5.03 -1.06 -1.96 116.97 120.32 1p4h h TYR 587 Ca 0.25 -0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.53 1p4h h TYR 587 Cb 0.03 -0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.25 1p4h h TYR 587 CO -0.05 0.13 0.29 -0.91 -1.32 0.00 0.00 178.16 176.30 1p4h h ASN 588 N 0.04 0.82 -0.46 -2.11 2.35 -0.67 -1.74 115.58 113.81 1p4h h ASN 588 Ca 0.03 -0.09 -0.07 0.00 -0.55 0.00 0.00 56.30 55.61 1p4h h ASN 588 Cb 0.06 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 1p4h h ASN 588 CO -0.00 0.71 0.02 0.03 -1.65 0.00 0.00 177.43 176.53 1p4h h ARG 589 N 0.90 0.86 -0.27 0.81 3.08 -0.98 -1.10 114.38 117.69 1p4h h ARG 589 Ca 0.22 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 1p4h h ARG 589 Cb 0.11 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1p4h h ARG 589 CO -0.03 0.84 -0.04 0.82 -1.07 0.00 0.00 179.97 180.49 1p4h h ILE 590 N 0.80 1.28 0.00 2.04 2.04 -0.86 -1.54 117.51 121.26 1p4h h ILE 590 Ca 0.16 -1.03 -0.04 0.00 1.00 0.00 0.00 64.86 64.95 1p4h h ILE 590 Cb 0.45 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 1p4h h ILE 590 CO 0.02 0.33 -0.17 0.11 0.00 0.00 0.00 178.15 178.44 1p4h h LYS 591 N 0.26 0.00 -0.08 2.37 1.79 -1.16 0.13 116.57 119.88 1p4h h LYS 591 Ca 0.07 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.33 1p4h h LYS 591 Cb 0.50 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.17 1p4h h LYS 591 CO 0.02 0.17 -0.76 -0.22 -1.08 0.00 0.00 179.45 177.58 1p4h h LYS 592 N 0.00 0.66 -2.33 3.15 3.64 -0.90 -3.39 116.57 117.40 1p4h h LYS 592 Ca -0.00 -0.60 -0.59 0.00 -1.27 0.00 0.00 60.65 58.20 1p4h h LYS 592 Cb 0.38 0.14 -0.39 0.00 -0.41 0.00 0.00 32.23 31.96 1p4h h LYS 592 CO 0.02 1.21 -0.95 0.39 -2.27 0.00 0.00 179.45 177.84 1p4h n GLU 593 N -4.03 0.60 -0.30 1.90 1.02 -0.61 -5.01 120.64 114.21 1p4h n GLU 593 Ca -0.09 -3.39 0.05 0.00 -0.02 0.00 0.00 57.16 53.72 1p4h n GLU 593 Cb 0.74 -1.64 0.20 0.00 -0.02 0.00 0.00 31.44 30.72 1p4h n GLU 593 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1p4h h PRO 594 N 5.11 0.73 -0.73 3.49 0.11 -0.95 -2.66 132.00 137.11 1p4h h PRO 594 Ca 0.20 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1p4h h PRO 594 Cb 0.87 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1p4h h PRO 594 CO 0.45 0.48 0.00 0.09 -0.21 0.00 0.00 178.00 178.81 1p4h n ASN 595 N -4.78 3.05 -4.87 -2.05 3.02 -1.26 -4.84 115.26 103.54 1p4h n ASN 595 Ca 0.16 -2.37 -0.37 0.00 -0.03 0.00 0.00 54.58 51.97 1p4h n ASN 595 Cb 0.36 -0.53 -0.06 0.00 -0.61 0.00 0.00 39.78 38.94 1p4h n ASN 595 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1p4h s LYS 596 N -1.79 3.61 0.28 3.52 2.36 -1.00 -5.07 119.74 121.64 1p4h s LYS 596 Ca 0.26 0.03 -0.29 0.00 -2.55 0.00 0.00 55.97 53.43 1p4h s LYS 596 Cb 0.19 -3.17 -0.09 0.00 -1.05 0.00 0.00 37.83 33.70 1p4h s LYS 596 CO 0.09 0.72 0.99 0.12 1.55 0.00 0.00 175.35 178.83 1p4h s PHE 597 N -1.11 3.76 -0.06 4.03 5.36 -1.26 -5.05 117.98 123.65 1p4h s PHE 597 Ca 0.20 1.81 -0.08 0.00 -0.96 0.00 0.00 56.93 57.91 1p4h s PHE 597 Cb -0.14 -3.07 0.02 0.00 -0.34 0.00 0.00 43.02 39.49 1p4h s PHE 597 CO 0.10 0.04 0.20 0.14 -1.46 0.00 0.00 175.22 174.24 1p4h s VAL 598 N -1.29 0.02 0.14 3.12 -7.23 -1.26 -5.12 120.40 108.78 1p4h s VAL 598 Ca 0.45 -0.19 -0.31 0.00 -1.81 0.00 0.00 61.98 60.12 1p4h s VAL 598 Cb -0.26 -0.35 -0.11 0.00 0.56 0.00 0.00 36.38 36.22 1p4h s VAL 598 CO 0.33 -0.11 1.82 0.52 -0.31 0.00 0.00 175.10 177.35 1p4h n VAL 599 N 2.50 0.30 -2.05 1.32 0.31 -1.26 -4.93 118.33 114.53 1p4h n VAL 599 Ca -0.16 -0.05 -0.39 0.00 -0.01 0.00 0.00 64.34 63.73 1p4h n VAL 599 Cb 0.58 -2.10 -0.00 0.00 -0.91 0.00 0.00 33.84 31.40 1p4h n VAL 599 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1p4h s PRO 600 N 2.47 3.96 0.01 5.55 0.02 -1.26 -4.92 135.00 140.82 1p4h s PRO 600 Ca 0.81 2.16 -0.02 0.00 0.02 0.00 0.00 61.00 63.98 1p4h s PRO 600 Cb -0.49 -2.76 -0.01 0.00 0.02 0.00 0.00 34.50 31.27 1p4h s PRO 600 CO 0.36 -0.50 0.02 1.03 -0.33 0.00 0.00 177.00 177.58 1p4h s ARG 601 N -2.24 0.25 -0.28 5.54 0.52 -0.72 -0.57 118.95 121.44 1p4h s ARG 601 Ca 0.57 -0.36 0.03 0.00 -0.52 0.00 0.00 55.73 55.44 1p4h s ARG 601 Cb -0.38 0.10 0.07 0.00 0.52 0.00 0.00 34.95 35.25 1p4h s ARG 601 CO 0.49 -0.05 -0.07 0.99 0.02 0.00 0.00 175.30 176.69 1p4h s THR 602 N -0.97 2.29 -0.34 0.02 2.01 0.07 -2.14 115.64 116.58 1p4h s THR 602 Ca -0.11 -1.75 -0.18 0.00 0.31 0.00 0.00 61.69 59.96 1p4h s THR 602 Cb -0.06 -2.41 -0.01 0.00 0.01 0.00 0.00 72.50 70.03 1p4h s THR 602 CO -0.00 -0.15 0.53 -0.69 -0.69 0.00 0.00 174.62 173.62 1p4h s VAL 603 N 1.08 5.00 -0.18 3.82 1.01 0.94 -0.99 120.40 131.09 1p4h s VAL 603 Ca -0.05 0.45 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 1p4h s VAL 603 Cb -0.20 -3.97 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1p4h s VAL 603 CO -0.05 -0.20 -0.09 -0.04 0.00 0.00 0.00 175.10 174.72 1p4h s MET 604 N 2.44 3.36 -0.06 2.72 -1.94 0.19 -0.90 119.30 125.10 1p4h s MET 604 Ca 0.20 -0.66 0.03 0.00 -1.71 0.00 0.00 55.69 53.54 1p4h s MET 604 Cb -0.15 -2.81 0.01 0.00 2.01 0.00 0.00 34.83 33.88 1p4h s MET 604 CO 0.13 -0.01 -0.15 0.42 -0.01 0.00 0.00 175.02 175.40 1p4h s ILE 605 N 0.96 1.30 0.05 2.53 1.01 -0.51 -0.37 121.20 126.16 1p4h s ILE 605 Ca -0.01 -0.59 -0.10 0.00 0.00 0.00 0.00 60.65 59.95 1p4h s ILE 605 Cb -0.15 -1.16 0.00 0.00 0.01 0.00 0.00 42.46 41.17 1p4h s ILE 605 CO -0.00 0.39 0.21 -0.83 0.00 0.00 0.00 174.94 174.70 1p4h s GLY 606 N 0.49 0.03 0.00 6.18 0.00 -0.63 -0.24 107.32 113.14 1p4h s GLY 606 Ca -0.13 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.26 1p4h s GLY 606 CO 0.04 -0.52 0.00 0.61 0.00 0.00 0.00 173.10 173.23 1p4h n GLY 607 N 0.47 3.94 3.90 0.20 0.00 -1.25 -2.05 105.19 110.40 1p4h n GLY 607 Ca -0.18 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 1p4h n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p4h s LYS 608 N -2.71 3.62 -0.02 1.61 1.02 -1.26 -4.62 119.74 117.38 1p4h s LYS 608 Ca 0.00 -0.08 0.02 0.00 0.02 0.00 0.00 55.97 55.93 1p4h s LYS 608 Cb 0.00 -2.81 -0.03 0.00 -0.52 0.00 0.00 37.83 34.47 1p4h s LYS 608 CO 0.00 0.42 -0.06 0.00 -0.92 0.00 0.00 175.35 174.79 1p4h s ALA 609 N -1.74 3.04 0.32 5.17 0.00 -1.26 -1.44 121.76 125.84 1p4h s ALA 609 Ca 0.42 -0.96 -0.29 0.00 0.00 0.00 0.00 51.96 51.12 1p4h s ALA 609 Cb -0.12 -1.19 -0.11 0.00 0.00 0.00 0.00 23.12 21.70 1p4h s ALA 609 CO 0.25 0.60 1.48 0.00 0.00 0.00 0.00 175.76 178.09 1p4h s ALA 610 N -0.93 3.62 0.37 0.00 0.00 -1.26 -4.87 121.76 118.68 1p4h s ALA 610 Ca 0.15 1.47 0.17 0.00 0.00 0.00 0.00 51.96 53.75 1p4h s ALA 610 Cb -0.11 -3.59 1.08 0.00 0.00 0.00 0.00 23.12 20.50 1p4h s ALA 610 CO 0.05 -0.90 1.72 -1.35 0.00 0.00 0.00 175.76 175.28 1p4h h PRO 611 N 3.99 0.38 -0.58 0.00 0.11 -1.98 -0.98 132.00 132.93 1p4h h PRO 611 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1p4h h PRO 611 Cb 1.23 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1p4h h PRO 611 CO 0.71 0.25 0.00 0.41 -0.21 0.00 0.00 178.00 179.17 1p4h n GLY 612 N -1.40 1.81 3.40 -0.55 0.00 -1.26 -4.75 105.19 102.44 1p4h n GLY 612 Ca 0.28 -0.67 -0.45 0.00 0.00 0.00 0.00 46.02 45.19 1p4h n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1p4h s TYR 613 N -1.23 3.57 0.16 1.61 6.04 -0.37 -4.92 117.35 122.20 1p4h s TYR 613 Ca 0.41 -1.90 -0.20 0.00 0.04 0.00 0.00 57.07 55.41 1p4h s TYR 613 Cb 0.21 -4.07 0.05 0.00 -1.04 0.00 0.00 41.96 37.12 1p4h s TYR 613 CO 0.28 -1.23 1.64 1.25 -1.54 0.00 0.00 175.55 175.96 1p4h h HIS 614 N 7.90 -0.49 -0.93 4.97 -0.00 -1.85 -2.21 115.15 122.53 1p4h h HIS 614 Ca 0.17 0.04 0.05 0.00 -0.00 0.00 0.00 60.37 60.63 1p4h h HIS 614 Cb 0.98 0.26 -0.06 0.00 -0.00 0.00 0.00 27.41 28.60 1p4h h HIS 614 CO 1.05 -0.27 0.59 1.98 -0.00 0.00 0.00 177.93 181.29 1p4h h MET 615 N -0.16 1.08 -0.52 5.26 1.85 -1.98 -0.59 114.93 119.87 1p4h h MET 615 Ca 0.16 -0.06 -0.03 0.00 -0.61 0.00 0.00 59.70 59.15 1p4h h MET 615 Cb 0.40 -0.24 -0.03 0.00 0.43 0.00 0.00 31.60 32.17 1p4h h MET 615 CO -0.40 0.71 0.21 0.00 -0.40 0.00 0.00 176.91 177.03 1p4h h ALA 616 N 1.41 1.39 0.00 0.39 0.00 -1.78 -0.80 119.26 119.88 1p4h h ALA 616 Ca 0.39 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 1p4h h ALA 616 Cb 0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1p4h h ALA 616 CO -0.15 0.46 -0.58 0.87 0.00 0.00 0.00 179.25 179.85 1p4h h LYS 617 N 0.74 0.00 -0.08 0.00 1.57 -0.64 -2.72 116.57 115.44 1p4h h LYS 617 Ca 0.18 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.79 1p4h h LYS 617 Cb 0.15 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1p4h h LYS 617 CO -0.02 0.58 -0.68 0.52 -0.57 0.00 0.00 179.45 179.28 1p4h h MET 618 N 0.00 0.35 -0.58 3.15 2.86 -0.26 -2.78 114.93 117.67 1p4h h MET 618 Ca -0.01 -0.27 -0.09 0.00 -2.06 0.00 0.00 59.70 57.28 1p4h h MET 618 Cb 1.14 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.83 1p4h h MET 618 CO 0.08 0.90 0.01 0.82 1.06 0.00 0.00 176.91 179.78 1p4h h ILE 619 N 0.24 1.26 -0.64 -1.22 2.04 -1.01 -0.67 117.51 117.51 1p4h h ILE 619 Ca -0.02 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 64.71 1p4h h ILE 619 Cb 1.24 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 1p4h h ILE 619 CO 0.11 0.40 0.28 0.40 0.00 0.00 0.00 178.15 179.34 1p4h h ILE 620 N 0.91 1.23 -0.60 -0.67 2.04 -1.41 -1.02 117.51 117.99 1p4h h ILE 620 Ca 0.17 -0.68 -0.06 0.00 1.00 0.00 0.00 64.86 65.29 1p4h h ILE 620 Cb 0.51 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 1p4h h ILE 620 CO 0.03 0.27 0.14 0.50 0.00 0.00 0.00 178.15 179.09 1p4h h LYS 621 N 0.88 0.93 -0.46 2.37 1.63 -1.19 -1.91 116.57 118.82 1p4h h LYS 621 Ca 0.21 -0.20 -0.03 0.00 -0.85 0.00 0.00 60.65 59.78 1p4h h LYS 621 Cb 0.17 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1p4h h LYS 621 CO -0.02 0.83 0.16 1.25 -3.45 0.00 0.00 179.45 178.22 1p4h h LEU 622 N 0.89 0.65 0.02 5.20 6.46 -0.65 0.93 115.31 128.82 1p4h h LEU 622 Ca 0.19 -0.19 0.01 0.00 -0.12 0.00 0.00 57.88 57.77 1p4h h LEU 622 Cb 0.33 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.08 1p4h h LEU 622 CO 0.00 0.66 -0.06 0.40 -0.62 0.00 0.00 178.44 178.82 1p4h h ILE 623 N 0.60 0.86 -0.27 4.05 2.04 -0.80 0.61 117.51 124.60 1p4h h ILE 623 Ca 0.15 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.95 1p4h h ILE 623 Cb 0.23 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1p4h h ILE 623 CO -0.01 0.00 -0.08 0.71 0.00 0.00 0.00 178.15 178.77 1p4h h THR 624 N -0.11 1.20 -0.65 -0.27 1.35 -1.22 -1.73 112.91 111.49 1p4h h THR 624 Ca 0.01 -0.86 -0.07 0.00 -0.55 0.00 0.00 66.41 64.94 1p4h h THR 624 Cb 0.12 1.09 -0.03 0.00 -1.73 0.00 0.00 68.15 67.61 1p4h h THR 624 CO -0.04 0.28 0.12 0.00 -0.25 0.00 0.00 175.52 175.63 1p4h h ALA 625 N 1.51 0.86 -0.68 6.62 0.00 -0.14 -0.54 119.26 126.90 1p4h h ALA 625 Ca 0.08 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 1p4h h ALA 625 Cb 0.40 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1p4h h ALA 625 CO 0.02 0.61 0.15 0.82 0.00 0.00 0.00 179.25 180.85 1p4h h ILE 626 N 0.98 1.26 -0.76 0.00 2.04 -0.52 -2.64 117.51 117.88 1p4h h ILE 626 Ca 0.20 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1p4h h ILE 626 Cb 0.42 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 1p4h h ILE 626 CO 0.01 0.37 0.45 1.23 0.00 0.00 0.00 178.15 180.21 1p4h h GLY 627 N 1.02 1.10 0.79 5.37 0.00 -0.82 0.12 103.07 110.66 1p4h h GLY 627 Ca 0.21 -0.47 0.08 0.00 0.00 0.00 0.00 47.33 47.16 1p4h h GLY 627 CO 0.01 0.45 0.58 -0.55 0.00 0.00 0.00 176.54 177.02 1p4h h ASP 628 N 1.04 0.83 0.00 0.19 3.45 -0.75 0.14 116.42 121.32 1p4h h ASP 628 Ca 0.27 0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.73 1p4h h ASP 628 Cb -0.02 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 38.58 1p4h h ASP 628 CO -0.05 0.51 -0.14 0.58 -1.57 0.00 0.00 179.24 178.57 1p4h h VAL 629 N 0.93 1.01 -0.41 -1.35 2.07 -1.24 -3.34 116.25 113.92 1p4h h VAL 629 Ca 0.40 -1.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.11 1p4h h VAL 629 Cb 0.32 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1p4h h VAL 629 CO -0.16 0.34 0.21 0.58 0.02 0.00 0.00 177.57 178.56 1p4h h VAL 630 N -1.00 1.17 0.00 2.57 2.07 -0.92 -2.94 116.25 117.20 1p4h h VAL 630 Ca -0.03 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1p4h h VAL 630 Cb 0.66 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1p4h h VAL 630 CO -0.02 0.18 0.00 0.59 0.02 0.00 0.00 177.57 178.34 1p4h n ASN 631 N -4.70 0.09 -0.02 0.57 3.02 0.48 -3.08 115.26 111.62 1p4h n ASN 631 Ca 0.00 0.52 0.02 0.00 -0.03 0.00 0.00 54.58 55.10 1p4h n ASN 631 Cb 0.10 -0.54 0.03 0.00 -0.61 0.00 0.00 39.78 38.76 1p4h n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1p4h n HIS 632 N -1.60 0.00 -2.96 3.10 8.25 -1.14 -4.97 115.22 115.90 1p4h n HIS 632 Ca 0.03 -0.58 -0.43 0.00 -0.26 0.00 0.00 57.72 56.49 1p4h n HIS 632 Cb 0.17 -0.07 -0.05 0.00 1.12 0.00 0.00 29.99 31.15 1p4h n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1p4h s ASP 633 N -1.37 6.48 0.26 0.41 -1.08 -1.12 -4.94 116.67 115.31 1p4h s ASP 633 Ca 0.07 0.13 -0.02 0.00 -0.52 0.00 0.00 52.55 52.21 1p4h s ASP 633 Cb 0.06 -2.39 0.53 0.00 -1.46 0.00 0.00 42.92 39.66 1p4h s ASP 633 CO 0.01 -0.81 1.73 -0.65 0.52 0.00 0.00 175.17 175.96 1p4h h PRO 634 N 8.72 0.44 -0.12 4.34 0.11 -1.93 -1.60 132.00 141.96 1p4h h PRO 634 Ca -0.25 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.85 1p4h h PRO 634 Cb 1.09 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1p4h h PRO 634 CO 0.93 0.29 0.08 0.28 -0.21 0.00 0.00 178.00 179.38 1p4h h VAL 635 N 0.46 0.99 -0.04 3.15 2.07 -1.98 -2.48 116.25 118.42 1p4h h VAL 635 Ca 0.45 -0.03 -0.25 0.00 0.82 0.00 0.00 66.70 67.69 1p4h h VAL 635 Cb 0.72 0.89 0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1p4h h VAL 635 CO -0.43 0.02 -0.97 0.58 0.02 0.00 0.00 177.57 176.79 1p4h h VAL 636 N 0.09 1.29 0.00 2.57 2.07 -1.63 -3.49 116.25 117.15 1p4h h VAL 636 Ca 0.05 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 65.37 1p4h h VAL 636 Cb 0.09 2.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1p4h h VAL 636 CO -0.01 0.68 0.00 0.61 0.02 0.00 0.00 177.57 178.87 1p4h n GLY 637 N 0.97 2.57 1.63 2.17 0.00 -0.94 -2.25 105.19 109.34 1p4h n GLY 637 Ca -0.10 -0.41 0.07 0.00 0.00 0.00 0.00 46.02 45.58 1p4h n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1p4h n ASP 638 N 2.86 4.86 0.11 1.61 5.75 -1.26 -4.31 116.55 126.17 1p4h n ASP 638 Ca 0.00 -2.69 0.01 0.00 -0.01 0.00 0.00 54.79 52.10 1p4h n ASP 638 Cb 0.00 -0.63 -0.01 0.00 -1.03 0.00 0.00 41.12 39.45 1p4h n ASP 638 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1p4h h ARG 639 N 3.50 0.00 -2.87 0.11 3.08 -1.80 -3.43 114.38 112.97 1p4h h ARG 639 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 1p4h h ARG 639 Cb 1.65 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 31.41 1p4h h ARG 639 CO 0.36 0.52 -0.43 -1.17 -1.07 0.00 0.00 179.97 178.18 1p4h s LEU 640 N -6.37 0.11 -0.02 3.04 2.96 -1.26 -1.76 118.68 115.37 1p4h s LEU 640 Ca 0.03 0.66 0.01 0.00 -0.22 0.00 0.00 54.13 54.61 1p4h s LEU 640 Cb 0.08 0.93 0.02 0.00 0.50 0.00 0.00 46.19 47.72 1p4h s LEU 640 CO 0.76 -0.19 -0.03 -0.13 -1.32 0.00 0.00 176.35 175.45 1p4h s ARG 641 N 1.54 0.49 -0.29 1.98 1.81 -0.91 -4.65 118.95 118.92 1p4h s ARG 641 Ca -0.07 -0.06 0.00 0.00 -1.72 0.00 0.00 55.73 53.88 1p4h s ARG 641 Cb -0.10 -0.55 0.06 0.00 -0.45 0.00 0.00 34.95 33.91 1p4h s ARG 641 CO -0.10 -0.04 -0.03 0.08 -0.68 0.00 0.00 175.30 174.53 1p4h s VAL 642 N 0.60 2.65 -0.07 3.52 1.01 -1.26 -0.04 120.40 126.80 1p4h s VAL 642 Ca -0.07 -1.57 0.04 0.00 0.00 0.00 0.00 61.98 60.38 1p4h s VAL 642 Cb -0.10 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1p4h s VAL 642 CO -0.01 -0.13 -0.18 -0.63 0.00 0.00 0.00 175.10 174.15 1p4h s ILE 643 N 1.17 2.66 -0.34 2.22 1.09 -0.08 -4.51 121.20 123.41 1p4h s ILE 643 Ca -0.05 -0.85 -0.12 0.00 -1.10 0.00 0.00 60.65 58.53 1p4h s ILE 643 Cb -0.20 -2.03 -0.01 0.00 -1.06 0.00 0.00 42.46 39.16 1p4h s ILE 643 CO -0.03 0.57 0.22 0.12 -0.10 0.00 0.00 174.94 175.72 1p4h s PHE 644 N -0.26 3.22 -0.42 3.97 2.19 -1.26 -1.42 117.98 123.99 1p4h s PHE 644 Ca 0.01 -0.34 -0.28 0.00 0.33 0.00 0.00 56.93 56.65 1p4h s PHE 644 Cb -0.13 -2.45 0.00 0.00 -1.31 0.00 0.00 43.02 39.13 1p4h s PHE 644 CO 0.03 -0.40 1.53 -0.51 1.83 0.00 0.00 175.22 177.69 1p4h s LEU 645 N 1.69 3.52 0.39 6.12 1.02 0.67 -4.95 118.68 127.14 1p4h s LEU 645 Ca 0.06 0.84 -0.25 0.00 0.02 0.00 0.00 54.13 54.79 1p4h s LEU 645 Cb -0.17 -3.42 -0.09 0.00 0.02 0.00 0.00 46.19 42.53 1p4h s LEU 645 CO 0.09 -1.59 1.15 -0.70 0.02 0.00 0.00 176.35 175.33 1p4h s GLU 646 N 5.30 4.11 -1.39 1.70 2.12 -1.26 -3.94 118.70 125.35 1p4h s GLU 646 Ca 0.65 1.81 -0.00 0.00 0.36 0.00 0.00 54.97 57.78 1p4h s GLU 646 Cb -0.15 -2.71 0.00 0.00 0.26 0.00 0.00 34.13 31.53 1p4h s GLU 646 CO 0.31 -0.26 0.47 -1.71 -0.54 0.00 0.00 175.26 173.54 1p4h n ASN 647 N 0.15 -0.47 -4.70 -1.70 5.15 -1.25 -4.87 115.26 107.57 1p4h n ASN 647 Ca 0.04 -0.97 -0.43 0.00 -0.60 0.00 0.00 54.58 52.62 1p4h n ASN 647 Cb 0.47 -3.25 -0.03 0.00 -0.53 0.00 0.00 39.78 36.44 1p4h n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1p4h n TYR 648 N -4.38 2.64 -3.93 1.20 9.36 -1.26 -4.87 117.16 115.92 1p4h n TYR 648 Ca -0.31 -0.00 -0.12 0.00 3.32 0.00 0.00 57.90 60.79 1p4h n TYR 648 Cb 0.68 -2.68 -0.00 0.00 -0.63 0.00 0.00 39.34 36.71 1p4h n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 1p4h s ARG 649 N 1.79 2.12 0.14 2.98 1.70 -1.26 -4.72 118.95 121.70 1p4h s ARG 649 Ca 0.79 -1.60 -0.20 0.00 -0.47 0.00 0.00 55.73 54.24 1p4h s ARG 649 Cb -0.52 0.55 0.02 0.00 -0.57 0.00 0.00 34.95 34.42 1p4h s ARG 649 CO 0.35 -0.95 1.67 0.28 -1.08 0.00 0.00 175.30 175.58 1p4h h VAL 650 N 2.04 0.61 -0.27 4.99 2.07 -1.96 0.81 116.25 124.53 1p4h h VAL 650 Ca -0.31 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1p4h h VAL 650 Cb 1.25 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1p4h h VAL 650 CO 0.40 0.00 0.18 0.77 0.02 0.00 0.00 177.57 178.94 1p4h h SER 651 N -0.11 0.31 0.40 0.57 4.64 -1.97 -1.00 113.55 116.40 1p4h h SER 651 Ca 0.13 -0.01 -0.21 0.00 -0.47 0.00 0.00 61.79 61.22 1p4h h SER 651 Cb 0.30 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1p4h h SER 651 CO -0.30 0.23 -0.91 0.25 -0.87 0.00 0.00 176.83 175.23 1p4h h LEU 652 N 0.37 0.45 -0.97 5.97 5.85 -1.65 -3.16 115.31 122.17 1p4h h LEU 652 Ca 0.10 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.47 1p4h h LEU 652 Cb -0.04 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 1p4h h LEU 652 CO -0.02 1.15 0.64 0.00 -0.34 0.00 0.00 178.44 179.87 1p4h h ALA 653 N 0.82 1.23 0.00 1.25 0.00 0.37 -0.10 119.26 122.83 1p4h h ALA 653 Ca -0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1p4h h ALA 653 Cb 1.54 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1p4h h ALA 653 CO 0.15 0.62 -0.00 0.93 0.00 0.00 0.00 179.25 180.95 1p4h h GLU 654 N 1.32 0.00 0.03 0.00 5.08 -1.24 -2.01 114.58 117.74 1p4h h GLU 654 Ca 0.36 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.36 1p4h h GLU 654 Cb -0.15 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.05 1p4h h GLU 654 CO -0.08 0.00 -1.99 1.63 -1.00 0.00 0.00 179.01 177.57 1p4h n LYS 655 N -3.13 0.63 -0.03 2.33 5.02 -0.17 -4.45 118.16 118.35 1p4h n LYS 655 Ca -0.02 0.35 -0.15 0.00 -2.02 0.00 0.00 58.31 56.46 1p4h n LYS 655 Cb 0.11 -1.63 -0.09 0.00 -0.02 0.00 0.00 35.03 33.41 1p4h n LYS 655 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1p4h h VAL 656 N -0.60 1.39 -0.55 -0.18 2.07 -1.14 -3.32 116.25 113.91 1p4h h VAL 656 Ca -0.51 -1.75 0.07 0.00 0.82 0.00 0.00 66.70 65.34 1p4h h VAL 656 Cb 1.65 2.22 -0.06 0.00 -1.52 0.00 0.00 31.29 33.58 1p4h h VAL 656 CO -0.19 0.52 0.22 0.40 0.02 0.00 0.00 177.57 178.53 1p4h h ILE 657 N 0.01 0.83 0.00 4.57 2.04 -1.61 -0.32 117.51 123.02 1p4h h ILE 657 Ca -0.02 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1p4h h ILE 657 Cb 1.04 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1p4h h ILE 657 CO 0.08 0.08 -0.03 -0.65 0.00 0.00 0.00 178.15 177.63 1p4h h PRO 658 N 0.41 0.00 -0.05 2.37 0.11 -1.78 -2.49 132.00 130.58 1p4h h PRO 658 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 1p4h h PRO 658 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1p4h h PRO 658 CO -0.25 0.03 0.00 0.00 -0.21 0.00 0.00 178.00 177.56 1p4h n ALA 659 N -2.13 2.51 -2.13 -0.75 0.00 -0.19 -4.76 120.51 113.06 1p4h n ALA 659 Ca -0.01 -0.59 -0.33 0.00 0.00 0.00 0.00 53.44 52.51 1p4h n ALA 659 Cb 0.19 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 1p4h n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p4h s ALA 660 N -1.96 3.35 -0.19 0.00 0.00 -0.87 -4.62 121.76 117.47 1p4h s ALA 660 Ca 0.33 0.07 -0.01 0.00 0.00 0.00 0.00 51.96 52.36 1p4h s ALA 660 Cb 0.20 -2.78 -0.12 0.00 0.00 0.00 0.00 23.12 20.43 1p4h s ALA 660 CO 0.31 0.33 -0.19 -0.25 0.00 0.00 0.00 175.76 175.97 1p4h n ASP 661 N -0.06 2.33 -4.17 0.00 8.00 -0.62 -4.15 116.55 117.87 1p4h n ASP 661 Ca 0.02 -0.04 -0.32 0.00 0.71 0.00 0.00 54.79 55.15 1p4h n ASP 661 Cb 0.53 -0.35 -0.16 0.00 -0.02 0.00 0.00 41.12 41.11 1p4h n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1p4h s LEU 662 N -6.29 2.11 -0.27 0.64 0.20 -0.55 0.31 118.68 114.82 1p4h s LEU 662 Ca -0.26 -0.60 -0.10 0.00 0.69 0.00 0.00 54.13 53.86 1p4h s LEU 662 Cb 0.07 -1.44 -0.04 0.00 -0.43 0.00 0.00 46.19 44.35 1p4h s LEU 662 CO 0.43 0.08 0.15 -0.55 -0.29 0.00 0.00 176.35 176.17 1p4h s SER 663 N 0.82 5.68 -0.47 3.68 0.15 0.74 -1.60 113.70 122.71 1p4h s SER 663 Ca -0.07 -0.13 -0.21 0.00 0.70 0.00 0.00 55.95 56.25 1p4h s SER 663 Cb -0.15 -2.04 0.03 0.00 -1.71 0.00 0.00 66.02 62.15 1p4h s SER 663 CO -0.02 -0.06 0.69 -1.61 1.20 0.00 0.00 173.24 173.44 1p4h s GLU 664 N 1.70 3.26 -0.59 5.44 0.41 -0.82 -1.58 118.70 126.52 1p4h s GLU 664 Ca 0.07 -0.46 0.06 0.00 -0.41 0.00 0.00 54.97 54.22 1p4h s GLU 664 Cb -0.16 -4.00 0.21 0.00 -1.78 0.00 0.00 34.13 28.40 1p4h s GLU 664 CO 0.08 -1.14 0.56 1.04 -0.49 0.00 0.00 175.26 175.32 1p4h n GLN 665 N 6.44 1.63 -1.64 1.61 1.13 -0.71 -4.78 117.38 121.06 1p4h n GLN 665 Ca -0.02 -4.14 -0.24 0.00 -1.94 0.00 0.00 57.00 50.65 1p4h n GLN 665 Cb 0.47 -2.01 0.06 0.00 0.11 0.00 0.00 30.24 28.88 1p4h n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 1p4h n ILE 666 N 1.62 2.86 -1.96 5.09 -5.35 -1.26 -2.41 119.36 117.96 1p4h n ILE 666 Ca 0.25 -3.63 -0.33 0.00 -0.27 0.00 0.00 62.75 58.77 1p4h n ILE 666 Cb 0.42 -1.03 0.03 0.00 -1.74 0.00 0.00 39.64 37.32 1p4h n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1p4h s SER 667 N -2.92 5.47 0.24 7.28 1.04 -1.25 -4.61 113.70 118.94 1p4h s SER 667 Ca 0.54 1.96 -0.31 0.00 0.48 0.00 0.00 55.95 58.63 1p4h s SER 667 Cb 0.44 -2.55 -0.11 0.00 0.10 0.00 0.00 66.02 63.90 1p4h s SER 667 CO 0.02 -1.38 1.55 -0.89 0.98 0.00 0.00 173.24 173.52 1p4h s THR 668 N -2.28 2.38 0.05 2.02 2.01 -1.15 -4.66 115.64 114.01 1p4h s THR 668 Ca 0.67 0.30 -0.37 0.00 0.31 0.00 0.00 61.69 62.60 1p4h s THR 668 Cb -0.19 -3.19 -0.16 0.00 0.01 0.00 0.00 72.50 68.96 1p4h s THR 668 CO 0.37 0.04 1.40 0.00 -0.69 0.00 0.00 174.62 175.74 1p4h n ALA 669 N 2.88 -0.73 -0.19 7.40 0.00 -1.26 -1.80 120.51 126.81 1p4h n ALA 669 Ca 0.10 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1p4h n ALA 669 Cb 0.38 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.72 1p4h n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p4h n GLY 670 N 2.77 0.66 0.10 0.00 0.00 -1.26 -4.70 105.19 102.76 1p4h n GLY 670 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 1p4h n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p4h n THR 671 N -2.00 1.30 -2.95 2.61 -2.24 -0.75 -4.83 114.28 105.42 1p4h n THR 671 Ca 0.00 -0.66 -0.43 0.00 -2.27 0.00 0.00 64.05 60.68 1p4h n THR 671 Cb 0.00 -0.87 -0.04 0.00 -2.10 0.00 0.00 70.33 67.31 1p4h n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1p4h s GLU 672 N -2.45 3.12 0.28 -0.78 2.56 -1.26 -4.76 118.70 115.41 1p4h s GLU 672 Ca -0.19 -0.89 -0.03 0.00 0.00 0.00 0.00 54.97 53.86 1p4h s GLU 672 Cb 0.07 -4.20 0.60 0.00 2.00 0.00 0.00 34.13 32.59 1p4h s GLU 672 CO 0.66 -1.65 1.59 0.00 -0.56 0.00 0.00 175.26 175.30 1p4h h ALA 673 N 9.38 0.96 0.00 6.30 0.00 -1.88 -2.88 119.26 131.14 1p4h h ALA 673 Ca -0.29 0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1p4h h ALA 673 Cb 1.08 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1p4h h ALA 673 CO 1.13 -0.49 0.00 0.45 0.00 0.00 0.00 179.25 180.34 1p4h n SER 674 N -5.46 -1.91 0.00 0.00 2.88 -1.26 -4.24 113.62 103.63 1p4h n SER 674 Ca 0.19 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.39 1p4h n SER 674 Cb 0.62 1.91 0.00 0.00 -0.75 0.00 0.00 64.21 65.99 1p4h n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1p4h n GLY 675 N 0.23 -0.61 0.00 0.46 0.00 -1.26 -0.78 105.19 103.23 1p4h n GLY 675 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1p4h n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p4h n THR 676 N 0.21 0.00 -0.18 2.61 -2.24 -1.26 -4.71 114.28 108.70 1p4h n THR 676 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1p4h n THR 676 Cb 0.00 -0.16 0.33 0.00 -2.10 0.00 0.00 70.33 68.40 1p4h n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1p4h h GLY 677 N 0.00 0.98 0.67 3.38 0.00 -1.94 -1.05 103.07 105.10 1p4h h GLY 677 Ca 0.00 -0.32 0.08 0.00 0.00 0.00 0.00 47.33 47.09 1p4h h GLY 677 CO 0.00 0.26 0.64 3.45 0.00 0.00 0.00 176.54 180.89 1p4h h ASN 678 N 0.81 1.00 -0.12 0.19 -0.00 -1.94 -1.91 115.58 113.61 1p4h h ASN 678 Ca 0.30 0.02 -0.14 0.00 -0.00 0.00 0.00 56.30 56.48 1p4h h ASN 678 Cb 0.16 -0.19 -0.01 0.00 -0.00 0.00 0.00 38.32 38.28 1p4h h ASN 678 CO -0.09 0.61 -0.39 0.24 -0.00 0.00 0.00 177.43 177.79 1p4h h MET 679 N 1.11 0.65 -0.39 4.14 2.86 -1.51 -2.45 114.93 119.34 1p4h h MET 679 Ca 0.45 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1p4h h MET 679 Cb 0.27 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 1p4h h MET 679 CO -0.20 0.93 0.24 0.87 1.06 0.00 0.00 176.91 179.80 1p4h h LYS 680 N 0.53 0.53 -0.72 1.72 1.57 -0.98 -1.93 116.57 117.30 1p4h h LYS 680 Ca 0.05 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1p4h h LYS 680 Cb 0.91 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 33.08 1p4h h LYS 680 CO 0.08 0.40 0.25 0.74 -0.57 0.00 0.00 179.45 180.35 1p4h h PHE 681 N 0.52 1.11 -0.47 -1.35 0.04 -1.33 -2.56 116.94 112.90 1p4h h PHE 681 Ca 0.14 -0.10 -0.09 0.00 2.80 0.00 0.00 57.97 60.73 1p4h h PHE 681 Cb 0.00 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 37.81 1p4h h PHE 681 CO -0.04 0.87 -0.06 1.98 -0.60 0.00 0.00 178.31 180.47 1p4h h MET 682 N 1.05 0.82 0.00 1.51 4.05 -1.12 -1.99 114.93 119.25 1p4h h MET 682 Ca 0.24 -0.25 -0.04 0.00 -0.28 0.00 0.00 59.70 59.37 1p4h h MET 682 Cb 0.26 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.98 1p4h h MET 682 CO -0.01 0.86 -0.18 1.25 0.23 0.00 0.00 176.91 179.05 1p4h h LEU 683 N 0.75 0.00 -3.52 3.39 5.85 -1.19 -3.26 115.31 117.33 1p4h h LEU 683 Ca 0.14 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1p4h h LEU 683 Cb 0.54 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1p4h h LEU 683 CO 0.03 0.18 0.05 0.59 -0.34 0.00 0.00 178.44 178.95 1p4h n ASN 684 N -3.26 5.04 0.00 1.25 3.02 -0.98 -4.92 115.26 115.41 1p4h n ASN 684 Ca 0.01 -3.03 0.00 0.00 -0.03 0.00 0.00 54.58 51.53 1p4h n ASN 684 Cb 0.46 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 1p4h n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p4h n GLY 685 N 0.14 0.51 3.68 7.41 0.00 -1.18 -4.78 105.19 110.96 1p4h n GLY 685 Ca 0.29 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 1p4h n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p4h s ALA 686 N -2.00 3.26 0.32 4.61 0.00 -0.78 -4.78 121.76 122.40 1p4h s ALA 686 Ca 0.00 -1.04 -0.09 0.00 0.00 0.00 0.00 51.96 50.83 1p4h s ALA 686 Cb 0.00 -1.25 -0.06 0.00 0.00 0.00 0.00 23.12 21.81 1p4h s ALA 686 CO 0.00 0.67 0.65 -0.51 0.00 0.00 0.00 175.76 176.57 1p4h s LEU 687 N -1.91 4.00 -0.12 0.00 1.02 0.15 -4.40 118.68 117.42 1p4h s LEU 687 Ca 0.22 0.97 -0.01 0.00 0.02 0.00 0.00 54.13 55.34 1p4h s LEU 687 Cb -0.12 -3.80 -0.02 0.00 0.02 0.00 0.00 46.19 42.27 1p4h s LEU 687 CO 0.14 -0.25 -0.09 -0.89 0.02 0.00 0.00 176.35 175.28 1p4h s THR 688 N -2.12 3.42 -0.19 5.49 2.01 -1.26 -0.18 115.64 122.80 1p4h s THR 688 Ca 0.48 -0.54 -0.01 0.00 0.31 0.00 0.00 61.69 61.93 1p4h s THR 688 Cb -0.11 -2.44 0.00 0.00 0.01 0.00 0.00 72.50 69.96 1p4h s THR 688 CO 0.27 0.53 -0.11 -0.51 -0.69 0.00 0.00 174.62 174.11 1p4h s ILE 689 N 0.08 2.82 0.15 1.82 2.07 -0.62 -0.95 121.20 126.57 1p4h s ILE 689 Ca -0.03 -0.69 -0.24 0.00 -1.41 0.00 0.00 60.65 58.28 1p4h s ILE 689 Cb -0.14 -2.24 0.08 0.00 0.13 0.00 0.00 42.46 40.29 1p4h s ILE 689 CO 0.04 0.48 1.07 -0.83 -1.91 0.00 0.00 174.94 173.79 1p4h s GLY 690 N 1.26 0.02 0.47 1.50 0.00 -0.05 -1.74 107.32 108.77 1p4h s GLY 690 Ca 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.56 1p4h s GLY 690 CO -0.06 2.33 0.71 -0.51 0.00 0.00 0.00 173.10 175.57 1p4h s THR 691 N -2.31 4.06 -1.39 0.90 -4.23 -1.01 -1.99 115.64 109.67 1p4h s THR 691 Ca 0.21 -0.38 -0.15 0.00 -1.18 0.00 0.00 61.69 60.19 1p4h s THR 691 Cb -0.02 -3.52 0.06 0.00 1.34 0.00 0.00 72.50 70.37 1p4h s THR 691 CO 0.04 -0.40 2.03 0.23 -0.54 0.00 0.00 174.62 175.97 1p4h n MET 692 N -2.15 3.03 -4.18 3.99 2.81 -1.26 -4.68 117.12 114.68 1p4h n MET 692 Ca 0.01 -2.92 -0.18 0.00 -1.81 0.00 0.00 57.70 52.80 1p4h n MET 692 Cb 0.57 -3.32 -0.12 0.00 -0.71 0.00 0.00 33.22 29.65 1p4h n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1p4h s ASP 693 N 3.33 1.72 0.46 7.83 3.68 -1.26 -4.65 116.67 127.79 1p4h s ASP 693 Ca 0.48 -0.65 0.00 0.00 2.13 0.00 0.00 52.55 54.51 1p4h s ASP 693 Cb 0.10 -0.05 0.00 0.00 -1.45 0.00 0.00 42.92 41.52 1p4h s ASP 693 CO -0.03 -0.09 0.00 0.61 0.13 0.00 0.00 175.17 175.79 1p4h n GLY 694 N 1.15 2.31 0.11 2.66 0.00 -1.09 -1.25 105.19 109.08 1p4h n GLY 694 Ca -0.20 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 45.76 1p4h n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p4h n ALA 695 N 7.35 1.81 -0.27 4.61 0.00 0.04 -3.18 120.51 130.87 1p4h n ALA 695 Ca 0.00 0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.61 1p4h n ALA 695 Cb 0.00 -1.39 0.39 0.00 0.00 0.00 0.00 19.45 18.44 1p4h n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1p4h h ASN 696 N 0.00 0.64 -0.45 0.00 2.35 -1.38 -0.05 115.58 116.70 1p4h h ASN 696 Ca 0.00 0.04 0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1p4h h ASN 696 Cb 0.43 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 1p4h h ASN 696 CO 0.00 0.31 0.28 0.58 -1.65 0.00 0.00 177.43 176.96 1p4h h VAL 697 N 0.67 1.09 -0.06 2.81 2.07 -1.63 -0.42 116.25 120.77 1p4h h VAL 697 Ca 0.45 -0.20 -0.17 0.00 0.82 0.00 0.00 66.70 67.61 1p4h h VAL 697 Cb 0.77 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1p4h h VAL 697 CO -0.21 0.10 -0.69 -0.33 0.02 0.00 0.00 177.57 176.46 1p4h h GLU 698 N 0.57 0.28 -0.15 1.57 5.08 -1.36 -1.53 114.58 119.04 1p4h h GLU 698 Ca 0.17 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1p4h h GLU 698 Cb -0.03 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1p4h h GLU 698 CO -0.06 0.86 0.05 0.52 -1.00 0.00 0.00 179.01 179.39 1p4h h MET 699 N 0.19 0.23 -0.53 2.33 2.86 -0.76 0.92 114.93 120.17 1p4h h MET 699 Ca -0.02 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 1p4h h MET 699 Cb 1.24 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.84 1p4h h MET 699 CO 0.11 0.34 0.14 0.00 1.06 0.00 0.00 176.91 178.55 1p4h h ALA 700 N 0.88 1.25 -0.66 6.32 0.00 -1.07 -0.42 119.26 125.56 1p4h h ALA 700 Ca 0.05 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 1p4h h ALA 700 Cb 0.20 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1p4h h ALA 700 CO -0.00 0.52 0.11 1.49 0.00 0.00 0.00 179.25 181.37 1p4h h GLU 701 N 0.77 1.08 -0.16 0.00 4.81 -0.92 0.46 114.58 120.63 1p4h h GLU 701 Ca 0.17 -0.28 -0.12 0.00 -0.13 0.00 0.00 59.36 59.00 1p4h h GLU 701 Cb 0.27 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.52 1p4h h GLU 701 CO -0.00 0.98 -0.36 0.93 -0.73 0.00 0.00 179.01 179.83 1p4h h GLU 702 N 1.01 0.52 0.00 1.92 4.39 -0.18 -3.30 114.58 118.95 1p4h h GLU 702 Ca 0.20 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.55 1p4h h GLU 702 Cb 0.43 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 1p4h h GLU 702 CO 0.01 0.97 -0.65 0.00 -1.16 0.00 0.00 179.01 178.18 1p4h h ALA 703 N 0.55 0.65 0.00 3.43 0.00 -1.08 -3.46 119.26 119.35 1p4h h ALA 703 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1p4h h ALA 703 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1p4h h ALA 703 CO 0.08 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.74 1p4h n GLY 704 N 1.21 1.47 0.32 0.00 0.00 0.16 -4.57 105.19 103.79 1p4h n GLY 704 Ca 0.02 -1.39 0.17 0.00 0.00 0.00 0.00 46.02 44.82 1p4h n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1p4h h GLU 705 N 0.00 0.00 0.00 1.61 5.08 -1.84 -0.32 114.58 119.11 1p4h h GLU 705 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1p4h h GLU 705 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1p4h h GLU 705 CO 0.00 0.00 0.00 0.93 -1.00 0.00 0.00 179.01 178.94 1p4h h GLU 706 N 0.00 0.00 -0.46 2.33 3.07 -1.89 -2.61 114.58 115.02 1p4h h GLU 706 Ca 0.04 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1p4h h GLU 706 Cb 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1p4h h GLU 706 CO -0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 1p4h n ASN 707 N -2.97 5.04 -4.07 1.42 3.02 -0.13 -4.93 115.26 112.65 1p4h n ASN 707 Ca 0.01 -2.94 -0.14 0.00 -0.03 0.00 0.00 54.58 51.48 1p4h n ASN 707 Cb 0.30 -0.63 -0.12 0.00 -0.61 0.00 0.00 39.78 38.72 1p4h n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1p4h s PHE 708 N -2.75 0.71 -0.95 3.10 5.36 -0.98 -4.79 117.98 117.67 1p4h s PHE 708 Ca 0.50 -0.46 -0.08 0.00 -0.96 0.00 0.00 56.93 55.93 1p4h s PHE 708 Cb 0.39 -0.43 0.24 0.00 -0.34 0.00 0.00 43.02 42.88 1p4h s PHE 708 CO 0.14 -0.06 0.90 -0.06 -1.46 0.00 0.00 175.22 174.67 1p4h s PHE 709 N -1.26 4.00 -0.00 10.12 0.08 -0.13 -4.94 117.98 125.84 1p4h s PHE 709 Ca -0.08 -2.62 -0.16 0.00 0.12 0.00 0.00 56.93 54.19 1p4h s PHE 709 Cb -0.09 -3.64 -0.06 0.00 -0.57 0.00 0.00 43.02 38.66 1p4h s PHE 709 CO 0.01 -0.90 0.43 0.42 -0.10 0.00 0.00 175.22 175.08 1p4h s ILE 710 N -0.87 5.01 0.33 0.64 -1.09 -1.26 -0.88 121.20 123.09 1p4h s ILE 710 Ca 0.26 0.89 -0.11 0.00 -2.23 0.00 0.00 60.65 59.46 1p4h s ILE 710 Cb -0.10 -3.74 0.02 0.00 -1.58 0.00 0.00 42.46 37.06 1p4h s ILE 710 CO -0.09 0.56 0.61 0.72 -1.23 0.00 0.00 174.94 175.51 1p4h s PHE 711 N -0.94 0.44 0.04 3.97 -0.71 -0.84 -4.95 117.98 115.00 1p4h s PHE 711 Ca 0.24 -0.88 0.00 0.00 -1.04 0.00 0.00 56.93 55.25 1p4h s PHE 711 Cb -0.17 0.39 0.00 0.00 -1.21 0.00 0.00 43.02 42.03 1p4h s PHE 711 CO 0.14 -1.27 0.00 0.41 -1.34 0.00 0.00 175.22 173.16 1p4h n GLY 712 N -0.50 -2.21 3.76 1.99 0.00 -1.26 -4.24 105.19 102.72 1p4h n GLY 712 Ca -0.03 -1.49 -0.37 0.00 0.00 0.00 0.00 46.02 44.13 1p4h n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1p4h s MET 713 N -1.11 3.47 0.55 1.61 -1.94 -1.26 -4.91 119.30 115.70 1p4h s MET 713 Ca 0.00 1.93 0.02 0.00 -1.71 0.00 0.00 55.69 55.94 1p4h s MET 713 Cb 0.00 -2.30 0.04 0.00 2.01 0.00 0.00 34.83 34.58 1p4h s MET 713 CO 0.00 -0.84 0.76 1.03 -0.01 0.00 0.00 175.02 175.97 1p4h s ARG 714 N -2.84 2.51 0.27 2.03 3.00 -1.26 -4.47 118.95 118.19 1p4h s ARG 714 Ca 0.68 -0.90 0.01 0.00 0.00 0.00 0.00 55.73 55.52 1p4h s ARG 714 Cb -0.33 -2.52 0.59 0.00 0.00 0.00 0.00 34.95 32.69 1p4h s ARG 714 CO 0.39 -0.71 1.77 0.28 0.00 0.00 0.00 175.30 177.03 1p4h h VAL 715 N 0.11 0.75 -0.79 3.52 2.07 -1.84 -0.88 116.25 119.19 1p4h h VAL 715 Ca -0.41 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 1p4h h VAL 715 Cb 1.29 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 1p4h h VAL 715 CO 0.50 0.13 0.42 -0.33 0.02 0.00 0.00 177.57 178.31 1p4h h GLU 716 N 0.70 1.10 -0.32 1.57 3.07 -1.95 -2.15 114.58 116.60 1p4h h GLU 716 Ca 0.50 -0.13 -0.08 0.00 -0.50 0.00 0.00 59.36 59.14 1p4h h GLU 716 Cb 0.69 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.37 1p4h h GLU 716 CO -0.36 0.81 -0.16 -0.44 -1.40 0.00 0.00 179.01 177.47 1p4h h ASP 717 N 1.10 0.56 -0.31 1.42 5.19 -1.55 -1.34 116.42 121.49 1p4h h ASP 717 Ca 0.28 -0.16 -0.05 0.00 -0.62 0.00 0.00 57.03 56.47 1p4h h ASP 717 Cb 0.04 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.39 1p4h h ASP 717 CO -0.04 0.74 0.00 0.58 -3.12 0.00 0.00 179.24 177.39 1p4h h VAL 718 N 0.52 1.26 -0.71 -1.35 2.07 -0.78 -1.59 116.25 115.66 1p4h h VAL 718 Ca 0.09 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.61 1p4h h VAL 718 Cb 0.57 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1p4h h VAL 718 CO 0.04 0.31 0.26 0.44 0.02 0.00 0.00 177.57 178.63 1p4h h ASP 719 N 0.35 1.01 -0.31 0.57 3.32 -1.20 -1.12 116.42 119.04 1p4h h ASP 719 Ca 0.09 -0.19 0.02 0.00 0.02 0.00 0.00 57.03 56.97 1p4h h ASP 719 Cb 0.44 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1p4h h ASP 719 CO 0.02 0.92 0.17 0.03 -1.72 0.00 0.00 179.24 178.66 1p4h h ARG 720 N 1.03 0.34 -0.58 3.56 3.08 -1.12 0.01 114.38 120.70 1p4h h ARG 720 Ca 0.23 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.28 1p4h h ARG 720 Cb 0.25 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1p4h h ARG 720 CO -0.01 0.22 0.38 1.25 -1.07 0.00 0.00 179.97 180.74 1p4h h LEU 721 N 0.35 0.65 -0.60 3.04 6.46 -0.90 -1.01 115.31 123.29 1p4h h LEU 721 Ca 0.13 -0.01 -0.15 0.00 -0.12 0.00 0.00 57.88 57.72 1p4h h LEU 721 Cb 0.02 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 39.78 1p4h h LEU 721 CO -0.07 0.46 -0.65 0.44 -0.62 0.00 0.00 178.44 178.00 1p4h h ASP 722 N 0.76 0.26 0.52 1.25 3.32 -0.25 0.64 116.42 122.91 1p4h h ASP 722 Ca 0.22 -0.16 -0.13 0.00 0.02 0.00 0.00 57.03 56.97 1p4h h ASP 722 Cb -0.05 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1p4h h ASP 722 CO -0.05 0.84 -0.61 1.56 -1.72 0.00 0.00 179.24 179.26 1p4h h GLN 723 N 0.16 0.09 0.07 3.56 4.20 -0.29 -3.19 115.11 119.71 1p4h h GLN 723 Ca -0.01 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.53 1p4h h GLN 723 Cb 1.17 0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.97 1p4h h GLN 723 CO 0.10 0.67 -0.48 -0.09 -0.67 0.00 0.00 178.83 178.35 1p4h h ARG 724 N 0.06 0.20 0.00 1.46 2.43 -1.00 -3.50 114.38 114.03 1p4h h ARG 724 Ca -0.01 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 1p4h h ARG 724 Cb 1.09 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1p4h h ARG 724 CO 0.08 1.12 0.00 0.41 -1.51 0.00 0.00 179.97 180.07 1p4h n GLY 725 N 1.52 2.86 3.66 2.80 0.00 0.22 -5.05 105.19 111.20 1p4h n GLY 725 Ca -0.12 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.41 1p4h n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1p4h s TYR 726 N 0.00 2.84 -0.37 1.61 5.04 -1.19 -4.90 117.35 120.39 1p4h s TYR 726 Ca 0.00 1.00 0.03 0.00 -2.44 0.00 0.00 57.07 55.66 1p4h s TYR 726 Cb 0.00 -3.55 0.11 0.00 0.35 0.00 0.00 41.96 38.87 1p4h s TYR 726 CO 0.00 -1.67 0.11 1.21 -1.34 0.00 0.00 175.55 173.86 1p4h s ASN 727 N 2.06 4.46 0.40 4.32 3.84 -1.26 -4.98 114.94 123.78 1p4h s ASN 727 Ca 0.55 -2.23 0.11 0.00 0.21 0.00 0.00 52.86 51.50 1p4h s ASN 727 Cb -0.21 -1.43 0.93 0.00 -0.55 0.00 0.00 41.25 39.99 1p4h s ASN 727 CO 0.15 -0.35 1.95 0.00 -2.79 0.00 0.00 177.10 176.06 1p4h h ALA 728 N 7.46 1.92 -1.00 1.71 0.00 -1.87 -2.36 119.26 125.12 1p4h h ALA 728 Ca -0.06 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 55.02 1p4h h ALA 728 Cb 0.99 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.56 1p4h h ALA 728 CO 0.53 -0.07 0.61 0.37 0.00 0.00 0.00 179.25 180.70 1p4h h GLN 729 N 0.54 0.74 -0.58 0.00 5.75 -1.92 -1.05 115.11 118.59 1p4h h GLN 729 Ca 0.32 -0.04 0.08 0.00 -0.15 0.00 0.00 58.65 58.86 1p4h h GLN 729 Cb 0.52 -0.17 -0.07 0.00 1.07 0.00 0.00 27.48 28.84 1p4h h GLN 729 CO -0.10 0.49 0.22 1.49 -2.65 0.00 0.00 178.83 178.28 1p4h h GLU 730 N 0.76 0.40 -0.43 1.69 4.81 -1.84 0.17 114.58 120.13 1p4h h GLU 730 Ca 0.57 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.65 1p4h h GLU 730 Cb 0.89 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1p4h h GLU 730 CO -0.36 0.26 -0.23 1.88 -0.73 0.00 0.00 179.01 179.83 1p4h h TYR 731 N 0.41 1.01 -0.86 0.92 -1.99 -1.36 -2.12 116.97 112.97 1p4h h TYR 731 Ca 0.29 -0.24 -0.00 0.00 2.00 0.00 0.00 58.73 60.77 1p4h h TYR 731 Cb 0.33 -0.24 -0.04 0.00 2.00 0.00 0.00 36.73 38.78 1p4h h TYR 731 CO -0.16 1.02 0.53 -0.92 -0.00 0.00 0.00 178.16 178.62 1p4h h TYR 732 N 0.76 1.13 0.00 4.88 5.03 -0.74 -1.65 116.97 126.38 1p4h h TYR 732 Ca 0.10 0.00 -0.14 0.00 2.58 0.00 0.00 58.73 61.27 1p4h h TYR 732 Cb 0.77 -0.37 -0.02 0.00 1.55 0.00 0.00 36.73 38.66 1p4h h TYR 732 CO 0.05 0.75 -0.65 -0.44 -1.32 0.00 0.00 178.16 176.54 1p4h h ASP 733 N 1.18 0.00 0.06 -2.11 3.32 -0.48 -3.32 116.42 115.06 1p4h h ASP 733 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1p4h h ASP 733 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1p4h h ASP 733 CO -0.06 0.65 -0.67 0.54 -1.72 0.00 0.00 179.24 177.98 1p4h n ARG 734 N -3.74 0.58 -3.93 3.56 1.74 -0.82 -4.79 116.66 109.26 1p4h n ARG 734 Ca -0.01 -0.46 -0.31 0.00 -0.77 0.00 0.00 57.85 56.30 1p4h n ARG 734 Cb 0.65 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.45 1p4h n ARG 734 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1p4h s ILE 735 N -2.74 1.96 0.21 0.55 1.01 -0.64 -5.01 121.20 116.54 1p4h s ILE 735 Ca 0.14 -2.27 -0.12 0.00 0.00 0.00 0.00 60.65 58.40 1p4h s ILE 735 Cb 0.17 -2.44 0.19 0.00 0.01 0.00 0.00 42.46 40.39 1p4h s ILE 735 CO 0.70 -0.66 1.66 -0.65 0.00 0.00 0.00 174.94 175.99 1p4h h PRO 736 N 7.53 0.08 -0.75 2.79 0.11 -1.87 -1.25 132.00 138.64 1p4h h PRO 736 Ca -0.06 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.05 1p4h h PRO 736 Cb 1.00 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.05 1p4h h PRO 736 CO 0.53 0.05 0.50 0.93 -0.21 0.00 0.00 178.00 179.80 1p4h h GLU 737 N 0.08 0.99 -0.41 1.05 5.08 -1.95 -0.76 114.58 118.66 1p4h h GLU 737 Ca 0.30 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.48 1p4h h GLU 737 Cb 0.48 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1p4h h GLU 737 CO -0.53 0.65 -0.21 1.25 -1.00 0.00 0.00 179.01 179.17 1p4h h LEU 738 N 1.02 0.89 -0.50 1.33 5.85 -1.65 -2.71 115.31 119.54 1p4h h LEU 738 Ca 0.28 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1p4h h LEU 738 Cb -0.12 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.64 1p4h h LEU 738 CO -0.06 1.10 0.33 -0.09 -0.34 0.00 0.00 178.44 179.38 1p4h h ARG 739 N 0.68 0.65 -0.92 1.25 2.43 -0.67 -2.10 114.38 115.70 1p4h h ARG 739 Ca 0.09 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.26 1p4h h ARG 739 Cb 0.78 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 30.13 1p4h h ARG 739 CO 0.06 0.44 0.60 0.37 -1.51 0.00 0.00 179.97 179.93 1p4h h GLN 740 N 0.67 1.11 -0.17 0.20 4.15 -1.05 -1.24 115.11 118.78 1p4h h GLN 740 Ca 0.18 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.50 1p4h h GLN 740 Cb -0.07 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.36 1p4h h GLN 740 CO -0.04 0.73 -0.02 0.82 -1.93 0.00 0.00 178.83 178.40 1p4h h ILE 741 N 1.14 1.27 -0.73 2.39 2.04 -1.10 -1.36 117.51 121.15 1p4h h ILE 741 Ca 0.37 -0.92 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 1p4h h ILE 741 Cb 0.04 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1p4h h ILE 741 CO -0.12 0.27 0.38 0.40 0.00 0.00 0.00 178.15 179.09 1p4h h ILE 742 N 0.05 1.22 -0.01 -0.67 5.03 -1.10 -1.21 117.51 120.81 1p4h h ILE 742 Ca 0.05 -0.57 -0.12 0.00 -0.12 0.00 0.00 64.86 64.10 1p4h h ILE 742 Cb 0.42 0.25 -0.02 0.00 -3.03 0.00 0.00 36.82 34.45 1p4h h ILE 742 CO 0.01 0.25 -0.55 -0.33 -0.68 0.00 0.00 178.15 176.86 1p4h h GLU 743 N 1.02 0.03 -0.33 2.37 5.08 -1.12 -0.36 114.58 121.27 1p4h h GLU 743 Ca 0.26 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.48 1p4h h GLU 743 Cb 0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1p4h h GLU 743 CO -0.04 0.57 -0.28 1.96 -1.00 0.00 0.00 179.01 180.21 1p4h h GLN 744 N 0.02 0.77 -0.32 2.33 4.20 -0.54 -1.01 115.11 120.57 1p4h h GLN 744 Ca -0.00 -0.39 -0.04 0.00 0.06 0.00 0.00 58.65 58.28 1p4h h GLN 744 Cb 0.98 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 1p4h h GLN 744 CO 0.07 1.02 0.05 -0.07 -0.67 0.00 0.00 178.83 179.23 1p4h h LEU 745 N 0.54 0.51 -0.78 1.46 3.38 -1.02 -1.30 115.31 118.09 1p4h h LEU 745 Ca 0.06 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1p4h h LEU 745 Cb 0.85 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1p4h h LEU 745 CO 0.07 0.64 0.05 0.28 0.09 0.00 0.00 178.44 179.57 1p4h h SER 746 N 0.35 0.93 0.95 -0.43 0.02 -1.03 -3.11 113.55 111.23 1p4h h SER 746 Ca 0.10 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1p4h h SER 746 Cb 0.35 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.65 1p4h h SER 746 CO 0.01 0.96 -0.02 -1.54 -1.14 0.00 0.00 176.83 175.10 1p4h n SER 747 N -4.21 0.02 0.00 3.07 3.41 -0.39 -4.67 113.62 110.85 1p4h n SER 747 Ca 0.03 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 1p4h n SER 747 Cb 0.30 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1p4h n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p4h n GLY 748 N 1.48 0.86 0.38 5.00 0.00 -1.09 -4.84 105.19 106.98 1p4h n GLY 748 Ca 0.08 -0.10 0.18 0.00 0.00 0.00 0.00 46.02 46.17 1p4h n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1p4h h PHE 749 N 0.00 0.25 -0.21 1.61 3.04 -1.49 0.77 116.94 120.90 1p4h h PHE 749 Ca 0.00 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.96 1p4h h PHE 749 Cb 0.00 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.43 1p4h h PHE 749 CO 0.00 0.10 0.00 1.19 -2.02 0.00 0.00 178.31 177.58 1p4h n PHE 750 N -4.43 0.26 -2.95 0.41 3.72 -1.26 -4.62 117.46 108.60 1p4h n PHE 750 Ca 0.12 -0.15 -0.14 0.00 -0.05 0.00 0.00 57.45 57.23 1p4h n PHE 750 Cb 0.56 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.10 1p4h n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1p4h n SER 751 N 1.29 -1.73 0.03 4.37 3.41 0.21 -4.80 113.62 116.39 1p4h n SER 751 Ca 0.15 -2.99 -0.14 0.00 -0.26 0.00 0.00 58.87 55.63 1p4h n SER 751 Cb 0.55 0.81 -0.08 0.00 -0.26 0.00 0.00 64.21 65.23 1p4h n SER 751 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1p4h h PRO 752 N 4.20 -0.57 0.00 4.33 0.11 -1.66 -1.74 132.00 136.67 1p4h h PRO 752 Ca -0.02 0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.10 1p4h h PRO 752 Cb 0.98 0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1p4h h PRO 752 CO 0.35 -0.38 -0.13 0.87 -0.21 0.00 0.00 178.00 178.50 1p4h h LYS 753 N -0.59 0.00 -2.47 1.05 1.57 -1.96 -3.28 116.57 110.88 1p4h h LYS 753 Ca 0.04 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.22 1p4h h LYS 753 Cb 0.68 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.59 1p4h h LYS 753 CO -0.38 0.13 -0.76 1.04 -0.57 0.00 0.00 179.45 178.90 1p4h n GLN 754 N -4.28 1.48 -0.36 3.15 6.02 -0.92 -4.99 117.38 117.48 1p4h n GLN 754 Ca -0.03 -4.03 0.28 0.00 -0.01 0.00 0.00 57.00 53.21 1p4h n GLN 754 Cb 0.20 -1.95 0.57 0.00 1.02 0.00 0.00 30.24 30.08 1p4h n GLN 754 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1p4h h PRO 755 N 4.83 0.27 -0.59 -1.09 0.11 -1.40 -0.71 132.00 133.41 1p4h h PRO 755 Ca 0.17 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1p4h h PRO 755 Cb 0.78 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1p4h h PRO 755 CO 0.63 0.18 0.00 -0.40 -0.21 0.00 0.00 178.00 178.20 1p4h n ASP 756 N -4.61 4.92 -0.33 -2.05 3.85 -1.26 -3.11 116.55 113.96 1p4h n ASP 756 Ca 0.29 -2.61 0.13 0.00 -0.71 0.00 0.00 54.79 51.89 1p4h n ASP 756 Cb 1.06 -0.59 0.32 0.00 -1.35 0.00 0.00 41.12 40.56 1p4h n ASP 756 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 1p4h h LEU 757 N 3.84 0.63 -3.77 -2.12 5.85 -1.44 -1.87 115.31 116.42 1p4h h LEU 757 Ca 0.00 0.12 -0.25 0.00 0.84 0.00 0.00 57.88 58.59 1p4h h LEU 757 Cb 1.58 0.02 -0.15 0.00 0.37 0.00 0.00 40.66 42.48 1p4h h LEU 757 CO 0.30 0.17 0.31 0.49 -0.34 0.00 0.00 178.44 179.36 1p4h n PHE 758 N -4.87 2.53 -0.24 1.25 3.01 -1.26 -4.56 117.46 113.32 1p4h n PHE 758 Ca 0.23 -1.27 -0.00 0.00 1.01 0.00 0.00 57.45 57.42 1p4h n PHE 758 Cb 0.61 -0.72 0.22 0.00 -0.01 0.00 0.00 39.48 39.59 1p4h n PHE 758 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 1p4h h LYS 759 N 2.51 1.04 -0.77 -1.08 2.10 -1.66 -1.98 116.57 116.74 1p4h h LYS 759 Ca 0.31 -0.07 -0.05 0.00 -2.00 0.00 0.00 60.65 58.83 1p4h h LYS 759 Cb 2.40 -0.23 -0.03 0.00 -0.90 0.00 0.00 32.23 33.47 1p4h h LYS 759 CO 0.78 0.70 0.28 -0.44 -2.00 0.00 0.00 179.45 178.77 1p4h h ASP 760 N 1.07 1.09 0.23 7.07 3.32 -1.83 0.13 116.42 127.50 1p4h h ASP 760 Ca 0.29 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1p4h h ASP 760 Cb -0.10 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.17 1p4h h ASP 760 CO -0.06 0.99 -0.11 0.40 -1.72 0.00 0.00 179.24 178.74 1p4h h ILE 761 N 1.14 0.83 -0.69 0.35 2.04 -1.74 -1.04 117.51 118.39 1p4h h ILE 761 Ca 0.25 -0.41 0.02 0.00 1.00 0.00 0.00 64.86 65.72 1p4h h ILE 761 Cb 0.26 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.37 1p4h h ILE 761 CO -0.02 0.09 0.44 0.58 0.00 0.00 0.00 178.15 179.25 1p4h h VAL 762 N -0.52 1.13 -0.73 1.67 2.07 -1.27 -0.40 116.25 118.20 1p4h h VAL 762 Ca -0.03 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1p4h h VAL 762 Cb 0.39 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 1p4h h VAL 762 CO 0.05 0.16 0.46 -1.13 0.02 0.00 0.00 177.57 177.14 1p4h h ASN 763 N 0.89 0.86 0.01 0.57 -0.00 -0.88 0.21 115.58 117.22 1p4h h ASN 763 Ca 0.27 -0.04 -0.00 0.00 -0.00 0.00 0.00 56.30 56.52 1p4h h ASN 763 Cb -0.04 -0.22 0.00 0.00 -0.00 0.00 0.00 38.32 38.07 1p4h h ASN 763 CO -0.08 0.65 -0.00 -0.03 -0.00 0.00 0.00 177.43 177.96 1p4h h MET 764 N 0.99 -0.01 -0.68 6.67 4.05 -0.70 0.96 114.93 126.21 1p4h h MET 764 Ca 0.26 0.00 0.09 0.00 -0.28 0.00 0.00 59.70 59.78 1p4h h MET 764 Cb -0.07 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 30.66 1p4h h MET 764 CO -0.05 0.27 0.33 -0.07 0.23 0.00 0.00 176.91 177.61 1p4h h LEU 765 N -0.28 0.41 -0.00 3.39 4.07 -0.82 -0.56 115.31 121.51 1p4h h LEU 765 Ca -0.00 0.06 -0.26 0.00 0.08 0.00 0.00 57.88 57.76 1p4h h LEU 765 Cb 0.28 -0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.02 1p4h h LEU 765 CO 0.00 0.24 -1.12 0.24 -1.08 0.00 0.00 178.44 176.72 1p4h h MET 766 N 0.56 0.39 0.00 1.13 2.86 -0.88 -3.41 114.93 115.58 1p4h h MET 766 Ca 0.34 -0.52 -0.03 0.00 -2.06 0.00 0.00 59.70 57.42 1p4h h MET 766 Cb 0.36 0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1p4h h MET 766 CO -0.27 1.20 -1.17 0.72 1.06 0.00 0.00 176.91 178.45 1p4h n HIS 767 N -3.67 0.00 -2.93 -0.22 8.25 0.32 -4.40 115.22 112.57 1p4h n HIS 767 Ca -0.09 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.24 1p4h n HIS 767 Cb 0.94 -0.11 0.01 0.00 1.12 0.00 0.00 29.99 31.95 1p4h n HIS 767 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1p4h n HIS 768 N -1.93 -0.05 -2.99 4.41 -0.00 -0.31 -5.03 115.22 109.32 1p4h n HIS 768 Ca -0.03 -3.16 -0.44 0.00 -0.00 0.00 0.00 57.72 54.10 1p4h n HIS 768 Cb 0.41 -0.02 -0.05 0.00 -0.00 0.00 0.00 29.99 30.33 1p4h n HIS 768 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1p4h s ASP 769 N -2.43 6.22 0.26 4.39 3.68 -0.68 -4.84 116.67 123.28 1p4h s ASP 769 Ca 0.32 -0.92 0.24 0.00 2.13 0.00 0.00 52.55 54.32 1p4h s ASP 769 Cb 0.38 -2.36 0.99 0.00 -1.45 0.00 0.00 42.92 40.48 1p4h s ASP 769 CO -0.04 -1.18 1.71 0.54 0.13 0.00 0.00 175.17 176.33 1p4h n ARG 770 N 6.95 0.19 -0.28 4.34 1.74 -1.26 -3.28 116.66 125.07 1p4h n ARG 770 Ca -0.05 0.43 0.07 0.00 -0.77 0.00 0.00 57.85 57.53 1p4h n ARG 770 Cb 0.45 -1.88 0.19 0.00 -1.02 0.00 0.00 32.46 30.21 1p4h n ARG 770 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1p4h n PHE 771 N -2.24 0.63 -4.00 -1.55 3.72 -1.26 -5.01 117.46 107.74 1p4h n PHE 771 Ca 0.02 -0.67 -0.33 0.00 -0.05 0.00 0.00 57.45 56.42 1p4h n PHE 771 Cb 0.22 -0.15 -0.01 0.00 -0.94 0.00 0.00 39.48 38.60 1p4h n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1p4h n LYS 772 N -0.01 -1.57 -0.03 -1.08 5.02 -1.20 -4.75 118.16 114.54 1p4h n LYS 772 Ca 0.15 0.27 -0.09 0.00 -2.02 0.00 0.00 58.31 56.62 1p4h n LYS 772 Cb 0.62 -3.74 -0.03 0.00 -0.02 0.00 0.00 35.03 31.86 1p4h n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1p4h h VAL 773 N -2.04 0.86 -0.61 -0.18 2.07 -1.93 -2.62 116.25 111.79 1p4h h VAL 773 Ca -0.67 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1p4h h VAL 773 Cb 1.39 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 1p4h h VAL 773 CO 0.58 0.01 0.32 -0.26 0.02 0.00 0.00 177.57 178.24 1p4h h PHE 774 N 0.04 0.83 -0.08 1.57 0.05 -1.91 -2.79 116.94 114.64 1p4h h PHE 774 Ca 0.08 -0.01 0.02 0.00 3.82 0.00 0.00 57.97 61.88 1p4h h PHE 774 Cb 0.11 -0.27 -0.00 0.00 2.00 0.00 0.00 35.95 37.79 1p4h h PHE 774 CO -0.18 0.59 0.10 0.00 -0.18 0.00 0.00 178.31 178.64 1p4h h ALA 775 N 1.50 1.62 -0.09 2.45 0.00 -1.84 -1.89 119.26 121.02 1p4h h ALA 775 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1p4h h ALA 775 Cb 0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1p4h h ALA 775 CO -0.03 -0.14 0.00 -0.25 0.00 0.00 0.00 179.25 178.83 1p4h n ASP 776 N -3.77 2.32 0.29 0.00 8.00 -1.07 -4.74 116.55 117.59 1p4h n ASP 776 Ca -0.01 -1.65 -0.17 0.00 0.71 0.00 0.00 54.79 53.67 1p4h n ASP 776 Cb 0.19 -0.05 -0.09 0.00 -0.02 0.00 0.00 41.12 41.16 1p4h n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1p4h h TYR 777 N 2.70 -1.13 -0.19 1.24 5.03 -1.20 -1.25 116.97 122.18 1p4h h TYR 777 Ca 0.00 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.36 1p4h h TYR 777 Cb 0.61 0.43 -0.05 0.00 1.55 0.00 0.00 36.73 39.26 1p4h h TYR 777 CO 0.05 -0.59 -0.16 0.93 -1.32 0.00 0.00 178.16 177.07 1p4h h GLU 778 N -0.91 -0.17 -0.10 1.82 5.08 -1.85 -1.16 114.58 117.29 1p4h h GLU 778 Ca -0.05 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1p4h h GLU 778 Cb 0.78 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 1p4h h GLU 778 CO -0.01 -0.11 -0.24 1.49 -1.00 0.00 0.00 179.01 179.14 1p4h h GLU 779 N -0.17 0.18 0.65 2.33 4.81 -1.88 -1.92 114.58 118.58 1p4h h GLU 779 Ca 0.12 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1p4h h GLU 779 Cb 0.34 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.71 1p4h h GLU 779 CO -0.29 0.41 -0.31 -0.92 -0.73 0.00 0.00 179.01 177.16 1p4h h TYR 780 N 0.16 -0.81 -0.42 0.92 3.20 -0.56 -0.55 116.97 118.91 1p4h h TYR 780 Ca 0.03 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 61.96 1p4h h TYR 780 Cb 0.51 0.27 -0.07 0.00 1.54 0.00 0.00 36.73 38.98 1p4h h TYR 780 CO 0.01 -0.47 -0.01 0.28 -1.64 0.00 0.00 178.16 176.33 1p4h h VAL 781 N -1.03 0.67 -0.36 1.81 2.07 -1.15 0.90 116.25 119.16 1p4h h VAL 781 Ca -0.09 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.45 1p4h h VAL 781 Cb 0.71 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1p4h h VAL 781 CO 0.15 0.02 0.09 0.50 0.02 0.00 0.00 177.57 178.35 1p4h h LYS 782 N 0.10 0.22 -0.64 1.57 1.63 -1.33 -1.66 116.57 116.46 1p4h h LYS 782 Ca 0.21 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.98 1p4h h LYS 782 Cb 0.30 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.85 1p4h h LYS 782 CO -0.35 0.14 0.33 0.00 -3.45 0.00 0.00 179.45 176.12 1p4h h GLN 784 N 0.90 0.12 -0.33 0.00 1.08 0.01 -1.42 115.11 115.47 1p4h h GLN 784 Ca 0.23 -0.02 -0.12 0.00 -1.45 0.00 0.00 58.65 57.28 1p4h h GLN 784 Cb 0.05 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 1p4h h GLN 784 CO -0.03 0.25 -0.30 0.93 -0.95 0.00 0.00 178.83 178.73 1p4h h GLU 785 N 0.12 0.70 -0.18 1.46 5.08 -0.47 -1.88 114.58 119.42 1p4h h GLU 785 Ca 0.03 -0.31 -0.08 0.00 -1.00 0.00 0.00 59.36 58.00 1p4h h GLU 785 Cb 0.29 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1p4h h GLU 785 CO 0.02 0.91 -0.23 0.00 -1.00 0.00 0.00 179.01 178.71 1p4h h ARG 786 N 0.60 0.33 -0.11 2.33 3.08 -1.00 -1.42 114.38 118.19 1p4h h ARG 786 Ca 0.07 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1p4h h ARG 786 Cb 0.81 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.83 1p4h h ARG 786 CO 0.07 0.54 -0.00 0.28 -1.07 0.00 0.00 179.97 179.79 1p4h h VAL 787 N 0.30 1.25 -0.99 2.04 2.07 -0.96 -2.35 116.25 117.60 1p4h h VAL 787 Ca 0.05 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.77 1p4h h VAL 787 Cb 0.57 1.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 1p4h h VAL 787 CO 0.04 0.23 0.65 0.28 0.02 0.00 0.00 177.57 178.79 1p4h h SER 788 N -0.08 1.15 -0.44 0.57 0.02 -1.08 -1.29 113.55 112.40 1p4h h SER 788 Ca 0.03 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1p4h h SER 788 Cb 0.36 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1p4h h SER 788 CO 0.01 0.85 0.29 0.00 -1.14 0.00 0.00 176.83 176.83 1p4h h ALA 789 N 1.36 0.56 -0.19 3.77 0.00 -1.17 -2.55 119.26 121.05 1p4h h ALA 789 Ca 0.36 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 1p4h h ALA 789 Cb -0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1p4h h ALA 789 CO -0.08 -0.00 -0.36 1.25 0.00 0.00 0.00 179.25 180.06 1p4h h LEU 790 N 0.58 0.41 -1.75 0.00 6.46 -0.98 -2.77 115.31 117.26 1p4h h LEU 790 Ca 0.17 -0.16 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 1p4h h LEU 790 Cb -0.05 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 39.76 1p4h h LEU 790 CO -0.05 0.74 -0.17 0.22 -0.62 0.00 0.00 178.44 178.57 1p4h h TYR 791 N 0.34 0.00 0.00 1.25 3.20 -0.86 -1.17 116.97 119.73 1p4h h TYR 791 Ca 0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1p4h h TYR 791 Cb 0.79 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.06 1p4h h TYR 791 CO 0.02 0.17 0.00 0.87 -1.64 0.00 0.00 178.16 177.58 1p4h h LYS 792 N 0.00 0.00 -2.97 1.82 1.57 -1.17 -3.29 116.57 112.53 1p4h h LYS 792 Ca -0.00 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.11 1p4h h LYS 792 Cb 0.37 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 32.31 1p4h h LYS 792 CO 0.02 0.00 -0.22 -1.71 -0.57 0.00 0.00 179.45 176.97 1p4h n ASN 793 N -2.31 4.08 -0.33 0.86 2.85 -0.44 -4.97 115.26 115.00 1p4h n ASN 793 Ca 0.01 -3.25 0.00 0.00 -0.11 0.00 0.00 54.58 51.23 1p4h n ASN 793 Cb 0.20 -0.92 0.05 0.00 1.24 0.00 0.00 39.78 40.35 1p4h n ASN 793 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1p4h n PRO 794 N 1.79 -0.18 -0.13 1.20 -0.02 -1.24 -1.40 135.00 135.02 1p4h n PRO 794 Ca 0.24 1.32 -0.05 0.00 -2.02 0.00 0.00 63.50 62.99 1p4h n PRO 794 Cb 0.37 -1.97 0.03 0.00 -0.02 0.00 0.00 33.50 31.91 1p4h n PRO 794 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1p4h h ARG 795 N 0.00 0.38 0.00 -0.52 2.43 -1.93 -0.79 114.38 113.95 1p4h h ARG 795 Ca 0.32 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.32 1p4h h ARG 795 Cb 0.54 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1p4h h ARG 795 CO -0.86 0.25 -0.71 0.93 -1.51 0.00 0.00 179.97 178.08 1p4h h GLU 796 N 0.39 0.00 -0.28 0.20 4.39 -1.56 -1.87 114.58 115.85 1p4h h GLU 796 Ca 0.19 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.85 1p4h h GLU 796 Cb 0.12 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1p4h h GLU 796 CO -0.15 0.71 0.03 2.35 -1.16 0.00 0.00 179.01 180.78 1p4h h TRP 797 N 0.00 0.51 -0.19 4.33 2.91 -0.88 -2.02 115.95 120.61 1p4h h TRP 797 Ca -0.01 -0.08 -0.07 0.00 1.13 0.00 0.00 58.89 59.86 1p4h h TRP 797 Cb 1.25 -0.14 -0.01 0.00 -0.51 0.00 0.00 29.16 29.75 1p4h h TRP 797 CO 0.00 0.60 -0.19 1.15 -1.03 0.00 0.00 178.44 178.96 1p4h h THR 798 N 0.28 1.22 -0.31 2.65 2.02 -1.07 -1.31 112.91 116.39 1p4h h THR 798 Ca 0.08 -1.02 -0.12 0.00 0.77 0.00 0.00 66.41 66.12 1p4h h THR 798 Cb 0.38 1.30 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1p4h h THR 798 CO 0.01 0.32 -0.29 0.03 0.37 0.00 0.00 175.52 175.96 1p4h h ARG 799 N 0.29 0.65 -0.26 6.66 3.08 -1.12 -0.69 114.38 122.99 1p4h h ARG 799 Ca 0.05 -0.28 -0.14 0.00 0.07 0.00 0.00 59.98 59.68 1p4h h ARG 799 Cb 0.51 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1p4h h ARG 799 CO 0.03 0.87 -0.42 1.98 -1.07 0.00 0.00 179.97 181.37 1p4h h MET 800 N 0.56 0.64 -0.18 0.04 4.05 -0.94 -2.37 114.93 116.72 1p4h h MET 800 Ca 0.07 -0.33 0.01 0.00 -0.28 0.00 0.00 59.70 59.17 1p4h h MET 800 Cb 0.79 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.58 1p4h h MET 800 CO 0.06 0.94 0.09 0.28 0.23 0.00 0.00 176.91 178.51 1p4h h VAL 801 N 0.52 0.99 -0.94 -5.77 2.07 -0.82 -1.83 116.25 110.47 1p4h h VAL 801 Ca 0.04 -0.07 0.08 0.00 0.82 0.00 0.00 66.70 67.57 1p4h h VAL 801 Cb 0.94 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 1p4h h VAL 801 CO 0.08 0.03 0.61 0.40 0.02 0.00 0.00 177.57 178.72 1p4h h ILE 802 N 0.19 1.04 -0.00 4.57 2.04 -0.92 -0.00 117.51 124.42 1p4h h ILE 802 Ca 0.07 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 1p4h h ILE 802 Cb 0.02 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.00 1p4h h ILE 802 CO -0.05 0.19 -0.27 0.03 0.00 0.00 0.00 178.15 178.04 1p4h h ARG 803 N 1.04 0.01 0.11 2.37 3.08 -0.86 -0.33 114.38 119.80 1p4h h ARG 803 Ca 0.42 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.46 1p4h h ARG 803 Cb 0.26 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1p4h h ARG 803 CO -0.17 0.28 -0.05 -0.91 -1.07 0.00 0.00 179.97 178.04 1p4h h ASN 804 N 0.01 -0.13 -0.81 7.04 2.35 -0.27 -3.05 115.58 120.71 1p4h h ASN 804 Ca -0.00 -0.41 0.10 0.00 -0.55 0.00 0.00 56.30 55.44 1p4h h ASN 804 Cb 0.49 0.03 -0.08 0.00 0.05 0.00 0.00 38.32 38.81 1p4h h ASN 804 CO 0.04 0.50 0.45 0.40 -1.65 0.00 0.00 177.43 177.16 1p4h h ILE 805 N -0.91 0.87 0.00 2.81 2.04 -1.08 -1.40 117.51 119.84 1p4h h ILE 805 Ca -0.02 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 1p4h h ILE 805 Cb 0.53 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1p4h h ILE 805 CO 0.03 0.13 -0.13 0.00 0.00 0.00 0.00 178.15 178.18 1p4h h ALA 806 N 1.47 1.44 -0.33 1.87 0.00 -1.14 -2.82 119.26 119.73 1p4h h ALA 806 Ca 0.40 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1p4h h ALA 806 Cb 0.41 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1p4h h ALA 806 CO -0.27 0.16 0.00 0.25 0.00 0.00 0.00 179.25 179.39 1p4h n THR 807 N -3.87 2.04 1.31 0.00 -2.24 -0.58 -2.37 114.28 108.56 1p4h n THR 807 Ca -0.02 -1.61 0.13 0.00 -2.27 0.00 0.00 64.05 60.28 1p4h n THR 807 Cb 0.22 -0.07 0.46 0.00 -2.10 0.00 0.00 70.33 68.84 1p4h n THR 807 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1p4h n SER 808 N -0.08 0.86 -0.33 3.42 3.41 -0.91 -4.36 113.62 115.64 1p4h n SER 808 Ca 0.20 -0.81 0.17 0.00 -0.26 0.00 0.00 58.87 58.17 1p4h n SER 808 Cb 0.83 0.06 0.38 0.00 -0.26 0.00 0.00 64.21 65.21 1p4h n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1p4h h GLY 809 N 4.94 1.82 1.66 5.00 0.00 -1.79 -0.50 103.07 114.20 1p4h h GLY 809 Ca 0.00 -0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.11 1p4h h GLY 809 CO 0.00 -0.30 0.14 1.70 0.00 0.00 0.00 176.54 178.08 1p4h h LYS 810 N 0.48 0.00 -0.83 4.80 3.64 -1.87 -2.63 116.57 120.16 1p4h h LYS 810 Ca 0.63 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.96 1p4h h LYS 810 Cb 1.25 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 1p4h h LYS 810 CO -0.52 0.00 0.06 1.19 -2.27 0.00 0.00 179.45 177.92 1p4h n PHE 811 N -3.75 1.15 -2.94 1.91 3.01 -0.19 -4.75 117.46 111.89 1p4h n PHE 811 Ca -0.00 -0.52 -0.40 0.00 1.01 0.00 0.00 57.45 57.54 1p4h n PHE 811 Cb 0.25 -0.37 -0.06 0.00 -0.01 0.00 0.00 39.48 39.29 1p4h n PHE 811 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1p4h s SER 812 N -0.34 7.38 0.00 4.37 0.15 -0.99 -0.85 113.70 123.42 1p4h s SER 812 Ca 0.28 1.63 0.11 0.00 0.70 0.00 0.00 55.95 58.67 1p4h s SER 812 Cb 0.22 -2.51 0.46 0.00 -1.71 0.00 0.00 66.02 62.48 1p4h s SER 812 CO 0.08 0.13 1.34 -1.54 1.20 0.00 0.00 173.24 174.45 1p4h n SER 813 N 2.00 0.00 -0.13 5.45 3.41 0.42 -1.90 113.62 122.88 1p4h n SER 813 Ca -0.04 0.48 -0.12 0.00 -0.26 0.00 0.00 58.87 58.94 1p4h n SER 813 Cb 0.49 -0.49 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1p4h n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1p4h h ASP 814 N 0.00 0.98 -0.15 4.04 3.32 -1.92 0.38 116.42 123.08 1p4h h ASP 814 Ca 0.00 -0.42 -0.03 0.00 0.02 0.00 0.00 57.03 56.61 1p4h h ASP 814 Cb 0.18 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1p4h h ASP 814 CO 0.00 1.21 -0.01 -0.09 -1.72 0.00 0.00 179.24 178.63 1p4h h ARG 815 N 0.79 0.27 -0.14 3.56 1.12 -1.70 -0.82 114.38 117.46 1p4h h ARG 815 Ca 0.08 -0.09 0.04 0.00 -1.11 0.00 0.00 59.98 58.90 1p4h h ARG 815 Cb 0.89 -0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 30.79 1p4h h ARG 815 CO 0.08 0.51 -0.12 1.15 -3.11 0.00 0.00 179.97 178.48 1p4h h THR 816 N 0.01 0.65 -0.37 0.20 2.02 -1.39 -1.73 112.91 112.29 1p4h h THR 816 Ca 0.04 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.16 1p4h h THR 816 Cb 0.39 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1p4h h THR 816 CO 0.01 0.00 -0.02 0.40 0.37 0.00 0.00 175.52 176.28 1p4h h ILE 817 N -0.14 1.22 -0.61 3.11 1.08 -0.87 -1.62 117.51 119.68 1p4h h ILE 817 Ca 0.09 -0.88 -0.04 0.00 -0.39 0.00 0.00 64.86 63.64 1p4h h ILE 817 Cb 0.28 0.96 -0.03 0.00 -3.07 0.00 0.00 36.82 34.95 1p4h h ILE 817 CO -0.23 0.30 0.22 0.00 -0.69 0.00 0.00 178.15 177.76 1p4h h ALA 818 N 1.42 1.25 -0.26 1.87 0.00 -0.64 0.43 119.26 123.34 1p4h h ALA 818 Ca 0.12 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 1p4h h ALA 818 Cb 0.39 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1p4h h ALA 818 CO 0.02 0.54 -0.56 1.96 0.00 0.00 0.00 179.25 181.20 1p4h h GLN 819 N 0.88 0.80 -0.30 0.00 4.20 -0.72 -1.75 115.11 118.21 1p4h h GLN 819 Ca 0.20 -0.51 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 1p4h h GLN 819 Cb 0.20 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1p4h h GLN 819 CO -0.02 1.14 0.16 1.88 -0.67 0.00 0.00 178.83 181.32 1p4h h TYR 820 N 0.61 0.42 -0.17 2.96 0.05 -0.94 0.74 116.97 120.63 1p4h h TYR 820 Ca 0.01 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1p4h h TYR 820 Cb 1.16 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.76 1p4h h TYR 820 CO 0.07 0.35 0.11 0.00 -1.05 0.00 0.00 178.16 177.64 1p4h h ALA 821 N 1.02 0.22 0.08 3.88 0.00 -0.84 0.19 119.26 123.81 1p4h h ALA 821 Ca 0.10 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.74 1p4h h ALA 821 Cb 0.08 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.83 1p4h h ALA 821 CO -0.02 -0.30 -1.06 0.00 0.00 0.00 0.00 179.25 177.88 1p4h h ARG 822 N 0.23 0.57 0.00 0.00 3.08 -1.26 0.40 114.38 117.40 1p4h h ARG 822 Ca 0.06 -0.72 0.00 0.00 0.07 0.00 0.00 59.98 59.39 1p4h h ARG 822 Cb -0.02 0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1p4h h ARG 822 CO -0.01 1.31 -0.80 0.39 -1.07 0.00 0.00 179.97 179.78 1p4h n GLU 823 N -3.91 0.08 0.00 0.04 1.02 0.25 -4.26 120.64 113.85 1p4h n GLU 823 Ca -0.13 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1p4h n GLU 823 Cb 0.90 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.79 1p4h n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1p4h n ILE 824 N -1.62 0.00 0.24 -3.67 5.41 -0.10 -4.87 119.36 114.75 1p4h n ILE 824 Ca 0.04 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.91 1p4h n ILE 824 Cb 0.36 -1.08 0.09 0.00 -0.71 0.00 0.00 39.64 38.30 1p4h n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1p4h h TRP 825 N 0.00 0.00 -3.85 1.39 6.55 -1.11 -3.49 115.95 115.44 1p4h h TRP 825 Ca 0.00 0.00 -0.21 0.00 0.95 0.00 0.00 58.89 59.63 1p4h h TRP 825 Cb 0.67 0.00 0.09 0.00 -0.86 0.00 0.00 29.16 29.05 1p4h h TRP 825 CO 0.00 0.00 -0.40 0.41 -1.05 0.00 0.00 178.44 177.40 1p4h n GLY 826 N 1.19 0.06 3.04 1.49 0.00 0.12 -4.96 105.19 106.13 1p4h n GLY 826 Ca 0.02 -0.15 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 1p4h n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p4h s VAL 827 N -3.19 0.53 -0.22 1.61 -7.23 0.03 -5.00 120.40 106.93 1p4h s VAL 827 Ca 0.21 -0.84 -0.15 0.00 -1.81 0.00 0.00 61.98 59.39 1p4h s VAL 827 Cb -0.09 -0.55 -0.04 0.00 0.56 0.00 0.00 36.38 36.25 1p4h s VAL 827 CO 0.41 -0.23 0.37 -1.61 -0.31 0.00 0.00 175.10 173.73 1p4h s GLU 828 N -1.16 4.14 0.68 4.82 0.41 -1.26 -3.53 118.70 122.80 1p4h s GLU 828 Ca -0.06 0.13 -0.15 0.00 -0.41 0.00 0.00 54.97 54.47 1p4h s GLU 828 Cb -0.08 -3.55 0.01 0.00 -1.78 0.00 0.00 34.13 28.73 1p4h s GLU 828 CO 0.00 -0.06 1.15 -1.25 -0.49 0.00 0.00 175.26 174.61 1p4h s PRO 829 N 1.39 2.56 -0.00 0.39 0.04 -1.26 -4.94 135.00 133.17 1p4h s PRO 829 Ca 0.17 1.55 -0.00 0.00 0.04 0.00 0.00 61.00 62.76 1p4h s PRO 829 Cb -0.15 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.49 1p4h s PRO 829 CO 0.08 -1.46 0.01 0.45 0.04 0.00 0.00 177.00 176.11 1p4h s SER 830 N -2.31 0.01 -0.10 6.66 0.15 0.12 -5.03 113.70 113.21 1p4h s SER 830 Ca 0.70 -0.03 0.14 0.00 0.70 0.00 0.00 55.95 57.47 1p4h s SER 830 Cb -0.24 0.03 0.44 0.00 -1.71 0.00 0.00 66.02 64.53 1p4h s SER 830 CO 0.42 -0.03 1.35 0.54 1.20 0.00 0.00 173.24 176.72 1p4h n ARG 831 N 2.94 2.95 -2.35 5.44 5.12 -1.26 -2.95 116.66 126.54 1p4h n ARG 831 Ca -0.13 -2.48 -0.41 0.00 -1.93 0.00 0.00 57.85 52.89 1p4h n ARG 831 Cb 0.59 -1.59 -0.03 0.00 -1.16 0.00 0.00 32.46 30.28 1p4h n ARG 831 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1p4h s GLN 832 N -1.95 4.46 0.05 5.56 -0.21 -1.26 -5.01 119.66 121.30 1p4h s GLN 832 Ca 0.34 1.89 -0.30 0.00 0.02 0.00 0.00 55.36 57.31 1p4h s GLN 832 Cb 0.24 -3.25 -0.04 0.00 1.00 0.00 0.00 33.01 30.96 1p4h s GLN 832 CO 0.13 -0.15 1.01 1.03 -2.12 0.00 0.00 175.29 175.19 1p4h s ARG 833 N 0.00 4.58 0.58 2.91 3.00 -1.26 -4.96 118.95 123.80 1p4h s ARG 833 Ca 0.55 1.49 -0.11 0.00 0.00 0.00 0.00 55.73 57.66 1p4h s ARG 833 Cb -0.33 -3.41 -0.05 0.00 0.00 0.00 0.00 34.95 31.16 1p4h s ARG 833 CO 0.36 -0.00 0.98 -0.51 0.00 0.00 0.00 175.30 176.12 1p4h s LEU 834 N 0.67 3.37 0.86 2.53 1.43 -0.04 -5.01 118.68 122.48 1p4h s LEU 834 Ca 0.51 1.37 -0.13 0.00 -1.03 0.00 0.00 54.13 54.85 1p4h s LEU 834 Cb -0.23 -4.38 0.04 0.00 0.03 0.00 0.00 46.19 41.65 1p4h s LEU 834 CO 0.29 -0.77 0.68 -2.65 0.23 0.00 0.00 176.35 174.13 1p4h n PRO 835 N -2.44 -0.06 0.00 1.29 -0.02 -1.26 -4.65 135.00 127.85 1p4h n PRO 835 Ca 0.05 0.04 0.07 0.00 -2.02 0.00 0.00 63.50 61.64 1p4h n PRO 835 Cb 0.54 -2.02 0.41 0.00 -0.02 0.00 0.00 33.50 32.41 1p4h n PRO 835 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48