#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orw n ARG 40 N 0.00 0.00 -5.13 -1.46 3.00 -1.26 -5.06 116.66 106.75 1orw n ARG 40 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.55 1orw n ARG 40 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 32.46 32.30 1orw n ARG 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1orw s ARG 41 N 0.00 2.34 0.48 -0.14 3.52 -1.26 -5.07 118.95 118.83 1orw s ARG 41 Ca 0.00 -0.81 0.04 0.00 -0.13 0.00 0.00 55.73 54.83 1orw s ARG 41 Cb 0.00 -1.98 -0.02 0.00 -1.56 0.00 0.00 34.95 31.39 1orw s ARG 41 CO 0.00 0.33 0.13 0.95 -0.81 0.00 0.00 175.30 175.90 1orw s THR 42 N -0.07 1.65 -0.43 4.11 -4.23 -1.26 -0.77 115.64 114.64 1orw s THR 42 Ca -0.05 -1.82 -0.29 0.00 -1.18 0.00 0.00 61.69 58.36 1orw s THR 42 Cb -0.13 -2.46 0.02 0.00 1.34 0.00 0.00 72.50 71.26 1orw s THR 42 CO 0.04 0.00 1.25 -0.47 -0.54 0.00 0.00 174.62 174.89 1orw s TYR 43 N -2.77 2.67 0.63 3.99 5.04 -1.26 -4.84 117.35 120.81 1orw s TYR 43 Ca 0.24 0.74 -0.01 0.00 -2.44 0.00 0.00 57.07 55.59 1orw s TYR 43 Cb 0.02 -4.31 0.06 0.00 0.35 0.00 0.00 41.96 38.08 1orw s TYR 43 CO 0.14 -1.53 0.89 0.95 -1.34 0.00 0.00 175.55 174.65 1orw s THR 44 N 4.76 2.45 0.31 4.34 -4.23 -1.26 -3.96 115.64 118.05 1orw s THR 44 Ca 0.53 -0.54 0.13 0.00 -1.18 0.00 0.00 61.69 60.64 1orw s THR 44 Cb -0.10 -2.91 0.07 0.00 1.34 0.00 0.00 72.50 70.89 1orw s THR 44 CO 0.31 0.00 1.75 0.25 -0.54 0.00 0.00 174.62 176.39 1orw h LEU 45 N -0.25 0.00 -0.26 4.79 5.85 -1.94 -2.18 115.31 121.32 1orw h LEU 45 Ca -0.41 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.13 1orw h LEU 45 Cb 1.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1orw h LEU 45 CO 0.51 0.45 -0.53 0.74 -0.34 0.00 0.00 178.44 179.27 1orw h THR 46 N 0.00 1.29 -0.92 1.05 2.02 -1.97 0.21 112.91 114.58 1orw h THR 46 Ca -0.00 -1.72 -0.01 0.00 0.77 0.00 0.00 66.41 65.44 1orw h THR 46 Cb 0.83 1.72 -0.04 0.00 -1.74 0.00 0.00 68.15 68.91 1orw h THR 46 CO 0.06 0.56 0.55 0.44 0.37 0.00 0.00 175.52 177.49 1orw h ASP 47 N 0.57 1.11 0.20 4.18 3.32 -1.87 0.98 116.42 124.92 1orw h ASP 47 Ca 0.01 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1orw h ASP 47 Cb 1.14 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1orw h ASP 47 CO 0.12 0.86 -0.10 0.22 -1.72 0.00 0.00 179.24 178.62 1orw h TYR 48 N 1.27 -0.25 0.00 4.55 3.20 -1.20 0.22 116.97 124.76 1orw h TYR 48 Ca 0.33 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.18 1orw h TYR 48 Cb -0.05 0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.31 1orw h TYR 48 CO 0.01 0.15 -0.08 -0.07 -1.64 0.00 0.00 178.16 176.52 1orw h LEU 49 N -0.78 0.00 0.00 2.82 3.38 -0.46 -2.66 115.31 117.61 1orw h LEU 49 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1orw h LEU 49 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1orw h LEU 49 CO 0.05 0.08 -0.80 0.29 0.09 0.00 0.00 178.44 178.14 1orw n LYS 50 N -4.03 1.38 -3.45 1.13 4.76 0.33 -4.94 118.16 113.33 1orw n LYS 50 Ca -0.03 -0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.24 1orw n LYS 50 Cb 0.17 -1.30 0.08 0.00 -1.84 0.00 0.00 35.03 32.13 1orw n LYS 50 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1orw n SER 51 N -1.40 -2.56 0.17 4.39 7.64 0.67 -4.85 113.62 117.68 1orw n SER 51 Ca 0.03 -0.67 0.05 0.00 1.01 0.00 0.00 58.87 59.29 1orw n SER 51 Cb 0.26 -4.95 0.48 0.00 -1.01 0.00 0.00 64.21 59.00 1orw n SER 51 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1orw h THR 52 N -1.79 1.12 -3.62 0.44 1.35 -1.54 -3.36 112.91 105.51 1orw h THR 52 Ca -0.60 -0.51 -0.69 0.00 -0.55 0.00 0.00 66.41 64.06 1orw h THR 52 Cb 1.34 1.15 -0.21 0.00 -1.73 0.00 0.00 68.15 68.69 1orw h THR 52 CO 0.50 0.16 -0.49 -0.36 -0.25 0.00 0.00 175.52 175.08 1orw s PHE 53 N -4.84 3.22 -0.05 4.73 0.08 -1.26 -5.07 117.98 114.79 1orw s PHE 53 Ca -0.05 -0.56 -0.19 0.00 0.12 0.00 0.00 56.93 56.26 1orw s PHE 53 Cb 0.16 -2.47 -0.05 0.00 -0.57 0.00 0.00 43.02 40.09 1orw s PHE 53 CO 0.71 -0.50 0.51 0.50 -0.10 0.00 0.00 175.22 176.33 1orw s ARG 54 N 1.65 4.26 -0.44 0.44 6.06 -1.26 -5.05 118.95 124.61 1orw s ARG 54 Ca 0.05 0.55 -0.12 0.00 -2.50 0.00 0.00 55.73 53.71 1orw s ARG 54 Cb -0.18 -3.36 0.08 0.00 0.06 0.00 0.00 34.95 31.54 1orw s ARG 54 CO 0.09 0.33 0.31 0.08 -2.50 0.00 0.00 175.30 173.61 1orw s VAL 55 N 0.03 4.64 0.51 7.11 1.01 -1.26 -4.61 120.40 127.84 1orw s VAL 55 Ca 0.28 -1.26 -0.18 0.00 0.00 0.00 0.00 61.98 60.81 1orw s VAL 55 Cb -0.17 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.33 1orw s VAL 55 CO 0.13 -0.54 1.02 -0.54 0.00 0.00 0.00 175.10 175.18 1orw s LYS 56 N 1.51 3.75 0.20 2.72 1.02 -1.26 -5.07 119.74 122.60 1orw s LYS 56 Ca 0.03 1.22 0.04 0.00 0.02 0.00 0.00 55.97 57.28 1orw s LYS 56 Cb -0.24 -2.10 -0.01 0.00 -0.52 0.00 0.00 37.83 34.96 1orw s LYS 56 CO 0.04 -0.46 0.14 1.97 -0.92 0.00 0.00 175.35 176.12 1orw n PHE 57 N -1.32 -0.32 -3.41 3.18 1.16 -1.26 -4.85 117.46 110.64 1orw n PHE 57 Ca 0.08 -1.54 -0.17 0.00 -1.87 0.00 0.00 57.45 53.96 1orw n PHE 57 Cb 0.53 0.12 -0.10 0.00 -1.61 0.00 0.00 39.48 38.42 1orw n PHE 57 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 1orw s TYR 58 N -2.67 -0.45 -0.10 2.97 6.14 -1.26 -4.95 117.35 117.03 1orw s TYR 58 Ca 0.20 -0.10 -0.09 0.00 0.64 0.00 0.00 57.07 57.72 1orw s TYR 58 Cb 0.01 -0.44 -0.04 0.00 0.42 0.00 0.00 41.96 41.91 1orw s TYR 58 CO 0.14 -0.88 0.19 0.99 0.64 0.00 0.00 175.55 176.63 1orw s THR 59 N 2.36 5.41 0.18 4.34 2.01 -1.26 -5.08 115.64 123.60 1orw s THR 59 Ca 0.09 0.34 -0.07 0.00 0.31 0.00 0.00 61.69 62.36 1orw s THR 59 Cb -0.14 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 1orw s THR 59 CO -0.30 0.60 0.26 -1.48 -0.69 0.00 0.00 174.62 173.01 1orw s LEU 60 N -0.95 0.98 -0.10 4.42 0.05 -1.26 -4.59 118.68 117.23 1orw s LEU 60 Ca 0.16 -1.02 0.01 0.00 0.05 0.00 0.00 54.13 53.33 1orw s LEU 60 Cb -0.13 1.04 0.02 0.00 -2.05 0.00 0.00 46.19 45.07 1orw s LEU 60 CO 0.06 -0.91 -0.10 -1.10 -0.55 0.00 0.00 176.35 173.75 1orw s GLN 61 N -4.02 1.70 0.26 1.48 -0.21 -0.68 -4.95 119.66 113.24 1orw s GLN 61 Ca 0.23 -0.35 -0.29 0.00 0.02 0.00 0.00 55.36 54.97 1orw s GLN 61 Cb 0.04 -1.61 -0.09 0.00 1.00 0.00 0.00 33.01 32.35 1orw s GLN 61 CO 0.04 -0.17 0.96 -1.58 -2.12 0.00 0.00 175.29 172.42 1orw s TRP 62 N 1.35 3.87 0.00 0.91 0.52 -1.26 0.33 118.94 124.67 1orw s TRP 62 Ca -0.01 1.86 0.00 0.00 0.02 0.00 0.00 56.10 57.97 1orw s TRP 62 Cb -0.14 -3.00 0.00 0.00 -1.15 0.00 0.00 33.47 29.18 1orw s TRP 62 CO -0.05 0.28 0.21 0.44 0.02 0.00 0.00 176.95 177.85 1orw n ILE 63 N 1.24 0.00 -2.90 2.03 -5.35 0.03 -4.90 119.36 109.51 1orw n ILE 63 Ca -0.01 -0.28 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 1orw n ILE 63 Cb 0.47 1.33 0.00 0.00 -1.74 0.00 0.00 39.64 39.71 1orw n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1orw n SER 64 N -0.14 0.00 -0.76 7.28 3.41 -1.15 -4.97 113.62 117.29 1orw n SER 64 Ca 0.00 -0.66 0.10 0.00 -0.26 0.00 0.00 58.87 58.05 1orw n SER 64 Cb 0.08 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.32 1orw n SER 64 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1orw n ASP 65 N -0.98 2.27 0.00 4.04 5.68 -1.26 -2.07 116.55 124.23 1orw n ASP 65 Ca 0.00 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.43 1orw n ASP 65 Cb 0.00 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 39.78 1orw n ASP 65 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1orw n HIS 66 N 0.72 0.00 -4.29 2.11 1.44 -1.26 -4.38 115.22 109.57 1orw n HIS 66 Ca 0.16 0.00 -0.18 0.00 -2.01 0.00 0.00 57.72 55.70 1orw n HIS 66 Cb 0.40 0.10 -0.15 0.00 0.12 0.00 0.00 29.99 30.46 1orw n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1orw s GLU 67 N 0.00 0.63 0.03 -1.40 2.02 -1.26 -2.35 118.70 116.37 1orw s GLU 67 Ca 0.00 -0.26 0.02 0.00 0.02 0.00 0.00 54.97 54.74 1orw s GLU 67 Cb 0.00 -0.61 -0.02 0.00 0.10 0.00 0.00 34.13 33.60 1orw s GLU 67 CO 0.00 0.15 -0.06 1.52 0.02 0.00 0.00 175.26 176.89 1orw s TYR 68 N -0.13 0.55 -0.09 1.61 -0.85 -0.89 -0.79 117.35 116.76 1orw s TYR 68 Ca 0.02 -0.50 -0.11 0.00 -0.52 0.00 0.00 57.07 55.96 1orw s TYR 68 Cb -0.03 -0.34 -0.05 0.00 0.38 0.00 0.00 41.96 41.92 1orw s TYR 68 CO -0.00 -0.11 0.26 -0.51 -1.52 0.00 0.00 175.55 173.66 1orw s LEU 69 N -1.51 4.38 -0.02 -3.49 1.43 0.15 -1.45 118.68 118.17 1orw s LEU 69 Ca -0.11 0.62 -0.01 0.00 -1.03 0.00 0.00 54.13 53.60 1orw s LEU 69 Cb -0.10 -2.30 0.02 0.00 0.03 0.00 0.00 46.19 43.84 1orw s LEU 69 CO -0.00 0.30 0.04 -0.47 0.23 0.00 0.00 176.35 176.45 1orw s TYR 70 N -0.64 -0.01 -0.23 0.29 5.04 -0.16 -1.69 117.35 119.96 1orw s TYR 70 Ca 0.18 0.15 -0.23 0.00 -2.44 0.00 0.00 57.07 54.73 1orw s TYR 70 Cb -0.14 -0.15 -0.01 0.00 0.35 0.00 0.00 41.96 42.01 1orw s TYR 70 CO 0.07 -0.08 0.73 0.21 -1.34 0.00 0.00 175.55 175.14 1orw s LYS 71 N 0.79 4.18 -0.19 4.97 2.20 -1.26 0.04 119.74 130.47 1orw s LYS 71 Ca -0.06 0.77 -0.01 0.00 -0.36 0.00 0.00 55.97 56.30 1orw s LYS 71 Cb -0.09 -3.62 0.05 0.00 -1.51 0.00 0.00 37.83 32.66 1orw s LYS 71 CO -0.02 -0.40 -0.01 -1.14 -0.36 0.00 0.00 175.35 173.41 1orw s GLN 72 N 2.45 1.11 -1.19 4.03 0.74 0.16 -4.77 119.66 122.20 1orw s GLN 72 Ca 0.32 -0.56 -0.06 0.00 0.05 0.00 0.00 55.36 55.11 1orw s GLN 72 Cb -0.16 -2.13 0.01 0.00 1.10 0.00 0.00 33.01 31.83 1orw s GLN 72 CO 0.09 -0.55 1.03 0.39 -0.55 0.00 0.00 175.29 175.69 1orw n GLU 73 N 4.91 -6.89 0.00 1.67 1.02 -1.26 -2.70 120.64 117.40 1orw n GLU 73 Ca -0.10 0.75 0.00 0.00 -0.02 0.00 0.00 57.16 57.79 1orw n GLU 73 Cb 0.47 -5.55 0.00 0.00 -0.02 0.00 0.00 31.44 26.34 1orw n GLU 73 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1orw n ASN 74 N -2.66 0.00 -4.77 1.62 4.05 -1.26 -4.80 115.26 107.44 1orw n ASN 74 Ca -0.06 0.00 -0.36 0.00 0.45 0.00 0.00 54.58 54.61 1orw n ASN 74 Cb 0.58 0.00 -0.08 0.00 1.23 0.00 0.00 39.78 41.51 1orw n ASN 74 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1orw s ASN 75 N -1.32 5.75 -0.20 1.20 2.20 -1.10 -4.45 114.94 117.02 1orw s ASN 75 Ca 0.00 0.28 -0.29 0.00 -0.94 0.00 0.00 52.86 51.91 1orw s ASN 75 Cb 0.00 -1.74 0.00 0.00 -2.00 0.00 0.00 41.25 37.52 1orw s ASN 75 CO 0.00 0.39 1.02 -0.63 -2.94 0.00 0.00 177.10 174.94 1orw s ILE 76 N -0.96 4.71 0.15 0.54 1.01 -0.03 -0.66 121.20 125.96 1orw s ILE 76 Ca 0.14 2.02 0.06 0.00 0.00 0.00 0.00 60.65 62.87 1orw s ILE 76 Cb -0.12 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 1orw s ILE 76 CO 0.04 -0.13 0.07 -0.76 0.00 0.00 0.00 174.94 174.15 1orw s LEU 77 N 2.91 3.59 -0.84 2.97 1.43 0.11 -1.48 118.68 127.36 1orw s LEU 77 Ca 0.45 -0.21 -0.04 0.00 -1.03 0.00 0.00 54.13 53.29 1orw s LEU 77 Cb -0.16 -2.24 0.21 0.00 0.03 0.00 0.00 46.19 44.03 1orw s LEU 77 CO 0.09 0.10 0.72 -0.22 0.23 0.00 0.00 176.35 177.27 1orw s LEU 78 N -2.87 5.69 0.39 1.79 2.96 0.18 -0.99 118.68 125.83 1orw s LEU 78 Ca 0.29 -3.36 -0.25 0.00 -0.22 0.00 0.00 54.13 50.59 1orw s LEU 78 Cb -0.10 -1.96 -0.09 0.00 0.50 0.00 0.00 46.19 44.54 1orw s LEU 78 CO 0.21 -0.29 1.10 -0.36 -1.32 0.00 0.00 176.35 175.70 1orw s PHE 79 N -0.83 3.22 -0.31 5.38 0.08 -0.53 -3.51 117.98 121.48 1orw s PHE 79 Ca 0.24 1.61 -0.06 0.00 0.12 0.00 0.00 56.93 58.84 1orw s PHE 79 Cb -0.11 -3.26 0.02 0.00 -0.57 0.00 0.00 43.02 39.10 1orw s PHE 79 CO -0.09 -0.91 0.09 1.21 -0.10 0.00 0.00 175.22 175.42 1orw s ASN 80 N -1.31 5.19 0.04 1.36 3.84 -1.18 -2.09 114.94 120.78 1orw s ASN 80 Ca 0.56 -0.93 -0.10 0.00 0.21 0.00 0.00 52.86 52.60 1orw s ASN 80 Cb -0.27 -1.87 -0.03 0.00 -0.55 0.00 0.00 41.25 38.53 1orw s ASN 80 CO 0.34 -0.26 1.17 0.00 -2.79 0.00 0.00 177.10 175.56 1orw h ALA 81 N 8.22 -0.44 -0.76 1.71 0.00 -1.83 1.21 119.26 127.36 1orw h ALA 81 Ca -0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1orw h ALA 81 Cb 1.10 0.84 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1orw h ALA 81 CO 0.60 -0.52 0.00 0.39 0.00 0.00 0.00 179.25 179.72 1orw n GLU 82 N -3.52 0.00 0.01 0.00 1.02 -1.26 -3.25 120.64 113.64 1orw n GLU 82 Ca -0.01 0.34 -0.22 0.00 -0.02 0.00 0.00 57.16 57.26 1orw n GLU 82 Cb 0.10 -0.58 -0.14 0.00 -0.02 0.00 0.00 31.44 30.81 1orw n GLU 82 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1orw h TYR 83 N 0.00 0.47 0.00 -0.32 0.05 -1.94 -3.49 116.97 111.74 1orw h TYR 83 Ca 0.00 -0.34 0.00 0.00 0.05 0.00 0.00 58.73 58.44 1orw h TYR 83 Cb 0.00 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.72 1orw h TYR 83 CO -0.21 1.62 0.00 0.41 -1.05 0.00 0.00 178.16 178.93 1orw n GLY 84 N 1.79 0.66 3.68 3.88 0.00 0.42 -5.02 105.19 110.59 1orw n GLY 84 Ca -0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1orw n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1orw s ASN 85 N -2.68 6.82 -0.10 1.61 4.22 -1.26 -4.62 114.94 118.93 1orw s ASN 85 Ca 0.00 2.07 -0.02 0.00 -2.14 0.00 0.00 52.86 52.77 1orw s ASN 85 Cb 0.00 -2.55 -0.03 0.00 1.28 0.00 0.00 41.25 39.95 1orw s ASN 85 CO 0.00 -0.78 -0.01 -0.94 -2.04 0.00 0.00 177.10 173.32 1orw s SER 86 N 2.28 5.08 0.20 3.54 1.04 -1.26 -3.13 113.70 121.45 1orw s SER 86 Ca 0.65 0.07 0.09 0.00 0.48 0.00 0.00 55.95 57.24 1orw s SER 86 Cb -0.30 -1.50 -0.04 0.00 0.10 0.00 0.00 66.02 64.27 1orw s SER 86 CO 0.25 0.33 -0.18 -0.94 0.98 0.00 0.00 173.24 173.68 1orw s SER 87 N -0.59 2.88 -0.06 7.02 1.04 -1.23 -4.97 113.70 117.79 1orw s SER 87 Ca 0.10 -0.94 -0.27 0.00 0.48 0.00 0.00 55.95 55.32 1orw s SER 87 Cb -0.12 -0.19 -0.03 0.00 0.10 0.00 0.00 66.02 65.79 1orw s SER 87 CO 0.02 -0.05 0.86 -0.63 0.98 0.00 0.00 173.24 174.42 1orw s ILE 88 N -2.37 4.93 -0.20 -1.02 1.01 -1.26 -0.65 121.20 121.64 1orw s ILE 88 Ca 0.21 1.76 0.13 0.00 0.00 0.00 0.00 60.65 62.75 1orw s ILE 88 Cb -0.04 -4.19 -0.23 0.00 0.01 0.00 0.00 42.46 38.01 1orw s ILE 88 CO 0.08 0.16 0.07 0.33 0.00 0.00 0.00 174.94 175.58 1orw n PHE 89 N 4.17 0.15 -3.26 3.97 -0.00 -0.55 -4.85 117.46 117.08 1orw n PHE 89 Ca 0.03 0.05 0.01 0.00 -0.00 0.00 0.00 57.45 57.54 1orw n PHE 89 Cb 0.51 -1.02 -0.03 0.00 -0.00 0.00 0.00 39.48 38.93 1orw n PHE 89 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1orw s LEU 90 N -5.84 -1.22 0.70 -2.13 0.20 -0.57 -5.01 118.68 104.80 1orw s LEU 90 Ca -0.16 0.87 -0.16 0.00 0.69 0.00 0.00 54.13 55.37 1orw s LEU 90 Cb 0.07 2.00 0.02 0.00 -0.43 0.00 0.00 46.19 47.85 1orw s LEU 90 CO 0.77 -0.26 1.23 -1.61 -0.29 0.00 0.00 176.35 176.20 1orw s GLU 91 N 2.81 2.30 0.01 1.98 2.02 -1.26 -0.85 118.70 125.71 1orw s GLU 91 Ca 0.16 1.86 -0.00 0.00 0.02 0.00 0.00 54.97 57.00 1orw s GLU 91 Cb -0.15 -1.84 0.00 0.00 0.10 0.00 0.00 34.13 32.24 1orw s GLU 91 CO -0.20 -1.74 0.01 0.27 0.02 0.00 0.00 175.26 173.62 1orw n ASN 92 N -2.41 -0.90 0.00 -0.19 0.23 -1.26 -3.28 115.26 107.44 1orw n ASN 92 Ca 0.14 -0.55 0.00 0.00 -0.53 0.00 0.00 54.58 53.64 1orw n ASN 92 Cb 0.50 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.19 1orw n ASN 92 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1orw n SER 93 N -3.01 0.00 0.00 0.53 3.41 -1.26 -4.39 113.62 108.90 1orw n SER 93 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.67 1orw n SER 93 Cb 0.00 -0.13 0.37 0.00 -0.26 0.00 0.00 64.21 64.19 1orw n SER 93 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1orw n THR 94 N -0.35 0.00 -3.06 6.66 -1.04 -1.21 -3.84 114.28 111.44 1orw n THR 94 Ca 0.00 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.56 1orw n THR 94 Cb 0.00 -0.73 -0.02 0.00 -1.82 0.00 0.00 70.33 67.76 1orw n THR 94 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1orw s PHE 95 N -2.00 3.46 -0.63 -1.42 0.08 -1.26 -4.89 117.98 111.32 1orw s PHE 95 Ca 0.18 -1.81 -0.05 0.00 0.12 0.00 0.00 56.93 55.37 1orw s PHE 95 Cb 0.08 -4.14 -0.03 0.00 -0.57 0.00 0.00 43.02 38.37 1orw s PHE 95 CO 0.14 -1.30 2.93 -0.25 -0.10 0.00 0.00 175.22 176.65 1orw n ASP 96 N 5.39 6.70 -2.59 1.36 8.00 -1.25 -4.84 116.55 129.33 1orw n ASP 96 Ca 0.24 -2.95 0.00 0.00 0.71 0.00 0.00 54.79 52.80 1orw n ASP 96 Cb 0.46 -1.34 0.00 0.00 -0.02 0.00 0.00 41.12 40.23 1orw n ASP 96 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1orw n GLU 97 N 1.72 -0.87 -1.51 -1.24 0.00 -1.26 -4.60 120.64 112.88 1orw n GLU 97 Ca 0.53 -0.22 -0.44 0.00 0.00 0.00 0.00 57.16 57.03 1orw n GLU 97 Cb 0.55 0.39 -0.06 0.00 0.00 0.00 0.00 31.44 32.32 1orw n GLU 97 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1orw n LEU 98 N -0.81 2.27 0.00 -1.84 4.77 -1.26 -3.76 117.00 116.37 1orw n LEU 98 Ca 0.00 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1orw n LEU 98 Cb 0.00 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 39.71 1orw n LEU 98 CO 0.00 -0.93 0.00 0.61 -1.33 0.00 0.00 177.39 175.74 1orw n GLY 99 N 6.23 1.52 0.00 -0.72 0.00 -1.26 -4.40 105.19 106.56 1orw n GLY 99 Ca 0.40 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1orw n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1orw n TYR 100 N 0.00 0.00 -3.82 1.61 4.02 -1.25 -5.10 117.16 112.63 1orw n TYR 100 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.69 1orw n TYR 100 Cb 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.15 1orw n TYR 100 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1orw s SER 101 N 1.00 1.07 -0.58 7.72 0.15 -1.26 -4.56 113.70 117.24 1orw s SER 101 Ca 0.00 -0.03 -0.26 0.00 0.70 0.00 0.00 55.95 56.36 1orw s SER 101 Cb 0.00 -0.30 -0.10 0.00 -1.71 0.00 0.00 66.02 63.92 1orw s SER 101 CO 0.00 -0.17 2.45 0.41 1.20 0.00 0.00 173.24 177.13 1orw n THR 102 N 4.80 -0.07 1.06 6.45 -1.04 -1.26 -4.54 114.28 119.67 1orw n THR 102 Ca -0.13 -0.69 0.02 0.00 -2.04 0.00 0.00 64.05 61.21 1orw n THR 102 Cb 0.50 -2.46 0.08 0.00 -1.82 0.00 0.00 70.33 66.63 1orw n THR 102 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1orw n ASN 103 N 15.49 1.43 0.00 8.00 6.94 -0.23 -4.91 115.26 141.98 1orw n ASN 103 Ca 0.41 -2.10 0.00 0.00 -0.02 0.00 0.00 54.58 52.88 1orw n ASN 103 Cb 0.48 -0.31 0.00 0.00 -2.36 0.00 0.00 39.78 37.58 1orw n ASN 103 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1orw n ASP 104 N 0.05 0.00 -4.13 0.53 2.03 -1.19 -4.99 116.55 108.85 1orw n ASP 104 Ca 0.06 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.23 1orw n ASP 104 Cb 0.29 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.58 1orw n ASP 104 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1orw s TYR 105 N -2.00 0.93 -0.14 -0.67 -0.85 -1.26 0.49 117.35 113.85 1orw s TYR 105 Ca 0.00 -0.60 -0.04 0.00 -0.52 0.00 0.00 57.07 55.91 1orw s TYR 105 Cb 0.00 -0.53 0.06 0.00 0.38 0.00 0.00 41.96 41.88 1orw s TYR 105 CO 0.00 -0.04 0.13 0.45 -1.52 0.00 0.00 175.55 174.57 1orw s SER 106 N -2.11 1.56 -0.16 -0.18 0.15 -0.19 -4.94 113.70 107.84 1orw s SER 106 Ca -0.00 -0.20 -0.20 0.00 0.70 0.00 0.00 55.95 56.25 1orw s SER 106 Cb -0.05 0.04 -0.03 0.00 -1.71 0.00 0.00 66.02 64.27 1orw s SER 106 CO -0.00 -0.31 0.57 -0.69 1.20 0.00 0.00 173.24 174.01 1orw s VAL 107 N 2.23 5.09 0.28 4.45 1.01 -1.26 0.11 120.40 132.30 1orw s VAL 107 Ca 0.04 1.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.81 1orw s VAL 107 Cb -0.14 -3.89 -0.13 0.00 0.00 0.00 0.00 36.38 32.21 1orw s VAL 107 CO -0.08 0.20 1.34 -1.54 0.00 0.00 0.00 175.10 175.01 1orw n SER 108 N 4.50 2.67 -0.33 3.32 3.41 -0.94 -4.85 113.62 121.39 1orw n SER 108 Ca -0.04 1.17 0.27 0.00 -0.26 0.00 0.00 58.87 60.01 1orw n SER 108 Cb 0.51 -1.44 0.52 0.00 -0.26 0.00 0.00 64.21 63.53 1orw n SER 108 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1orw h PRO 109 N 3.45 0.21 0.00 4.33 0.13 -1.81 0.72 132.00 139.03 1orw h PRO 109 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1orw h PRO 109 Cb 1.28 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1orw h PRO 109 CO 0.70 0.14 0.00 -0.40 -0.23 0.00 0.00 178.00 178.21 1orw n ASP 110 N -5.10 0.00 -0.54 1.44 5.75 -1.05 -4.85 116.55 112.20 1orw n ASP 110 Ca 0.34 -1.09 -0.07 0.00 -0.01 0.00 0.00 54.79 53.96 1orw n ASP 110 Cb 1.09 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 41.15 1orw n ASP 110 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1orw n ARG 111 N -0.89 -1.32 0.01 0.11 1.74 0.25 -4.89 116.66 111.67 1orw n ARG 111 Ca 0.17 0.68 -0.08 0.00 -0.77 0.00 0.00 57.85 57.85 1orw n ARG 111 Cb 0.08 -4.82 -0.13 0.00 -1.02 0.00 0.00 32.46 26.56 1orw n ARG 111 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1orw h GLN 112 N 0.14 0.00 -5.15 5.56 4.20 -1.90 -3.46 115.11 114.50 1orw h GLN 112 Ca -0.14 -0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.06 1orw h GLN 112 Cb 0.87 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.52 1orw h GLN 112 CO 0.21 0.70 -0.57 -0.06 -0.67 0.00 0.00 178.83 178.43 1orw s PHE 113 N -2.64 1.88 -0.14 2.96 0.08 -1.26 0.32 117.98 119.18 1orw s PHE 113 Ca -0.03 -1.08 -0.10 0.00 0.12 0.00 0.00 56.93 55.85 1orw s PHE 113 Cb 0.09 -1.24 0.05 0.00 -0.57 0.00 0.00 43.02 41.34 1orw s PHE 113 CO 0.82 -0.10 0.35 -1.50 -0.10 0.00 0.00 175.22 174.69 1orw s ILE 114 N -3.27 -0.02 -0.02 0.64 2.07 -0.82 -2.21 121.20 117.57 1orw s ILE 114 Ca 0.31 0.06 -0.19 0.00 -1.41 0.00 0.00 60.65 59.43 1orw s ILE 114 Cb 0.06 -0.51 -0.05 0.00 0.13 0.00 0.00 42.46 42.09 1orw s ILE 114 CO 0.15 0.03 0.53 -0.76 -1.91 0.00 0.00 174.94 172.97 1orw s LEU 115 N 0.84 4.41 -0.25 8.50 1.43 0.29 -1.75 118.68 132.15 1orw s LEU 115 Ca -0.05 1.05 -0.01 0.00 -1.03 0.00 0.00 54.13 54.08 1orw s LEU 115 Cb -0.06 -2.80 0.03 0.00 0.03 0.00 0.00 46.19 43.39 1orw s LEU 115 CO -0.06 0.14 -0.06 -0.36 0.23 0.00 0.00 176.35 176.24 1orw s PHE 116 N -0.28 3.08 -0.18 0.29 2.99 -0.43 -1.02 117.98 122.43 1orw s PHE 116 Ca 0.28 -1.62 -0.14 0.00 0.00 0.00 0.00 56.93 55.45 1orw s PHE 116 Cb -0.17 -2.05 -0.04 0.00 0.00 0.00 0.00 43.02 40.75 1orw s PHE 116 CO 0.15 -0.74 0.30 -2.00 -0.00 0.00 0.00 175.22 172.92 1orw s GLU 117 N 1.31 4.21 0.28 0.44 2.12 0.18 -2.18 118.70 125.06 1orw s GLU 117 Ca -0.01 0.07 -0.15 0.00 0.36 0.00 0.00 54.97 55.25 1orw s GLU 117 Cb -0.17 -3.47 0.01 0.00 0.26 0.00 0.00 34.13 30.76 1orw s GLU 117 CO -0.05 0.14 0.58 1.52 -0.54 0.00 0.00 175.26 176.91 1orw s TYR 118 N 0.77 0.24 -0.71 5.30 1.13 -0.89 -1.07 117.35 122.12 1orw s TYR 118 Ca 0.16 -0.65 -0.01 0.00 -1.41 0.00 0.00 57.07 55.16 1orw s TYR 118 Cb -0.13 0.38 0.00 0.00 -1.10 0.00 0.00 41.96 41.10 1orw s TYR 118 CO 0.05 -1.13 0.10 -1.71 -2.51 0.00 0.00 175.55 170.34 1orw n ASN 119 N -0.59 -3.20 -4.54 -0.18 5.15 -1.26 -0.76 115.26 109.88 1orw n ASN 119 Ca -0.03 -0.05 -0.42 0.00 -0.60 0.00 0.00 54.58 53.49 1orw n ASN 119 Cb 0.61 -2.35 0.01 0.00 -0.53 0.00 0.00 39.78 37.52 1orw n ASN 119 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1orw n TYR 120 N -3.92 0.46 -3.01 1.20 9.36 -1.26 -4.38 117.16 115.60 1orw n TYR 120 Ca -0.08 0.59 -0.09 0.00 3.32 0.00 0.00 57.90 61.64 1orw n TYR 120 Cb 0.57 -2.12 -0.02 0.00 -0.63 0.00 0.00 39.34 37.13 1orw n TYR 120 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1orw s VAL 121 N -1.34 -0.67 0.79 2.97 1.01 -0.77 -4.99 120.40 117.41 1orw s VAL 121 Ca 0.63 -1.18 -0.16 0.00 0.00 0.00 0.00 61.98 61.27 1orw s VAL 121 Cb -0.59 -0.32 -0.09 0.00 0.00 0.00 0.00 36.38 35.39 1orw s VAL 121 CO 0.57 -0.31 -0.04 1.17 0.00 0.00 0.00 175.10 176.49 1orw n LYS 122 N 3.26 0.06 0.00 2.72 4.81 -1.26 -2.68 118.16 125.07 1orw n LYS 122 Ca 0.19 0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 1orw n LYS 122 Cb 0.53 -1.40 0.00 0.00 0.02 0.00 0.00 35.03 34.19 1orw n LYS 122 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1orw n GLN 123 N 0.61 0.00 0.00 1.64 7.27 -0.79 -4.83 117.38 121.28 1orw n GLN 123 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.12 1orw n GLN 123 Cb 0.52 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.17 1orw n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1orw n TRP 124 N -0.13 0.00 0.04 3.69 5.03 -1.21 -4.98 117.44 119.87 1orw n TRP 124 Ca 0.00 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.53 1orw n TRP 124 Cb 0.00 0.00 0.32 0.00 -1.03 0.00 0.00 31.31 30.60 1orw n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 1orw h ARG 125 N 0.00 0.43 0.00 -0.99 2.43 -1.98 -3.37 114.38 110.90 1orw h ARG 125 Ca 0.00 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1orw h ARG 125 Cb 0.00 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1orw h ARG 125 CO 0.00 0.51 -0.96 0.72 -1.51 0.00 0.00 179.97 178.73 1orw n HIS 126 N -4.26 0.00 -1.21 2.20 8.25 -1.26 -5.07 115.22 113.86 1orw n HIS 126 Ca 0.01 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.14 1orw n HIS 126 Cb 0.27 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.49 1orw n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1orw s SER 127 N -3.90 3.91 0.00 0.41 1.04 -1.26 -4.80 113.70 109.10 1orw s SER 127 Ca 0.00 2.22 0.00 0.00 0.48 0.00 0.00 55.95 58.65 1orw s SER 127 Cb 0.00 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1orw s SER 127 CO 0.00 -2.44 0.00 0.00 0.98 0.00 0.00 173.24 171.78 1orw n TYR 128 N -3.25 0.00 -4.31 5.02 0.18 -1.26 -1.89 117.16 111.64 1orw n TYR 128 Ca 0.12 0.00 -0.30 0.00 1.88 0.00 0.00 57.90 59.60 1orw n TYR 128 Cb 0.51 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.36 1orw n TYR 128 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1orw s THR 129 N -2.00 3.10 0.35 -3.48 -4.23 -1.09 -4.58 115.64 103.72 1orw s THR 129 Ca 0.00 -1.34 -0.03 0.00 -1.18 0.00 0.00 61.69 59.14 1orw s THR 129 Cb 0.00 -2.42 0.01 0.00 1.34 0.00 0.00 72.50 71.43 1orw s THR 129 CO 0.00 0.14 0.51 0.00 -0.54 0.00 0.00 174.62 174.73 1orw n ALA 130 N 0.86 -0.46 -2.47 3.99 0.00 -0.64 -1.84 120.51 119.97 1orw n ALA 130 Ca -0.15 -1.59 -0.31 0.00 0.00 0.00 0.00 53.44 51.40 1orw n ALA 130 Cb 0.52 1.28 -0.12 0.00 0.00 0.00 0.00 19.45 21.13 1orw n ALA 130 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1orw s SER 131 N -3.16 3.84 0.03 0.00 0.01 0.06 -0.11 113.70 114.37 1orw s SER 131 Ca 0.28 -0.44 0.04 0.00 1.31 0.00 0.00 55.95 57.13 1orw s SER 131 Cb -0.01 -0.61 -0.02 0.00 0.21 0.00 0.00 66.02 65.59 1orw s SER 131 CO 0.20 0.24 -0.11 -0.31 0.41 0.00 0.00 173.24 173.67 1orw s TYR 132 N -0.97 1.00 -0.09 2.43 1.51 -1.26 -2.09 117.35 117.88 1orw s TYR 132 Ca 0.15 -0.31 0.04 0.00 -1.01 0.00 0.00 57.07 55.94 1orw s TYR 132 Cb -0.11 -0.60 -0.00 0.00 -0.11 0.00 0.00 41.96 41.14 1orw s TYR 132 CO 0.06 0.00 -0.23 -0.51 -1.11 0.00 0.00 175.55 173.76 1orw s ASP 133 N -0.91 2.98 -0.16 2.29 1.01 -0.93 -4.26 116.67 116.68 1orw s ASP 133 Ca 0.00 -0.53 -0.11 0.00 0.71 0.00 0.00 52.55 52.62 1orw s ASP 133 Cb -0.07 -1.30 -0.05 0.00 1.01 0.00 0.00 42.92 42.51 1orw s ASP 133 CO 0.01 0.16 0.19 -0.63 0.21 0.00 0.00 175.17 175.10 1orw s ILE 134 N 0.31 5.38 -0.18 0.77 1.01 -1.26 -1.31 121.20 125.92 1orw s ILE 134 Ca -0.17 0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.81 1orw s ILE 134 Cb -0.17 -3.51 0.02 0.00 0.01 0.00 0.00 42.46 38.80 1orw s ILE 134 CO 0.08 0.47 -0.19 -0.47 0.00 0.00 0.00 174.94 174.83 1orw s TYR 135 N 0.05 2.77 -0.34 3.97 5.04 -0.71 -1.31 117.35 126.81 1orw s TYR 135 Ca 0.12 -1.55 -0.29 0.00 -2.44 0.00 0.00 57.07 52.92 1orw s TYR 135 Cb -0.12 -1.91 0.00 0.00 0.35 0.00 0.00 41.96 40.28 1orw s TYR 135 CO 0.02 -0.76 1.41 0.34 -1.34 0.00 0.00 175.55 175.22 1orw s ASP 136 N 1.22 6.45 0.29 4.32 -1.08 0.15 -1.95 116.67 126.07 1orw s ASP 136 Ca 0.03 1.09 0.05 0.00 -0.52 0.00 0.00 52.55 53.20 1orw s ASP 136 Cb -0.14 -2.54 0.45 0.00 -1.46 0.00 0.00 42.92 39.24 1orw s ASP 136 CO -0.10 -1.29 1.71 -0.07 0.52 0.00 0.00 175.17 175.94 1orw h LEU 137 N 11.70 0.34 0.19 -1.34 3.38 -0.41 0.55 115.31 129.71 1orw h LEU 137 Ca -0.28 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1orw h LEU 137 Cb 1.11 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1orw h LEU 137 CO 1.05 0.67 -0.09 0.78 0.09 0.00 0.00 178.44 180.94 1orw h ASN 138 N 0.28 -0.21 0.36 -0.43 2.35 -1.90 -3.08 115.58 112.95 1orw h ASN 138 Ca 0.03 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1orw h ASN 138 Cb 0.75 0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1orw h ASN 138 CO 0.06 -0.10 0.00 0.29 -1.65 0.00 0.00 177.43 176.02 1orw n LYS 139 N -2.96 0.08 -4.10 0.81 5.02 -1.25 -4.84 118.16 110.93 1orw n LYS 139 Ca -0.03 0.23 -0.28 0.00 -2.02 0.00 0.00 58.31 56.22 1orw n LYS 139 Cb 0.10 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.56 1orw n LYS 139 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1orw n ARG 140 N -1.41 -2.36 -4.60 1.97 1.74 0.18 -4.94 116.66 107.24 1orw n ARG 140 Ca 0.04 0.28 -0.28 0.00 -0.77 0.00 0.00 57.85 57.13 1orw n ARG 140 Cb 0.13 -4.15 -0.09 0.00 -1.02 0.00 0.00 32.46 27.33 1orw n ARG 140 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1orw s GLN 141 N -6.88 1.96 -0.28 5.56 -0.21 -0.59 -4.96 119.66 114.27 1orw s GLN 141 Ca 0.00 -2.18 0.02 0.00 0.02 0.00 0.00 55.36 53.22 1orw s GLN 141 Cb -0.00 -1.20 0.06 0.00 1.00 0.00 0.00 33.01 32.87 1orw s GLN 141 CO 0.93 -0.28 -0.06 -1.17 -2.12 0.00 0.00 175.29 172.59 1orw s LEU 142 N -3.69 3.69 -0.14 2.90 0.20 -1.26 0.29 118.68 120.68 1orw s LEU 142 Ca 0.23 -1.43 -0.40 0.00 0.69 0.00 0.00 54.13 53.23 1orw s LEU 142 Cb 0.05 -1.60 -0.17 0.00 -0.43 0.00 0.00 46.19 44.04 1orw s LEU 142 CO 0.12 -0.23 1.50 -0.38 -0.29 0.00 0.00 176.35 177.07 1orw n ILE 143 N 4.47 0.13 -0.01 6.68 -0.00 -0.43 -4.83 119.36 125.37 1orw n ILE 143 Ca -0.12 -0.02 -0.00 0.00 -0.00 0.00 0.00 62.75 62.60 1orw n ILE 143 Cb 0.42 -0.86 -0.03 0.00 -0.00 0.00 0.00 39.64 39.17 1orw n ILE 143 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 1orw n THR 144 N 3.41 0.17 -3.29 1.39 -2.24 -1.26 -4.65 114.28 107.81 1orw n THR 144 Ca 0.23 -0.14 -0.29 0.00 -2.27 0.00 0.00 64.05 61.59 1orw n THR 144 Cb 0.13 -0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 67.90 1orw n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1orw s GLU 145 N -2.16 3.65 -1.22 -0.78 1.03 -1.26 -4.37 118.70 113.59 1orw s GLU 145 Ca -0.02 0.06 -0.17 0.00 0.03 0.00 0.00 54.97 54.87 1orw s GLU 145 Cb 0.02 -2.62 0.00 0.00 -0.80 0.00 0.00 34.13 30.73 1orw s GLU 145 CO 0.16 0.19 0.68 0.39 -1.33 0.00 0.00 175.26 175.35 1orw n GLU 146 N -0.95 -1.65 -1.72 -4.83 -0.58 -1.26 -4.76 120.64 104.89 1orw n GLU 146 Ca -0.01 0.39 -0.31 0.00 -0.42 0.00 0.00 57.16 56.81 1orw n GLU 146 Cb 0.54 -4.02 0.04 0.00 -0.57 0.00 0.00 31.44 27.42 1orw n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1orw s ARG 147 N -6.33 3.15 0.00 3.49 0.52 -1.26 -4.79 118.95 113.74 1orw s ARG 147 Ca 0.35 0.81 -0.30 0.00 -0.52 0.00 0.00 55.73 56.06 1orw s ARG 147 Cb -0.14 -2.03 -0.04 0.00 0.52 0.00 0.00 34.95 33.27 1orw s ARG 147 CO 0.88 -0.91 1.08 0.42 0.02 0.00 0.00 175.30 176.79 1orw s ILE 148 N -3.13 4.52 1.05 1.52 -1.09 -1.26 -5.01 121.20 117.80 1orw s ILE 148 Ca 0.57 1.81 -0.24 0.00 -2.23 0.00 0.00 60.65 60.55 1orw s ILE 148 Cb -0.13 -4.16 -0.07 0.00 -1.58 0.00 0.00 42.46 36.52 1orw s ILE 148 CO 0.54 0.11 -0.93 -2.65 -1.23 0.00 0.00 174.94 170.79 1orw n PRO 149 N 4.17 -0.68 -3.60 2.79 -0.02 -1.26 -4.47 135.00 131.93 1orw n PRO 149 Ca 0.08 -0.19 -0.37 0.00 -2.02 0.00 0.00 63.50 61.00 1orw n PRO 149 Cb 0.49 -1.29 -0.06 0.00 -0.02 0.00 0.00 33.50 32.62 1orw n PRO 149 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1orw s ASN 150 N -1.34 6.55 -0.06 2.55 3.04 -1.26 -4.28 114.94 120.13 1orw s ASN 150 Ca 0.44 0.65 -0.00 0.00 0.04 0.00 0.00 52.86 53.99 1orw s ASN 150 Cb 0.02 -2.18 0.00 0.00 -1.54 0.00 0.00 41.25 37.55 1orw s ASN 150 CO 0.66 0.24 0.05 0.59 -3.04 0.00 0.00 177.10 175.60 1orw n ASN 151 N 2.68 -2.05 -4.67 -4.21 3.02 -1.09 -4.99 115.26 103.94 1orw n ASN 151 Ca -0.14 -0.03 -0.43 0.00 -0.03 0.00 0.00 54.58 53.95 1orw n ASN 151 Cb 0.53 -0.73 -0.02 0.00 -0.61 0.00 0.00 39.78 38.94 1orw n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1orw s THR 152 N -3.02 4.71 0.30 3.41 2.01 0.85 -4.60 115.64 119.31 1orw s THR 152 Ca 0.01 2.03 0.10 0.00 0.31 0.00 0.00 61.69 64.13 1orw s THR 152 Cb -0.00 -4.31 0.02 0.00 0.01 0.00 0.00 72.50 68.22 1orw s THR 152 CO 0.04 -0.10 1.69 1.56 -0.69 0.00 0.00 174.62 177.11 1orw h GLN 153 N 7.32 0.07 -1.56 4.92 4.20 -1.48 -1.69 115.11 126.89 1orw h GLN 153 Ca -0.24 -0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.51 1orw h GLN 153 Cb 1.10 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 28.63 1orw h GLN 153 CO 0.93 0.56 0.52 -0.46 -0.67 0.00 0.00 178.83 179.71 1orw s TRP 154 N -3.91 -0.40 0.03 2.96 -0.11 -1.22 -4.66 118.94 111.64 1orw s TRP 154 Ca -0.03 0.85 -0.05 0.00 1.22 0.00 0.00 56.10 58.09 1orw s TRP 154 Cb 0.13 0.41 -0.01 0.00 -1.50 0.00 0.00 33.47 32.50 1orw s TRP 154 CO 0.76 -0.28 0.08 -1.50 -4.62 0.00 0.00 176.95 171.39 1orw s ILE 155 N -0.46 0.13 -0.26 5.86 2.07 -1.26 0.78 121.20 128.06 1orw s ILE 155 Ca 0.01 -1.05 -0.26 0.00 -1.41 0.00 0.00 60.65 57.95 1orw s ILE 155 Cb -0.03 -0.78 0.11 0.00 0.13 0.00 0.00 42.46 41.89 1orw s ILE 155 CO -0.03 -0.58 0.96 0.28 -1.91 0.00 0.00 174.94 173.66 1orw s THR 156 N -2.36 0.00 0.46 4.00 -1.32 0.30 -4.98 115.64 111.74 1orw s THR 156 Ca -0.07 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.23 1orw s THR 156 Cb -0.03 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.87 1orw s THR 156 CO -0.03 0.00 0.93 0.26 -2.21 0.00 0.00 174.62 173.57 1orw s TRP 157 N 0.10 3.40 0.81 9.09 0.52 -1.26 -0.92 118.94 130.68 1orw s TRP 157 Ca 0.02 1.46 -0.11 0.00 0.02 0.00 0.00 56.10 57.49 1orw s TRP 157 Cb -0.04 -2.76 0.08 0.00 -1.15 0.00 0.00 33.47 29.59 1orw s TRP 157 CO -0.04 -0.22 1.09 -1.54 0.02 0.00 0.00 176.95 176.27 1orw s SER 158 N -2.70 4.19 0.57 2.95 1.04 -0.85 -4.90 113.70 114.00 1orw s SER 158 Ca 0.59 1.62 0.25 0.00 0.48 0.00 0.00 55.95 58.89 1orw s SER 158 Cb -0.10 -2.33 1.61 0.00 0.10 0.00 0.00 66.02 65.31 1orw s SER 158 CO 0.24 -2.20 2.19 -0.65 0.98 0.00 0.00 173.24 173.80 1orw h PRO 159 N -1.25 0.00 -4.65 4.02 0.11 -1.80 -3.42 132.00 125.01 1orw h PRO 159 Ca -0.46 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.37 1orw h PRO 159 Cb 1.25 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.16 1orw h PRO 159 CO 0.54 0.00 -0.73 0.14 -0.21 0.00 0.00 178.00 177.74 1orw s VAL 160 N -4.78 0.62 0.00 3.15 -7.23 -1.26 -4.71 120.40 106.18 1orw s VAL 160 Ca -0.05 -1.26 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 1orw s VAL 160 Cb 0.16 -0.84 0.00 0.00 0.56 0.00 0.00 36.38 36.26 1orw s VAL 160 CO 0.59 -0.46 0.00 0.61 -0.31 0.00 0.00 175.10 175.53 1orw n GLY 161 N 1.17 0.41 1.14 2.32 0.00 -1.26 -4.41 105.19 104.57 1orw n GLY 161 Ca -0.21 -0.86 -0.01 0.00 0.00 0.00 0.00 46.02 44.94 1orw n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1orw n HIS 162 N 12.07 0.00 -1.11 1.61 1.44 -1.26 -2.54 115.22 125.43 1orw n HIS 162 Ca 0.00 -0.43 -0.31 0.00 -2.01 0.00 0.00 57.72 54.98 1orw n HIS 162 Cb 0.00 0.16 0.12 0.00 0.12 0.00 0.00 29.99 30.40 1orw n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1orw s LYS 163 N 0.00 1.64 -0.00 -1.40 1.02 -1.26 -4.62 119.74 115.12 1orw s LYS 163 Ca 0.15 1.14 0.01 0.00 0.02 0.00 0.00 55.97 57.30 1orw s LYS 163 Cb 0.17 -1.83 -0.01 0.00 -0.52 0.00 0.00 37.83 35.64 1orw s LYS 163 CO -0.07 -2.07 -0.05 -0.51 -0.92 0.00 0.00 175.35 171.73 1orw s LEU 164 N -6.18 2.03 -0.04 3.17 1.43 0.55 -2.01 118.68 117.62 1orw s LEU 164 Ca 0.63 -0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.65 1orw s LEU 164 Cb -0.19 -0.23 0.00 0.00 0.03 0.00 0.00 46.19 45.80 1orw s LEU 164 CO 0.57 0.04 -0.15 0.00 0.23 0.00 0.00 176.35 177.04 1orw s ALA 165 N -0.21 1.36 0.08 4.21 0.00 -0.09 -0.41 121.76 126.69 1orw s ALA 165 Ca 0.01 -0.58 -0.12 0.00 0.00 0.00 0.00 51.96 51.27 1orw s ALA 165 Cb -0.02 -0.48 0.01 0.00 0.00 0.00 0.00 23.12 22.62 1orw s ALA 165 CO -0.00 0.22 0.27 1.52 0.00 0.00 0.00 175.76 177.77 1orw s TYR 166 N 0.18 -0.01 -0.06 0.00 -0.85 0.29 -0.53 117.35 116.36 1orw s TYR 166 Ca -0.06 -0.29 0.02 0.00 -0.52 0.00 0.00 57.07 56.23 1orw s TYR 166 Cb -0.12 0.05 -0.03 0.00 0.38 0.00 0.00 41.96 42.25 1orw s TYR 166 CO 0.02 -0.55 -0.12 0.08 -1.52 0.00 0.00 175.55 173.47 1orw s VAL 167 N -3.30 3.26 -0.18 -3.49 1.01 0.23 -0.28 120.40 117.67 1orw s VAL 167 Ca 0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 61.26 1orw s VAL 167 Cb 0.02 -2.31 0.07 0.00 0.00 0.00 0.00 36.38 34.16 1orw s VAL 167 CO -0.08 0.59 0.41 0.86 0.00 0.00 0.00 175.10 176.87 1orw s TRP 168 N -0.63 -0.65 -1.49 5.22 -0.00 -0.41 -1.40 118.94 119.59 1orw s TRP 168 Ca 0.09 1.34 -0.09 0.00 -0.00 0.00 0.00 56.10 57.44 1orw s TRP 168 Cb -0.11 0.27 0.06 0.00 -0.00 0.00 0.00 33.47 33.69 1orw s TRP 168 CO 0.01 -0.38 0.81 0.09 -0.00 0.00 0.00 176.95 177.49 1orw n ASN 169 N 4.59 -3.12 -0.52 5.86 5.03 -1.26 -1.25 115.26 124.59 1orw n ASN 169 Ca -0.19 -0.85 -0.07 0.00 0.87 0.00 0.00 54.58 54.34 1orw n ASN 169 Cb 0.54 -3.66 -0.03 0.00 -1.02 0.00 0.00 39.78 35.61 1orw n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1orw n ASN 170 N -2.88 -5.10 -4.40 6.41 5.03 -1.26 -4.48 115.26 108.57 1orw n ASN 170 Ca -0.08 0.17 -0.25 0.00 0.87 0.00 0.00 54.58 55.28 1orw n ASN 170 Cb 0.58 -3.20 -0.11 0.00 -1.02 0.00 0.00 39.78 36.03 1orw n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1orw s ASP 171 N -2.36 3.23 0.04 6.41 1.01 -0.38 -2.22 116.67 122.41 1orw s ASP 171 Ca 0.00 -0.89 -0.16 0.00 0.71 0.00 0.00 52.55 52.20 1orw s ASP 171 Cb 0.00 -0.23 -0.06 0.00 1.01 0.00 0.00 42.92 43.64 1orw s ASP 171 CO 0.00 0.06 0.48 -0.63 0.21 0.00 0.00 175.17 175.29 1orw s ILE 172 N -1.93 4.91 -0.02 0.77 1.01 -1.26 -1.29 121.20 123.39 1orw s ILE 172 Ca 0.21 0.96 0.02 0.00 0.00 0.00 0.00 60.65 61.84 1orw s ILE 172 Cb -0.07 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.63 1orw s ILE 172 CO 0.10 0.53 -0.07 -0.31 0.00 0.00 0.00 174.94 175.19 1orw s TYR 173 N -1.13 0.77 -0.03 3.97 1.51 0.62 -0.55 117.35 122.51 1orw s TYR 173 Ca 0.27 -0.17 0.07 0.00 -1.01 0.00 0.00 57.07 56.23 1orw s TYR 173 Cb -0.18 -0.55 -0.02 0.00 -0.11 0.00 0.00 41.96 41.10 1orw s TYR 173 CO 0.16 -0.07 -0.25 0.08 -1.11 0.00 0.00 175.55 174.35 1orw s VAL 174 N 0.15 2.09 -0.22 0.71 1.01 -0.40 -0.55 120.40 123.19 1orw s VAL 174 Ca -0.02 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 60.88 1orw s VAL 174 Cb -0.07 -1.73 0.06 0.00 0.00 0.00 0.00 36.38 34.64 1orw s VAL 174 CO 0.00 0.58 -0.04 -0.54 0.00 0.00 0.00 175.10 175.10 1orw s LYS 175 N -0.50 1.46 0.08 2.72 1.02 0.45 0.20 119.74 125.18 1orw s LYS 175 Ca 0.07 -0.86 -0.18 0.00 0.02 0.00 0.00 55.97 55.01 1orw s LYS 175 Cb -0.11 -2.47 -0.09 0.00 -0.52 0.00 0.00 37.83 34.64 1orw s LYS 175 CO 0.00 -0.59 1.48 -0.91 -0.92 0.00 0.00 175.35 174.41 1orw h ASN 176 N 8.01 0.49 -4.10 2.83 -0.26 -1.87 0.16 115.58 120.85 1orw h ASN 176 Ca -0.18 -0.36 -0.69 0.00 -0.56 0.00 0.00 56.30 54.50 1orw h ASN 176 Cb 1.08 -0.13 -0.24 0.00 -1.06 0.00 0.00 38.32 37.97 1orw h ASN 176 CO 0.40 0.74 -0.84 -1.61 -1.06 0.00 0.00 177.43 175.06 1orw s GLU 177 N -4.77 1.88 0.25 0.81 0.41 -1.26 -4.02 118.70 111.98 1orw s GLU 177 Ca -0.13 -1.08 -0.06 0.00 -0.41 0.00 0.00 54.97 53.28 1orw s GLU 177 Cb 0.07 -2.07 0.29 0.00 -1.78 0.00 0.00 34.13 30.65 1orw s GLU 177 CO 0.76 0.52 1.90 -1.35 -0.49 0.00 0.00 175.26 176.60 1orw h PRO 178 N 4.55 1.18 -0.32 0.39 0.11 -1.84 -2.12 132.00 133.95 1orw h PRO 178 Ca -0.48 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1orw h PRO 178 Cb 1.15 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1orw h PRO 178 CO 0.45 0.78 0.00 0.27 -0.21 0.00 0.00 178.00 179.29 1orw n ASN 179 N -4.47 1.58 -5.00 -2.05 6.94 -1.26 -4.85 115.26 106.14 1orw n ASN 179 Ca 0.12 -2.02 -0.18 0.00 -0.02 0.00 0.00 54.58 52.48 1orw n ASN 179 Cb 0.08 -0.21 0.02 0.00 -2.36 0.00 0.00 39.78 37.30 1orw n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1orw s LEU 180 N -1.00 3.57 0.14 -4.53 2.01 -0.80 -4.73 118.68 113.33 1orw s LEU 180 Ca 0.19 -0.35 -0.25 0.00 0.01 0.00 0.00 54.13 53.73 1orw s LEU 180 Cb 0.10 -2.67 -0.07 0.00 0.01 0.00 0.00 46.19 43.55 1orw s LEU 180 CO 0.12 -0.86 0.77 -0.94 1.01 0.00 0.00 176.35 176.46 1orw s SER 181 N -4.37 7.35 0.54 2.29 1.04 -1.26 -4.76 113.70 114.52 1orw s SER 181 Ca 0.56 1.60 -0.18 0.00 0.48 0.00 0.00 55.95 58.41 1orw s SER 181 Cb -0.10 -2.49 -0.06 0.00 0.10 0.00 0.00 66.02 63.47 1orw s SER 181 CO 0.34 0.17 1.04 -0.94 0.98 0.00 0.00 173.24 174.83 1orw s SER 182 N -0.90 6.11 -0.19 7.02 1.04 -1.26 -4.79 113.70 120.73 1orw s SER 182 Ca 0.36 1.84 -0.07 0.00 0.48 0.00 0.00 55.95 58.57 1orw s SER 182 Cb -0.23 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.32 1orw s SER 182 CO 0.26 -0.94 0.04 -1.58 0.98 0.00 0.00 173.24 172.00 1orw s GLN 183 N -3.70 3.83 -0.06 4.02 2.00 0.13 -4.88 119.66 121.00 1orw s GLN 183 Ca 0.65 -0.41 -0.30 0.00 -2.00 0.00 0.00 55.36 53.29 1orw s GLN 183 Cb -0.16 -3.17 -0.03 0.00 0.80 0.00 0.00 33.01 30.45 1orw s GLN 183 CO 0.29 0.16 1.17 0.50 -0.50 0.00 0.00 175.29 176.90 1orw s ARG 184 N 0.66 4.37 -0.14 1.67 3.52 -1.26 -1.28 118.95 126.49 1orw s ARG 184 Ca 0.02 1.63 -0.09 0.00 -0.13 0.00 0.00 55.73 57.16 1orw s ARG 184 Cb -0.13 -3.55 -0.25 0.00 -1.56 0.00 0.00 34.95 29.46 1orw s ARG 184 CO 0.02 -0.42 0.32 -0.89 -0.81 0.00 0.00 175.30 173.52 1orw n ILE 185 N 4.57 1.74 -4.34 4.11 2.08 0.29 -4.98 119.36 122.83 1orw n ILE 185 Ca 0.10 -0.55 -0.21 0.00 0.56 0.00 0.00 62.75 62.65 1orw n ILE 185 Cb 0.47 -1.78 -0.11 0.00 -0.75 0.00 0.00 39.64 37.47 1orw n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1orw s THR 186 N -2.53 1.82 -0.01 1.39 -4.23 -1.25 -4.93 115.64 105.91 1orw s THR 186 Ca -0.24 -1.97 0.02 0.00 -1.18 0.00 0.00 61.69 58.32 1orw s THR 186 Cb 0.07 -1.88 0.02 0.00 1.34 0.00 0.00 72.50 72.05 1orw s THR 186 CO 0.73 -0.36 0.76 0.79 -0.54 0.00 0.00 174.62 176.01 1orw n TRP 187 N 0.18 0.00 0.86 3.99 7.02 -1.26 -4.54 117.44 123.69 1orw n TRP 187 Ca -0.12 -0.19 0.11 0.00 -1.02 0.00 0.00 57.50 56.27 1orw n TRP 187 Cb 0.58 -0.03 0.02 0.00 -2.42 0.00 0.00 31.31 29.46 1orw n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1orw n THR 188 N -0.23 0.04 -1.51 -0.99 -2.24 -1.26 -4.99 114.28 103.10 1orw n THR 188 Ca 0.01 -0.08 -0.51 0.00 -2.27 0.00 0.00 64.05 61.20 1orw n THR 188 Cb 0.49 0.55 -0.05 0.00 -2.10 0.00 0.00 70.33 69.22 1orw n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1orw n GLY 189 N 1.46 -0.53 3.49 3.38 0.00 -1.26 -4.69 105.19 107.04 1orw n GLY 189 Ca 0.04 0.54 -0.09 0.00 0.00 0.00 0.00 46.02 46.51 1orw n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1orw s LYS 190 N -0.46 0.60 0.22 1.61 2.20 -0.81 -4.92 119.74 118.18 1orw s LYS 190 Ca 0.76 1.00 -0.32 0.00 -0.36 0.00 0.00 55.97 57.05 1orw s LYS 190 Cb -0.99 0.12 -0.12 0.00 -1.51 0.00 0.00 37.83 35.33 1orw s LYS 190 CO 0.55 -0.14 1.70 -2.00 -0.36 0.00 0.00 175.35 175.10 1orw s GLU 191 N 1.31 4.13 -0.33 4.03 2.12 -1.26 -1.15 118.70 127.54 1orw s GLU 191 Ca -0.08 2.59 0.00 0.00 0.36 0.00 0.00 54.97 57.84 1orw s GLU 191 Cb -0.06 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.26 1orw s GLU 191 CO -0.14 -0.73 0.00 0.09 -0.54 0.00 0.00 175.26 173.94 1orw n ASN 192 N 3.78 -5.69 0.11 -1.70 5.03 -1.26 -4.69 115.26 110.83 1orw n ASN 192 Ca 0.15 0.08 0.00 0.00 0.87 0.00 0.00 54.58 55.68 1orw n ASN 192 Cb 0.36 -3.47 0.00 0.00 -1.02 0.00 0.00 39.78 35.65 1orw n ASN 192 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 1orw n VAL 193 N -2.14 0.45 -4.61 2.41 0.31 -0.82 -4.70 118.33 109.22 1orw n VAL 193 Ca -0.03 0.15 -0.33 0.00 -0.01 0.00 0.00 64.34 64.12 1orw n VAL 193 Cb 0.49 -0.89 -0.16 0.00 -0.91 0.00 0.00 33.84 32.37 1orw n VAL 193 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1orw s ILE 194 N -1.95 2.40 -0.17 2.52 -1.09 -0.30 -0.49 121.20 122.12 1orw s ILE 194 Ca 0.00 -0.86 0.01 0.00 -2.23 0.00 0.00 60.65 57.56 1orw s ILE 194 Cb 0.00 -1.99 0.01 0.00 -1.58 0.00 0.00 42.46 38.90 1orw s ILE 194 CO 0.00 0.53 -0.18 -0.31 -1.23 0.00 0.00 174.94 173.75 1orw s TYR 195 N 0.79 2.78 -0.28 3.97 1.51 0.21 -1.93 117.35 124.41 1orw s TYR 195 Ca -0.07 -1.41 0.00 0.00 -1.01 0.00 0.00 57.07 54.59 1orw s TYR 195 Cb -0.15 -1.91 0.05 0.00 -0.11 0.00 0.00 41.96 39.83 1orw s TYR 195 CO -0.00 -0.68 -0.06 -0.80 -1.11 0.00 0.00 175.55 172.90 1orw s ASN 196 N 1.13 4.62 0.00 2.29 0.01 -0.94 -0.51 114.94 121.54 1orw s ASN 196 Ca 0.01 -1.28 0.00 0.00 -0.71 0.00 0.00 52.86 50.88 1orw s ASN 196 Cb -0.14 -1.64 0.00 0.00 0.41 0.00 0.00 41.25 39.88 1orw s ASN 196 CO -0.07 -0.21 0.00 0.61 -1.51 0.00 0.00 177.10 175.91 1orw n GLY 197 N 4.55 3.14 3.18 0.66 0.00 -1.01 -4.20 105.19 111.51 1orw n GLY 197 Ca -0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 1orw n GLY 197 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1orw s VAL 198 N -2.86 1.04 0.60 1.61 -7.23 -1.26 0.52 120.40 112.83 1orw s VAL 198 Ca 0.00 -1.53 -0.14 0.00 -1.81 0.00 0.00 61.98 58.50 1orw s VAL 198 Cb 0.00 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.63 1orw s VAL 198 CO 0.00 -0.43 1.03 0.42 -0.31 0.00 0.00 175.10 175.81 1orw s THR 199 N -2.00 4.24 0.39 5.32 -4.23 0.18 -4.74 115.64 114.80 1orw s THR 199 Ca 0.03 0.91 -0.02 0.00 -1.18 0.00 0.00 61.69 61.44 1orw s THR 199 Cb -0.06 -3.58 0.08 0.00 1.34 0.00 0.00 72.50 70.29 1orw s THR 199 CO 0.01 -0.77 0.54 -0.90 -0.54 0.00 0.00 174.62 172.96 1orw n ASP 200 N -2.31 0.56 -0.06 3.99 5.75 -1.26 -4.76 116.55 118.45 1orw n ASP 200 Ca 0.07 -1.51 -0.14 0.00 -0.01 0.00 0.00 54.79 53.20 1orw n ASP 200 Cb 0.54 -0.36 -0.09 0.00 -1.03 0.00 0.00 41.12 40.17 1orw n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 1orw h TRP 201 N -0.66 -1.57 -0.72 2.11 7.01 -1.99 -1.13 115.95 118.99 1orw h TRP 201 Ca -0.18 0.07 -0.06 0.00 2.11 0.00 0.00 58.89 60.83 1orw h TRP 201 Cb 0.61 0.72 -0.03 0.00 -2.10 0.00 0.00 29.16 28.36 1orw h TRP 201 CO 0.00 -0.51 0.20 -0.24 -2.79 0.00 0.00 178.44 175.09 1orw h VAL 202 N -0.49 1.26 -0.14 2.65 3.04 -1.95 -1.26 116.25 119.37 1orw h VAL 202 Ca 0.06 -0.94 -0.12 0.00 -1.01 0.00 0.00 66.70 64.69 1orw h VAL 202 Cb 0.64 0.50 -0.01 0.00 -2.01 0.00 0.00 31.29 30.41 1orw h VAL 202 CO -0.50 0.36 -0.45 1.88 -1.01 0.00 0.00 177.57 177.85 1orw h TYR 203 N 1.08 0.39 0.19 3.17 -1.99 -1.90 0.52 116.97 118.42 1orw h TYR 203 Ca 0.23 -0.12 -0.01 0.00 2.00 0.00 0.00 58.73 60.83 1orw h TYR 203 Cb 0.34 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 38.99 1orw h TYR 203 CO 0.03 0.73 -0.09 1.49 -0.00 0.00 0.00 178.16 180.31 1orw h GLU 204 N 0.27 -0.24 -0.03 4.88 4.81 -0.89 0.70 114.58 124.08 1orw h GLU 204 Ca 0.02 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 1orw h GLU 204 Cb 0.90 0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.35 1orw h GLU 204 CO 0.07 0.10 -0.36 1.49 -0.73 0.00 0.00 179.01 179.59 1orw h GLU 205 N -0.62 0.29 0.00 1.92 4.57 -1.21 -2.16 114.58 117.37 1orw h GLU 205 Ca -0.03 -0.28 -0.10 0.00 -1.18 0.00 0.00 59.36 57.77 1orw h GLU 205 Cb 0.45 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.10 1orw h GLU 205 CO 0.04 0.96 -1.67 0.39 -1.18 0.00 0.00 179.01 177.55 1orw n GLU 206 N -4.41 0.64 0.00 1.92 -0.58 0.18 -4.58 120.64 113.81 1orw n GLU 206 Ca -0.09 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 1orw n GLU 206 Cb 0.54 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.74 1orw n GLU 206 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1orw n VAL 207 N -2.61 0.00 -0.01 2.62 0.24 -0.95 -4.85 118.33 112.78 1orw n VAL 207 Ca -0.09 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.29 1orw n VAL 207 Cb 0.73 -0.67 -0.13 0.00 -1.47 0.00 0.00 33.84 32.30 1orw n VAL 207 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1orw n PHE 208 N -1.69 0.00 -3.44 6.34 3.01 0.20 -4.95 117.46 116.92 1orw n PHE 208 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.21 1orw n PHE 208 Cb 0.36 -0.39 0.04 0.00 -0.01 0.00 0.00 39.48 39.48 1orw n PHE 208 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1orw n SER 209 N -2.09 -5.42 -3.46 4.37 7.64 -0.83 -4.92 113.62 108.90 1orw n SER 209 Ca -0.04 -0.49 -0.13 0.00 1.01 0.00 0.00 58.87 59.23 1orw n SER 209 Cb 0.45 -4.35 -0.03 0.00 -1.01 0.00 0.00 64.21 59.27 1orw n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1orw s ALA 210 N -3.20 -1.69 -0.05 -0.43 0.00 -1.09 -4.98 121.76 110.33 1orw s ALA 210 Ca 0.48 0.80 0.06 0.00 0.00 0.00 0.00 51.96 53.31 1orw s ALA 210 Cb -0.23 0.55 -0.24 0.00 0.00 0.00 0.00 23.12 23.20 1orw s ALA 210 CO 0.59 -0.65 0.64 -0.92 0.00 0.00 0.00 175.76 175.43 1orw h TYR 211 N 2.25 0.16 -3.49 0.00 3.20 -1.87 -3.36 116.97 113.86 1orw h TYR 211 Ca -0.30 -0.12 -0.52 0.00 3.14 0.00 0.00 58.73 60.93 1orw h TYR 211 Cb 1.25 -0.01 0.03 0.00 1.54 0.00 0.00 36.73 39.55 1orw h TYR 211 CO 0.27 1.23 0.63 0.45 -1.64 0.00 0.00 178.16 179.09 1orw s SER 212 N -6.44 6.93 -0.33 -2.11 0.15 -1.26 0.48 113.70 111.11 1orw s SER 212 Ca -0.09 2.41 0.17 0.00 0.70 0.00 0.00 55.95 59.14 1orw s SER 212 Cb 0.08 -2.62 0.45 0.00 -1.71 0.00 0.00 66.02 62.22 1orw s SER 212 CO 0.81 -0.48 1.00 0.00 1.20 0.00 0.00 173.24 175.78 1orw n ALA 213 N 2.26 3.07 -3.68 5.45 0.00 0.18 -4.69 120.51 123.11 1orw n ALA 213 Ca 0.05 -2.87 -0.20 0.00 0.00 0.00 0.00 53.44 50.41 1orw n ALA 213 Cb 0.43 -0.95 -0.17 0.00 0.00 0.00 0.00 19.45 18.76 1orw n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1orw s LEU 214 N -3.12 1.13 -0.24 0.00 1.43 -1.23 -1.92 118.68 114.74 1orw s LEU 214 Ca 0.26 -0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 53.24 1orw s LEU 214 Cb 0.45 -0.42 0.07 0.00 0.03 0.00 0.00 46.19 46.32 1orw s LEU 214 CO 0.02 -0.10 0.04 0.26 0.23 0.00 0.00 176.35 176.81 1orw s TRP 215 N 1.20 1.40 0.46 0.29 0.51 0.74 -4.98 118.94 118.56 1orw s TRP 215 Ca -0.07 -1.25 -0.23 0.00 -2.12 0.00 0.00 56.10 52.44 1orw s TRP 215 Cb -0.14 -1.30 -0.07 0.00 -0.81 0.00 0.00 33.47 31.15 1orw s TRP 215 CO -0.02 -0.72 1.17 -1.58 -0.51 0.00 0.00 176.95 175.29 1orw s TRP 216 N 1.73 2.86 0.60 -1.98 0.52 -1.26 -0.37 118.94 121.04 1orw s TRP 216 Ca 0.02 1.53 -0.14 0.00 0.02 0.00 0.00 56.10 57.53 1orw s TRP 216 Cb -0.17 -3.39 -0.04 0.00 -1.15 0.00 0.00 33.47 28.72 1orw s TRP 216 CO -0.14 -1.53 1.04 -1.54 0.02 0.00 0.00 176.95 174.80 1orw s SER 217 N -1.35 5.97 0.21 2.95 1.04 0.14 -4.89 113.70 117.76 1orw s SER 217 Ca 0.64 1.65 -0.13 0.00 0.48 0.00 0.00 55.95 58.58 1orw s SER 217 Cb -0.29 -2.51 0.25 0.00 0.10 0.00 0.00 66.02 63.58 1orw s SER 217 CO 0.35 -1.04 1.34 -2.65 0.98 0.00 0.00 173.24 172.22 1orw n PRO 218 N -2.28 -0.17 -0.35 4.02 -0.02 -1.26 -0.34 135.00 134.59 1orw n PRO 218 Ca 0.07 1.33 0.09 0.00 -2.02 0.00 0.00 63.50 62.97 1orw n PRO 218 Cb 0.53 -1.98 0.26 0.00 -0.02 0.00 0.00 33.50 32.30 1orw n PRO 218 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1orw n ASN 219 N -5.30 3.33 -0.12 2.55 3.02 -1.26 -4.10 115.26 113.37 1orw n ASN 219 Ca 0.10 -2.11 -0.02 0.00 -0.03 0.00 0.00 54.58 52.53 1orw n ASN 219 Cb 0.37 -0.42 -0.01 0.00 -0.61 0.00 0.00 39.78 39.10 1orw n ASN 219 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1orw n GLY 220 N 1.28 0.51 0.10 7.41 0.00 0.54 -4.81 105.19 110.22 1orw n GLY 220 Ca 0.20 -0.27 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 1orw n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1orw h THR 221 N 0.00 1.36 -3.53 2.61 2.02 -1.92 -3.45 112.91 110.00 1orw h THR 221 Ca -0.03 -1.25 -0.67 0.00 0.77 0.00 0.00 66.41 65.23 1orw h THR 221 Cb 0.26 1.99 -0.15 0.00 -1.74 0.00 0.00 68.15 68.51 1orw h THR 221 CO 0.05 0.35 -0.70 -0.36 0.37 0.00 0.00 175.52 175.23 1orw s PHE 222 N -4.28 2.87 -0.27 3.16 0.08 -1.26 -1.04 117.98 117.25 1orw s PHE 222 Ca -0.15 -0.07 0.02 0.00 0.12 0.00 0.00 56.93 56.85 1orw s PHE 222 Cb 0.04 -1.54 0.07 0.00 -0.57 0.00 0.00 43.02 41.02 1orw s PHE 222 CO 0.72 0.41 -0.06 -1.17 -0.10 0.00 0.00 175.22 175.03 1orw s LEU 223 N -1.88 3.32 0.29 -0.37 2.96 0.95 0.26 118.68 124.21 1orw s LEU 223 Ca 0.20 -1.46 -0.13 0.00 -0.22 0.00 0.00 54.13 52.52 1orw s LEU 223 Cb -0.11 -1.41 -0.08 0.00 0.50 0.00 0.00 46.19 45.08 1orw s LEU 223 CO 0.12 -0.25 0.67 0.00 -1.32 0.00 0.00 176.35 175.58 1orw s ALA 224 N 1.19 3.41 -0.07 5.97 0.00 0.50 -0.85 121.76 131.90 1orw s ALA 224 Ca -0.04 -0.06 -0.31 0.00 0.00 0.00 0.00 51.96 51.55 1orw s ALA 224 Cb -0.19 -2.66 0.08 0.00 0.00 0.00 0.00 23.12 20.35 1orw s ALA 224 CO -0.07 0.39 0.74 1.52 0.00 0.00 0.00 175.76 178.35 1orw s TYR 225 N -1.92 -0.60 0.08 0.00 1.13 0.16 -0.19 117.35 116.01 1orw s TYR 225 Ca 0.52 1.04 0.02 0.00 -1.41 0.00 0.00 57.07 57.24 1orw s TYR 225 Cb -0.11 0.42 -0.04 0.00 -1.10 0.00 0.00 41.96 41.13 1orw s TYR 225 CO 0.19 -0.55 0.14 0.00 -2.51 0.00 0.00 175.55 172.81 1orw s ALA 226 N -1.16 3.73 -0.10 9.51 0.00 -0.81 -0.82 121.76 132.12 1orw s ALA 226 Ca -0.09 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 50.93 1orw s ALA 226 Cb -0.00 -1.58 0.01 0.00 0.00 0.00 0.00 23.12 21.55 1orw s ALA 226 CO 0.08 0.75 -0.20 -1.14 0.00 0.00 0.00 175.76 175.25 1orw s GLN 227 N -2.52 2.67 -0.11 0.00 0.74 0.08 -2.40 119.66 118.12 1orw s GLN 227 Ca 0.32 -0.74 0.00 0.00 0.05 0.00 0.00 55.36 54.99 1orw s GLN 227 Cb -0.12 -2.11 -0.02 0.00 1.10 0.00 0.00 33.01 31.86 1orw s GLN 227 CO 0.24 0.07 -0.11 -0.06 -0.55 0.00 0.00 175.29 174.88 1orw s PHE 228 N 0.62 2.84 -0.27 1.67 0.08 0.33 -1.31 117.98 121.94 1orw s PHE 228 Ca -0.13 -0.42 -0.01 0.00 0.12 0.00 0.00 56.93 56.48 1orw s PHE 228 Cb -0.17 -1.81 0.04 0.00 -0.57 0.00 0.00 43.02 40.52 1orw s PHE 228 CO 0.04 -0.05 -0.04 1.21 -0.10 0.00 0.00 175.22 176.29 1orw s ASN 229 N 0.03 4.61 0.00 1.36 3.84 -0.05 -0.62 114.94 124.11 1orw s ASN 229 Ca -0.03 -1.11 0.23 0.00 0.21 0.00 0.00 52.86 52.16 1orw s ASN 229 Cb -0.14 -1.68 0.17 0.00 -0.55 0.00 0.00 41.25 39.05 1orw s ASN 229 CO 0.04 -0.20 1.20 0.47 -2.79 0.00 0.00 177.10 175.82 1orw n ASP 230 N 4.63 1.61 -0.06 -4.21 9.92 0.35 -1.56 116.55 127.24 1orw n ASP 230 Ca -0.15 -1.26 0.05 0.00 -0.53 0.00 0.00 54.79 52.90 1orw n ASP 230 Cb 0.45 0.45 0.09 0.00 -0.64 0.00 0.00 41.12 41.46 1orw n ASP 230 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1orw n THR 231 N -0.40 -0.07 -0.21 -3.53 -1.04 -1.25 0.12 114.28 107.89 1orw n THR 231 Ca 0.09 0.36 0.07 0.00 -2.04 0.00 0.00 64.05 62.54 1orw n THR 231 Cb 0.42 -0.57 0.19 0.00 -1.82 0.00 0.00 70.33 68.55 1orw n THR 231 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1orw n GLU 232 N -3.57 2.83 -2.84 -2.82 1.02 -1.26 -4.96 120.64 109.04 1orw n GLU 232 Ca 0.06 -2.19 -0.42 0.00 -0.02 0.00 0.00 57.16 54.59 1orw n GLU 232 Cb 0.20 -1.34 -0.04 0.00 -0.02 0.00 0.00 31.44 30.24 1orw n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1orw s VAL 233 N -1.00 4.82 0.79 2.62 1.01 0.33 -4.65 120.40 124.31 1orw s VAL 233 Ca 0.29 1.69 -0.15 0.00 0.00 0.00 0.00 61.98 63.82 1orw s VAL 233 Cb 0.15 -4.17 0.02 0.00 0.00 0.00 0.00 36.38 32.39 1orw s VAL 233 CO 0.20 -0.07 0.83 -2.65 0.00 0.00 0.00 175.10 173.41 1orw n PRO 234 N 5.84 0.20 -3.74 2.72 -0.02 -1.26 -4.60 135.00 134.14 1orw n PRO 234 Ca 0.07 0.13 -0.35 0.00 -2.02 0.00 0.00 63.50 61.32 1orw n PRO 234 Cb 0.48 -2.12 -0.08 0.00 -0.02 0.00 0.00 33.50 31.75 1orw n PRO 234 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1orw s LEU 235 N -2.81 4.19 -0.08 2.45 1.43 -1.26 -1.72 118.68 120.88 1orw s LEU 235 Ca 0.68 0.22 -0.23 0.00 -1.03 0.00 0.00 54.13 53.78 1orw s LEU 235 Cb -0.31 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 1orw s LEU 235 CO 0.55 0.18 0.68 -0.51 0.23 0.00 0.00 176.35 177.48 1orw s ILE 236 N 0.37 5.05 -0.03 -0.59 1.10 0.52 -4.87 121.20 122.76 1orw s ILE 236 Ca 0.08 1.38 0.07 0.00 -0.51 0.00 0.00 60.65 61.67 1orw s ILE 236 Cb -0.11 -4.01 -0.02 0.00 0.15 0.00 0.00 42.46 38.47 1orw s ILE 236 CO -0.02 0.24 -0.23 -1.61 -2.11 0.00 0.00 174.94 171.21 1orw s GLU 237 N 0.90 2.02 0.26 3.50 2.02 -1.26 -1.59 118.70 124.55 1orw s GLU 237 Ca 0.36 -0.83 -0.11 0.00 0.02 0.00 0.00 54.97 54.41 1orw s GLU 237 Cb -0.17 -1.88 -0.00 0.00 0.10 0.00 0.00 34.13 32.17 1orw s GLU 237 CO 0.17 0.46 0.46 1.52 0.02 0.00 0.00 175.26 177.89 1orw s TYR 238 N -0.43 0.51 -0.08 1.61 1.13 -0.93 -5.00 117.35 114.16 1orw s TYR 238 Ca 0.06 -0.86 -0.10 0.00 -1.41 0.00 0.00 57.07 54.76 1orw s TYR 238 Cb -0.10 0.12 -0.05 0.00 -1.10 0.00 0.00 41.96 40.83 1orw s TYR 238 CO 0.00 -1.01 0.24 -1.12 -2.51 0.00 0.00 175.55 171.16 1orw s SER 239 N -3.06 6.54 -0.19 -0.18 0.01 -1.26 -1.03 113.70 114.53 1orw s SER 239 Ca 0.25 0.65 0.01 0.00 1.31 0.00 0.00 55.95 58.17 1orw s SER 239 Cb -0.00 -2.14 0.03 0.00 0.21 0.00 0.00 66.02 64.11 1orw s SER 239 CO 0.11 0.36 -0.18 0.12 0.41 0.00 0.00 173.24 174.06 1orw s PHE 240 N -0.97 2.86 -0.17 2.43 5.36 0.68 -4.68 117.98 123.51 1orw s PHE 240 Ca 0.18 -1.74 0.17 0.00 -0.96 0.00 0.00 56.93 54.58 1orw s PHE 240 Cb -0.14 -1.93 0.00 0.00 -0.34 0.00 0.00 43.02 40.62 1orw s PHE 240 CO 0.07 -0.81 1.20 1.88 -1.46 0.00 0.00 175.22 176.10 1orw h TYR 241 N 7.92 0.00 -1.55 10.12 -1.99 -1.96 -0.80 116.97 128.71 1orw h TYR 241 Ca -0.41 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.32 1orw h TYR 241 Cb 1.12 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.85 1orw h TYR 241 CO 0.50 0.45 0.00 0.45 -0.00 0.00 0.00 178.16 179.56 1orw n SER 242 N -3.05 -4.65 -4.75 3.88 2.88 -1.26 -4.75 113.62 101.92 1orw n SER 242 Ca -0.02 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.10 1orw n SER 242 Cb 0.74 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.20 1orw n SER 242 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1orw n ASP 243 N -3.07 3.64 -0.50 -3.46 -0.08 -1.26 -4.87 116.55 106.94 1orw n ASP 243 Ca 0.00 1.20 0.41 0.00 -1.51 0.00 0.00 54.79 54.89 1orw n ASP 243 Cb 0.00 -1.59 0.71 0.00 2.34 0.00 0.00 41.12 42.58 1orw n ASP 243 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1orw h GLU 244 N 3.43 0.06 0.00 -0.67 4.81 -2.05 0.43 114.58 120.59 1orw h GLU 244 Ca -0.49 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1orw h GLU 244 Cb 1.24 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1orw h GLU 244 CO 0.68 0.04 0.00 0.66 -0.73 0.00 0.00 179.01 179.66 1orw h SER 245 N 0.06 0.00 -3.07 1.04 4.64 -1.94 -3.42 113.55 110.85 1orw h SER 245 Ca 0.82 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.58 1orw h SER 245 Cb 2.86 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.90 1orw h SER 245 CO -0.26 0.00 1.11 -0.22 -0.87 0.00 0.00 176.83 176.59 1orw s LEU 246 N -5.27 3.52 0.19 5.97 0.20 0.15 -4.91 118.68 118.54 1orw s LEU 246 Ca 0.01 0.74 -0.11 0.00 0.69 0.00 0.00 54.13 55.45 1orw s LEU 246 Cb 0.09 -3.39 0.12 0.00 -0.43 0.00 0.00 46.19 42.58 1orw s LEU 246 CO 0.42 -1.56 1.84 -0.61 -0.29 0.00 0.00 176.35 176.14 1orw h GLN 247 N 11.18 0.92 -5.77 1.98 4.15 -1.87 -3.42 115.11 122.27 1orw h GLN 247 Ca -0.28 -0.08 -0.67 0.00 0.77 0.00 0.00 58.65 58.39 1orw h GLN 247 Cb 1.11 -0.19 -0.25 0.00 0.21 0.00 0.00 27.48 28.36 1orw h GLN 247 CO 1.11 0.65 -0.76 0.71 -1.93 0.00 0.00 178.83 178.61 1orw s TYR 248 N -5.99 2.78 0.69 3.99 1.51 -1.26 -5.11 117.35 113.96 1orw s TYR 248 Ca -0.13 -0.40 -0.16 0.00 -1.01 0.00 0.00 57.07 55.38 1orw s TYR 248 Cb 0.14 -1.75 0.02 0.00 -0.11 0.00 0.00 41.96 40.25 1orw s TYR 248 CO 0.78 -0.01 1.18 -2.14 -1.11 0.00 0.00 175.55 174.24 1orw s PRO 249 N -0.16 2.47 -0.09 -1.71 0.02 -1.26 -5.01 135.00 129.25 1orw s PRO 249 Ca -0.00 1.65 -0.05 0.00 0.02 0.00 0.00 61.00 62.62 1orw s PRO 249 Cb -0.13 -1.88 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 1orw s PRO 249 CO 0.03 -1.56 0.12 0.15 -0.33 0.00 0.00 177.00 175.41 1orw s LYS 250 N -3.88 3.35 -0.33 5.54 1.02 -0.31 -4.95 119.74 120.18 1orw s LYS 250 Ca 0.72 -0.22 -0.14 0.00 0.02 0.00 0.00 55.97 56.36 1orw s LYS 250 Cb -0.26 -3.10 -0.02 0.00 -0.52 0.00 0.00 37.83 33.93 1orw s LYS 250 CO 0.42 0.75 0.28 0.99 -0.92 0.00 0.00 175.35 176.87 1orw s THR 251 N -1.05 5.24 0.08 2.17 2.01 -1.26 -0.23 115.64 122.60 1orw s THR 251 Ca 0.17 -0.06 -0.28 0.00 0.31 0.00 0.00 61.69 61.82 1orw s THR 251 Cb -0.12 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 1orw s THR 251 CO 0.06 -0.01 0.90 -0.69 -0.69 0.00 0.00 174.62 174.19 1orw s VAL 252 N 1.84 4.62 -0.13 3.82 1.01 -0.19 -4.92 120.40 126.44 1orw s VAL 252 Ca 0.08 1.93 0.01 0.00 0.00 0.00 0.00 61.98 64.00 1orw s VAL 252 Cb -0.17 -4.26 0.02 0.00 0.00 0.00 0.00 36.38 31.97 1orw s VAL 252 CO 0.11 0.31 -0.16 -0.13 0.00 0.00 0.00 175.10 175.23 1orw s ARG 253 N 0.11 2.41 -0.04 2.72 0.52 -1.26 -2.19 118.95 121.22 1orw s ARG 253 Ca 0.45 -0.62 0.03 0.00 -0.52 0.00 0.00 55.73 55.07 1orw s ARG 253 Cb -0.22 -2.09 0.00 0.00 0.52 0.00 0.00 34.95 33.16 1orw s ARG 253 CO 0.27 -0.13 -0.13 0.42 0.02 0.00 0.00 175.30 175.74 1orw s ILE 254 N 1.18 1.16 -0.22 1.52 1.01 -0.62 -4.95 121.20 120.28 1orw s ILE 254 Ca -0.01 -0.55 -0.29 0.00 0.00 0.00 0.00 60.65 59.79 1orw s ILE 254 Cb -0.14 -1.02 -0.01 0.00 0.01 0.00 0.00 42.46 41.30 1orw s ILE 254 CO -0.06 0.35 1.39 -2.84 0.00 0.00 0.00 174.94 173.78 1orw s PRO 255 N 0.21 4.01 -0.12 2.79 0.02 -1.26 -0.35 135.00 140.30 1orw s PRO 255 Ca -0.06 1.55 -0.04 0.00 0.02 0.00 0.00 61.00 62.48 1orw s PRO 255 Cb -0.11 -3.89 0.06 0.00 0.02 0.00 0.00 34.50 30.58 1orw s PRO 255 CO 0.02 -1.01 0.17 -0.47 -0.33 0.00 0.00 177.00 175.38 1orw s TYR 256 N 4.26 -0.17 -0.12 6.54 6.14 -0.70 -4.56 117.35 128.74 1orw s TYR 256 Ca 0.61 0.45 -0.22 0.00 0.64 0.00 0.00 57.07 58.54 1orw s TYR 256 Cb -0.21 -0.32 -0.03 0.00 0.42 0.00 0.00 41.96 41.82 1orw s TYR 256 CO 0.22 -0.37 0.66 -1.25 0.64 0.00 0.00 175.55 175.45 1orw s PRO 257 N 2.29 4.35 0.35 4.97 0.04 -1.26 -4.51 135.00 141.24 1orw s PRO 257 Ca 0.04 0.77 0.04 0.00 0.04 0.00 0.00 61.00 61.88 1orw s PRO 257 Cb -0.13 -3.49 -0.01 0.00 0.04 0.00 0.00 34.50 30.90 1orw s PRO 257 CO -0.08 -0.04 0.51 0.15 0.04 0.00 0.00 177.00 177.59 1orw s LYS 258 N 1.18 3.20 -0.36 4.56 1.02 -1.26 -0.52 119.74 127.56 1orw s LYS 258 Ca 0.34 -0.75 -0.36 0.00 0.02 0.00 0.00 55.97 55.22 1orw s LYS 258 Cb -0.17 -2.75 -0.15 0.00 -0.52 0.00 0.00 37.83 34.24 1orw s LYS 258 CO 0.14 0.05 1.20 0.00 -0.92 0.00 0.00 175.35 175.82 1orw n ALA 259 N -1.73 -1.19 -0.90 5.17 0.00 0.33 0.44 120.51 122.63 1orw n ALA 259 Ca -0.02 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1orw n ALA 259 Cb 0.58 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1orw n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orw n GLY 260 N 2.93 0.76 3.92 0.00 0.00 -1.26 -4.85 105.19 106.68 1orw n GLY 260 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 1orw n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orw s ALA 261 N -3.25 2.67 0.08 4.61 0.00 0.17 -4.97 121.76 121.07 1orw s ALA 261 Ca 0.00 -0.86 -0.31 0.00 0.00 0.00 0.00 51.96 50.79 1orw s ALA 261 Cb 0.00 -2.83 -0.09 0.00 0.00 0.00 0.00 23.12 20.20 1orw s ALA 261 CO 0.00 -1.79 1.76 -2.00 0.00 0.00 0.00 175.76 173.74 1orw s GLU 262 N -5.58 4.16 0.41 0.00 2.56 -1.26 -4.84 118.70 114.16 1orw s GLU 262 Ca 0.65 2.46 -0.01 0.00 0.00 0.00 0.00 54.97 58.07 1orw s GLU 262 Cb -0.09 -3.69 -0.03 0.00 2.00 0.00 0.00 34.13 32.32 1orw s GLU 262 CO 0.49 -0.81 0.65 -0.80 -0.56 0.00 0.00 175.26 174.23 1orw s ASN 263 N 2.85 6.17 0.52 -1.70 0.01 -1.26 -4.35 114.94 117.18 1orw s ASN 263 Ca 0.79 0.57 -0.19 0.00 -0.71 0.00 0.00 52.86 53.31 1orw s ASN 263 Cb -0.42 -1.99 -0.07 0.00 0.41 0.00 0.00 41.25 39.18 1orw s ASN 263 CO 0.35 -0.48 1.04 -2.16 -1.51 0.00 0.00 177.10 174.34 1orw s PRO 264 N -4.51 3.66 0.25 -0.60 0.04 -1.26 -4.75 135.00 127.83 1orw s PRO 264 Ca 0.44 1.30 0.07 0.00 0.04 0.00 0.00 61.00 62.85 1orw s PRO 264 Cb -0.10 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 1orw s PRO 264 CO 0.39 -0.54 0.25 0.95 0.04 0.00 0.00 177.00 178.09 1orw s THR 265 N -2.14 4.61 0.16 1.26 -4.23 -0.60 -4.91 115.64 109.78 1orw s THR 265 Ca 0.66 -1.29 0.06 0.00 -1.18 0.00 0.00 61.69 59.95 1orw s THR 265 Cb -0.16 -3.51 -0.04 0.00 1.34 0.00 0.00 72.50 70.12 1orw s THR 265 CO 0.25 -0.33 -0.14 0.54 -0.54 0.00 0.00 174.62 174.40 1orw s VAL 266 N -2.10 1.47 -0.10 2.29 0.11 -1.26 -0.87 120.40 119.93 1orw s VAL 266 Ca 0.34 -1.97 -0.04 0.00 -2.93 0.00 0.00 61.98 57.38 1orw s VAL 266 Cb -0.08 -1.79 0.05 0.00 -1.53 0.00 0.00 36.38 33.03 1orw s VAL 266 CO 0.26 -0.54 0.21 -0.54 -3.33 0.00 0.00 175.10 171.17 1orw s LYS 267 N -3.22 0.10 -0.12 1.54 1.02 -0.42 -4.96 119.74 113.68 1orw s LYS 267 Ca 0.15 0.62 -0.12 0.00 0.02 0.00 0.00 55.97 56.64 1orw s LYS 267 Cb -0.02 -0.15 -0.05 0.00 -0.52 0.00 0.00 37.83 37.09 1orw s LYS 267 CO 0.04 -0.27 0.27 0.12 -0.92 0.00 0.00 175.35 174.59 1orw s PHE 268 N 2.12 3.54 0.03 3.18 5.36 -1.26 -0.74 117.98 130.20 1orw s PHE 268 Ca -0.00 0.63 0.04 0.00 -0.96 0.00 0.00 56.93 56.65 1orw s PHE 268 Cb -0.12 -2.22 -0.02 0.00 -0.34 0.00 0.00 43.02 40.32 1orw s PHE 268 CO -0.07 0.44 -0.13 -0.06 -1.46 0.00 0.00 175.22 173.93 1orw s PHE 269 N -0.18 1.17 -0.13 10.12 0.40 0.00 -1.79 117.98 127.57 1orw s PHE 269 Ca 0.17 -0.32 0.01 0.00 -0.60 0.00 0.00 56.93 56.19 1orw s PHE 269 Cb -0.13 -0.71 -0.00 0.00 0.51 0.00 0.00 43.02 42.68 1orw s PHE 269 CO 0.05 0.02 -0.17 0.08 0.70 0.00 0.00 175.22 175.90 1orw s VAL 270 N -0.72 2.56 -0.14 -0.44 1.01 -0.06 -0.67 120.40 121.93 1orw s VAL 270 Ca 0.02 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 1orw s VAL 270 Cb -0.07 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 1orw s VAL 270 CO 0.01 0.53 -0.11 -0.69 0.00 0.00 0.00 175.10 174.83 1orw s VAL 271 N 0.60 3.13 -0.68 2.92 1.01 -0.03 -1.00 120.40 126.35 1orw s VAL 271 Ca -0.10 -0.62 -0.25 0.00 0.00 0.00 0.00 61.98 61.01 1orw s VAL 271 Cb -0.16 -2.33 0.05 0.00 0.00 0.00 0.00 36.38 33.94 1orw s VAL 271 CO 0.03 0.51 1.10 -0.62 0.00 0.00 0.00 175.10 176.13 1orw s ASP 272 N 0.49 6.19 0.00 3.32 3.68 -0.43 -0.04 116.67 129.88 1orw s ASP 272 Ca -0.08 -0.69 0.16 0.00 2.13 0.00 0.00 52.55 54.07 1orw s ASP 272 Cb -0.16 -2.48 0.71 0.00 -1.45 0.00 0.00 42.92 39.54 1orw s ASP 272 CO 0.04 -1.60 1.53 0.35 0.13 0.00 0.00 175.17 175.62 1orw n THR 273 N 6.16 0.86 0.10 1.71 -2.24 -0.20 -3.42 114.28 117.24 1orw n THR 273 Ca -0.00 0.21 0.01 0.00 -2.27 0.00 0.00 64.05 62.00 1orw n THR 273 Cb 0.47 -0.93 0.34 0.00 -2.10 0.00 0.00 70.33 68.11 1orw n THR 273 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1orw h ARG 274 N 0.00 0.28 -0.64 -0.78 3.08 -1.90 -2.80 114.38 111.62 1orw h ARG 274 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1orw h ARG 274 Cb 0.28 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1orw h ARG 274 CO 0.00 0.45 0.00 0.25 -1.07 0.00 0.00 179.97 179.60 1orw n THR 275 N -4.23 1.74 -2.08 2.04 -2.24 -1.22 -4.92 114.28 103.37 1orw n THR 275 Ca -0.01 -1.07 -0.43 0.00 -2.27 0.00 0.00 64.05 60.28 1orw n THR 275 Cb 0.30 0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.53 1orw n THR 275 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1orw s LEU 276 N -1.79 3.75 -0.14 3.22 1.43 -1.06 -4.82 118.68 119.28 1orw s LEU 276 Ca 0.46 1.48 -0.18 0.00 -1.03 0.00 0.00 54.13 54.86 1orw s LEU 276 Cb 0.30 -3.53 0.05 0.00 0.03 0.00 0.00 46.19 43.04 1orw s LEU 276 CO 0.21 -1.42 0.48 -0.55 0.23 0.00 0.00 176.35 175.30 1orw s SER 277 N 4.84 -0.47 0.38 2.29 0.15 -1.26 -5.03 113.70 114.60 1orw s SER 277 Ca 0.74 0.78 0.21 0.00 0.70 0.00 0.00 55.95 58.38 1orw s SER 277 Cb -0.24 0.82 1.26 0.00 -1.71 0.00 0.00 66.02 66.15 1orw s SER 277 CO 0.31 -0.27 1.63 1.55 1.20 0.00 0.00 173.24 177.66 1orw h PRO 278 N 4.81 0.17 -0.56 5.44 0.13 -1.98 0.34 132.00 140.34 1orw h PRO 278 Ca -0.28 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1orw h PRO 278 Cb 1.17 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1orw h PRO 278 CO 0.26 0.11 0.00 0.09 -0.23 0.00 0.00 178.00 178.23 1orw n ASN 279 N -4.98 4.70 -4.55 1.44 3.02 -1.26 -4.93 115.26 108.70 1orw n ASN 279 Ca 0.35 -2.59 -0.30 0.00 -0.03 0.00 0.00 54.58 52.01 1orw n ASN 279 Cb 1.19 -0.57 -0.11 0.00 -0.61 0.00 0.00 39.78 39.69 1orw n ASN 279 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1orw s ALA 280 N -2.10 2.87 0.94 5.41 0.00 0.12 -5.13 121.76 123.88 1orw s ALA 280 Ca 0.48 -1.20 -0.15 0.00 0.00 0.00 0.00 51.96 51.09 1orw s ALA 280 Cb 0.33 -0.89 0.17 0.00 0.00 0.00 0.00 23.12 22.73 1orw s ALA 280 CO 0.20 0.62 1.26 -1.54 0.00 0.00 0.00 175.76 176.30 1orw s SER 281 N -1.90 3.34 -0.16 0.00 1.04 -1.26 -4.58 113.70 110.17 1orw s SER 281 Ca 0.19 0.48 -0.17 0.00 0.48 0.00 0.00 55.95 56.93 1orw s SER 281 Cb -0.11 -0.69 -0.04 0.00 0.10 0.00 0.00 66.02 65.28 1orw s SER 281 CO 0.11 -2.61 0.42 -0.69 0.98 0.00 0.00 173.24 171.44 1orw s VAL 282 N -3.70 5.21 -0.37 5.02 1.01 -1.26 -4.77 120.40 121.54 1orw s VAL 282 Ca 0.70 0.80 -0.20 0.00 0.00 0.00 0.00 61.98 63.27 1orw s VAL 282 Cb -0.07 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1orw s VAL 282 CO 0.52 0.30 0.61 -0.89 0.00 0.00 0.00 175.10 175.64 1orw s THR 283 N 0.94 4.90 0.11 3.92 2.01 -1.26 -5.02 115.64 121.24 1orw s THR 283 Ca 0.22 0.47 -0.13 0.00 0.31 0.00 0.00 61.69 62.55 1orw s THR 283 Cb -0.15 -4.08 0.02 0.00 0.01 0.00 0.00 72.50 68.31 1orw s THR 283 CO 0.08 -0.34 0.32 -0.94 -0.69 0.00 0.00 174.62 173.05 1orw s SER 284 N 1.82 -0.10 -0.06 3.53 1.04 -1.26 -1.32 113.70 117.35 1orw s SER 284 Ca 0.23 -0.44 0.03 0.00 0.48 0.00 0.00 55.95 56.25 1orw s SER 284 Cb -0.15 0.42 0.01 0.00 0.10 0.00 0.00 66.02 66.40 1orw s SER 284 CO 0.15 -0.80 -0.14 -0.47 0.98 0.00 0.00 173.24 172.96 1orw s TYR 285 N -3.79 1.57 -0.30 5.02 5.04 -0.17 -4.96 117.35 119.76 1orw s TYR 285 Ca 0.03 -0.54 -0.19 0.00 -2.44 0.00 0.00 57.07 53.93 1orw s TYR 285 Cb 0.03 -1.11 -0.01 0.00 0.35 0.00 0.00 41.96 41.21 1orw s TYR 285 CO -0.11 -0.25 0.55 -1.14 -1.34 0.00 0.00 175.55 173.26 1orw s GLN 286 N 0.45 3.89 -0.30 4.97 0.74 -1.26 -0.89 119.66 127.26 1orw s GLN 286 Ca -0.11 0.17 -0.18 0.00 0.05 0.00 0.00 55.36 55.29 1orw s GLN 286 Cb -0.14 -3.72 -0.02 0.00 1.10 0.00 0.00 33.01 30.23 1orw s GLN 286 CO 0.04 -0.50 0.52 0.42 -0.55 0.00 0.00 175.29 175.21 1orw s ILE 287 N 2.43 5.04 0.39 -2.34 1.01 -0.74 -5.00 121.20 121.98 1orw s ILE 287 Ca 0.22 0.64 -0.03 0.00 0.00 0.00 0.00 60.65 61.47 1orw s ILE 287 Cb -0.15 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 1orw s ILE 287 CO 0.11 -0.06 0.64 0.68 0.00 0.00 0.00 174.94 176.31 1orw s VAL 288 N 2.36 5.01 0.72 2.92 -7.23 -1.26 -4.28 120.40 118.65 1orw s VAL 288 Ca 0.20 -0.11 -0.11 0.00 -1.81 0.00 0.00 61.98 60.15 1orw s VAL 288 Cb -0.15 -3.84 0.02 0.00 0.56 0.00 0.00 36.38 32.97 1orw s VAL 288 CO 0.11 -0.62 1.07 -2.16 -0.31 0.00 0.00 175.10 173.19 1orw s PRO 289 N -4.32 2.74 0.56 4.82 0.04 -1.26 -4.99 135.00 132.58 1orw s PRO 289 Ca 0.43 0.82 -0.20 0.00 0.04 0.00 0.00 61.00 62.09 1orw s PRO 289 Cb -0.10 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 1orw s PRO 289 CO 0.38 -1.20 1.05 -2.30 0.04 0.00 0.00 177.00 174.96 1orw n PRO 290 N -3.18 1.13 -0.21 0.56 -0.02 -1.26 -4.44 135.00 127.58 1orw n PRO 290 Ca 0.07 0.42 0.22 0.00 -2.02 0.00 0.00 63.50 62.20 1orw n PRO 290 Cb 0.55 -2.22 0.59 0.00 -0.02 0.00 0.00 33.50 32.39 1orw n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1orw h ALA 291 N 0.85 2.42 0.00 3.55 0.00 -1.97 0.11 119.26 124.23 1orw h ALA 291 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1orw h ALA 291 Cb 1.35 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1orw h ALA 291 CO 0.53 -0.69 0.00 -1.13 0.00 0.00 0.00 179.25 177.96 1orw n SER 292 N -4.43 0.59 -0.05 0.00 3.41 -1.26 -2.85 113.62 109.02 1orw n SER 292 Ca 0.18 0.72 -0.09 0.00 -0.26 0.00 0.00 58.87 59.42 1orw n SER 292 Cb 0.77 -0.82 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 1orw n SER 292 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1orw n VAL 293 N -2.23 0.55 0.26 -3.33 0.31 0.27 -4.58 118.33 109.57 1orw n VAL 293 Ca -0.00 -0.17 0.10 0.00 -0.01 0.00 0.00 64.34 64.26 1orw n VAL 293 Cb 0.11 -1.32 0.51 0.00 -0.91 0.00 0.00 33.84 32.24 1orw n VAL 293 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1orw h LEU 294 N -0.22 0.00 -1.24 7.52 6.46 -1.24 -1.97 115.31 124.62 1orw h LEU 294 Ca -0.24 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.55 1orw h LEU 294 Cb 1.26 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.15 1orw h LEU 294 CO -0.11 0.00 0.52 -0.29 -0.62 0.00 0.00 178.44 177.95 1orw h ILE 295 N 0.00 1.14 -1.89 4.05 2.10 -1.77 -3.46 117.51 117.68 1orw h ILE 295 Ca 0.00 -0.34 0.00 0.00 1.08 0.00 0.00 64.86 65.60 1orw h ILE 295 Cb 0.80 0.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.59 1orw h ILE 295 CO 0.00 0.18 0.00 0.61 -1.08 0.00 0.00 178.15 177.86 1orw n GLY 296 N -1.42 4.81 3.75 8.18 0.00 -0.74 -5.12 105.19 114.64 1orw n GLY 296 Ca 0.10 -1.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 1orw n GLY 296 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1orw n ASP 297 N -1.41 2.97 -2.76 1.61 8.00 -1.26 -4.93 116.55 118.78 1orw n ASP 297 Ca 0.00 1.07 -0.11 0.00 0.71 0.00 0.00 54.79 56.46 1orw n ASP 297 Cb 0.00 -1.58 -0.00 0.00 -0.02 0.00 0.00 41.12 39.52 1orw n ASP 297 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1orw n HIS 298 N -0.51 -1.83 -3.82 1.24 1.44 -1.26 -1.64 115.22 108.84 1orw n HIS 298 Ca 0.07 -1.97 -0.13 0.00 -2.01 0.00 0.00 57.72 53.69 1orw n HIS 298 Cb 0.42 0.69 -0.14 0.00 0.12 0.00 0.00 29.99 31.08 1orw n HIS 298 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 1orw s TYR 299 N -2.88 -0.05 -0.04 -1.40 2.02 -0.23 -4.82 117.35 109.94 1orw s TYR 299 Ca 0.21 0.19 -0.26 0.00 -0.37 0.00 0.00 57.07 56.84 1orw s TYR 299 Cb -0.03 -0.06 -0.03 0.00 -0.40 0.00 0.00 41.96 41.44 1orw s TYR 299 CO 0.15 -0.06 0.80 -1.17 -1.57 0.00 0.00 175.55 173.70 1orw s LEU 300 N 0.47 4.34 0.00 -1.29 2.96 -1.26 -1.38 118.68 122.52 1orw s LEU 300 Ca -0.04 1.36 0.00 0.00 -0.22 0.00 0.00 54.13 55.23 1orw s LEU 300 Cb -0.05 -3.26 0.00 0.00 0.50 0.00 0.00 46.19 43.38 1orw s LEU 300 CO -0.02 -0.17 0.54 0.00 -1.32 0.00 0.00 176.35 175.38 1orw s GLY 302 N -0.29 -0.28 -0.05 0.00 0.00 -0.94 -4.90 107.32 100.86 1orw s GLY 302 Ca 0.00 2.48 -0.01 0.00 0.00 0.00 0.00 44.72 47.18 1orw s GLY 302 CO 0.00 1.82 0.03 0.14 0.00 0.00 0.00 173.10 175.10 1orw s VAL 303 N 0.31 0.11 -0.06 1.40 1.01 -1.26 -0.67 120.40 121.24 1orw s VAL 303 Ca 0.02 0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.27 1orw s VAL 303 Cb -0.05 -0.31 0.02 0.00 0.00 0.00 0.00 36.38 36.04 1orw s VAL 303 CO -0.04 0.21 -0.05 -0.89 0.00 0.00 0.00 175.10 174.32 1orw s THR 304 N 1.95 0.67 -0.09 3.92 2.01 0.53 -4.98 115.64 119.65 1orw s THR 304 Ca 0.03 -0.15 -0.26 0.00 0.31 0.00 0.00 61.69 61.62 1orw s THR 304 Cb -0.12 -0.70 -0.03 0.00 0.01 0.00 0.00 72.50 71.66 1orw s THR 304 CO -0.04 0.27 0.83 0.26 -0.69 0.00 0.00 174.62 175.25 1orw s TRP 305 N 1.21 3.53 -0.22 4.92 0.52 -1.26 0.11 118.94 127.75 1orw s TRP 305 Ca -0.06 1.37 -0.18 0.00 0.02 0.00 0.00 56.10 57.25 1orw s TRP 305 Cb -0.14 -2.97 -0.15 0.00 -1.15 0.00 0.00 33.47 29.06 1orw s TRP 305 CO -0.02 -0.07 -0.03 0.28 0.02 0.00 0.00 176.95 177.13 1orw n VAL 306 N 4.20 1.52 -3.73 4.03 0.31 0.30 -4.93 118.33 120.02 1orw n VAL 306 Ca 0.03 -0.10 -0.10 0.00 -0.01 0.00 0.00 64.34 64.16 1orw n VAL 306 Cb 0.50 -2.04 -0.05 0.00 -0.91 0.00 0.00 33.84 31.34 1orw n VAL 306 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1orw s THR 307 N -2.42 0.06 0.12 2.52 -4.23 -0.92 -4.79 115.64 105.96 1orw s THR 307 Ca -0.31 -0.80 0.09 0.00 -1.18 0.00 0.00 61.69 59.50 1orw s THR 307 Cb 0.08 -1.43 0.09 0.00 1.34 0.00 0.00 72.50 72.58 1orw s THR 307 CO 0.52 -0.25 1.13 -0.62 -0.54 0.00 0.00 174.62 174.85 1orw n GLU 308 N -0.26 0.07 0.00 3.99 -0.58 -1.26 -0.20 120.64 122.39 1orw n GLU 308 Ca -0.12 0.54 0.00 0.00 -0.42 0.00 0.00 57.16 57.16 1orw n GLU 308 Cb 0.63 -2.15 0.00 0.00 -0.57 0.00 0.00 31.44 29.35 1orw n GLU 308 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1orw n GLU 309 N -1.96 1.44 -3.75 3.49 1.02 -1.26 -4.90 120.64 114.72 1orw n GLU 309 Ca -0.01 -1.07 -0.23 0.00 -0.02 0.00 0.00 57.16 55.83 1orw n GLU 309 Cb 0.45 -0.96 -0.18 0.00 -0.02 0.00 0.00 31.44 30.74 1orw n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1orw s ARG 310 N -0.59 0.48 -0.00 3.49 3.52 0.72 0.22 118.95 126.78 1orw s ARG 310 Ca 0.00 0.13 0.08 0.00 -0.13 0.00 0.00 55.73 55.81 1orw s ARG 310 Cb 0.00 -0.96 -0.02 0.00 -1.56 0.00 0.00 34.95 32.41 1orw s ARG 310 CO 0.00 -0.33 -0.24 -1.50 -0.81 0.00 0.00 175.30 172.42 1orw s ILE 311 N 2.01 2.22 -0.38 4.11 2.07 -0.58 -0.53 121.20 130.12 1orw s ILE 311 Ca 0.05 -1.16 -0.06 0.00 -1.41 0.00 0.00 60.65 58.07 1orw s ILE 311 Cb -0.12 -1.81 0.07 0.00 0.13 0.00 0.00 42.46 40.72 1orw s ILE 311 CO -0.05 0.51 0.17 -0.55 -1.91 0.00 0.00 174.94 173.11 1orw s SER 312 N -0.85 5.37 -0.16 4.50 0.15 0.30 -1.29 113.70 121.71 1orw s SER 312 Ca 0.11 -1.48 -0.10 0.00 0.70 0.00 0.00 55.95 55.18 1orw s SER 312 Cb -0.10 -1.88 -0.05 0.00 -1.71 0.00 0.00 66.02 62.28 1orw s SER 312 CO 0.00 -0.44 0.18 -0.76 1.20 0.00 0.00 173.24 173.42 1orw s LEU 313 N 1.34 4.28 -0.25 3.45 1.43 -0.25 -0.35 118.68 128.33 1orw s LEU 313 Ca 0.02 0.39 -0.02 0.00 -1.03 0.00 0.00 54.13 53.49 1orw s LEU 313 Cb -0.22 -2.17 0.03 0.00 0.03 0.00 0.00 46.19 43.86 1orw s LEU 313 CO 0.01 0.24 -0.06 -1.58 0.23 0.00 0.00 176.35 175.18 1orw s GLN 314 N -0.10 2.85 0.25 1.70 0.74 0.15 0.51 119.66 125.76 1orw s GLN 314 Ca 0.13 -0.97 0.09 0.00 0.05 0.00 0.00 55.36 54.65 1orw s GLN 314 Cb -0.12 -2.98 -0.04 0.00 1.10 0.00 0.00 33.01 30.97 1orw s GLN 314 CO 0.02 -0.39 0.05 -1.58 -0.55 0.00 0.00 175.29 172.83 1orw s TRP 315 N 1.33 2.83 -0.06 1.67 0.52 -0.42 -0.94 118.94 123.87 1orw s TRP 315 Ca 0.00 -0.18 -0.06 0.00 0.02 0.00 0.00 56.10 55.89 1orw s TRP 315 Cb -0.17 -1.28 0.02 0.00 -1.15 0.00 0.00 33.47 30.89 1orw s TRP 315 CO -0.05 0.58 0.16 -1.50 0.02 0.00 0.00 176.95 176.17 1orw s ILE 316 N -2.18 -0.00 0.80 2.03 2.07 -0.48 -0.28 121.20 123.16 1orw s ILE 316 Ca 0.31 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.45 1orw s ILE 316 Cb -0.07 -0.24 0.07 0.00 0.13 0.00 0.00 42.46 42.35 1orw s ILE 316 CO 0.21 0.00 1.09 -0.13 -1.91 0.00 0.00 174.94 174.20 1orw s ARG 317 N 0.09 2.06 0.27 3.50 0.52 -0.57 -1.07 118.95 123.75 1orw s ARG 317 Ca -0.00 1.11 -0.00 0.00 -0.52 0.00 0.00 55.73 56.32 1orw s ARG 317 Cb -0.01 -1.88 0.52 0.00 0.52 0.00 0.00 34.95 34.10 1orw s ARG 317 CO 0.00 -1.77 1.82 -0.09 0.02 0.00 0.00 175.30 175.28 1orw h ARG 318 N -1.22 0.87 -0.03 3.54 2.43 -1.63 0.50 114.38 118.84 1orw h ARG 318 Ca -0.45 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 58.68 1orw h ARG 318 Cb 1.24 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1orw h ARG 318 CO 0.52 0.58 0.03 0.00 -1.51 0.00 0.00 179.97 179.58 1orw h ALA 319 N 1.53 1.91 -1.69 2.80 0.00 -1.92 -3.44 119.26 118.44 1orw h ALA 319 Ca 0.48 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 55.13 1orw h ALA 319 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1orw h ALA 319 CO -0.28 -0.04 -0.32 1.04 0.00 0.00 0.00 179.25 179.65 1orw n GLN 320 N -4.34 -1.00 -0.05 0.00 6.02 0.17 -4.57 117.38 113.61 1orw n GLN 320 Ca -0.02 0.64 0.03 0.00 -0.01 0.00 0.00 57.00 57.65 1orw n GLN 320 Cb 0.12 -4.83 0.05 0.00 1.02 0.00 0.00 30.24 26.60 1orw n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1orw n ASN 321 N -0.38 1.88 -3.42 1.08 0.23 -1.26 -2.07 115.26 111.32 1orw n ASN 321 Ca -0.15 -2.30 -0.14 0.00 -0.53 0.00 0.00 54.58 51.46 1orw n ASN 321 Cb 0.60 -0.16 -0.10 0.00 -2.08 0.00 0.00 39.78 38.04 1orw n ASN 321 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1orw s TYR 322 N -1.52 -0.55 0.06 -2.53 6.14 -1.26 -0.81 117.35 116.87 1orw s TYR 322 Ca 0.11 0.46 0.07 0.00 0.64 0.00 0.00 57.07 58.35 1orw s TYR 322 Cb 0.10 -0.20 -0.03 0.00 0.42 0.00 0.00 41.96 42.25 1orw s TYR 322 CO 0.01 -0.69 -0.19 -1.54 0.64 0.00 0.00 175.55 173.78 1orw s SER 323 N 2.43 2.29 -0.04 4.32 1.04 0.16 -1.51 113.70 122.39 1orw s SER 323 Ca 0.10 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 55.97 1orw s SER 323 Cb -0.15 -0.16 0.02 0.00 0.10 0.00 0.00 66.02 65.83 1orw s SER 323 CO -0.16 0.09 -0.03 -0.51 0.98 0.00 0.00 173.24 173.61 1orw s ILE 324 N -0.95 0.45 -0.15 -1.02 2.07 0.62 0.18 121.20 122.39 1orw s ILE 324 Ca 0.05 -0.07 -0.20 0.00 -1.41 0.00 0.00 60.65 59.02 1orw s ILE 324 Cb -0.09 -0.50 -0.03 0.00 0.13 0.00 0.00 42.46 41.97 1orw s ILE 324 CO 0.02 0.21 0.60 -0.63 -1.91 0.00 0.00 174.94 173.23 1orw s ILE 325 N 0.97 5.07 -0.24 2.00 1.01 -0.37 -1.30 121.20 128.34 1orw s ILE 325 Ca -0.10 1.16 0.01 0.00 0.00 0.00 0.00 60.65 61.72 1orw s ILE 325 Cb -0.14 -3.93 0.04 0.00 0.01 0.00 0.00 42.46 38.44 1orw s ILE 325 CO -0.00 0.19 -0.12 -0.62 0.00 0.00 0.00 174.94 174.39 1orw s ASP 326 N 0.99 4.07 -0.44 3.58 2.15 0.18 -1.71 116.67 125.49 1orw s ASP 326 Ca 0.29 -1.04 -0.17 0.00 0.43 0.00 0.00 52.55 52.06 1orw s ASP 326 Cb -0.16 -1.57 0.04 0.00 -0.30 0.00 0.00 42.92 40.93 1orw s ASP 326 CO 0.12 -0.12 0.43 -0.63 -0.17 0.00 0.00 175.17 174.80 1orw s ILE 327 N 1.22 5.11 -0.09 4.11 1.01 -1.16 -1.09 121.20 130.32 1orw s ILE 327 Ca -0.02 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.03 1orw s ILE 327 Cb -0.17 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 1orw s ILE 327 CO -0.07 -0.49 0.06 0.00 0.00 0.00 0.00 174.94 174.44 1orw s ASP 329 N -1.04 4.99 0.10 0.00 1.01 0.25 -1.52 116.67 120.47 1orw s ASP 329 Ca 0.15 0.02 -0.30 0.00 0.71 0.00 0.00 52.55 53.12 1orw s ASP 329 Cb -0.12 -1.31 -0.06 0.00 1.01 0.00 0.00 42.92 42.44 1orw s ASP 329 CO 0.04 0.33 1.12 -0.47 0.21 0.00 0.00 175.17 176.40 1orw s TYR 330 N -0.96 3.55 -0.50 4.23 5.04 0.13 -0.29 117.35 128.55 1orw s TYR 330 Ca 0.16 1.50 -0.09 0.00 -2.44 0.00 0.00 57.07 56.20 1orw s TYR 330 Cb -0.11 -3.30 0.13 0.00 0.35 0.00 0.00 41.96 39.02 1orw s TYR 330 CO 0.06 -0.77 0.37 0.34 -1.34 0.00 0.00 175.55 174.22 1orw s ASP 331 N 0.51 5.71 0.46 4.32 2.15 0.19 -4.95 116.67 125.07 1orw s ASP 331 Ca 0.53 -2.05 0.27 0.00 0.43 0.00 0.00 52.55 51.73 1orw s ASP 331 Cb -0.28 -2.00 1.31 0.00 -0.30 0.00 0.00 42.92 41.65 1orw s ASP 331 CO 0.32 -0.65 1.79 -0.33 -0.17 0.00 0.00 175.17 176.12 1orw h GLU 332 N 8.27 0.20 0.00 4.34 5.08 -1.95 -0.06 114.58 130.47 1orw h GLU 332 Ca -0.17 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1orw h GLU 332 Cb 1.06 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1orw h GLU 332 CO 0.84 0.13 0.00 -1.13 -1.00 0.00 0.00 179.01 177.85 1orw n SER 333 N -4.44 0.00 0.00 1.42 3.41 -1.26 -4.26 113.62 108.49 1orw n SER 333 Ca 0.25 0.33 0.00 0.00 -0.26 0.00 0.00 58.87 59.20 1orw n SER 333 Cb 1.04 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 1orw n SER 333 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1orw n THR 334 N -1.44 0.00 0.00 6.66 -2.24 -0.59 -5.02 114.28 111.64 1orw n THR 334 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1orw n THR 334 Cb 0.31 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1orw n THR 334 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1orw n GLY 335 N 1.57 1.09 3.77 3.38 0.00 -0.14 -5.06 105.19 109.80 1orw n GLY 335 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1orw n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1orw s ARG 336 N -0.88 2.71 -0.27 1.61 0.52 -1.25 -4.78 118.95 116.61 1orw s ARG 336 Ca 0.00 1.39 0.00 0.00 -0.52 0.00 0.00 55.73 56.61 1orw s ARG 336 Cb 0.00 -1.94 0.05 0.00 0.52 0.00 0.00 34.95 33.58 1orw s ARG 336 CO 0.00 -1.32 -0.07 -1.58 0.02 0.00 0.00 175.30 172.35 1orw s TRP 337 N -2.37 3.20 0.05 -0.53 0.52 -1.26 -0.64 118.94 117.92 1orw s TRP 337 Ca 0.67 -1.99 0.00 0.00 0.02 0.00 0.00 56.10 54.80 1orw s TRP 337 Cb -0.21 -2.02 -0.04 0.00 -1.15 0.00 0.00 33.47 30.06 1orw s TRP 337 CO 0.43 -0.82 0.19 0.42 0.02 0.00 0.00 176.95 177.19 1orw s ILE 338 N 1.21 5.30 0.25 2.03 1.01 0.61 -4.82 121.20 126.78 1orw s ILE 338 Ca -0.05 -0.41 0.11 0.00 0.00 0.00 0.00 60.65 60.30 1orw s ILE 338 Cb -0.19 -3.57 -0.05 0.00 0.01 0.00 0.00 42.46 38.66 1orw s ILE 338 CO -0.04 0.16 -0.19 -0.94 0.00 0.00 0.00 174.94 173.93 1orw s SER 339 N -2.43 3.34 -0.09 3.58 1.04 -1.26 -0.58 113.70 117.29 1orw s SER 339 Ca 0.34 -1.01 -0.11 0.00 0.48 0.00 0.00 55.95 55.65 1orw s SER 339 Cb -0.13 -0.26 0.03 0.00 0.10 0.00 0.00 66.02 65.76 1orw s SER 339 CO 0.26 0.00 0.29 -0.94 0.98 0.00 0.00 173.24 173.84 1orw s SER 340 N -3.37 -0.28 0.42 7.02 1.04 -1.26 -5.03 113.70 112.24 1orw s SER 340 Ca 0.27 0.49 0.20 0.00 0.48 0.00 0.00 55.95 57.39 1orw s SER 340 Cb -0.04 0.55 1.13 0.00 0.10 0.00 0.00 66.02 67.76 1orw s SER 340 CO 0.13 -0.17 1.82 0.58 0.98 0.00 0.00 173.24 176.58 1orw h VAL 341 N 4.54 0.59 -0.59 5.02 2.07 -1.98 0.14 116.25 126.03 1orw h VAL 341 Ca -0.27 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.16 1orw h VAL 341 Cb 1.19 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1orw h VAL 341 CO 0.33 0.07 0.39 0.00 0.02 0.00 0.00 177.57 178.38 1orw h ALA 342 N 1.60 1.69 -0.33 1.67 0.00 -1.95 -1.62 119.26 120.31 1orw h ALA 342 Ca 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1orw h ALA 342 Cb 1.40 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1orw h ALA 342 CO -0.21 0.25 0.00 0.54 0.00 0.00 0.00 179.25 179.83 1orw n ARG 343 N -4.46 2.52 -4.33 0.00 1.74 0.47 -3.91 116.66 108.70 1orw n ARG 343 Ca 0.07 -1.52 -0.35 0.00 -0.77 0.00 0.00 57.85 55.28 1orw n ARG 343 Cb 0.13 -1.64 -0.10 0.00 -1.02 0.00 0.00 32.46 29.84 1orw n ARG 343 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1orw s GLN 344 N -1.73 3.19 -0.22 5.56 -0.21 -0.61 -2.98 119.66 122.66 1orw s GLN 344 Ca 0.27 -0.41 0.00 0.00 0.02 0.00 0.00 55.36 55.24 1orw s GLN 344 Cb 0.18 -2.86 0.06 0.00 1.00 0.00 0.00 33.01 31.38 1orw s GLN 344 CO 0.12 0.60 -0.05 -1.01 -2.12 0.00 0.00 175.29 172.83 1orw s HIS 345 N -0.59 2.18 0.18 0.91 3.76 -0.70 -4.81 115.29 116.23 1orw s HIS 345 Ca 0.10 -1.56 -0.20 0.00 -0.15 0.00 0.00 55.06 53.24 1orw s HIS 345 Cb -0.12 -1.50 -0.08 0.00 1.11 0.00 0.00 32.58 31.99 1orw s HIS 345 CO 0.02 -0.73 0.70 0.42 -0.85 0.00 0.00 174.74 174.30 1orw s ILE 346 N 1.47 4.57 -0.05 0.60 1.01 -1.26 -1.24 121.20 126.30 1orw s ILE 346 Ca -0.04 1.33 -0.00 0.00 0.00 0.00 0.00 60.65 61.94 1orw s ILE 346 Cb -0.18 -3.92 0.03 0.00 0.01 0.00 0.00 42.46 38.40 1orw s ILE 346 CO -0.07 0.33 -0.01 -0.70 0.00 0.00 0.00 174.94 174.50 1orw s GLU 347 N -1.66 0.55 0.01 2.79 2.12 0.13 -4.99 118.70 117.64 1orw s GLU 347 Ca 0.39 0.07 -0.01 0.00 0.36 0.00 0.00 54.97 55.78 1orw s GLU 347 Cb -0.18 -0.80 -0.01 0.00 0.26 0.00 0.00 34.13 33.40 1orw s GLU 347 CO 0.22 -0.21 -0.01 0.96 -0.54 0.00 0.00 175.26 175.68 1orw s ILE 348 N 1.50 0.08 -0.13 -3.70 -4.36 -1.26 0.37 121.20 113.71 1orw s ILE 348 Ca -0.02 -0.70 0.02 0.00 -0.26 0.00 0.00 60.65 59.68 1orw s ILE 348 Cb -0.13 -0.22 -0.00 0.00 1.25 0.00 0.00 42.46 43.35 1orw s ILE 348 CO -0.03 -0.39 -0.19 -0.55 0.24 0.00 0.00 174.94 174.03 1orw s SER 349 N -1.14 3.48 -0.01 4.36 0.15 0.01 -4.98 113.70 115.56 1orw s SER 349 Ca -0.13 -0.48 0.22 0.00 0.70 0.00 0.00 55.95 56.26 1orw s SER 349 Cb -0.08 -1.51 -0.30 0.00 -1.71 0.00 0.00 66.02 62.43 1orw s SER 349 CO -0.01 0.13 0.55 0.35 1.20 0.00 0.00 173.24 175.46 1orw n THR 350 N 3.76 0.06 0.64 6.45 -2.24 -1.26 -4.32 114.28 117.37 1orw n THR 350 Ca -0.19 -0.49 0.07 0.00 -2.27 0.00 0.00 64.05 61.17 1orw n THR 350 Cb 0.52 -0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1orw n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1orw n THR 351 N -2.28 0.00 0.00 4.28 -2.24 -1.26 -5.06 114.28 107.72 1orw n THR 351 Ca -0.03 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1orw n THR 351 Cb 0.56 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.96 1orw n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1orw n GLY 352 N 1.08 0.91 3.47 3.38 0.00 -1.26 -4.82 105.19 107.96 1orw n GLY 352 Ca 0.06 0.34 -0.24 0.00 0.00 0.00 0.00 46.02 46.18 1orw n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1orw s TRP 353 N 2.06 2.22 0.23 1.61 -2.14 -1.26 -4.67 118.94 116.99 1orw s TRP 353 Ca 0.00 -0.45 -0.30 0.00 2.66 0.00 0.00 56.10 58.01 1orw s TRP 353 Cb 0.00 -1.10 -0.09 0.00 -3.10 0.00 0.00 33.47 29.18 1orw s TRP 353 CO 0.00 0.59 1.11 0.08 -2.66 0.00 0.00 176.95 176.07 1orw s VAL 354 N -2.65 3.63 0.18 -0.66 1.01 -0.88 -4.80 120.40 116.23 1orw s VAL 354 Ca 0.30 1.52 0.00 0.00 0.00 0.00 0.00 61.98 63.80 1orw s VAL 354 Cb -0.01 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.40 1orw s VAL 354 CO 0.14 0.31 0.00 0.61 0.00 0.00 0.00 175.10 176.16 1orw n GLY 355 N 1.61 -1.63 0.12 4.51 0.00 -1.26 -3.91 105.19 104.63 1orw n GLY 355 Ca 0.01 -1.15 -0.03 0.00 0.00 0.00 0.00 46.02 44.84 1orw n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1orw h ARG 356 N 0.00 -0.21 -0.00 1.61 3.08 -1.92 -3.41 114.38 113.53 1orw h ARG 356 Ca 0.02 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1orw h ARG 356 Cb 0.72 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1orw h ARG 356 CO 0.01 -0.14 -0.01 1.19 -1.07 0.00 0.00 179.97 179.95 1orw n PHE 357 N -4.56 0.00 -3.60 3.04 3.72 -1.26 -4.92 117.46 109.88 1orw n PHE 357 Ca -0.03 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.35 1orw n PHE 357 Cb 0.09 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.61 1orw n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1orw s ARG 358 N -0.88 0.36 0.72 -1.08 1.70 -1.26 -5.02 118.95 113.49 1orw s ARG 358 Ca 0.00 -0.16 -0.16 0.00 -0.47 0.00 0.00 55.73 54.94 1orw s ARG 358 Cb 0.00 0.15 0.02 0.00 -0.57 0.00 0.00 34.95 34.55 1orw s ARG 358 CO 0.01 -0.16 1.10 -0.35 -1.08 0.00 0.00 175.30 174.82 1orw n PRO 359 N -0.22 0.61 -2.28 3.89 -0.04 -1.25 -4.16 135.00 131.55 1orw n PRO 359 Ca -0.03 0.27 -0.34 0.00 -0.04 0.00 0.00 63.50 63.37 1orw n PRO 359 Cb 0.60 -2.35 -0.01 0.00 -0.04 0.00 0.00 33.50 31.70 1orw n PRO 359 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1orw s ALA 360 N -1.76 2.78 0.30 0.55 0.00 -1.26 -4.94 121.76 117.43 1orw s ALA 360 Ca 0.76 0.55 -0.27 0.00 0.00 0.00 0.00 51.96 53.00 1orw s ALA 360 Cb -0.35 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 1orw s ALA 360 CO 0.48 -0.60 0.97 -1.21 0.00 0.00 0.00 175.76 175.39 1orw s GLU 361 N -3.60 4.63 0.10 0.00 0.41 -1.26 -4.89 118.70 114.09 1orw s GLU 361 Ca 0.67 1.45 -0.23 0.00 -0.41 0.00 0.00 54.97 56.45 1orw s GLU 361 Cb -0.17 -2.96 -0.07 0.00 -1.78 0.00 0.00 34.13 29.15 1orw s GLU 361 CO 0.28 0.30 0.71 -1.25 -0.49 0.00 0.00 175.26 174.81 1orw s PRO 362 N -1.77 4.45 -0.41 0.39 0.04 -1.26 -4.63 135.00 131.81 1orw s PRO 362 Ca 0.48 1.00 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 1orw s PRO 362 Cb -0.23 -3.29 0.11 0.00 0.04 0.00 0.00 34.50 31.13 1orw s PRO 362 CO 0.29 0.50 0.20 -1.01 0.04 0.00 0.00 177.00 177.01 1orw s HIS 363 N -0.78 3.60 0.76 0.56 3.76 -0.28 -4.96 115.29 117.95 1orw s HIS 363 Ca 0.34 -2.45 -0.11 0.00 -0.15 0.00 0.00 55.06 52.70 1orw s HIS 363 Cb -0.21 -3.22 0.04 0.00 1.11 0.00 0.00 32.58 30.31 1orw s HIS 363 CO 0.23 -0.97 1.08 -0.06 -0.85 0.00 0.00 174.74 174.17 1orw s PHE 364 N 1.12 2.97 0.36 1.40 0.40 -1.26 -1.22 117.98 121.74 1orw s PHE 364 Ca 0.08 1.23 -0.05 0.00 -0.60 0.00 0.00 56.93 57.60 1orw s PHE 364 Cb -0.23 -3.04 -0.05 0.00 0.51 0.00 0.00 43.02 40.22 1orw s PHE 364 CO -0.04 -1.55 0.63 0.95 0.70 0.00 0.00 175.22 175.91 1orw s THR 365 N -3.13 4.98 0.40 0.64 -4.23 -1.05 -4.92 115.64 108.32 1orw s THR 365 Ca 0.60 0.07 0.24 0.00 -1.18 0.00 0.00 61.69 61.41 1orw s THR 365 Cb -0.14 -3.79 0.41 0.00 1.34 0.00 0.00 72.50 70.32 1orw s THR 365 CO 0.54 -0.51 1.61 -1.28 -0.54 0.00 0.00 174.62 174.44 1orw h SER 366 N 1.13 0.32 1.19 3.99 0.87 -1.93 0.97 113.55 120.10 1orw h SER 366 Ca -0.48 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 1orw h SER 366 Cb 1.20 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 1orw h SER 366 CO 0.64 -0.28 -0.40 -2.24 -0.53 0.00 0.00 176.83 174.02 1orw h ASP 367 N 0.09 0.00 -1.72 6.23 2.03 -1.93 -3.47 116.42 117.64 1orw h ASP 367 Ca 0.82 -0.10 -0.24 0.00 -0.73 0.00 0.00 57.03 56.78 1orw h ASP 367 Cb 2.32 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 40.81 1orw h ASP 367 CO -0.59 0.05 -0.31 0.61 -1.03 0.00 0.00 179.24 177.97 1orw n GLY 368 N 1.29 -0.13 0.47 7.15 0.00 0.34 -4.90 105.19 109.40 1orw n GLY 368 Ca 0.04 -0.38 0.10 0.00 0.00 0.00 0.00 46.02 45.78 1orw n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1orw n ASN 369 N -0.31 1.91 -3.56 1.61 5.03 -1.26 -4.86 115.26 113.82 1orw n ASN 369 Ca -0.14 -1.46 -0.08 0.00 0.87 0.00 0.00 54.58 53.77 1orw n ASN 369 Cb 0.61 0.44 -0.01 0.00 -1.02 0.00 0.00 39.78 39.80 1orw n ASN 369 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1orw s SER 370 N -2.19 -0.07 0.09 6.41 1.04 -1.26 -1.31 113.70 116.40 1orw s SER 370 Ca 0.17 -0.88 -0.26 0.00 0.48 0.00 0.00 55.95 55.45 1orw s SER 370 Cb 0.16 0.74 0.08 0.00 0.10 0.00 0.00 66.02 67.10 1orw s SER 370 CO 0.48 -1.41 0.85 0.72 0.98 0.00 0.00 173.24 174.86 1orw s PHE 371 N -3.40 -0.31 -0.10 5.02 -0.12 0.01 -2.52 117.98 116.56 1orw s PHE 371 Ca 0.16 0.09 0.02 0.00 -0.05 0.00 0.00 56.93 57.15 1orw s PHE 371 Cb -0.04 0.58 -0.01 0.00 -0.63 0.00 0.00 43.02 42.92 1orw s PHE 371 CO 0.10 -0.73 -0.17 0.71 -0.05 0.00 0.00 175.22 175.08 1orw s TYR 372 N -3.33 2.68 -0.03 3.49 1.51 -0.36 0.24 117.35 121.56 1orw s TYR 372 Ca 0.07 -0.65 -0.04 0.00 -1.01 0.00 0.00 57.07 55.44 1orw s TYR 372 Cb -0.01 -1.74 0.01 0.00 -0.11 0.00 0.00 41.96 40.10 1orw s TYR 372 CO -0.05 -0.18 0.11 0.21 -1.11 0.00 0.00 175.55 174.52 1orw s LYS 373 N 0.07 0.24 -0.07 -0.62 2.20 -0.44 -1.12 119.74 120.00 1orw s LYS 373 Ca -0.07 -0.06 -0.26 0.00 -0.36 0.00 0.00 55.97 55.22 1orw s LYS 373 Cb -0.15 0.11 -0.03 0.00 -1.51 0.00 0.00 37.83 36.24 1orw s LYS 373 CO 0.05 -0.04 0.80 0.42 -0.36 0.00 0.00 175.35 176.22 1orw s ILE 374 N -0.47 4.97 0.24 5.43 1.01 -1.26 0.22 121.20 131.33 1orw s ILE 374 Ca -0.05 1.65 -0.07 0.00 0.00 0.00 0.00 60.65 62.17 1orw s ILE 374 Cb -0.04 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 1orw s ILE 374 CO 0.00 0.18 0.34 0.27 0.00 0.00 0.00 174.94 175.74 1orw s ILE 375 N 1.11 0.00 0.02 2.92 -4.36 -0.14 -4.51 121.20 116.24 1orw s ILE 375 Ca 0.42 -1.66 -0.30 0.00 -0.26 0.00 0.00 60.65 58.85 1orw s ILE 375 Cb -0.18 -2.35 -0.04 0.00 1.25 0.00 0.00 42.46 41.14 1orw s ILE 375 CO 0.20 0.00 1.00 -0.44 0.24 0.00 0.00 174.94 175.94 1orw s SER 376 N -3.09 7.36 1.24 4.36 0.01 -1.26 -1.12 113.70 121.20 1orw s SER 376 Ca 0.30 1.71 -0.12 0.00 1.31 0.00 0.00 55.95 59.14 1orw s SER 376 Cb 0.02 -2.57 0.19 0.00 0.21 0.00 0.00 66.02 63.87 1orw s SER 376 CO 0.11 -0.26 0.44 0.59 0.41 0.00 0.00 173.24 174.53 1orw n ASN 377 N 3.78 -3.02 0.16 2.44 3.02 0.21 -4.82 115.26 117.04 1orw n ASN 377 Ca 0.06 -0.46 0.09 0.00 -0.03 0.00 0.00 54.58 54.24 1orw n ASN 377 Cb 0.50 -0.50 0.08 0.00 -0.61 0.00 0.00 39.78 39.26 1orw n ASN 377 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1orw h GLU 378 N 0.00 0.00 -0.30 3.52 3.07 -1.97 -2.95 114.58 115.95 1orw h GLU 378 Ca -0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.66 1orw h GLU 378 Cb 0.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 1orw h GLU 378 CO 0.12 0.12 0.00 0.39 -1.40 0.00 0.00 179.01 178.24 1orw n GLU 379 N -3.02 2.09 -1.00 2.33 1.02 -1.26 -4.94 120.64 115.87 1orw n GLU 379 Ca 0.02 -1.65 -0.00 0.00 -0.02 0.00 0.00 57.16 55.51 1orw n GLU 379 Cb 0.60 -1.43 -0.00 0.00 -0.02 0.00 0.00 31.44 30.58 1orw n GLU 379 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1orw n GLY 380 N 1.29 0.47 3.88 0.62 0.00 -1.11 -4.76 105.19 105.58 1orw n GLY 380 Ca 0.17 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1orw n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1orw s TYR 381 N -2.00 3.58 -0.52 1.61 1.51 -1.26 -0.35 117.35 119.92 1orw s TYR 381 Ca 0.00 0.49 -0.29 0.00 -1.01 0.00 0.00 57.07 56.26 1orw s TYR 381 Cb 0.00 -1.92 0.03 0.00 -0.11 0.00 0.00 41.96 39.96 1orw s TYR 381 CO 0.00 0.72 1.15 0.15 -1.11 0.00 0.00 175.55 176.46 1orw s LYS 382 N -1.18 3.63 0.22 -0.62 -0.14 -1.26 0.66 119.74 121.05 1orw s LYS 382 Ca 0.17 0.42 0.03 0.00 -1.36 0.00 0.00 55.97 55.23 1orw s LYS 382 Cb -0.12 -3.95 -0.05 0.00 -1.68 0.00 0.00 37.83 32.03 1orw s LYS 382 CO 0.06 -1.50 0.01 -1.01 -0.76 0.00 0.00 175.35 172.15 1orw s HIS 383 N 4.64 1.49 -0.19 3.18 3.76 -0.27 -0.39 115.29 127.51 1orw s HIS 383 Ca 0.46 -0.97 -0.29 0.00 -0.15 0.00 0.00 55.06 54.11 1orw s HIS 383 Cb -0.07 -0.86 0.00 0.00 1.11 0.00 0.00 32.58 32.75 1orw s HIS 383 CO 0.29 -0.11 1.00 0.42 -0.85 0.00 0.00 174.74 175.49 1orw s ILE 384 N -3.50 4.74 0.11 0.60 1.01 -1.26 -0.96 121.20 121.92 1orw s ILE 384 Ca 0.29 1.97 0.04 0.00 0.00 0.00 0.00 60.65 62.95 1orw s ILE 384 Cb 0.06 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 1orw s ILE 384 CO 0.08 -0.10 0.07 0.00 0.00 0.00 0.00 174.94 174.99 1orw s HIS 386 N -1.47 3.07 0.13 0.00 2.46 0.94 -1.33 115.29 119.09 1orw s HIS 386 Ca 0.29 -0.46 0.07 0.00 0.47 0.00 0.00 55.06 55.43 1orw s HIS 386 Cb -0.11 -2.17 -0.04 0.00 -0.13 0.00 0.00 32.58 30.12 1orw s HIS 386 CO 0.21 -0.32 -0.07 -0.06 -2.47 0.00 0.00 174.74 172.03 1orw s PHE 387 N 1.36 2.76 -0.15 3.88 0.40 0.14 -0.55 117.98 125.82 1orw s PHE 387 Ca 0.05 -0.16 -0.13 0.00 -0.60 0.00 0.00 56.93 56.09 1orw s PHE 387 Cb -0.15 -1.40 -0.05 0.00 0.51 0.00 0.00 43.02 41.94 1orw s PHE 387 CO 0.02 0.47 0.29 -0.65 0.70 0.00 0.00 175.22 176.05 1orw s GLN 388 N -2.50 4.18 0.37 0.44 -1.52 -1.25 -0.81 119.66 118.58 1orw s GLN 388 Ca 0.24 0.11 0.15 0.00 -1.95 0.00 0.00 55.36 53.91 1orw s GLN 388 Cb -0.10 -3.40 1.03 0.00 -0.22 0.00 0.00 33.01 30.32 1orw s GLN 388 CO 0.15 0.30 1.77 1.15 -0.25 0.00 0.00 175.29 178.41 1orw h THR 389 N 4.57 0.55 -0.19 -0.19 2.02 -1.51 -2.12 112.91 116.04 1orw h THR 389 Ca -0.43 -0.16 -0.10 0.00 0.77 0.00 0.00 66.41 66.49 1orw h THR 389 Cb 1.17 0.04 -0.06 0.00 -1.74 0.00 0.00 68.15 67.56 1orw h THR 389 CO 0.74 0.09 -0.27 -0.90 0.37 0.00 0.00 175.52 175.54 1orw n ASP 390 N -4.69 2.11 -3.76 4.18 5.68 -1.26 -4.32 116.55 114.50 1orw n ASP 390 Ca 0.25 -3.85 -0.22 0.00 -0.50 0.00 0.00 54.79 50.48 1orw n ASP 390 Cb 0.82 -0.59 -0.18 0.00 -1.14 0.00 0.00 41.12 40.03 1orw n ASP 390 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1orw s LYS 391 N -3.25 0.45 0.36 0.11 -0.14 -0.80 -4.75 119.74 111.73 1orw s LYS 391 Ca 0.42 0.16 0.04 0.00 -1.36 0.00 0.00 55.97 55.22 1orw s LYS 391 Cb 0.39 -0.84 0.69 0.00 -1.68 0.00 0.00 37.83 36.39 1orw s LYS 391 CO -0.03 -0.29 2.01 0.66 -0.76 0.00 0.00 175.35 176.93 1orw h SER 392 N 8.26 0.67 -4.11 2.83 4.64 -1.83 -3.33 113.55 120.68 1orw h SER 392 Ca -0.20 -0.01 -0.48 0.00 -0.47 0.00 0.00 61.79 60.63 1orw h SER 392 Cb 1.12 -0.16 0.03 0.00 -0.31 0.00 0.00 62.40 63.08 1orw h SER 392 CO 0.25 0.48 0.38 0.20 -0.87 0.00 0.00 176.83 177.28 1orw s ASN 393 N -6.46 6.23 0.26 4.97 -0.87 -1.26 -4.98 114.94 112.83 1orw s ASN 393 Ca -0.10 1.87 0.03 0.00 -1.57 0.00 0.00 52.86 53.10 1orw s ASN 393 Cb 0.18 -2.55 -0.05 0.00 -0.02 0.00 0.00 41.25 38.80 1orw s ASN 393 CO 0.76 -0.86 0.03 0.00 -2.57 0.00 0.00 177.10 174.46 1orw s THR 395 N -3.45 1.82 0.04 0.00 2.01 0.29 -4.85 115.64 111.51 1orw s THR 395 Ca 0.32 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.02 1orw s THR 395 Cb 0.07 -1.79 -0.08 0.00 0.01 0.00 0.00 72.50 70.72 1orw s THR 395 CO 0.11 0.31 1.63 -0.36 -0.69 0.00 0.00 174.62 175.63 1orw s PHE 396 N 1.34 2.39 -2.31 4.92 0.08 -1.26 -0.04 117.98 123.09 1orw s PHE 396 Ca 0.01 0.35 0.22 0.00 0.12 0.00 0.00 56.93 57.62 1orw s PHE 396 Cb -0.15 -3.93 0.39 0.00 -0.57 0.00 0.00 43.02 38.76 1orw s PHE 396 CO -0.10 -3.73 1.35 0.44 -0.10 0.00 0.00 175.22 173.08 1orw n ILE 397 N 4.83 0.49 -3.79 0.64 -5.35 0.27 -4.92 119.36 111.53 1orw n ILE 397 Ca 0.16 -0.75 -0.13 0.00 -0.27 0.00 0.00 62.75 61.77 1orw n ILE 397 Cb 0.41 0.99 -0.10 0.00 -1.74 0.00 0.00 39.64 39.19 1orw n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1orw s THR 398 N -1.43 0.03 0.15 7.28 -4.23 -1.24 -4.90 115.64 111.30 1orw s THR 398 Ca 0.36 -0.21 -0.07 0.00 -1.18 0.00 0.00 61.69 60.59 1orw s THR 398 Cb 0.21 -0.45 -0.02 0.00 1.34 0.00 0.00 72.50 73.59 1orw s THR 398 CO 0.30 -0.12 0.22 -1.59 -0.54 0.00 0.00 174.62 172.89 1orw s LYS 399 N -0.43 1.09 0.00 3.99 0.00 -1.26 -4.58 119.74 118.55 1orw s LYS 399 Ca -0.05 -1.24 0.00 0.00 0.00 0.00 0.00 55.97 54.68 1orw s LYS 399 Cb -0.04 0.34 0.00 0.00 0.00 0.00 0.00 37.83 38.14 1orw s LYS 399 CO 0.01 -0.38 0.00 0.41 0.00 0.00 0.00 175.35 175.40 1orw n GLY 400 N -0.18 4.17 2.46 0.59 0.00 -1.26 -4.92 105.19 106.04 1orw n GLY 400 Ca -0.07 -1.57 -0.40 0.00 0.00 0.00 0.00 46.02 43.98 1orw n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orw n ALA 401 N -1.91 6.93 -3.87 4.61 0.00 -1.26 -4.74 120.51 120.27 1orw n ALA 401 Ca 0.00 -3.80 -0.03 0.00 0.00 0.00 0.00 53.44 49.60 1orw n ALA 401 Cb 0.00 -3.19 0.02 0.00 0.00 0.00 0.00 19.45 16.28 1orw n ALA 401 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1orw s TRP 402 N 1.16 0.06 0.10 0.00 1.48 -1.26 -5.03 118.94 115.45 1orw s TRP 402 Ca 0.60 -0.46 0.03 0.00 -1.06 0.00 0.00 56.10 55.21 1orw s TRP 402 Cb 0.17 0.70 -0.04 0.00 -1.16 0.00 0.00 33.47 33.14 1orw s TRP 402 CO -0.07 -0.94 -0.09 -1.21 -4.06 0.00 0.00 176.95 170.57 1orw s GLU 403 N -2.26 0.87 -0.14 3.25 2.02 -1.26 -4.48 118.70 116.70 1orw s GLU 403 Ca 0.21 -1.24 -0.21 0.00 0.02 0.00 0.00 54.97 53.74 1orw s GLU 403 Cb -0.03 -0.47 -0.03 0.00 0.10 0.00 0.00 34.13 33.70 1orw s GLU 403 CO 0.05 0.06 0.64 0.08 0.02 0.00 0.00 175.26 176.11 1orw s VAL 404 N -2.82 5.05 -0.15 2.63 1.01 0.47 -2.79 120.40 123.80 1orw s VAL 404 Ca 0.08 1.26 -0.28 0.00 0.00 0.00 0.00 61.98 63.05 1orw s VAL 404 Cb -0.00 -3.97 -0.25 0.00 0.00 0.00 0.00 36.38 32.16 1orw s VAL 404 CO -0.01 0.19 0.71 0.40 0.00 0.00 0.00 175.10 176.39 1orw h ILE 405 N 4.97 1.69 -2.81 2.22 1.08 -0.33 -3.45 117.51 120.88 1orw h ILE 405 Ca -0.36 -2.32 0.02 0.00 -0.39 0.00 0.00 64.86 61.81 1orw h ILE 405 Cb 1.17 3.25 -0.13 0.00 -3.07 0.00 0.00 36.82 38.04 1orw h ILE 405 CO 0.77 0.57 0.28 -0.83 -0.69 0.00 0.00 178.15 178.26 1orw s GLY 406 N -4.27 -0.56 -0.43 5.37 0.00 -1.07 -4.99 107.32 101.37 1orw s GLY 406 Ca -0.20 0.60 -0.18 0.00 0.00 0.00 0.00 44.72 44.93 1orw s GLY 406 CO 0.67 0.20 0.50 -0.42 0.00 0.00 0.00 173.10 174.05 1orw s ILE 407 N -3.59 5.00 -0.10 0.90 1.01 -1.26 -1.16 121.20 122.00 1orw s ILE 407 Ca 0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 60.65 60.44 1orw s ILE 407 Cb -0.01 -4.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.35 1orw s ILE 407 CO -0.11 -0.49 0.06 -0.33 0.00 0.00 0.00 174.94 174.06 1orw h GLU 408 N 8.78 -0.03 -5.23 2.79 4.39 -1.42 -3.49 114.58 120.38 1orw h GLU 408 Ca -0.26 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.07 1orw h GLU 408 Cb 1.11 0.01 -0.17 0.00 -0.10 0.00 0.00 28.75 29.59 1orw h GLU 408 CO 0.83 0.01 -0.74 0.00 -1.16 0.00 0.00 179.01 177.95 1orw s ALA 409 N -2.61 1.44 -0.07 3.43 0.00 -1.15 -4.95 121.76 117.84 1orw s ALA 409 Ca -0.01 -1.36 -0.03 0.00 0.00 0.00 0.00 51.96 50.56 1orw s ALA 409 Cb -0.00 -0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.14 1orw s ALA 409 CO 0.03 0.01 0.15 -1.17 0.00 0.00 0.00 175.76 174.78 1orw s LEU 410 N -2.73 0.39 0.00 0.00 2.96 -1.26 -0.77 118.68 117.27 1orw s LEU 410 Ca 0.11 0.30 0.00 0.00 -0.22 0.00 0.00 54.13 54.33 1orw s LEU 410 Cb -0.02 0.31 0.00 0.00 0.50 0.00 0.00 46.19 46.98 1orw s LEU 410 CO 0.02 -0.19 0.00 0.35 -1.32 0.00 0.00 176.35 175.21 1orw n THR 411 N 4.69 0.00 1.53 3.68 -2.24 0.33 -4.98 114.28 117.28 1orw n THR 411 Ca -0.17 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.75 1orw n THR 411 Cb 0.51 0.00 0.61 0.00 -2.10 0.00 0.00 70.33 69.35 1orw n THR 411 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1orw n SER 412 N -1.06 0.82 0.00 3.42 3.41 -1.26 -4.21 113.62 114.74 1orw n SER 412 Ca 0.00 -1.02 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 1orw n SER 412 Cb 0.00 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1orw n SER 412 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1orw n ASP 413 N -0.52 2.08 -4.50 4.04 8.00 -1.26 -4.91 116.55 119.48 1orw n ASP 413 Ca 0.18 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.43 1orw n ASP 413 Cb 0.28 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.29 1orw n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1orw s TYR 414 N -1.82 2.35 -0.08 1.24 1.51 -1.26 0.13 117.35 119.42 1orw s TYR 414 Ca 0.00 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1orw s TYR 414 Cb 0.00 -1.06 0.02 0.00 -0.11 0.00 0.00 41.96 40.81 1orw s TYR 414 CO 0.00 0.69 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.88 1orw s LEU 415 N -3.54 1.35 -0.10 -1.29 1.98 -0.83 -0.51 118.68 115.74 1orw s LEU 415 Ca 0.30 -0.24 -0.02 0.00 -2.89 0.00 0.00 54.13 51.29 1orw s LEU 415 Cb -0.04 -0.71 -0.03 0.00 0.66 0.00 0.00 46.19 46.07 1orw s LEU 415 CO 0.16 -0.05 -0.03 -0.31 -1.89 0.00 0.00 176.35 174.22 1orw s TYR 416 N 1.14 3.05 0.15 5.38 1.51 0.05 -1.38 117.35 127.24 1orw s TYR 416 Ca -0.06 -0.00 -0.10 0.00 -1.01 0.00 0.00 57.07 55.89 1orw s TYR 416 Cb -0.14 -1.81 0.00 0.00 -0.11 0.00 0.00 41.96 39.89 1orw s TYR 416 CO -0.01 0.28 0.30 1.52 -1.11 0.00 0.00 175.55 176.52 1orw s TYR 417 N -0.49 0.24 -0.08 2.71 -0.85 0.58 -1.00 117.35 118.45 1orw s TYR 417 Ca 0.08 -0.61 0.03 0.00 -0.52 0.00 0.00 57.07 56.05 1orw s TYR 417 Cb -0.12 0.02 -0.02 0.00 0.38 0.00 0.00 41.96 42.22 1orw s TYR 417 CO 0.02 -0.70 -0.15 0.42 -1.52 0.00 0.00 175.55 173.62 1orw s ILE 418 N -3.92 2.91 0.14 -3.49 1.01 -0.31 0.84 121.20 118.37 1orw s ILE 418 Ca 0.12 -0.75 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1orw s ILE 418 Cb 0.03 -2.16 0.01 0.00 0.01 0.00 0.00 42.46 40.35 1orw s ILE 418 CO -0.04 0.57 0.30 -0.94 0.00 0.00 0.00 174.94 174.83 1orw s SER 419 N -0.28 -0.01 -0.62 3.58 1.04 -0.55 0.45 113.70 117.30 1orw s SER 419 Ca 0.02 -0.66 -0.01 0.00 0.48 0.00 0.00 55.95 55.78 1orw s SER 419 Cb -0.13 0.43 0.46 0.00 0.10 0.00 0.00 66.02 66.88 1orw s SER 419 CO 0.03 -0.85 1.95 -0.46 0.98 0.00 0.00 173.24 174.88 1orw n ASN 420 N -0.18 7.21 -0.03 7.02 0.23 -1.12 -1.46 115.26 126.93 1orw n ASN 420 Ca -0.12 -3.78 -0.15 0.00 -0.53 0.00 0.00 54.58 50.01 1orw n ASN 420 Cb 0.63 -0.91 -0.11 0.00 -2.08 0.00 0.00 39.78 37.31 1orw n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1orw h GLU 421 N 1.96 0.13 -6.11 -3.83 4.81 -1.85 -3.37 114.58 106.32 1orw h GLU 421 Ca 0.58 -0.13 -0.76 0.00 -0.13 0.00 0.00 59.36 58.92 1orw h GLU 421 Cb 0.99 0.04 0.04 0.00 0.63 0.00 0.00 28.75 30.44 1orw h GLU 421 CO 1.48 0.88 0.44 1.58 -0.73 0.00 0.00 179.01 182.66 1orw n HIS 422 N -4.57 1.36 -0.83 0.92 -0.00 -1.26 -0.90 115.22 109.94 1orw n HIS 422 Ca -0.10 0.86 0.00 0.00 0.46 0.00 0.00 57.72 58.94 1orw n HIS 422 Cb 0.47 -2.25 0.00 0.00 -0.12 0.00 0.00 29.99 28.08 1orw n HIS 422 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1orw n LYS 423 N 2.94 -0.75 -1.67 1.57 4.01 -1.26 -3.35 118.16 119.65 1orw n LYS 423 Ca 0.23 0.19 -0.15 0.00 -0.51 0.00 0.00 58.31 58.06 1orw n LYS 423 Cb 0.10 -4.18 -0.05 0.00 -0.51 0.00 0.00 35.03 30.39 1orw n LYS 423 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1orw n GLY 424 N -1.03 1.08 3.23 0.72 0.00 -0.08 -4.99 105.19 104.13 1orw n GLY 424 Ca 0.00 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 1orw n GLY 424 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1orw s MET 425 N -3.68 2.91 0.59 1.61 0.23 -1.21 -4.98 119.30 114.77 1orw s MET 425 Ca 0.00 -0.94 0.39 0.00 -1.03 0.00 0.00 55.69 54.11 1orw s MET 425 Cb 0.00 -3.05 1.96 0.00 -1.53 0.00 0.00 34.83 32.21 1orw s MET 425 CO 0.00 -0.39 2.18 -1.00 -2.03 0.00 0.00 175.02 173.77 1orw h PRO 426 N 8.05 0.00 -0.01 3.16 0.13 -1.88 -2.19 132.00 139.27 1orw h PRO 426 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1orw h PRO 426 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1orw h PRO 426 CO 0.58 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.76 1orw n GLY 427 N -0.68 -0.89 3.73 1.56 0.00 -1.26 -4.81 105.19 102.85 1orw n GLY 427 Ca -0.02 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 1orw n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1orw s GLY 428 N -1.91 1.58 -0.01 -0.02 0.00 -0.82 -2.36 107.32 103.77 1orw s GLY 428 Ca 0.43 -1.46 0.02 0.00 0.00 0.00 0.00 44.72 43.70 1orw s GLY 428 CO 0.34 -1.51 -0.05 0.50 0.00 0.00 0.00 173.10 172.38 1orw s ARG 429 N -3.54 0.44 0.06 2.90 1.81 0.15 -4.06 118.95 116.71 1orw s ARG 429 Ca 0.31 -0.17 -0.04 0.00 -1.72 0.00 0.00 55.73 54.11 1orw s ARG 429 Cb -0.08 -0.44 -0.02 0.00 -0.45 0.00 0.00 34.95 33.96 1orw s ARG 429 CO 0.22 0.09 0.06 -0.80 -0.68 0.00 0.00 175.30 174.18 1orw s ASN 430 N 0.01 0.31 -0.11 0.23 0.01 -0.54 -1.83 114.94 113.02 1orw s ASN 430 Ca 0.00 -0.77 -0.14 0.00 -0.71 0.00 0.00 52.86 51.24 1orw s ASN 430 Cb -0.04 0.24 -0.05 0.00 0.41 0.00 0.00 41.25 41.82 1orw s ASN 430 CO -0.00 -0.60 0.33 -0.22 -1.51 0.00 0.00 177.10 175.10 1orw s LEU 431 N -2.64 4.32 0.08 0.60 2.96 -1.26 -1.47 118.68 121.27 1orw s LEU 431 Ca 0.02 0.66 0.05 0.00 -0.22 0.00 0.00 54.13 54.65 1orw s LEU 431 Cb 0.04 -2.44 -0.03 0.00 0.50 0.00 0.00 46.19 44.26 1orw s LEU 431 CO -0.09 0.18 -0.14 -0.31 -1.32 0.00 0.00 176.35 174.68 1orw s TYR 432 N -0.07 1.23 -0.12 5.38 1.51 0.25 -0.97 117.35 124.56 1orw s TYR 432 Ca 0.19 -0.50 0.01 0.00 -1.01 0.00 0.00 57.07 55.76 1orw s TYR 432 Cb -0.14 -0.68 0.02 0.00 -0.11 0.00 0.00 41.96 41.05 1orw s TYR 432 CO 0.07 0.07 -0.13 0.50 -1.11 0.00 0.00 175.55 174.95 1orw s ARG 433 N -2.06 2.05 -0.02 -0.62 3.52 0.37 -0.31 118.95 121.88 1orw s ARG 433 Ca 0.01 -0.48 0.05 0.00 -0.13 0.00 0.00 55.73 55.18 1orw s ARG 433 Cb -0.08 -1.85 -0.03 0.00 -1.56 0.00 0.00 34.95 31.44 1orw s ARG 433 CO 0.02 -0.15 -0.18 -1.50 -0.81 0.00 0.00 175.30 172.68 1orw s ILE 434 N 1.26 2.78 -0.09 4.11 2.07 -0.48 0.55 121.20 131.40 1orw s ILE 434 Ca -0.01 -0.93 -0.28 0.00 -1.41 0.00 0.00 60.65 58.01 1orw s ILE 434 Cb -0.14 -2.09 -0.02 0.00 0.13 0.00 0.00 42.46 40.34 1orw s ILE 434 CO -0.05 0.52 0.95 -1.58 -1.91 0.00 0.00 174.94 172.86 1orw s GLN 435 N -0.90 4.44 0.50 3.50 0.74 0.10 -1.96 119.66 126.07 1orw s GLN 435 Ca 0.12 1.29 0.22 0.00 0.05 0.00 0.00 55.36 57.05 1orw s GLN 435 Cb -0.10 -3.52 1.29 0.00 1.10 0.00 0.00 33.01 31.78 1orw s GLN 435 CO 0.02 -0.22 1.98 -0.07 -0.55 0.00 0.00 175.29 176.44 1orw h LEU 436 N 7.68 0.11 -1.95 3.68 4.07 0.75 -2.10 115.31 127.55 1orw h LEU 436 Ca -0.34 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.63 1orw h LEU 436 Cb 1.17 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.89 1orw h LEU 436 CO 0.82 0.06 0.00 -0.46 -1.08 0.00 0.00 178.44 177.78 1orw n ASN 437 N -4.41 2.95 -3.28 -0.43 0.23 -1.26 -4.74 115.26 104.32 1orw n ASN 437 Ca 0.11 -1.93 -0.07 0.00 -0.53 0.00 0.00 54.58 52.16 1orw n ASN 437 Cb 0.56 -0.05 -0.04 0.00 -2.08 0.00 0.00 39.78 38.17 1orw n ASN 437 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1orw s ASP 438 N -1.75 -0.20 0.00 0.53 -1.08 -0.79 -5.00 116.67 108.38 1orw s ASP 438 Ca 0.28 -0.88 0.01 0.00 -0.52 0.00 0.00 52.55 51.44 1orw s ASP 438 Cb 0.19 1.30 0.06 0.00 -1.46 0.00 0.00 42.92 43.01 1orw s ASP 438 CO 0.28 -0.25 0.37 -1.22 0.52 0.00 0.00 175.17 174.86 1orw n TYR 439 N 4.66 0.00 -0.04 -5.34 4.01 -1.22 -1.20 117.16 118.04 1orw n TYR 439 Ca 0.08 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.78 1orw n TYR 439 Cb 0.51 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.40 1orw n TYR 439 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1orw n THR 440 N -0.56 1.21 -2.99 -0.72 -1.04 -1.26 -4.67 114.28 104.26 1orw n THR 440 Ca 0.01 -0.76 -0.44 0.00 -2.04 0.00 0.00 64.05 60.82 1orw n THR 440 Cb 0.00 -0.59 -0.02 0.00 -1.82 0.00 0.00 70.33 67.90 1orw n THR 440 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1orw s LYS 441 N -2.75 3.64 -0.11 -2.82 1.02 -0.34 -4.95 119.74 113.43 1orw s LYS 441 Ca -0.07 -1.93 0.01 0.00 0.02 0.00 0.00 55.97 54.00 1orw s LYS 441 Cb 0.08 -4.86 0.02 0.00 -0.52 0.00 0.00 37.83 32.55 1orw s LYS 441 CO 0.83 -1.70 -0.12 0.54 -0.92 0.00 0.00 175.35 173.98 1orw s VAL 442 N 2.22 1.32 0.01 3.17 0.11 -1.26 0.03 120.40 126.00 1orw s VAL 442 Ca 0.31 -0.51 0.08 0.00 -2.93 0.00 0.00 61.98 58.93 1orw s VAL 442 Cb -0.05 -1.24 -0.03 0.00 -1.53 0.00 0.00 36.38 33.53 1orw s VAL 442 CO -0.09 0.41 -0.23 0.28 -3.33 0.00 0.00 175.10 172.14 1orw s THR 443 N 1.21 2.32 -0.25 5.04 -1.32 0.19 -4.93 115.64 117.90 1orw s THR 443 Ca -0.03 -1.16 -0.18 0.00 -1.21 0.00 0.00 61.69 59.11 1orw s THR 443 Cb -0.14 -1.88 -0.03 0.00 -1.51 0.00 0.00 72.50 68.95 1orw s THR 443 CO -0.04 0.48 0.53 0.00 -2.21 0.00 0.00 174.62 173.38 1orw h LEU 445 N 8.61 0.00 0.00 0.00 3.38 -1.42 -3.40 115.31 122.48 1orw h LEU 445 Ca -0.30 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.48 1orw h LEU 445 Cb 1.14 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.85 1orw h LEU 445 CO 0.73 0.82 -2.17 -1.54 0.09 0.00 0.00 178.44 176.37 1orw n SER 446 N -3.09 0.20 -0.26 -0.43 3.41 -1.24 -4.65 113.62 107.55 1orw n SER 446 Ca -0.09 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.45 1orw n SER 446 Cb 0.93 1.42 -0.06 0.00 -0.26 0.00 0.00 64.21 66.24 1orw n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1orw n GLU 448 N -4.64 2.64 -0.29 0.00 4.71 -1.26 -4.06 120.64 117.75 1orw n GLU 448 Ca 0.01 -2.54 -0.05 0.00 -0.01 0.00 0.00 57.16 54.57 1orw n GLU 448 Cb 0.16 -1.55 0.09 0.00 -1.01 0.00 0.00 31.44 29.13 1orw n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1orw h LEU 449 N 4.28 1.08 -5.00 -4.62 3.38 -1.70 -3.37 115.31 109.36 1orw h LEU 449 Ca 0.00 -0.14 -0.23 0.00 0.09 0.00 0.00 57.88 57.61 1orw h LEU 449 Cb 0.97 -0.28 -0.14 0.00 0.09 0.00 0.00 40.66 41.30 1orw h LEU 449 CO 0.00 0.92 -0.44 0.59 0.09 0.00 0.00 178.44 179.60 1orw n ASN 450 N -4.30 -2.55 -0.35 -0.43 5.03 -1.26 -5.06 115.26 106.34 1orw n ASN 450 Ca 0.08 -3.46 0.32 0.00 0.87 0.00 0.00 54.58 52.39 1orw n ASN 450 Cb 0.15 1.86 0.56 0.00 -1.02 0.00 0.00 39.78 41.34 1orw n ASN 450 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 1orw n PRO 451 N 0.94 -0.04 0.00 3.52 -0.04 -1.26 0.39 135.00 138.52 1orw n PRO 451 Ca 0.07 1.17 -0.14 0.00 -0.04 0.00 0.00 63.50 64.55 1orw n PRO 451 Cb 0.67 -2.20 -0.14 0.00 -0.04 0.00 0.00 33.50 31.79 1orw n PRO 451 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1orw h GLU 452 N 0.00 0.13 0.00 0.54 4.39 -1.97 -3.38 114.58 114.29 1orw h GLU 452 Ca 0.77 -0.23 -0.16 0.00 0.34 0.00 0.00 59.36 60.08 1orw h GLU 452 Cb 2.26 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 30.96 1orw h GLU 452 CO -0.55 0.85 -1.34 -0.09 -1.16 0.00 0.00 179.01 176.72 1orw h ARG 453 N 0.04 0.00 -4.43 2.33 2.43 -1.70 -3.40 114.38 109.65 1orw h ARG 453 Ca -0.33 0.00 -0.61 0.00 -0.81 0.00 0.00 59.98 58.23 1orw h ARG 453 Cb 2.02 0.00 -0.38 0.00 -0.42 0.00 0.00 29.97 31.19 1orw h ARG 453 CO 0.09 0.29 -0.80 0.00 -1.51 0.00 0.00 179.97 178.05 1orw n GLN 455 N 4.69 0.19 -3.60 0.00 6.02 0.55 -4.37 117.38 120.86 1orw n GLN 455 Ca -0.13 -0.40 -0.24 0.00 -0.01 0.00 0.00 57.00 56.22 1orw n GLN 455 Cb 0.45 -0.57 -0.16 0.00 1.02 0.00 0.00 30.24 30.98 1orw n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1orw s TYR 456 N -0.08 0.11 0.32 1.08 6.14 -1.09 -0.67 117.35 123.15 1orw s TYR 456 Ca 0.00 -0.19 0.03 0.00 0.64 0.00 0.00 57.07 57.56 1orw s TYR 456 Cb 0.00 -0.62 -0.06 0.00 0.42 0.00 0.00 41.96 41.70 1orw s TYR 456 CO 0.00 -0.50 0.07 0.71 0.64 0.00 0.00 175.55 176.47 1orw s TYR 457 N 2.17 1.86 0.18 4.97 1.51 -0.76 -0.61 117.35 126.66 1orw s TYR 457 Ca 0.03 -1.03 -0.12 0.00 -1.01 0.00 0.00 57.07 54.94 1orw s TYR 457 Cb -0.16 -1.19 0.00 0.00 -0.11 0.00 0.00 41.96 40.51 1orw s TYR 457 CO -0.09 -0.09 0.37 -1.54 -1.11 0.00 0.00 175.55 173.09 1orw s SER 458 N -3.46 -0.06 0.08 2.29 1.04 -0.93 -4.62 113.70 108.04 1orw s SER 458 Ca 0.36 -0.75 -0.09 0.00 0.48 0.00 0.00 55.95 55.95 1orw s SER 458 Cb 0.08 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.69 1orw s SER 458 CO 0.15 -0.95 0.21 0.00 0.98 0.00 0.00 173.24 173.63 1orw s ALA 459 N -3.94 -0.30 -0.14 5.32 0.00 -1.26 -1.94 121.76 119.49 1orw s ALA 459 Ca 0.15 -0.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.58 1orw s ALA 459 Cb 0.02 0.47 0.03 0.00 0.00 0.00 0.00 23.12 23.65 1orw s ALA 459 CO -0.01 -0.50 -0.06 0.45 0.00 0.00 0.00 175.76 175.64 1orw s SER 460 N -2.75 2.49 -0.02 0.00 0.15 -0.89 -4.98 113.70 107.69 1orw s SER 460 Ca 0.03 -0.48 -0.03 0.00 0.70 0.00 0.00 55.95 56.18 1orw s SER 460 Cb 0.04 -0.87 -0.04 0.00 -1.71 0.00 0.00 66.02 63.44 1orw s SER 460 CO -0.10 -0.15 0.15 -0.36 1.20 0.00 0.00 173.24 173.97 1orw s PHE 461 N 1.68 3.48 0.92 3.44 0.40 -1.26 -0.44 117.98 126.19 1orw s PHE 461 Ca 0.03 0.34 -0.12 0.00 -0.60 0.00 0.00 56.93 56.58 1orw s PHE 461 Cb -0.14 -1.82 0.14 0.00 0.51 0.00 0.00 43.02 41.72 1orw s PHE 461 CO -0.08 0.63 1.11 -1.54 0.70 0.00 0.00 175.22 176.04 1orw s SER 462 N -1.74 3.34 0.06 1.36 1.04 0.35 -4.80 113.70 113.31 1orw s SER 462 Ca 0.24 1.17 -0.12 0.00 0.48 0.00 0.00 55.95 57.73 1orw s SER 462 Cb -0.12 -1.82 -0.03 0.00 0.10 0.00 0.00 66.02 64.15 1orw s SER 462 CO 0.15 -2.68 0.64 0.59 0.98 0.00 0.00 173.24 172.93 1orw n ASN 463 N -3.87 -0.40 -1.78 7.02 5.03 -0.88 0.40 115.26 120.78 1orw n ASN 463 Ca 0.06 0.73 -0.16 0.00 0.87 0.00 0.00 54.58 56.09 1orw n ASN 463 Cb 0.57 -0.12 0.19 0.00 -1.02 0.00 0.00 39.78 39.40 1orw n ASN 463 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1orw n LYS 464 N -4.25 2.08 -1.41 3.52 5.02 -1.26 -4.90 118.16 116.97 1orw n LYS 464 Ca 0.01 -3.11 -0.14 0.00 -2.02 0.00 0.00 58.31 53.05 1orw n LYS 464 Cb 0.10 -2.03 -0.06 0.00 -0.02 0.00 0.00 35.03 33.02 1orw n LYS 464 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1orw n ALA 465 N -1.13 -0.22 0.30 7.82 0.00 0.16 -4.81 120.51 122.63 1orw n ALA 465 Ca 0.49 0.23 0.17 0.00 0.00 0.00 0.00 53.44 54.33 1orw n ALA 465 Cb 1.38 -1.84 0.80 0.00 0.00 0.00 0.00 19.45 19.80 1orw n ALA 465 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1orw h LYS 466 N 0.00 0.00 -3.54 0.00 1.57 -1.77 -3.40 116.57 109.42 1orw h LYS 466 Ca -0.29 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.42 1orw h LYS 466 Cb 1.21 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.40 1orw h LYS 466 CO 0.43 0.00 -0.15 0.71 -0.57 0.00 0.00 179.45 179.87 1orw s TYR 467 N -3.73 0.01 0.12 -1.35 2.02 -1.26 -0.89 117.35 112.26 1orw s TYR 467 Ca -0.01 -0.36 -0.19 0.00 -0.37 0.00 0.00 57.07 56.14 1orw s TYR 467 Cb 0.10 0.17 0.05 0.00 -0.40 0.00 0.00 41.96 41.88 1orw s TYR 467 CO 0.41 -0.73 0.48 1.52 -1.57 0.00 0.00 175.55 175.65 1orw s TYR 468 N -3.87 -0.33 -0.15 2.71 1.13 0.66 -0.49 117.35 117.00 1orw s TYR 468 Ca 0.08 0.11 -0.01 0.00 -1.41 0.00 0.00 57.07 55.84 1orw s TYR 468 Cb 0.02 0.36 -0.01 0.00 -1.10 0.00 0.00 41.96 41.23 1orw s TYR 468 CO -0.07 -0.73 -0.12 -1.14 -2.51 0.00 0.00 175.55 170.98 1orw s GLN 469 N -3.56 3.36 -0.20 -3.49 0.74 0.41 0.20 119.66 117.11 1orw s GLN 469 Ca 0.01 -0.68 -0.10 0.00 0.05 0.00 0.00 55.36 54.64 1orw s GLN 469 Cb 0.01 -2.70 -0.05 0.00 1.10 0.00 0.00 33.01 31.37 1orw s GLN 469 CO -0.11 0.11 0.13 -0.51 -0.55 0.00 0.00 175.29 174.36 1orw s LEU 470 N 0.63 4.21 -0.26 3.68 1.43 -0.77 -2.10 118.68 125.50 1orw s LEU 470 Ca -0.07 0.24 -0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1orw s LEU 470 Cb -0.15 -2.09 0.03 0.00 0.03 0.00 0.00 46.19 44.01 1orw s LEU 470 CO 0.03 0.19 -0.04 -0.13 0.23 0.00 0.00 176.35 176.63 1orw s ARG 471 N 0.30 2.80 -0.28 1.70 0.52 -0.82 -2.42 118.95 120.76 1orw s ARG 471 Ca 0.08 -1.01 -0.11 0.00 -0.52 0.00 0.00 55.73 54.18 1orw s ARG 471 Cb -0.11 -3.06 -0.05 0.00 0.52 0.00 0.00 34.95 32.26 1orw s ARG 471 CO -0.02 -0.44 0.18 0.00 0.02 0.00 0.00 175.30 175.04 1orw n PHE 473 N 5.05 0.40 -0.86 0.00 3.01 0.22 -1.92 117.46 123.35 1orw n PHE 473 Ca -0.14 -0.23 0.00 0.00 1.01 0.00 0.00 57.45 58.09 1orw n PHE 473 Cb 0.52 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 1orw n PHE 473 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1orw n GLY 474 N 1.29 -1.48 0.31 1.37 0.00 -1.25 -0.02 105.19 105.41 1orw n GLY 474 Ca 0.17 -1.48 0.20 0.00 0.00 0.00 0.00 46.02 44.90 1orw n GLY 474 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1orw h PRO 475 N 1.89 0.00 0.00 1.61 0.13 -1.04 0.16 132.00 134.75 1orw h PRO 475 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.80 1orw h PRO 475 Cb 0.00 0.00 0.14 0.00 0.13 0.00 0.00 31.00 31.27 1orw h PRO 475 CO 0.00 0.02 0.30 0.41 -0.23 0.00 0.00 178.00 178.50 1orw n GLY 476 N -0.84 -1.59 3.77 1.56 0.00 -0.04 -4.39 105.19 103.66 1orw n GLY 476 Ca -0.02 -1.67 -0.41 0.00 0.00 0.00 0.00 46.02 43.91 1orw n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1orw s LEU 477 N 0.00 4.36 0.66 0.99 1.43 -1.26 -4.56 118.68 120.30 1orw s LEU 477 Ca 0.59 2.90 -0.17 0.00 -1.03 0.00 0.00 54.13 56.42 1orw s LEU 477 Cb -0.02 -3.66 -0.09 0.00 0.03 0.00 0.00 46.19 42.46 1orw s LEU 477 CO 0.42 -0.76 0.24 -2.65 0.23 0.00 0.00 176.35 173.83 1orw n PRO 478 N 0.90 0.25 -3.36 1.29 -0.02 -1.26 -4.77 135.00 128.03 1orw n PRO 478 Ca 0.02 0.11 -0.08 0.00 -2.02 0.00 0.00 63.50 61.53 1orw n PRO 478 Cb 0.40 -1.52 -0.07 0.00 -0.02 0.00 0.00 33.50 32.28 1orw n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1orw s LEU 479 N 2.04 -0.72 -0.08 2.45 2.96 -0.81 -4.33 118.68 120.20 1orw s LEU 479 Ca 0.62 0.38 -0.13 0.00 -0.22 0.00 0.00 54.13 54.77 1orw s LEU 479 Cb -0.39 1.25 -0.05 0.00 0.50 0.00 0.00 46.19 47.50 1orw s LEU 479 CO 0.61 -0.29 0.33 -0.31 -1.32 0.00 0.00 176.35 175.37 1orw s TYR 480 N 2.59 3.61 0.10 5.38 1.51 0.93 -2.95 117.35 128.51 1orw s TYR 480 Ca 0.12 0.77 -0.03 0.00 -1.01 0.00 0.00 57.07 56.93 1orw s TYR 480 Cb -0.15 -2.26 -0.03 0.00 -0.11 0.00 0.00 41.96 39.41 1orw s TYR 480 CO -0.16 0.50 0.07 0.95 -1.11 0.00 0.00 175.55 175.81 1orw s THR 481 N -0.47 0.14 -0.08 -0.71 -4.23 -1.02 -0.34 115.64 108.94 1orw s THR 481 Ca 0.20 -1.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.00 1orw s THR 481 Cb -0.15 -1.77 -0.02 0.00 1.34 0.00 0.00 72.50 71.90 1orw s THR 481 CO 0.08 -0.63 -0.13 -0.22 -0.54 0.00 0.00 174.62 173.18 1orw s LEU 482 N -2.98 2.78 0.06 4.79 2.96 -0.37 -1.85 118.68 124.07 1orw s LEU 482 Ca 0.16 -0.21 0.03 0.00 -0.22 0.00 0.00 54.13 53.88 1orw s LEU 482 Cb 0.07 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 1orw s LEU 482 CO -0.04 0.29 -0.10 -1.00 -1.32 0.00 0.00 176.35 174.19 1orw s HIS 483 N -0.41 0.88 -0.16 5.38 3.76 0.13 -3.59 115.29 121.28 1orw s HIS 483 Ca 0.05 -0.53 -0.05 0.00 -0.15 0.00 0.00 55.06 54.37 1orw s HIS 483 Cb -0.12 -0.51 -0.04 0.00 1.11 0.00 0.00 32.58 33.02 1orw s HIS 483 CO 0.02 -0.04 0.02 0.45 -0.85 0.00 0.00 174.74 174.35 1orw s SER 484 N -1.83 5.33 0.60 1.40 0.15 -1.26 -0.25 113.70 117.86 1orw s SER 484 Ca -0.04 0.04 0.40 0.00 0.70 0.00 0.00 55.95 57.04 1orw s SER 484 Cb -0.08 -1.84 2.00 0.00 -1.71 0.00 0.00 66.02 64.39 1orw s SER 484 CO 0.01 0.21 2.20 0.28 1.20 0.00 0.00 173.24 177.13 1orw h SER 485 N 6.42 0.00 -0.00 5.45 0.02 -1.23 -2.46 113.55 121.75 1orw h SER 485 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1orw h SER 485 Cb 1.18 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 1orw h SER 485 CO 0.66 0.00 -0.04 0.77 -1.14 0.00 0.00 176.83 177.07 1orw h SER 486 N 0.00 -0.14 -0.01 3.07 4.64 -1.92 -3.36 113.55 115.85 1orw h SER 486 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1orw h SER 486 Cb 0.17 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1orw h SER 486 CO 0.00 -0.04 0.00 -1.54 -0.87 0.00 0.00 176.83 174.38 1orw n SER 487 N -2.74 2.08 -2.45 4.97 3.41 -1.23 -4.97 113.62 112.67 1orw n SER 487 Ca -0.01 -2.19 -0.20 0.00 -0.26 0.00 0.00 58.87 56.21 1orw n SER 487 Cb 0.03 -0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 63.90 1orw n SER 487 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1orw n ASP 488 N -0.64 -5.80 -4.78 4.04 10.43 -0.93 -4.94 116.55 113.94 1orw n ASP 488 Ca 0.03 -0.02 -0.37 0.00 2.57 0.00 0.00 54.79 57.00 1orw n ASP 488 Cb 0.32 -4.82 -0.03 0.00 1.84 0.00 0.00 41.12 38.43 1orw n ASP 488 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 1orw s LYS 489 N -5.10 4.09 0.34 -1.24 2.47 -1.26 -4.94 119.74 114.09 1orw s LYS 489 Ca 0.02 1.56 0.07 0.00 -1.56 0.00 0.00 55.97 56.06 1orw s LYS 489 Cb -0.01 -2.51 0.76 0.00 -1.46 0.00 0.00 37.83 34.61 1orw s LYS 489 CO 0.03 -0.22 1.86 1.49 0.16 0.00 0.00 175.35 178.67 1orw h GLU 490 N 2.40 0.74 0.00 4.03 4.57 -1.92 -3.34 114.58 121.05 1orw h GLU 490 Ca -0.48 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 1orw h GLU 490 Cb 1.22 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 1orw h GLU 490 CO 0.62 0.49 0.00 -0.11 -1.18 0.00 0.00 179.01 178.82 1orw n LEU 491 N -4.58 0.00 0.00 1.64 7.94 -1.25 -4.16 117.00 116.59 1orw n LEU 491 Ca 0.18 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.08 1orw n LEU 491 Cb 0.45 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.40 1orw n LEU 491 CO 0.28 0.00 0.00 -2.11 -1.11 0.00 0.00 177.39 174.45 1orw n ARG 492 N 0.00 0.00 -3.55 1.96 1.85 -1.24 -4.99 116.66 110.69 1orw n ARG 492 Ca 0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.48 1orw n ARG 492 Cb 0.00 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.34 1orw n ARG 492 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1orw s VAL 493 N -2.00 5.29 -0.14 8.89 1.01 -1.26 -1.24 120.40 130.95 1orw s VAL 493 Ca 0.00 0.57 0.09 0.00 0.00 0.00 0.00 61.98 62.63 1orw s VAL 493 Cb 0.00 -3.63 -0.23 0.00 0.00 0.00 0.00 36.38 32.52 1orw s VAL 493 CO 0.00 0.42 0.29 0.18 0.00 0.00 0.00 175.10 176.00 1orw n LEU 494 N 3.27 1.26 -3.61 3.92 4.77 0.54 -4.95 117.00 122.21 1orw n LEU 494 Ca -0.13 0.17 -0.03 0.00 -0.03 0.00 0.00 56.01 55.99 1orw n LEU 494 Cb 0.52 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1orw n LEU 494 CO 0.39 0.59 0.52 -0.70 -1.33 0.00 0.00 177.39 176.87 1orw s GLU 495 N -2.55 0.49 0.00 3.23 2.56 -1.09 -4.97 118.70 116.37 1orw s GLU 495 Ca -0.14 0.93 0.01 0.00 0.00 0.00 0.00 54.97 55.77 1orw s GLU 495 Cb 0.07 0.24 -0.00 0.00 2.00 0.00 0.00 34.13 36.44 1orw s GLU 495 CO 0.78 -0.12 0.25 -0.40 -0.56 0.00 0.00 175.26 175.21 1orw n ASP 496 N 4.26 0.49 -1.30 -1.70 5.75 -1.26 -0.05 116.55 122.74 1orw n ASP 496 Ca -0.17 -0.74 -0.15 0.00 -0.01 0.00 0.00 54.79 53.71 1orw n ASP 496 Cb 0.56 0.58 -0.05 0.00 -1.03 0.00 0.00 41.12 41.18 1orw n ASP 496 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1orw n ASN 497 N -0.57 -4.81 -0.23 -1.12 3.02 -1.26 -4.77 115.26 105.53 1orw n ASN 497 Ca 0.00 0.30 0.32 0.00 -0.03 0.00 0.00 54.58 55.17 1orw n ASN 497 Cb 0.02 -3.72 0.72 0.00 -0.61 0.00 0.00 39.78 36.19 1orw n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1orw h SER 498 N 0.00 0.00 -0.21 6.41 4.64 -1.94 0.30 113.55 122.75 1orw h SER 498 Ca -0.33 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.93 1orw h SER 498 Cb 1.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 1orw h SER 498 CO 0.45 0.00 -0.12 0.00 -0.87 0.00 0.00 176.83 176.29 1orw h ALA 499 N 1.34 0.30 -0.60 5.18 0.00 -1.97 -2.14 119.26 121.38 1orw h ALA 499 Ca 0.48 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1orw h ALA 499 Cb 2.09 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 1orw h ALA 499 CO -0.01 0.16 0.20 1.25 0.00 0.00 0.00 179.25 180.86 1orw h LEU 500 N 0.15 0.81 -0.80 0.00 5.85 -0.70 -2.42 115.31 118.21 1orw h LEU 500 Ca 0.04 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1orw h LEU 500 Cb 0.63 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 1orw h LEU 500 CO 0.04 0.76 0.43 -0.78 -0.34 0.00 0.00 178.44 178.54 1orw h ASP 501 N 0.86 1.00 0.03 1.25 3.58 -1.18 -1.29 116.42 120.68 1orw h ASP 501 Ca 0.20 -0.10 -0.00 0.00 0.42 0.00 0.00 57.03 57.54 1orw h ASP 501 Cb 0.22 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.01 1orw h ASP 501 CO -0.01 0.82 -0.01 0.50 -2.88 0.00 0.00 179.24 177.65 1orw h LYS 502 N 1.11 -0.04 0.58 0.28 1.63 -0.92 -3.00 116.57 116.21 1orw h LYS 502 Ca 0.28 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.06 1orw h LYS 502 Cb 0.04 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.68 1orw h LYS 502 CO -0.04 -0.01 -0.32 0.52 -3.45 0.00 0.00 179.45 176.15 1orw h MET 503 N -0.05 -0.81 -0.50 1.90 2.86 -1.18 -3.19 114.93 113.97 1orw h MET 503 Ca -0.00 0.05 0.14 0.00 -2.06 0.00 0.00 59.70 57.84 1orw h MET 503 Cb 0.05 0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1orw h MET 503 CO 0.01 -0.54 0.37 -0.07 1.06 0.00 0.00 176.91 177.74 1orw h LEU 504 N -0.84 0.00 0.00 1.22 3.38 -1.27 -1.73 115.31 116.08 1orw h LEU 504 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1orw h LEU 504 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1orw h LEU 504 CO 0.10 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.63 1orw n GLN 505 N -4.33 0.29 -0.01 1.13 10.64 -1.13 -1.32 117.38 122.64 1orw n GLN 505 Ca 0.09 0.03 0.06 0.00 -1.83 0.00 0.00 57.00 55.35 1orw n GLN 505 Cb 0.58 -1.50 -0.11 0.00 -0.86 0.00 0.00 30.24 28.35 1orw n GLN 505 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1orw n ASP 506 N -1.05 1.60 -4.90 2.61 4.64 -0.65 -4.95 116.55 113.85 1orw n ASP 506 Ca 0.07 0.00 -0.34 0.00 -1.38 0.00 0.00 54.79 53.14 1orw n ASP 506 Cb 0.04 1.58 -0.05 0.00 -1.04 0.00 0.00 41.12 41.66 1orw n ASP 506 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1orw s VAL 507 N -2.95 5.40 -1.24 5.18 0.11 -0.43 -4.12 120.40 122.34 1orw s VAL 507 Ca -0.06 -0.02 -0.20 0.00 -2.93 0.00 0.00 61.98 58.78 1orw s VAL 507 Cb 0.09 -3.53 0.01 0.00 -1.53 0.00 0.00 36.38 31.42 1orw s VAL 507 CO 0.61 0.37 1.79 -1.10 -3.33 0.00 0.00 175.10 173.45 1orw s GLN 508 N -1.79 3.45 0.55 1.54 -0.21 0.05 -4.95 119.66 118.30 1orw s GLN 508 Ca 0.26 -1.65 -0.20 0.00 0.02 0.00 0.00 55.36 53.79 1orw s GLN 508 Cb -0.13 -5.42 -0.05 0.00 1.00 0.00 0.00 33.01 28.41 1orw s GLN 508 CO 0.16 -2.85 1.18 -1.64 -2.12 0.00 0.00 175.29 170.02 1orw s MET 509 N 5.06 3.23 0.59 2.91 -1.94 -1.26 -4.47 119.30 123.42 1orw s MET 509 Ca 0.59 1.77 -0.08 0.00 -1.71 0.00 0.00 55.69 56.25 1orw s MET 509 Cb 0.02 -2.04 -0.01 0.00 2.01 0.00 0.00 34.83 34.81 1orw s MET 509 CO 0.09 -0.98 0.93 -1.25 -0.01 0.00 0.00 175.02 173.80 1orw s PRO 510 N -3.20 3.21 0.04 2.03 0.04 -1.26 -4.42 135.00 131.45 1orw s PRO 510 Ca 0.73 0.29 0.03 0.00 0.04 0.00 0.00 61.00 62.10 1orw s PRO 510 Cb -0.28 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 1orw s PRO 510 CO 0.32 -0.61 -0.01 -1.54 0.04 0.00 0.00 177.00 175.20 1orw s SER 511 N -4.24 4.97 -0.18 6.66 1.04 -0.39 -4.90 113.70 116.66 1orw s SER 511 Ca 0.53 -0.11 -0.01 0.00 0.48 0.00 0.00 55.95 56.84 1orw s SER 511 Cb -0.11 -1.22 0.00 0.00 0.10 0.00 0.00 66.02 64.80 1orw s SER 511 CO 0.48 0.23 -0.13 -0.75 0.98 0.00 0.00 173.24 174.05 1orw s LYS 512 N -1.87 3.21 0.16 4.02 2.20 -1.26 0.34 119.74 126.54 1orw s LYS 512 Ca 0.22 -0.73 0.09 0.00 -0.36 0.00 0.00 55.97 55.19 1orw s LYS 512 Cb -0.11 -2.72 -0.04 0.00 -1.51 0.00 0.00 37.83 33.44 1orw s LYS 512 CO 0.13 -0.10 -0.15 0.21 -0.36 0.00 0.00 175.35 175.08 1orw s LYS 513 N 1.13 1.86 -0.03 4.03 2.20 -0.19 -4.98 119.74 123.76 1orw s LYS 513 Ca 0.01 -1.30 0.04 0.00 -0.36 0.00 0.00 55.97 54.37 1orw s LYS 513 Cb -0.14 -2.08 -0.00 0.00 -1.51 0.00 0.00 37.83 34.09 1orw s LYS 513 CO -0.05 0.44 -0.16 -0.51 -0.36 0.00 0.00 175.35 174.71 1orw s LEU 514 N -2.58 1.93 0.00 5.43 1.02 -1.26 -1.49 118.68 121.72 1orw s LEU 514 Ca 0.22 -0.33 -0.00 0.00 0.02 0.00 0.00 54.13 54.04 1orw s LEU 514 Cb -0.09 -0.91 0.00 0.00 0.02 0.00 0.00 46.19 45.21 1orw s LEU 514 CO 0.12 0.16 0.02 -0.67 0.02 0.00 0.00 176.35 176.01 1orw n ASP 515 N 3.05 -0.07 -4.24 2.29 4.64 -0.91 -5.02 116.55 116.29 1orw n ASP 515 Ca -0.17 -1.07 -0.15 0.00 -1.38 0.00 0.00 54.79 52.02 1orw n ASP 515 Cb 0.53 0.12 -0.10 0.00 -1.04 0.00 0.00 41.12 40.63 1orw n ASP 515 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1orw s VAL 516 N -2.64 1.18 0.09 5.18 1.01 -1.26 -2.24 120.40 121.73 1orw s VAL 516 Ca 0.01 -1.96 -0.06 0.00 0.00 0.00 0.00 61.98 59.98 1orw s VAL 516 Cb -0.00 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 1orw s VAL 516 CO 0.01 -0.67 0.12 0.27 0.00 0.00 0.00 175.10 174.83 1orw s ILE 517 N -3.01 0.15 -0.24 2.22 -4.36 -0.62 -4.94 121.20 110.39 1orw s ILE 517 Ca 0.14 -1.45 -0.08 0.00 -0.26 0.00 0.00 60.65 59.00 1orw s ILE 517 Cb 0.01 -1.51 -0.03 0.00 1.25 0.00 0.00 42.46 42.17 1orw s ILE 517 CO 0.01 -0.70 0.08 0.21 0.24 0.00 0.00 174.94 174.78 1orw s ASN 518 N -2.91 5.27 -0.09 4.36 2.47 -1.26 -1.24 114.94 121.54 1orw s ASN 518 Ca 0.09 -0.15 0.04 0.00 0.42 0.00 0.00 52.86 53.26 1orw s ASN 518 Cb 0.06 -1.94 0.00 0.00 -1.45 0.00 0.00 41.25 37.91 1orw s ASN 518 CO -0.08 -0.01 -0.22 -0.76 -3.72 0.00 0.00 177.10 172.31 1orw s LEU 519 N 1.45 2.02 -1.09 3.21 1.43 -0.24 -4.78 118.68 120.67 1orw s LEU 519 Ca 0.06 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.53 1orw s LEU 519 Cb -0.15 -1.30 0.02 0.00 0.03 0.00 0.00 46.19 44.78 1orw s LEU 519 CO 0.04 0.15 0.22 0.00 0.23 0.00 0.00 176.35 176.99 1orw n HIS 520 N 3.48 -1.01 0.00 0.29 1.44 -1.26 0.13 115.22 118.29 1orw n HIS 520 Ca -0.19 0.29 0.00 0.00 -2.01 0.00 0.00 57.72 55.80 1orw n HIS 520 Cb 0.53 -2.15 0.00 0.00 0.12 0.00 0.00 29.99 28.48 1orw n HIS 520 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1orw n GLY 521 N -2.07 2.57 3.87 -1.39 0.00 -1.26 -5.00 105.19 101.91 1orw n GLY 521 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1orw n GLY 521 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1orw s THR 522 N -2.20 5.37 0.16 2.61 2.01 0.12 -5.08 115.64 118.64 1orw s THR 522 Ca 0.00 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.73 1orw s THR 522 Cb 0.00 -3.41 -0.07 0.00 0.01 0.00 0.00 72.50 69.02 1orw s THR 522 CO 0.00 0.48 0.85 -1.59 -0.69 0.00 0.00 174.62 173.68 1orw s LYS 523 N -1.43 4.67 0.06 4.92 -2.85 -1.26 -1.08 119.74 122.76 1orw s LYS 523 Ca 0.20 1.29 0.00 0.00 -1.00 0.00 0.00 55.97 56.47 1orw s LYS 523 Cb -0.12 -3.30 -0.04 0.00 -2.06 0.00 0.00 37.83 32.31 1orw s LYS 523 CO 0.10 0.45 -0.05 -0.06 0.10 0.00 0.00 175.35 175.90 1orw s PHE 524 N -0.78 0.63 0.08 1.78 0.40 -0.37 -4.95 117.98 114.77 1orw s PHE 524 Ca 0.40 -0.89 0.02 0.00 -0.60 0.00 0.00 56.93 55.86 1orw s PHE 524 Cb -0.24 -0.41 -0.04 0.00 0.51 0.00 0.00 43.02 42.84 1orw s PHE 524 CO 0.28 -0.25 0.15 -1.58 0.70 0.00 0.00 175.22 174.52 1orw s TRP 525 N -3.25 3.33 0.12 0.36 0.52 -1.26 -1.59 118.94 117.17 1orw s TRP 525 Ca 0.04 0.14 -0.12 0.00 0.02 0.00 0.00 56.10 56.18 1orw s TRP 525 Cb 0.03 -1.67 0.01 0.00 -1.15 0.00 0.00 33.47 30.70 1orw s TRP 525 CO -0.06 0.55 0.29 1.52 0.02 0.00 0.00 176.95 179.27 1orw s TYR 526 N -1.49 0.04 0.02 -1.98 -0.85 -0.95 -1.57 117.35 110.56 1orw s TYR 526 Ca 0.32 -0.41 0.01 0.00 -0.52 0.00 0.00 57.07 56.47 1orw s TYR 526 Cb -0.12 0.08 -0.01 0.00 0.38 0.00 0.00 41.96 42.28 1orw s TYR 526 CO 0.25 -0.64 -0.05 1.14 -1.52 0.00 0.00 175.55 174.73 1orw s GLN 527 N -3.85 0.39 -0.05 -3.49 -2.07 0.03 -2.13 119.66 108.48 1orw s GLN 527 Ca 0.06 -0.42 0.03 0.00 -1.82 0.00 0.00 55.36 53.20 1orw s GLN 527 Cb 0.03 -0.25 0.01 0.00 -1.09 0.00 0.00 33.01 31.71 1orw s GLN 527 CO -0.10 0.05 -0.12 -1.64 -1.32 0.00 0.00 175.29 172.16 1orw s MET 528 N -0.80 1.56 -0.33 9.60 -1.94 -0.56 -1.03 119.30 125.82 1orw s MET 528 Ca -0.05 -0.42 -0.12 0.00 -1.71 0.00 0.00 55.69 53.40 1orw s MET 528 Cb -0.06 -1.33 -0.02 0.00 2.01 0.00 0.00 34.83 35.44 1orw s MET 528 CO -0.00 0.07 0.21 0.42 -0.01 0.00 0.00 175.02 175.72 1orw s ILE 529 N 0.50 5.12 -0.10 2.53 -1.09 0.17 -1.02 121.20 127.30 1orw s ILE 529 Ca -0.11 -0.22 -0.03 0.00 -2.23 0.00 0.00 60.65 58.06 1orw s ILE 529 Cb -0.14 -3.60 -0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1orw s ILE 529 CO 0.03 0.04 0.03 -0.76 -1.23 0.00 0.00 174.94 173.05 1orw s LEU 530 N 1.70 3.76 0.83 2.97 1.43 0.15 -2.15 118.68 127.38 1orw s LEU 530 Ca 0.06 0.20 -0.13 0.00 -1.03 0.00 0.00 54.13 53.23 1orw s LEU 530 Cb -0.17 -1.88 0.10 0.00 0.03 0.00 0.00 46.19 44.26 1orw s LEU 530 CO 0.10 0.36 1.18 -2.65 0.23 0.00 0.00 176.35 175.57 1orw n PRO 531 N 2.26 0.05 -0.71 1.29 -0.02 -1.26 -1.26 135.00 135.35 1orw n PRO 531 Ca -0.19 0.10 -0.31 0.00 -2.02 0.00 0.00 63.50 61.07 1orw n PRO 531 Cb 0.54 -2.42 0.16 0.00 -0.02 0.00 0.00 33.50 31.76 1orw n PRO 531 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1orw n PRO 532 N -3.44 -0.41 -3.92 0.52 -0.02 -1.26 -3.58 135.00 122.89 1orw n PRO 532 Ca 0.13 -0.06 -0.35 0.00 -2.02 0.00 0.00 63.50 61.21 1orw n PRO 532 Cb 0.51 -2.31 0.01 0.00 -0.02 0.00 0.00 33.50 31.69 1orw n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1orw n HIS 533 N -4.13 -1.30 -1.84 6.00 8.25 -1.26 -4.72 115.22 116.22 1orw n HIS 533 Ca 0.11 0.22 -0.42 0.00 -0.26 0.00 0.00 57.72 57.38 1orw n HIS 533 Cb 0.52 -2.32 -0.03 0.00 1.12 0.00 0.00 29.99 29.29 1orw n HIS 533 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1orw s PHE 534 N -3.50 1.53 -0.52 4.41 5.36 -1.23 -4.94 117.98 119.08 1orw s PHE 534 Ca 0.30 0.69 -0.21 0.00 -0.96 0.00 0.00 56.93 56.76 1orw s PHE 534 Cb -0.17 -4.02 0.05 0.00 -0.34 0.00 0.00 43.02 38.55 1orw s PHE 534 CO 0.81 -3.23 0.72 0.34 -1.46 0.00 0.00 175.22 172.40 1orw s ASP 535 N 7.46 6.26 0.64 6.13 3.68 -1.26 -4.92 116.67 134.66 1orw s ASP 535 Ca 0.87 -0.76 0.43 0.00 2.13 0.00 0.00 52.55 55.22 1orw s ASP 535 Cb -0.25 -2.33 2.32 0.00 -1.45 0.00 0.00 42.92 41.21 1orw s ASP 535 CO 0.32 -1.00 2.31 0.11 0.13 0.00 0.00 175.17 177.05 1orw h LYS 536 N 9.09 0.00 0.00 4.34 6.56 -1.98 -1.00 116.57 133.58 1orw h LYS 536 Ca -0.27 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.32 1orw h LYS 536 Cb 1.09 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 1orw h LYS 536 CO 1.00 0.00 0.00 -1.13 -2.06 0.00 0.00 179.45 177.26 1orw n SER 537 N -3.01 0.55 -4.95 0.86 3.41 -1.26 -4.54 113.62 104.68 1orw n SER 537 Ca -0.03 0.59 -0.23 0.00 -0.26 0.00 0.00 58.87 58.94 1orw n SER 537 Cb 0.08 -0.72 -0.01 0.00 -0.26 0.00 0.00 64.21 63.30 1orw n SER 537 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1orw s LYS 538 N -3.15 3.47 -0.38 4.33 2.20 -0.38 -5.08 119.74 120.76 1orw s LYS 538 Ca 0.09 -0.44 -0.02 0.00 -0.36 0.00 0.00 55.97 55.23 1orw s LYS 538 Cb 0.12 -2.72 0.09 0.00 -1.51 0.00 0.00 37.83 33.82 1orw s LYS 538 CO 0.48 0.21 0.15 0.15 -0.36 0.00 0.00 175.35 175.98 1orw s LYS 539 N -4.24 2.07 0.10 4.03 1.02 -1.26 -4.36 119.74 117.10 1orw s LYS 539 Ca 0.39 -1.69 -0.22 0.00 0.02 0.00 0.00 55.97 54.46 1orw s LYS 539 Cb -0.09 -3.47 -0.07 0.00 -0.52 0.00 0.00 37.83 33.67 1orw s LYS 539 CO 0.34 -0.96 0.66 0.71 -0.92 0.00 0.00 175.35 175.19 1orw s TYR 540 N 1.16 3.83 0.74 3.18 1.51 0.07 -4.41 117.35 123.42 1orw s TYR 540 Ca 0.05 1.42 -0.13 0.00 -1.01 0.00 0.00 57.07 57.40 1orw s TYR 540 Cb -0.22 -2.63 0.04 0.00 -0.11 0.00 0.00 41.96 39.04 1orw s TYR 540 CO -0.04 0.52 1.14 -1.25 -1.11 0.00 0.00 175.55 174.82 1orw s PRO 541 N -0.98 2.24 -0.08 -1.71 0.04 -1.26 -0.90 135.00 132.35 1orw s PRO 541 Ca 0.32 1.47 0.05 0.00 0.04 0.00 0.00 61.00 62.89 1orw s PRO 541 Cb -0.21 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.45 1orw s PRO 541 CO 0.22 -1.70 -0.24 -1.17 0.04 0.00 0.00 177.00 174.15 1orw s LEU 542 N -5.42 2.07 -0.21 -3.56 0.20 -0.28 -1.56 118.68 109.91 1orw s LEU 542 Ca 0.68 -0.52 -0.00 0.00 0.69 0.00 0.00 54.13 54.97 1orw s LEU 542 Cb -0.23 -1.37 0.02 0.00 -0.43 0.00 0.00 46.19 44.19 1orw s LEU 542 CO 0.48 0.20 -0.13 -0.22 -0.29 0.00 0.00 176.35 176.39 1orw s LEU 543 N 0.07 2.69 -0.34 -0.68 0.20 0.22 -0.05 118.68 120.78 1orw s LEU 543 Ca -0.10 -0.76 -0.16 0.00 0.69 0.00 0.00 54.13 53.80 1orw s LEU 543 Cb -0.16 -1.58 -0.01 0.00 -0.43 0.00 0.00 46.19 44.02 1orw s LEU 543 CO 0.06 -0.06 0.41 -0.63 -0.29 0.00 0.00 176.35 175.84 1orw s ILE 544 N 1.31 5.12 -0.28 6.68 -1.09 0.44 -0.66 121.20 132.72 1orw s ILE 544 Ca 0.02 0.19 -0.15 0.00 -2.23 0.00 0.00 60.65 58.47 1orw s ILE 544 Cb -0.15 -3.86 -0.03 0.00 -1.58 0.00 0.00 42.46 36.84 1orw s ILE 544 CO -0.08 -0.11 0.40 -0.70 -1.23 0.00 0.00 174.94 173.22 1orw s GLU 545 N 2.14 3.94 0.09 2.79 2.12 0.12 -0.69 118.70 129.21 1orw s GLU 545 Ca 0.14 0.01 0.07 0.00 0.36 0.00 0.00 54.97 55.55 1orw s GLU 545 Cb -0.16 -3.68 -0.03 0.00 0.26 0.00 0.00 34.13 30.51 1orw s GLU 545 CO 0.12 -0.34 -0.18 0.54 -0.54 0.00 0.00 175.26 174.86 1orw s VAL 546 N 2.12 1.45 0.04 3.70 0.11 -0.42 -4.38 120.40 123.02 1orw s VAL 546 Ca 0.16 -1.43 0.00 0.00 -2.93 0.00 0.00 61.98 57.78 1orw s VAL 546 Cb -0.16 -1.35 0.00 0.00 -1.53 0.00 0.00 36.38 33.35 1orw s VAL 546 CO 0.10 -0.12 0.00 0.00 -3.33 0.00 0.00 175.10 171.75 1orw n TYR 547 N 1.19 -0.20 -0.86 1.54 9.36 -1.26 -4.27 117.16 122.66 1orw n TYR 547 Ca -0.20 0.04 0.00 0.00 3.32 0.00 0.00 57.90 61.05 1orw n TYR 547 Cb 0.54 0.17 0.00 0.00 -0.63 0.00 0.00 39.34 39.41 1orw n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1orw n ALA 548 N -2.74 0.00 -1.20 2.98 0.00 -1.26 -2.84 120.51 115.45 1orw n ALA 548 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1orw n ALA 548 Cb 0.00 -0.58 0.11 0.00 0.00 0.00 0.00 19.45 18.97 1orw n ALA 548 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orw n GLY 549 N -1.62 -0.47 3.67 0.00 0.00 -1.26 -4.74 105.19 100.78 1orw n GLY 549 Ca 0.00 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.14 1orw n GLY 549 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1orw n PRO 550 N -2.36 2.63 -1.36 1.61 -0.04 -1.26 -0.85 135.00 133.36 1orw n PRO 550 Ca 0.12 0.96 -0.05 0.00 -0.04 0.00 0.00 63.50 64.50 1orw n PRO 550 Cb 0.50 -2.87 -0.02 0.00 -0.04 0.00 0.00 33.50 31.08 1orw n PRO 550 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1orw s SER 552 N -2.91 5.30 -0.25 0.00 1.04 -0.03 -3.96 113.70 112.88 1orw s SER 552 Ca 0.00 0.52 -0.02 0.00 0.48 0.00 0.00 55.95 56.93 1orw s SER 552 Cb 0.00 -1.39 0.13 0.00 0.10 0.00 0.00 66.02 64.86 1orw s SER 552 CO 0.00 -1.24 0.34 -1.58 0.98 0.00 0.00 173.24 171.75 1orw s GLN 553 N -5.03 0.33 0.04 4.02 0.74 -1.26 -2.02 119.66 116.48 1orw s GLN 553 Ca 0.56 0.27 0.18 0.00 0.05 0.00 0.00 55.36 56.42 1orw s GLN 553 Cb -0.11 -0.61 -0.15 0.00 1.10 0.00 0.00 33.01 33.25 1orw s GLN 553 CO 0.44 -0.79 0.75 1.63 -0.55 0.00 0.00 175.29 176.76 1orw n LYS 554 N 5.34 0.63 -3.34 1.67 4.76 -1.26 -4.82 118.16 121.15 1orw n LYS 554 Ca -0.03 0.16 -0.41 0.00 -2.87 0.00 0.00 58.31 55.17 1orw n LYS 554 Cb 0.49 -1.76 -0.09 0.00 -1.84 0.00 0.00 35.03 31.83 1orw n LYS 554 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1orw s VAL 555 N -2.97 5.11 0.33 -0.18 1.01 -1.26 -4.96 120.40 117.48 1orw s VAL 555 Ca -0.04 0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 1orw s VAL 555 Cb 0.09 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.64 1orw s VAL 555 CO 0.82 -0.09 0.62 1.51 0.00 0.00 0.00 175.10 177.96 1orw s ASP 556 N 1.72 0.20 -0.33 3.32 1.47 -1.26 -4.34 116.67 117.46 1orw s ASP 556 Ca 0.15 -1.12 0.08 0.00 1.18 0.00 0.00 52.55 52.84 1orw s ASP 556 Cb -0.16 0.72 0.67 0.00 -0.34 0.00 0.00 42.92 43.82 1orw s ASP 556 CO 0.12 -1.41 1.75 0.35 0.68 0.00 0.00 175.17 176.66 1orw n THR 557 N -0.50 2.81 -2.66 2.11 -2.24 -1.00 -4.94 114.28 107.86 1orw n THR 557 Ca -0.04 -1.55 -0.43 0.00 -2.27 0.00 0.00 64.05 59.77 1orw n THR 557 Cb 0.61 -0.42 -0.02 0.00 -2.10 0.00 0.00 70.33 68.39 1orw n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1orw s VAL 558 N -2.84 4.62 0.33 2.28 1.01 -1.26 -1.47 120.40 123.06 1orw s VAL 558 Ca 0.51 1.90 -0.29 0.00 0.00 0.00 0.00 61.98 64.11 1orw s VAL 558 Cb 0.41 -4.35 -0.10 0.00 0.00 0.00 0.00 36.38 32.34 1orw s VAL 558 CO 0.12 -0.30 1.39 0.12 0.00 0.00 0.00 175.10 176.43 1orw s PHE 559 N 3.37 2.91 -0.05 5.22 5.36 0.97 -4.95 117.98 130.82 1orw s PHE 559 Ca 0.44 1.26 -0.11 0.00 -0.96 0.00 0.00 56.93 57.57 1orw s PHE 559 Cb -0.14 -3.81 0.02 0.00 -0.34 0.00 0.00 43.02 38.75 1orw s PHE 559 CO 0.10 -2.35 0.25 1.03 -1.46 0.00 0.00 175.22 172.79 1orw s ARG 560 N -1.58 0.47 -0.72 10.12 0.52 -1.26 -4.92 118.95 121.58 1orw s ARG 560 Ca 0.52 0.00 0.02 0.00 -0.52 0.00 0.00 55.73 55.76 1orw s ARG 560 Cb -0.42 0.21 0.18 0.00 0.52 0.00 0.00 34.95 35.44 1orw s ARG 560 CO 0.54 -0.10 0.53 -0.51 0.02 0.00 0.00 175.30 175.77 1orw s LEU 561 N -0.71 4.98 0.00 2.53 1.02 -1.26 -4.90 118.68 120.34 1orw s LEU 561 Ca -0.08 -3.60 0.03 0.00 0.02 0.00 0.00 54.13 50.50 1orw s LEU 561 Cb -0.04 -1.73 0.03 0.00 0.02 0.00 0.00 46.19 44.47 1orw s LEU 561 CO 0.02 -0.16 0.26 -1.54 0.02 0.00 0.00 176.35 174.95 1orw n SER 562 N 2.38 1.62 0.03 2.29 3.41 -1.26 -4.99 113.62 117.10 1orw n SER 562 Ca 0.17 -1.88 -0.02 0.00 -0.26 0.00 0.00 58.87 56.88 1orw n SER 562 Cb 0.35 -0.08 0.24 0.00 -0.26 0.00 0.00 64.21 64.47 1orw n SER 562 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 1orw h TRP 563 N 0.42 0.48 -0.67 7.33 7.01 -1.97 -2.53 115.95 126.03 1orw h TRP 563 Ca -0.16 -0.09 -0.02 0.00 2.11 0.00 0.00 58.89 60.73 1orw h TRP 563 Cb 0.62 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.53 1orw h TRP 563 CO 0.00 0.62 0.33 0.00 -2.79 0.00 0.00 178.44 176.60 1orw h ALA 564 N 1.39 0.86 -0.57 2.65 0.00 -1.97 0.15 119.26 121.77 1orw h ALA 564 Ca 0.07 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 54.95 1orw h ALA 564 Cb 0.59 -0.26 -0.09 0.00 0.00 0.00 0.00 17.79 18.02 1orw h ALA 564 CO 0.04 0.42 0.04 1.15 0.00 0.00 0.00 179.25 180.89 1orw h THR 565 N 0.92 0.57 -0.10 0.00 2.02 -1.80 0.13 112.91 114.65 1orw h THR 565 Ca 0.23 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.35 1orw h THR 565 Cb 0.11 0.41 -0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1orw h THR 565 CO -0.03 0.03 0.05 0.22 0.37 0.00 0.00 175.52 176.16 1orw h TYR 566 N 0.15 0.15 -0.15 3.16 3.20 -1.27 -0.41 116.97 121.81 1orw h TYR 566 Ca 0.30 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.20 1orw h TYR 566 Cb 0.46 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1orw h TYR 566 CO -0.31 0.21 0.18 -0.07 -1.64 0.00 0.00 178.16 176.53 1orw h LEU 567 N 0.05 0.00 0.00 2.82 3.38 0.13 -0.82 115.31 120.87 1orw h LEU 567 Ca 0.04 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.63 1orw h LEU 567 Cb 0.11 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.79 1orw h LEU 567 CO -0.00 0.00 -2.44 0.00 0.09 0.00 0.00 178.44 176.09 1orw n ALA 568 N -2.29 1.46 0.00 1.53 0.00 0.25 -0.51 120.51 120.96 1orw n ALA 568 Ca 0.01 -1.16 -0.12 0.00 0.00 0.00 0.00 53.44 52.16 1orw n ALA 568 Cb 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.63 1orw n ALA 568 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1orw h SER 569 N 0.00 0.70 0.00 0.00 0.87 -0.87 -3.08 113.55 111.16 1orw h SER 569 Ca -0.56 -0.42 -0.28 0.00 -1.23 0.00 0.00 61.79 59.30 1orw h SER 569 Cb 1.99 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 63.71 1orw h SER 569 CO -0.05 1.17 -1.89 0.41 -0.53 0.00 0.00 176.83 175.94 1orw n THR 570 N -3.92 1.42 1.40 2.23 -1.04 -0.33 -4.56 114.28 109.47 1orw n THR 570 Ca -0.05 -0.17 0.10 0.00 -2.04 0.00 0.00 64.05 61.89 1orw n THR 570 Cb 0.68 -2.00 0.40 0.00 -1.82 0.00 0.00 70.33 67.58 1orw n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1orw n GLU 571 N -4.22 1.55 -3.84 -2.82 -0.58 -1.23 -4.95 120.64 104.56 1orw n GLU 571 Ca -0.37 -0.84 -0.33 0.00 -0.42 0.00 0.00 57.16 55.20 1orw n GLU 571 Cb 0.72 -1.36 0.02 0.00 -0.57 0.00 0.00 31.44 30.25 1orw n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1orw n ASN 572 N 0.07 -3.84 -4.22 1.62 4.13 -1.16 -4.93 115.26 106.92 1orw n ASN 572 Ca 0.15 -1.08 -0.32 0.00 1.68 0.00 0.00 54.58 55.01 1orw n ASN 572 Cb 0.26 -2.92 -0.17 0.00 -1.54 0.00 0.00 39.78 35.42 1orw n ASN 572 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1orw s ILE 573 N -3.61 2.14 -0.02 2.41 1.01 0.33 -4.42 121.20 119.05 1orw s ILE 573 Ca 0.37 -0.98 -0.30 0.00 0.00 0.00 0.00 60.65 59.73 1orw s ILE 573 Cb -0.15 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.46 1orw s ILE 573 CO 0.89 0.55 1.09 -0.63 0.00 0.00 0.00 174.94 176.85 1orw s ILE 574 N 0.47 4.49 -0.20 2.92 1.01 -0.60 -3.53 121.20 125.76 1orw s ILE 574 Ca -0.15 1.79 -0.03 0.00 0.00 0.00 0.00 60.65 62.26 1orw s ILE 574 Cb -0.17 -4.15 -0.01 0.00 0.01 0.00 0.00 42.46 38.15 1orw s ILE 574 CO 0.06 0.08 -0.07 -0.69 0.00 0.00 0.00 174.94 174.31 1orw s VAL 575 N 1.50 3.18 0.29 2.92 1.01 -0.91 0.70 120.40 129.09 1orw s VAL 575 Ca 0.54 -0.57 0.11 0.00 0.00 0.00 0.00 61.98 62.06 1orw s VAL 575 Cb -0.24 -2.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 1orw s VAL 575 CO 0.25 0.45 -0.16 0.00 0.00 0.00 0.00 175.10 175.65 1orw s ALA 576 N 1.26 2.71 -0.01 5.51 0.00 0.16 0.43 121.76 131.83 1orw s ALA 576 Ca 0.03 -1.92 -0.09 0.00 0.00 0.00 0.00 51.96 49.98 1orw s ALA 576 Cb -0.14 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.83 1orw s ALA 576 CO -0.03 0.18 0.19 -1.12 0.00 0.00 0.00 175.76 174.98 1orw s SER 577 N -3.52 -0.06 -0.10 0.00 0.01 -0.19 -0.70 113.70 109.14 1orw s SER 577 Ca 0.30 -0.07 -0.05 0.00 1.31 0.00 0.00 55.95 57.44 1orw s SER 577 Cb -0.02 0.26 0.04 0.00 0.21 0.00 0.00 66.02 66.51 1orw s SER 577 CO 0.14 -0.36 0.23 0.12 0.41 0.00 0.00 173.24 173.78 1orw s PHE 578 N -1.22 -0.30 -0.43 2.43 5.36 -1.26 -0.79 117.98 121.77 1orw s PHE 578 Ca -0.13 0.73 -0.11 0.00 -0.96 0.00 0.00 56.93 56.46 1orw s PHE 578 Cb -0.06 0.04 0.07 0.00 -0.34 0.00 0.00 43.02 42.72 1orw s PHE 578 CO 0.02 -0.21 0.29 -0.51 -1.46 0.00 0.00 175.22 173.35 1orw s ASP 579 N 1.11 5.77 0.00 6.13 1.01 -0.61 -4.88 116.67 125.20 1orw s ASP 579 Ca -0.08 -1.40 0.00 0.00 0.71 0.00 0.00 52.55 51.78 1orw s ASP 579 Cb -0.09 -2.04 0.00 0.00 1.01 0.00 0.00 42.92 41.80 1orw s ASP 579 CO -0.07 -0.54 0.00 0.61 0.21 0.00 0.00 175.17 175.37 1orw n GLY 580 N 5.00 2.74 3.72 0.21 0.00 -1.26 -4.09 105.19 111.50 1orw n GLY 580 Ca -0.11 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 1orw n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1orw s ARG 581 N 4.09 4.16 0.00 1.61 0.52 -1.26 -1.93 118.95 126.14 1orw s ARG 581 Ca 0.00 2.52 0.00 0.00 -0.52 0.00 0.00 55.73 57.73 1orw s ARG 581 Cb 0.00 -3.10 0.00 0.00 0.52 0.00 0.00 34.95 32.37 1orw s ARG 581 CO 0.00 -0.70 0.00 0.41 0.02 0.00 0.00 175.30 175.03 1orw n GLY 582 N 3.84 2.05 3.41 -3.53 0.00 -0.67 -3.62 105.19 106.66 1orw n GLY 582 Ca 0.15 -0.52 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1orw n GLY 582 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1orw n SER 583 N 0.13 -1.85 -2.09 1.61 3.41 -0.81 -0.54 113.62 113.48 1orw n SER 583 Ca 0.00 -0.06 -0.01 0.00 -0.26 0.00 0.00 58.87 58.54 1orw n SER 583 Cb 0.00 -1.16 -0.00 0.00 -0.26 0.00 0.00 64.21 62.79 1orw n SER 583 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1orw n GLY 584 N 1.38 3.97 2.69 5.00 0.00 -0.86 -3.08 105.19 114.30 1orw n GLY 584 Ca 0.03 -2.21 -0.05 0.00 0.00 0.00 0.00 46.02 43.79 1orw n GLY 584 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1orw n TYR 585 N -0.14 0.00 -1.23 1.61 4.01 -1.26 -4.79 117.16 115.36 1orw n TYR 585 Ca -0.01 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.79 1orw n TYR 585 Cb 0.02 -2.01 0.08 0.00 -0.31 0.00 0.00 39.34 37.12 1orw n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1orw n GLN 586 N -0.69 1.01 0.00 -0.72 6.02 -1.26 -4.38 117.38 117.35 1orw n GLN 586 Ca -0.05 -1.91 0.00 0.00 -0.01 0.00 0.00 57.00 55.03 1orw n GLN 586 Cb 0.45 -1.11 0.00 0.00 1.02 0.00 0.00 30.24 30.60 1orw n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1orw n GLY 587 N -0.85 1.91 0.21 1.08 0.00 -1.26 -4.64 105.19 101.64 1orw n GLY 587 Ca 0.09 -1.92 0.13 0.00 0.00 0.00 0.00 46.02 44.31 1orw n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1orw h ASP 588 N 0.00 0.00 -0.59 1.61 3.32 -0.99 -2.40 116.42 117.37 1orw h ASP 588 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 1orw h ASP 588 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1orw h ASP 588 CO 0.00 0.00 0.07 0.11 -1.72 0.00 0.00 179.24 177.70 1orw h LYS 589 N 0.00 0.99 0.00 3.56 1.57 -1.86 0.14 116.57 120.97 1orw h LYS 589 Ca 0.00 -0.28 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1orw h LYS 589 Cb 0.91 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.11 1orw h LYS 589 CO 0.00 0.95 -0.00 0.82 -0.57 0.00 0.00 179.45 180.65 1orw h ILE 590 N 0.89 1.14 -0.15 1.86 2.04 -1.82 -3.22 117.51 118.27 1orw h ILE 590 Ca 0.18 -1.86 -0.00 0.00 1.00 0.00 0.00 64.86 64.17 1orw h ILE 590 Cb 0.45 2.16 -0.01 0.00 -0.74 0.00 0.00 36.82 38.69 1orw h ILE 590 CO 0.02 0.39 0.07 -0.03 0.00 0.00 0.00 178.15 178.59 1orw h MET 591 N -1.00 0.20 -0.02 2.37 4.05 -1.35 -1.67 114.93 117.51 1orw h MET 591 Ca -0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1orw h MET 591 Cb 0.64 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 1orw h MET 591 CO -0.00 0.16 -0.03 0.72 0.23 0.00 0.00 176.91 177.99 1orw n HIS 592 N -4.49 0.00 -0.14 1.39 8.25 0.50 -4.29 115.22 116.45 1orw n HIS 592 Ca -0.01 0.00 0.23 0.00 -0.26 0.00 0.00 57.72 57.68 1orw n HIS 592 Cb 0.10 -0.01 0.66 0.00 1.12 0.00 0.00 29.99 31.86 1orw n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1orw h ALA 593 N 4.36 2.56 -0.69 -1.41 0.00 -1.44 -0.91 119.26 121.73 1orw h ALA 593 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1orw h ALA 593 Cb 0.60 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1orw h ALA 593 CO 0.00 -0.79 0.00 0.44 0.00 0.00 0.00 179.25 178.90 1orw n ILE 594 N -4.36 1.55 -1.70 0.00 -5.35 -1.26 -4.95 119.36 103.28 1orw n ILE 594 Ca 0.16 -1.12 -0.43 0.00 -0.27 0.00 0.00 62.75 61.09 1orw n ILE 594 Cb 0.78 0.25 -0.02 0.00 -1.74 0.00 0.00 39.64 38.91 1orw n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1orw n ASN 595 N 1.34 3.08 -0.24 7.28 4.05 -0.35 -1.50 115.26 128.92 1orw n ASN 595 Ca 0.26 1.16 -0.03 0.00 0.45 0.00 0.00 54.58 56.42 1orw n ASN 595 Cb 0.81 -1.49 -0.01 0.00 1.23 0.00 0.00 39.78 40.31 1orw n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1orw n ARG 596 N 1.60 -1.92 -2.97 1.20 1.74 0.29 -4.82 116.66 111.77 1orw n ARG 596 Ca 0.09 0.61 -0.15 0.00 -0.77 0.00 0.00 57.85 57.63 1orw n ARG 596 Cb 0.34 -5.09 0.01 0.00 -1.02 0.00 0.00 32.46 26.70 1orw n ARG 596 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1orw n ARG 597 N 0.49 0.88 -2.43 5.56 1.85 -0.56 -4.84 116.66 117.60 1orw n ARG 597 Ca -0.03 -2.59 -0.38 0.00 -1.00 0.00 0.00 57.85 53.85 1orw n ARG 597 Cb 0.53 -1.36 -0.03 0.00 -1.05 0.00 0.00 32.46 30.55 1orw n ARG 597 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1orw s LEU 598 N -1.69 4.19 0.00 2.89 1.43 -1.25 -3.50 118.68 120.75 1orw s LEU 598 Ca 0.32 2.19 0.00 0.00 -1.03 0.00 0.00 54.13 55.61 1orw s LEU 598 Cb 0.26 -4.08 0.00 0.00 0.03 0.00 0.00 46.19 42.41 1orw s LEU 598 CO -0.12 -0.56 0.00 0.61 0.23 0.00 0.00 176.35 176.52 1orw n GLY 599 N 0.54 0.72 0.00 -3.19 0.00 -1.26 -4.83 105.19 97.17 1orw n GLY 599 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1orw n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1orw n THR 600 N -2.47 0.00 -0.34 2.61 -2.24 -1.23 -4.55 114.28 106.06 1orw n THR 600 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 1orw n THR 600 Cb 0.00 -0.50 0.18 0.00 -2.10 0.00 0.00 70.33 67.90 1orw n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1orw h PHE 601 N 0.00 1.16 0.00 4.78 0.04 -1.91 0.16 116.94 121.16 1orw h PHE 601 Ca 0.00 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.73 1orw h PHE 601 Cb 0.00 -0.39 -0.01 0.00 2.20 0.00 0.00 35.95 37.75 1orw h PHE 601 CO 0.00 0.66 -0.31 1.05 -0.60 0.00 0.00 178.31 179.11 1orw h GLU 602 N 1.19 0.00 0.04 1.51 9.09 -1.89 -1.11 114.58 123.40 1orw h GLU 602 Ca 0.39 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.79 1orw h GLU 602 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.14 1orw h GLU 602 CO -0.12 0.31 -0.02 0.28 0.05 0.00 0.00 179.01 179.50 1orw h VAL 603 N 0.00 1.19 -0.88 -1.06 2.07 -1.55 -3.09 116.25 112.93 1orw h VAL 603 Ca -0.00 -1.71 0.12 0.00 0.82 0.00 0.00 66.70 65.93 1orw h VAL 603 Cb 0.78 2.17 -0.08 0.00 -1.52 0.00 0.00 31.29 32.64 1orw h VAL 603 CO 0.04 0.37 0.50 -0.33 0.02 0.00 0.00 177.57 178.18 1orw h GLU 604 N -0.93 0.76 0.00 1.57 5.08 -0.68 -1.10 114.58 119.28 1orw h GLU 604 Ca -0.01 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1orw h GLU 604 Cb 0.65 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1orw h GLU 604 CO 0.01 0.50 -0.13 -0.44 -1.00 0.00 0.00 179.01 177.96 1orw h ASP 605 N 0.79 0.00 -0.04 1.42 3.32 -1.32 -1.64 116.42 118.95 1orw h ASP 605 Ca 0.45 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.34 1orw h ASP 605 Cb 0.50 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1orw h ASP 605 CO -0.29 0.13 -0.50 1.56 -1.72 0.00 0.00 179.24 178.42 1orw h GLN 606 N 0.00 0.60 0.02 3.56 1.08 -1.12 -1.28 115.11 117.96 1orw h GLN 606 Ca -0.00 -0.35 -0.00 0.00 -1.45 0.00 0.00 58.65 56.84 1orw h GLN 606 Cb 0.75 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 1orw h GLN 606 CO 0.02 0.96 -0.01 0.82 -0.95 0.00 0.00 178.83 179.67 1orw h ILE 607 N 0.48 1.36 -0.55 2.54 2.04 -1.10 -2.31 117.51 119.96 1orw h ILE 607 Ca 0.02 -1.15 -0.01 0.00 1.00 0.00 0.00 64.86 64.72 1orw h ILE 607 Cb 1.03 2.13 -0.03 0.00 -0.74 0.00 0.00 36.82 39.22 1orw h ILE 607 CO 0.10 0.30 0.31 -0.08 0.00 0.00 0.00 178.15 178.77 1orw h GLU 608 N -0.52 0.76 -0.57 2.37 4.81 -1.33 0.13 114.58 120.24 1orw h GLU 608 Ca -0.00 -0.08 -0.07 0.00 -0.13 0.00 0.00 59.36 59.08 1orw h GLU 608 Cb 0.50 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 1orw h GLU 608 CO 0.00 0.58 0.09 0.00 -0.73 0.00 0.00 179.01 178.95 1orw h ALA 609 N 1.14 1.09 -0.40 2.92 0.00 -1.30 -0.97 119.26 121.74 1orw h ALA 609 Ca 0.19 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1orw h ALA 609 Cb 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1orw h ALA 609 CO -0.03 0.59 -0.05 1.15 0.00 0.00 0.00 179.25 180.90 1orw h THR 610 N 0.86 1.27 -0.82 0.00 2.02 -0.98 -1.08 112.91 114.17 1orw h THR 610 Ca 0.18 -1.12 0.11 0.00 0.77 0.00 0.00 66.41 66.35 1orw h THR 610 Cb 0.38 1.17 -0.08 0.00 -1.74 0.00 0.00 68.15 67.88 1orw h THR 610 CO 0.01 0.38 0.44 -0.09 0.37 0.00 0.00 175.52 176.63 1orw h ARG 611 N 0.57 0.69 -0.27 6.66 2.43 -0.20 0.19 114.38 124.45 1orw h ARG 611 Ca 0.11 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1orw h ARG 611 Cb 0.56 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 1orw h ARG 611 CO 0.03 0.45 0.06 1.96 -1.51 0.00 0.00 179.97 180.97 1orw h GLN 612 N 0.71 0.43 -0.72 0.20 4.20 -0.81 -2.78 115.11 116.34 1orw h GLN 612 Ca 0.41 -0.11 0.11 0.00 0.06 0.00 0.00 58.65 59.13 1orw h GLN 612 Cb 0.46 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.14 1orw h GLN 612 CO -0.29 0.53 0.48 0.74 -0.67 0.00 0.00 178.83 179.61 1orw h PHE 613 N 0.26 0.58 0.00 2.96 0.04 0.37 -1.69 116.94 119.45 1orw h PHE 613 Ca 0.08 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.82 1orw h PHE 613 Cb 0.29 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 1orw h PHE 613 CO 0.01 0.26 -0.21 0.66 -0.60 0.00 0.00 178.31 178.43 1orw h SER 614 N 0.53 0.00 -0.08 2.17 4.64 -0.45 -2.71 113.55 117.65 1orw h SER 614 Ca 0.34 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.63 1orw h SER 614 Cb 0.61 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 1orw h SER 614 CO -0.12 0.21 -0.03 0.11 -0.87 0.00 0.00 176.83 176.14 1orw h LYS 615 N 0.00 0.28 -6.80 4.77 1.79 -1.25 -3.42 116.57 111.95 1orw h LYS 615 Ca -0.00 -0.05 -0.57 0.00 -2.18 0.00 0.00 60.65 57.85 1orw h LYS 615 Cb 0.47 -0.05 0.13 0.00 -1.58 0.00 0.00 32.23 31.20 1orw h LYS 615 CO 0.03 0.34 0.36 -1.33 -1.08 0.00 0.00 179.45 177.76 1orw n MET 616 N -4.35 1.60 0.28 3.15 2.81 -1.02 -4.90 117.12 114.69 1orw n MET 616 Ca -0.00 0.58 0.18 0.00 -1.81 0.00 0.00 57.70 56.64 1orw n MET 616 Cb 0.20 -2.28 0.73 0.00 -0.71 0.00 0.00 33.22 31.16 1orw n MET 616 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1orw h GLY 617 N 1.65 0.00 -1.48 3.03 0.00 -1.89 -2.99 103.07 101.38 1orw h GLY 617 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1orw h GLY 617 CO 0.57 0.00 0.00 1.97 0.00 0.00 0.00 176.54 179.08 1orw n PHE 618 N -3.08 0.32 -4.11 5.60 1.16 -1.26 -4.63 117.46 111.46 1orw n PHE 618 Ca 0.00 -0.16 -0.35 0.00 -1.87 0.00 0.00 57.45 55.08 1orw n PHE 618 Cb 0.29 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.04 1orw n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1orw s VAL 619 N -1.68 4.26 -1.26 1.97 1.01 -1.13 -0.75 120.40 122.80 1orw s VAL 619 Ca 0.35 -0.22 -0.16 0.00 0.00 0.00 0.00 61.98 61.94 1orw s VAL 619 Cb 0.20 -2.92 0.11 0.00 0.00 0.00 0.00 36.38 33.77 1orw s VAL 619 CO 0.29 0.44 1.62 -0.62 0.00 0.00 0.00 175.10 176.83 1orw s ASP 620 N 0.70 6.92 0.03 3.32 -1.08 -0.07 -4.75 116.67 121.74 1orw s ASP 620 Ca 0.01 -2.65 0.00 0.00 -0.52 0.00 0.00 52.55 49.39 1orw s ASP 620 Cb -0.14 -2.51 0.00 0.00 -1.46 0.00 0.00 42.92 38.81 1orw s ASP 620 CO 0.02 -1.01 0.53 -0.90 0.52 0.00 0.00 175.17 174.33 1orw n ASP 621 N 7.38 0.00 -1.10 -0.34 5.75 -1.26 0.86 116.55 127.84 1orw n ASP 621 Ca 0.44 0.03 0.10 0.00 -0.01 0.00 0.00 54.79 55.36 1orw n ASP 621 Cb 0.45 -0.01 0.23 0.00 -1.03 0.00 0.00 41.12 40.76 1orw n ASP 621 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1orw n LYS 622 N -1.08 2.51 -3.18 0.11 4.01 -1.26 -4.65 118.16 114.62 1orw n LYS 622 Ca -0.00 -2.30 -0.22 0.00 -0.51 0.00 0.00 58.31 55.27 1orw n LYS 622 Cb 0.51 -1.48 -0.06 0.00 -0.51 0.00 0.00 35.03 33.49 1orw n LYS 622 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1orw n ARG 623 N 1.35 0.60 -4.24 1.97 1.74 0.25 -4.89 116.66 113.44 1orw n ARG 623 Ca 0.19 -3.02 -0.30 0.00 -0.77 0.00 0.00 57.85 53.95 1orw n ARG 623 Cb 0.57 -1.34 -0.17 0.00 -1.02 0.00 0.00 32.46 30.50 1orw n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1orw s ILE 624 N -0.66 1.57 0.36 0.55 1.01 -1.26 -1.13 121.20 121.64 1orw s ILE 624 Ca 0.34 -0.65 0.08 0.00 0.00 0.00 0.00 60.65 60.42 1orw s ILE 624 Cb 0.14 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 1orw s ILE 624 CO -0.14 0.46 0.16 0.00 0.00 0.00 0.00 174.94 175.41 1orw s ALA 625 N 1.24 3.54 -0.08 9.38 0.00 0.92 -1.43 121.76 135.33 1orw s ALA 625 Ca -0.01 -1.90 -0.03 0.00 0.00 0.00 0.00 51.96 50.02 1orw s ALA 625 Cb -0.14 -0.65 0.04 0.00 0.00 0.00 0.00 23.12 22.37 1orw s ALA 625 CO -0.06 -0.03 0.17 -1.50 0.00 0.00 0.00 175.76 174.34 1orw s ILE 626 N -2.47 -0.10 0.13 0.00 2.07 -1.06 -0.42 121.20 119.35 1orw s ILE 626 Ca 0.39 0.21 0.03 0.00 -1.41 0.00 0.00 60.65 59.87 1orw s ILE 626 Cb -0.01 -0.29 -0.04 0.00 0.13 0.00 0.00 42.46 42.25 1orw s ILE 626 CO 0.23 0.09 -0.07 -1.66 -1.91 0.00 0.00 174.94 171.62 1orw s TRP 627 N 1.45 1.07 -0.02 3.50 1.48 0.13 -2.02 118.94 124.53 1orw s TRP 627 Ca -0.07 -0.88 -0.30 0.00 -1.06 0.00 0.00 56.10 53.80 1orw s TRP 627 Cb -0.11 -0.59 0.11 0.00 -1.16 0.00 0.00 33.47 31.71 1orw s TRP 627 CO -0.07 -0.08 0.96 0.20 -4.06 0.00 0.00 176.95 173.91 1orw s GLY 628 N -3.11 -0.41 -0.04 3.67 0.00 -0.66 -1.30 107.32 105.47 1orw s GLY 628 Ca 0.15 1.02 0.07 0.00 0.00 0.00 0.00 44.72 45.96 1orw s GLY 628 CO -0.02 0.33 -0.25 0.86 0.00 0.00 0.00 173.10 174.02 1orw s TRP 629 N -2.99 2.36 0.00 1.90 -0.11 -1.26 0.14 118.94 118.98 1orw s TRP 629 Ca 0.07 -0.57 0.00 0.00 1.22 0.00 0.00 56.10 56.82 1orw s TRP 629 Cb -0.01 -1.53 0.00 0.00 -1.50 0.00 0.00 33.47 30.43 1orw s TRP 629 CO -0.07 -0.12 0.00 0.45 -4.62 0.00 0.00 176.95 172.59 1orw n SER 630 N 2.68 0.00 -0.03 5.86 2.88 0.43 -1.44 113.62 123.99 1orw n SER 630 Ca -0.17 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.21 1orw n SER 630 Cb 0.51 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.91 1orw n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1orw h TYR 631 N 0.00 1.06 -0.01 0.66 5.03 -1.85 -2.31 116.97 119.55 1orw h TYR 631 Ca 0.00 -0.45 -0.02 0.00 2.58 0.00 0.00 58.73 60.84 1orw h TYR 631 Cb 0.00 -0.17 -0.00 0.00 1.55 0.00 0.00 36.73 38.11 1orw h TYR 631 CO 0.00 1.29 -0.08 0.78 -1.32 0.00 0.00 178.16 178.83 1orw h GLY 632 N 0.61 0.02 1.89 1.82 0.00 -1.09 0.18 103.07 106.50 1orw h GLY 632 Ca -0.04 -0.01 -0.17 0.00 0.00 0.00 0.00 47.33 47.12 1orw h GLY 632 CO 0.15 0.01 -0.75 -1.33 0.00 0.00 0.00 176.54 174.62 1orw h GLY 633 N 0.27 0.11 0.66 4.60 0.00 -1.47 0.56 103.07 107.80 1orw h GLY 633 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1orw h GLY 633 CO 0.01 0.15 -0.01 -1.82 0.00 0.00 0.00 176.54 174.88 1orw h TYR 634 N 0.06 0.06 -0.22 5.60 3.20 -0.33 -1.57 116.97 123.77 1orw h TYR 634 Ca -0.02 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 1orw h TYR 634 Cb 1.33 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.57 1orw h TYR 634 CO 0.01 0.41 0.09 0.28 -1.64 0.00 0.00 178.16 177.30 1orw h VAL 635 N -0.30 1.17 -0.67 1.81 2.07 -0.72 0.18 116.25 119.80 1orw h VAL 635 Ca 0.01 -0.52 0.14 0.00 0.82 0.00 0.00 66.70 67.14 1orw h VAL 635 Cb 0.39 1.10 -0.10 0.00 -1.52 0.00 0.00 31.29 31.16 1orw h VAL 635 CO 0.00 0.17 0.15 0.74 0.02 0.00 0.00 177.57 178.65 1orw h THR 636 N 0.21 0.57 -0.55 2.57 2.02 -0.89 0.51 112.91 117.36 1orw h THR 636 Ca 0.07 -0.09 -0.06 0.00 0.77 0.00 0.00 66.41 67.10 1orw h THR 636 Cb 0.19 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 1orw h THR 636 CO -0.01 0.05 0.10 0.28 0.37 0.00 0.00 175.52 176.32 1orw h SER 637 N 0.26 0.86 -0.20 4.18 0.02 -0.68 0.79 113.55 118.78 1orw h SER 637 Ca 0.36 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 60.99 1orw h SER 637 Cb 0.58 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 1orw h SER 637 CO -0.46 0.89 -0.09 0.24 -1.14 0.00 0.00 176.83 176.27 1orw h MET 638 N 0.79 0.57 -0.12 3.45 2.86 0.11 -2.16 114.93 120.42 1orw h MET 638 Ca 0.17 -0.16 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 1orw h MET 638 Cb 0.39 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 1orw h MET 638 CO 0.01 0.66 -0.11 0.28 1.06 0.00 0.00 176.91 178.81 1orw h VAL 639 N 0.53 1.35 0.00 -2.22 2.07 0.35 -2.57 116.25 115.76 1orw h VAL 639 Ca 0.10 -1.26 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 1orw h VAL 639 Cb 0.48 1.92 -0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1orw h VAL 639 CO 0.03 0.36 -0.04 -0.07 0.02 0.00 0.00 177.57 177.87 1orw h LEU 640 N -0.10 0.00 -3.17 2.57 3.38 -0.67 -0.88 115.31 116.44 1orw h LEU 640 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1orw h LEU 640 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1orw h LEU 640 CO 0.03 0.04 0.00 0.61 0.09 0.00 0.00 178.44 179.21 1orw n GLY 641 N -1.36 2.76 0.10 0.83 0.00 -0.83 -4.25 105.19 102.43 1orw n GLY 641 Ca -0.03 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 44.98 1orw n GLY 641 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orw h ALA 642 N 4.18 0.09 0.00 4.61 0.00 -0.73 -3.44 119.26 123.97 1orw h ALA 642 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1orw h ALA 642 Cb 1.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1orw h ALA 642 CO 0.25 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.93 1orw n GLY 643 N 0.59 0.98 0.23 0.00 0.00 -1.26 -4.97 105.19 100.75 1orw n GLY 643 Ca -0.08 -0.04 0.16 0.00 0.00 0.00 0.00 46.02 46.06 1orw n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1orw h SER 644 N 0.00 0.00 0.00 1.61 4.64 -1.90 -3.45 113.55 114.45 1orw h SER 644 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1orw h SER 644 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1orw h SER 644 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1orw n GLY 645 N -0.66 0.11 0.09 -0.77 0.00 -1.26 -4.81 105.19 97.88 1orw n GLY 645 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.96 1orw n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1orw h VAL 646 N 0.00 0.80 -3.54 1.61 2.07 -1.97 -3.47 116.25 111.75 1orw h VAL 646 Ca 0.00 -2.50 -0.67 0.00 0.82 0.00 0.00 66.70 64.35 1orw h VAL 646 Cb 0.74 2.32 -0.20 0.00 -1.52 0.00 0.00 31.29 32.64 1orw h VAL 646 CO 0.00 0.45 -0.69 -0.36 0.02 0.00 0.00 177.57 177.00 1orw s PHE 647 N -2.73 2.96 -0.14 1.57 0.40 -1.26 -4.66 117.98 114.12 1orw s PHE 647 Ca -0.03 -0.09 -0.24 0.00 -0.60 0.00 0.00 56.93 55.97 1orw s PHE 647 Cb 0.08 -1.78 -0.21 0.00 0.51 0.00 0.00 43.02 41.62 1orw s PHE 647 CO 0.82 0.21 0.59 -0.22 0.70 0.00 0.00 175.22 177.32 1orw h LYS 648 N 5.69 0.00 -4.42 0.44 3.64 -1.58 -3.46 116.57 116.88 1orw h LYS 648 Ca -0.43 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 58.71 1orw h LYS 648 Cb 1.18 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.87 1orw h LYS 648 CO 0.55 0.83 -0.47 0.00 -2.27 0.00 0.00 179.45 178.09 1orw s GLY 650 N -3.17 -0.44 -0.13 0.00 0.00 -0.55 -2.56 107.32 100.47 1orw s GLY 650 Ca 0.35 1.35 0.02 0.00 0.00 0.00 0.00 44.72 46.44 1orw s GLY 650 CO 0.15 0.66 -0.18 -0.42 0.00 0.00 0.00 173.10 173.30 1orw s ILE 651 N -2.16 1.77 -0.29 0.90 1.01 -0.86 -1.59 121.20 119.98 1orw s ILE 651 Ca -0.01 -0.80 -0.06 0.00 0.00 0.00 0.00 60.65 59.78 1orw s ILE 651 Cb -0.01 -1.60 0.01 0.00 0.01 0.00 0.00 42.46 40.88 1orw s ILE 651 CO -0.02 0.49 0.06 0.00 0.00 0.00 0.00 174.94 175.47 1orw s ALA 652 N 0.96 3.02 -0.22 9.38 0.00 -0.55 -1.66 121.76 132.69 1orw s ALA 652 Ca -0.05 -1.47 -0.11 0.00 0.00 0.00 0.00 51.96 50.33 1orw s ALA 652 Cb -0.15 -2.10 -0.05 0.00 0.00 0.00 0.00 23.12 20.83 1orw s ALA 652 CO -0.03 -0.93 0.16 0.08 0.00 0.00 0.00 175.76 175.04 1orw s VAL 653 N 1.47 5.37 -1.00 0.00 1.01 0.12 -2.02 120.40 125.34 1orw s VAL 653 Ca 0.02 0.21 -0.22 0.00 0.00 0.00 0.00 61.98 61.99 1orw s VAL 653 Cb -0.17 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.74 1orw s VAL 653 CO 0.02 0.37 0.42 0.00 0.00 0.00 0.00 175.10 175.91 1orw n ALA 654 N 4.04 -2.16 -1.75 5.51 0.00 0.93 -0.43 120.51 126.64 1orw n ALA 654 Ca -0.15 -0.44 -0.30 0.00 0.00 0.00 0.00 53.44 52.54 1orw n ALA 654 Cb 0.52 -1.71 0.06 0.00 0.00 0.00 0.00 19.45 18.32 1orw n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1orw s PRO 655 N -6.85 2.61 0.00 0.00 0.04 -1.26 -3.10 135.00 126.44 1orw s PRO 655 Ca 0.31 0.55 -0.12 0.00 0.04 0.00 0.00 61.00 61.78 1orw s PRO 655 Cb -0.17 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.33 1orw s PRO 655 CO 0.77 -1.23 0.37 0.08 0.04 0.00 0.00 177.00 177.02 1orw s VAL 656 N -3.27 5.11 0.00 -0.36 1.01 -1.17 -4.58 120.40 117.15 1orw s VAL 656 Ca 0.59 0.64 0.00 0.00 0.00 0.00 0.00 61.98 63.21 1orw s VAL 656 Cb -0.12 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.61 1orw s VAL 656 CO 0.53 0.51 0.00 -1.54 0.00 0.00 0.00 175.10 174.60 1orw n SER 657 N 1.60 4.47 -3.60 3.32 3.41 -1.26 -4.29 113.62 117.26 1orw n SER 657 Ca -0.13 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.42 1orw n SER 657 Cb 0.53 0.85 -0.08 0.00 -0.26 0.00 0.00 64.21 65.25 1orw n SER 657 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1orw s LYS 658 N -1.80 0.40 0.58 4.33 2.20 -1.26 -0.76 119.74 123.43 1orw s LYS 658 Ca 0.00 1.09 0.28 0.00 -0.36 0.00 0.00 55.97 56.98 1orw s LYS 658 Cb 0.00 0.41 1.57 0.00 -1.51 0.00 0.00 37.83 38.29 1orw s LYS 658 CO 0.00 -0.29 2.05 -1.49 -0.36 0.00 0.00 175.35 175.26 1orw h TRP 659 N 8.12 0.00 0.00 4.03 4.06 -1.88 0.00 115.95 130.28 1orw h TRP 659 Ca -0.17 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.78 1orw h TRP 659 Cb 1.11 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.27 1orw h TRP 659 CO 0.23 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.50 1orw n GLU 660 N -3.91 0.16 0.08 0.49 1.02 -1.26 -1.72 120.64 115.50 1orw n GLU 660 Ca 0.04 0.16 0.11 0.00 -0.02 0.00 0.00 57.16 57.46 1orw n GLU 660 Cb 0.42 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.35 1orw n GLU 660 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1orw n TYR 661 N -1.35 0.73 -2.18 -0.32 4.01 -0.01 -4.00 117.16 114.05 1orw n TYR 661 Ca 0.06 0.21 -0.26 0.00 -0.16 0.00 0.00 57.90 57.75 1orw n TYR 661 Cb 0.14 -0.81 0.07 0.00 -0.31 0.00 0.00 39.34 38.43 1orw n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1orw s TYR 662 N -3.32 2.96 0.38 -0.72 5.04 -0.70 -4.85 117.35 116.13 1orw s TYR 662 Ca 0.00 0.50 -0.26 0.00 -2.44 0.00 0.00 57.07 54.88 1orw s TYR 662 Cb 0.11 -3.18 -0.09 0.00 0.35 0.00 0.00 41.96 39.15 1orw s TYR 662 CO 0.79 -1.39 1.15 0.16 -1.34 0.00 0.00 175.55 174.92 1orw s ASP 663 N -4.50 6.68 0.23 4.32 1.47 -1.26 -0.51 116.67 123.10 1orw s ASP 663 Ca 0.60 2.30 -0.14 0.00 1.18 0.00 0.00 52.55 56.49 1orw s ASP 663 Cb -0.11 -2.61 0.27 0.00 -0.34 0.00 0.00 42.92 40.13 1orw s ASP 663 CO 0.45 -0.56 1.59 0.77 0.68 0.00 0.00 175.17 178.10 1orw h SER 664 N 2.82 -0.95 0.69 2.11 4.64 -0.94 -1.49 113.55 120.43 1orw h SER 664 Ca -0.48 0.25 -0.03 0.00 -0.47 0.00 0.00 61.79 61.06 1orw h SER 664 Cb 1.23 0.56 -0.01 0.00 -0.31 0.00 0.00 62.40 63.87 1orw h SER 664 CO 0.63 -0.28 -0.46 0.58 -0.87 0.00 0.00 176.83 176.43 1orw h VAL 665 N -0.04 0.07 -0.08 0.95 2.07 -1.93 0.11 116.25 117.40 1orw h VAL 665 Ca 0.34 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.85 1orw h VAL 665 Cb 0.58 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1orw h VAL 665 CO -0.81 0.00 -0.01 0.22 0.02 0.00 0.00 177.57 176.98 1orw h TYR 666 N -1.09 0.16 -0.00 1.57 5.03 -1.89 -2.72 116.97 118.03 1orw h TYR 666 Ca -0.09 -0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.19 1orw h TYR 666 Cb 0.89 -0.04 -0.00 0.00 1.55 0.00 0.00 36.73 39.13 1orw h TYR 666 CO -0.14 0.45 0.00 1.15 -1.32 0.00 0.00 178.16 178.30 1orw h THR 667 N -0.17 1.06 -0.01 1.81 2.02 -1.32 -3.04 112.91 113.26 1orw h THR 667 Ca 0.02 -0.17 -0.06 0.00 0.77 0.00 0.00 66.41 66.98 1orw h THR 667 Cb 0.39 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 1orw h THR 667 CO 0.01 0.04 -0.26 -0.33 0.37 0.00 0.00 175.52 175.36 1orw h GLU 668 N -0.06 0.02 -0.97 6.66 5.08 -1.04 0.16 114.58 124.43 1orw h GLU 668 Ca 0.00 -0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1orw h GLU 668 Cb 0.07 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 1orw h GLU 668 CO -0.00 0.27 0.63 -0.09 -1.00 0.00 0.00 179.01 178.82 1orw h ARG 669 N 0.01 1.13 0.00 2.33 2.43 -1.36 -0.94 114.38 117.99 1orw h ARG 669 Ca 0.00 -0.07 -0.30 0.00 -0.81 0.00 0.00 59.98 58.80 1orw h ARG 669 Cb 0.46 -0.26 -0.06 0.00 -0.42 0.00 0.00 29.97 29.70 1orw h ARG 669 CO 0.03 0.75 -2.12 0.66 -1.51 0.00 0.00 179.97 177.78 1orw n TYR 670 N -4.50 0.29 0.40 2.20 4.01 -0.94 -4.64 117.16 113.99 1orw n TYR 670 Ca 0.14 0.10 0.04 0.00 -0.16 0.00 0.00 57.90 58.03 1orw n TYR 670 Cb 0.14 -1.00 -0.02 0.00 -0.31 0.00 0.00 39.34 38.15 1orw n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1orw n MET 671 N -2.78 3.15 0.00 -0.72 2.81 0.53 0.10 117.12 120.22 1orw n MET 671 Ca -0.25 -0.29 0.00 0.00 -1.81 0.00 0.00 57.70 55.36 1orw n MET 671 Cb 1.05 -0.98 0.00 0.00 -0.71 0.00 0.00 33.22 32.58 1orw n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1orw n GLY 672 N 1.03 -0.88 3.77 3.03 0.00 -0.36 -4.65 105.19 107.12 1orw n GLY 672 Ca 0.03 -1.19 -0.36 0.00 0.00 0.00 0.00 46.02 44.50 1orw n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1orw s LEU 673 N 0.00 4.27 -0.94 0.99 1.43 -1.26 -4.33 118.68 118.83 1orw s LEU 673 Ca 0.00 0.35 -0.21 0.00 -1.03 0.00 0.00 54.13 53.23 1orw s LEU 673 Cb 0.00 -2.13 -0.12 0.00 0.03 0.00 0.00 46.19 43.97 1orw s LEU 673 CO 0.00 0.24 1.94 -0.81 0.23 0.00 0.00 176.35 177.95 1orw n PRO 674 N 3.07 1.70 -4.01 1.29 -0.04 -1.26 -1.63 135.00 134.12 1orw n PRO 674 Ca -0.17 -2.11 -0.10 0.00 -0.04 0.00 0.00 63.50 61.08 1orw n PRO 674 Cb 0.53 -3.16 -0.11 0.00 -0.04 0.00 0.00 33.50 30.71 1orw n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1orw s THR 675 N 6.29 0.26 0.34 0.52 -4.23 -1.26 -4.64 115.64 112.91 1orw s THR 675 Ca 0.59 -0.99 0.02 0.00 -1.18 0.00 0.00 61.69 60.14 1orw s THR 675 Cb 0.10 -0.41 0.27 0.00 1.34 0.00 0.00 72.50 73.81 1orw s THR 675 CO 0.11 -0.47 1.97 1.55 -0.54 0.00 0.00 174.62 177.24 1orw h PRO 676 N 4.57 0.88 -0.56 3.99 0.13 -1.94 0.14 132.00 139.20 1orw h PRO 676 Ca -0.33 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.73 1orw h PRO 676 Cb 1.21 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 32.11 1orw h PRO 676 CO 0.41 0.58 0.31 0.93 -0.23 0.00 0.00 178.00 180.01 1orw h GLU 677 N 0.91 0.77 0.00 0.86 3.07 -1.96 -3.43 114.58 114.80 1orw h GLU 677 Ca 0.29 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 1orw h GLU 677 Cb 0.04 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 27.79 1orw h GLU 677 CO -0.08 0.56 0.00 -3.47 -1.40 0.00 0.00 179.01 174.62 1orw n ASP 678 N -4.40 0.00 -0.19 1.42 -0.08 -0.31 -4.99 116.55 108.00 1orw n ASP 678 Ca 0.05 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.42 1orw n ASP 678 Cb 0.09 0.00 0.14 0.00 2.34 0.00 0.00 41.12 43.69 1orw n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1orw n ASN 679 N 0.00 2.54 -0.37 1.67 4.05 -0.64 -4.81 115.26 117.70 1orw n ASN 679 Ca 0.00 -2.94 0.29 0.00 0.45 0.00 0.00 54.58 52.38 1orw n ASN 679 Cb 0.00 -0.40 0.56 0.00 1.23 0.00 0.00 39.78 41.17 1orw n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1orw h LEU 680 N 0.29 0.39 -0.35 1.20 5.85 -0.87 -2.47 115.31 119.35 1orw h LEU 680 Ca 0.00 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1orw h LEU 680 Cb 1.00 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 1orw h LEU 680 CO 0.03 -0.14 0.14 0.44 -0.34 0.00 0.00 178.44 178.57 1orw h ASP 681 N 0.22 0.49 0.75 1.25 3.32 -1.87 -1.89 116.42 118.69 1orw h ASP 681 Ca 0.75 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.63 1orw h ASP 681 Cb 2.04 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 41.46 1orw h ASP 681 CO -0.50 0.53 0.00 -1.22 -1.72 0.00 0.00 179.24 176.33 1orw n TYR 682 N -4.69 0.00 0.02 4.55 4.02 -0.94 -2.61 117.16 117.50 1orw n TYR 682 Ca -0.01 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.70 1orw n TYR 682 Cb 0.14 -0.43 -0.13 0.00 -0.02 0.00 0.00 39.34 38.91 1orw n TYR 682 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 176.86 177.73 1orw h TYR 683 N 0.00 0.51 -0.04 -0.72 0.05 -1.29 -3.25 116.97 112.23 1orw h TYR 683 Ca 0.00 -0.32 -0.19 0.00 0.05 0.00 0.00 58.73 58.27 1orw h TYR 683 Cb 0.38 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.07 1orw h TYR 683 CO 0.00 1.19 -0.78 0.00 -1.05 0.00 0.00 178.16 177.52 1orw h ARG 684 N -0.31 0.32 -0.55 4.88 3.08 -1.16 -3.25 114.38 117.40 1orw h ARG 684 Ca -0.10 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.66 1orw h ARG 684 Cb 1.41 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.53 1orw h ARG 684 CO 0.12 0.96 0.00 0.27 -1.07 0.00 0.00 179.97 180.25 1orw n ASN 685 N -3.78 3.01 -0.51 7.04 6.94 -1.07 -3.78 115.26 123.11 1orw n ASN 685 Ca -0.04 -2.12 0.05 0.00 -0.02 0.00 0.00 54.58 52.45 1orw n ASN 685 Cb 0.74 -0.39 0.12 0.00 -2.36 0.00 0.00 39.78 37.88 1orw n ASN 685 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1orw n SER 686 N 0.89 2.67 -4.83 0.53 3.41 -1.22 -4.99 113.62 110.08 1orw n SER 686 Ca 0.17 -1.95 -0.33 0.00 -0.26 0.00 0.00 58.87 56.51 1orw n SER 686 Cb 0.52 -0.17 -0.05 0.00 -0.26 0.00 0.00 64.21 64.24 1orw n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1orw s THR 687 N -0.98 4.45 0.20 6.66 -4.23 -1.25 -4.84 115.64 115.65 1orw s THR 687 Ca 0.18 1.35 -0.02 0.00 -1.18 0.00 0.00 61.69 62.02 1orw s THR 687 Cb 0.10 -3.66 -0.05 0.00 1.34 0.00 0.00 72.50 70.23 1orw s THR 687 CO 0.13 -0.50 1.52 0.58 -0.54 0.00 0.00 174.62 175.80 1orw h VAL 688 N 1.40 1.32 -0.68 2.29 2.07 -1.29 -3.21 116.25 118.16 1orw h VAL 688 Ca -0.48 -1.79 0.08 0.00 0.82 0.00 0.00 66.70 65.34 1orw h VAL 688 Cb 1.18 1.77 -0.07 0.00 -1.52 0.00 0.00 31.29 32.65 1orw h VAL 688 CO 0.61 0.55 0.34 0.24 0.02 0.00 0.00 177.57 179.33 1orw h MET 689 N 0.41 0.58 0.00 1.57 2.86 -1.93 -0.66 114.93 117.76 1orw h MET 689 Ca 0.01 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1orw h MET 689 Cb 1.07 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.60 1orw h MET 689 CO 0.10 0.38 0.15 -1.13 1.06 0.00 0.00 176.91 177.47 1orw n SER 690 N -4.86 0.25 -0.65 1.22 3.41 -1.21 0.69 113.62 112.47 1orw n SER 690 Ca 0.10 0.54 0.06 0.00 -0.26 0.00 0.00 58.87 59.31 1orw n SER 690 Cb 0.25 -0.54 0.17 0.00 -0.26 0.00 0.00 64.21 63.83 1orw n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1orw n ARG 691 N -1.83 2.86 -0.19 4.33 1.74 -0.26 -4.79 116.66 118.52 1orw n ARG 691 Ca -0.01 -2.26 -0.01 0.00 -0.77 0.00 0.00 57.85 54.80 1orw n ARG 691 Cb 0.16 -1.43 0.06 0.00 -1.02 0.00 0.00 32.46 30.23 1orw n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1orw h ALA 692 N 1.75 0.40 -0.85 7.54 0.00 0.29 -1.92 119.26 126.45 1orw h ALA 692 Ca 0.00 0.22 0.23 0.00 0.00 0.00 0.00 54.91 55.37 1orw h ALA 692 Cb 0.93 0.43 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 1orw h ALA 692 CO 0.07 -0.43 0.60 1.49 0.00 0.00 0.00 179.25 180.98 1orw h GLU 693 N 0.01 0.11 0.00 0.00 4.57 -1.87 -1.02 114.58 116.39 1orw h GLU 693 Ca 0.28 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.46 1orw h GLU 693 Cb 0.43 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1orw h GLU 693 CO -0.59 0.08 0.00 0.09 -1.18 0.00 0.00 179.01 177.40 1orw n ASN 694 N -4.35 0.00 0.07 1.04 5.03 -0.72 -3.31 115.26 113.01 1orw n ASN 694 Ca 0.18 0.12 0.12 0.00 0.87 0.00 0.00 54.58 55.87 1orw n ASN 694 Cb 0.84 -0.35 0.47 0.00 -1.02 0.00 0.00 39.78 39.72 1orw n ASN 694 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1orw n PHE 695 N -1.35 0.53 0.32 3.10 3.01 -0.39 -2.57 117.46 120.13 1orw n PHE 695 Ca 0.09 0.17 0.20 0.00 1.01 0.00 0.00 57.45 58.92 1orw n PHE 695 Cb 0.20 -0.78 1.10 0.00 -0.01 0.00 0.00 39.48 39.99 1orw n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1orw h LYS 696 N 0.00 0.00 0.00 -1.08 1.57 -1.76 -1.49 116.57 113.81 1orw h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1orw h LYS 696 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1orw h LYS 696 CO 0.00 0.00 -0.04 1.04 -0.57 0.00 0.00 179.45 179.88 1orw n GLN 697 N -3.32 0.16 -4.22 3.15 6.02 -1.06 -4.94 117.38 113.18 1orw n GLN 697 Ca -0.03 0.13 -0.13 0.00 -0.01 0.00 0.00 57.00 56.96 1orw n GLN 697 Cb 0.09 -1.68 -0.10 0.00 1.02 0.00 0.00 30.24 29.56 1orw n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1orw s VAL 698 N -3.07 0.06 -0.31 5.09 -7.23 -0.56 -4.96 120.40 109.43 1orw s VAL 698 Ca 0.12 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.13 1orw s VAL 698 Cb 0.15 -2.51 -0.02 0.00 0.56 0.00 0.00 36.38 34.55 1orw s VAL 698 CO 0.58 0.00 0.41 -1.61 -0.31 0.00 0.00 175.10 174.18 1orw s GLU 699 N -4.12 3.80 -0.04 4.82 2.02 -0.64 -4.97 118.70 119.57 1orw s GLU 699 Ca 0.39 -0.11 0.05 0.00 0.02 0.00 0.00 54.97 55.31 1orw s GLU 699 Cb 0.07 -3.73 -0.02 0.00 0.10 0.00 0.00 34.13 30.54 1orw s GLU 699 CO 0.13 -0.44 -0.18 -0.47 0.02 0.00 0.00 175.26 174.31 1orw s TYR 700 N 2.15 2.58 -0.21 1.61 5.04 -1.26 -1.48 117.35 125.78 1orw s TYR 700 Ca 0.15 -0.30 0.01 0.00 -2.44 0.00 0.00 57.07 54.50 1orw s TYR 700 Cb -0.16 -1.60 0.04 0.00 0.35 0.00 0.00 41.96 40.60 1orw s TYR 700 CO 0.11 0.07 -0.12 -1.17 -1.34 0.00 0.00 175.55 173.11 1orw s LEU 701 N -0.61 2.47 -0.32 6.97 0.20 -0.62 -1.59 118.68 125.17 1orw s LEU 701 Ca 0.09 -0.94 -0.08 0.00 0.69 0.00 0.00 54.13 53.89 1orw s LEU 701 Cb -0.11 -1.32 0.02 0.00 -0.43 0.00 0.00 46.19 44.35 1orw s LEU 701 CO 0.00 -0.13 0.12 -0.22 -0.29 0.00 0.00 176.35 175.83 1orw s LEU 702 N 1.33 4.17 0.01 -0.68 2.96 -0.13 -1.48 118.68 124.86 1orw s LEU 702 Ca -0.02 -0.86 0.04 0.00 -0.22 0.00 0.00 54.13 53.08 1orw s LEU 702 Cb -0.16 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1orw s LEU 702 CO -0.08 -0.27 -0.10 -0.63 -1.32 0.00 0.00 176.35 173.95 1orw s ILE 703 N 1.50 3.40 -0.28 6.68 1.01 -0.86 -1.51 121.20 131.14 1orw s ILE 703 Ca 0.02 -0.89 -0.20 0.00 0.00 0.00 0.00 60.65 59.58 1orw s ILE 703 Cb -0.18 -2.47 0.12 0.00 0.01 0.00 0.00 42.46 39.95 1orw s ILE 703 CO 0.04 0.38 0.95 -2.28 0.00 0.00 0.00 174.94 174.02 1orw s HIS 704 N -0.97 -0.61 0.24 3.97 2.46 -0.75 -0.05 115.29 119.57 1orw s HIS 704 Ca 0.16 1.32 -0.30 0.00 0.47 0.00 0.00 55.06 56.72 1orw s HIS 704 Cb -0.11 0.39 -0.09 0.00 -0.13 0.00 0.00 32.58 32.64 1orw s HIS 704 CO 0.07 -0.30 1.11 0.20 -2.47 0.00 0.00 174.74 173.35 1orw s GLY 705 N 0.90 2.95 0.00 1.59 0.00 -1.26 -2.12 107.32 109.38 1orw s GLY 705 Ca -0.04 0.89 0.28 0.00 0.00 0.00 0.00 44.72 45.84 1orw s GLY 705 CO -0.11 1.60 1.95 -1.30 0.00 0.00 0.00 173.10 175.23 1orw n THR 706 N 1.69 0.10 -1.40 0.90 -2.24 -0.82 -3.05 114.28 109.45 1orw n THR 706 Ca 0.01 0.02 0.04 0.00 -2.27 0.00 0.00 64.05 61.85 1orw n THR 706 Cb 0.45 -0.56 0.20 0.00 -2.10 0.00 0.00 70.33 68.32 1orw n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1orw n ALA 707 N -1.30 3.57 -2.32 6.98 0.00 -0.53 -4.62 120.51 122.30 1orw n ALA 707 Ca 0.13 -3.04 -0.43 0.00 0.00 0.00 0.00 53.44 50.10 1orw n ALA 707 Cb 0.23 -0.52 -0.02 0.00 0.00 0.00 0.00 19.45 19.14 1orw n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1orw s ASP 708 N -2.82 6.79 0.03 0.00 -1.08 -1.17 -4.29 116.67 114.12 1orw s ASP 708 Ca 0.40 1.70 0.24 0.00 -0.52 0.00 0.00 52.55 54.36 1orw s ASP 708 Cb 0.36 -2.54 0.21 0.00 -1.46 0.00 0.00 42.92 39.50 1orw s ASP 708 CO -0.02 -0.90 1.19 -0.90 0.52 0.00 0.00 175.17 175.06 1orw n ASP 709 N 7.08 0.64 0.00 -0.34 5.75 -1.26 -3.99 116.55 124.42 1orw n ASP 709 Ca 0.15 -0.32 0.00 0.00 -0.01 0.00 0.00 54.79 54.61 1orw n ASP 709 Cb 0.45 0.56 0.00 0.00 -1.03 0.00 0.00 41.12 41.09 1orw n ASP 709 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1orw n ASN 710 N -1.72 0.00 -4.33 -1.12 2.85 -1.26 -4.71 115.26 104.97 1orw n ASN 710 Ca 0.04 0.25 -0.45 0.00 -0.11 0.00 0.00 54.58 54.31 1orw n ASN 710 Cb 0.38 -0.41 -0.06 0.00 1.24 0.00 0.00 39.78 40.92 1orw n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1orw s VAL 711 N -0.82 5.11 0.59 3.44 1.01 -1.26 -4.85 120.40 123.61 1orw s VAL 711 Ca 0.00 -1.37 -0.19 0.00 0.00 0.00 0.00 61.98 60.42 1orw s VAL 711 Cb 0.00 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 1orw s VAL 711 CO 0.00 -0.75 1.13 1.41 0.00 0.00 0.00 175.10 176.89 1orw n HIS 712 N 5.20 1.42 -0.03 5.22 8.25 -1.26 -4.65 115.22 129.37 1orw n HIS 712 Ca -0.13 0.44 0.14 0.00 -0.26 0.00 0.00 57.72 57.91 1orw n HIS 712 Cb 0.41 -2.22 0.57 0.00 1.12 0.00 0.00 29.99 29.87 1orw n HIS 712 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1orw h PHE 713 N 0.78 0.26 -0.86 4.41 3.57 -1.79 -0.99 116.94 122.32 1orw h PHE 713 Ca -0.49 0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.19 1orw h PHE 713 Cb 1.34 -0.08 -0.16 0.00 2.79 0.00 0.00 35.95 39.84 1orw h PHE 713 CO 0.40 0.12 -0.20 0.37 -2.23 0.00 0.00 178.31 176.77 1orw h GLN 714 N 0.24 0.00 -0.72 1.11 4.15 -1.94 0.75 115.11 118.71 1orw h GLN 714 Ca 0.25 -0.00 0.14 0.00 0.77 0.00 0.00 58.65 59.80 1orw h GLN 714 Cb 0.65 -0.00 -0.14 0.00 0.21 0.00 0.00 27.48 28.21 1orw h GLN 714 CO -0.05 0.00 -0.25 1.96 -1.93 0.00 0.00 178.83 178.56 1orw h GLN 715 N 0.00 -0.05 0.00 1.69 1.08 -1.51 0.14 115.11 116.46 1orw h GLN 715 Ca 0.42 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.44 1orw h GLN 715 Cb 0.64 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.06 1orw h GLN 715 CO -0.88 -0.04 -0.85 0.77 -0.95 0.00 0.00 178.83 176.88 1orw h SER 716 N -0.06 0.06 -0.84 1.46 0.02 -1.07 -2.44 113.55 110.68 1orw h SER 716 Ca 0.32 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 61.19 1orw h SER 716 Cb 0.56 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.04 1orw h SER 716 CO -0.76 0.88 0.42 0.00 -1.14 0.00 0.00 176.83 176.23 1orw h ALA 717 N 1.11 1.08 -0.08 3.77 0.00 0.36 0.13 119.26 125.64 1orw h ALA 717 Ca -0.02 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 1orw h ALA 717 Cb 1.50 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1orw h ALA 717 CO 0.12 0.64 -0.68 1.96 0.00 0.00 0.00 179.25 181.29 1orw h GLN 718 N 1.19 0.33 -0.08 0.00 1.08 -0.80 -2.10 115.11 114.73 1orw h GLN 718 Ca 0.29 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.22 1orw h GLN 718 Cb 0.10 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1orw h GLN 718 CO -0.04 0.89 -0.00 1.25 -0.95 0.00 0.00 178.83 179.98 1orw h LEU 719 N 0.23 0.15 -0.48 1.46 5.85 -0.89 -2.18 115.31 119.45 1orw h LEU 719 Ca -0.02 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.34 1orw h LEU 719 Cb 1.22 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 1orw h LEU 719 CO 0.11 0.43 0.15 0.77 -0.34 0.00 0.00 178.44 179.56 1orw h SER 720 N -0.14 0.70 -0.74 1.25 4.64 -0.77 -1.99 113.55 116.49 1orw h SER 720 Ca 0.02 -0.21 0.12 0.00 -0.47 0.00 0.00 61.79 61.25 1orw h SER 720 Cb 0.36 -0.18 -0.08 0.00 -0.31 0.00 0.00 62.40 62.18 1orw h SER 720 CO 0.00 0.72 0.35 0.50 -0.87 0.00 0.00 176.83 177.53 1orw h LYS 721 N 0.64 0.53 0.05 4.77 3.64 -1.37 -0.35 116.57 124.47 1orw h LYS 721 Ca 0.15 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1orw h LYS 721 Cb 0.27 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1orw h LYS 721 CO -0.00 0.35 -0.02 0.00 -2.27 0.00 0.00 179.45 177.51 1orw h ALA 722 N 1.49 -0.06 -0.91 5.00 0.00 -0.92 -1.44 119.26 122.41 1orw h ALA 722 Ca 0.39 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.34 1orw h ALA 722 Cb 0.50 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 1orw h ALA 722 CO -0.33 -0.47 0.59 -0.07 0.00 0.00 0.00 179.25 178.97 1orw h LEU 723 N -0.19 0.77 -1.10 0.00 3.38 -0.75 0.70 115.31 118.11 1orw h LEU 723 Ca -0.01 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1orw h LEU 723 Cb 0.17 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1orw h LEU 723 CO 0.01 0.42 -0.29 0.58 0.09 0.00 0.00 178.44 179.25 1orw h VAL 724 N 0.83 1.26 0.00 1.22 2.07 -0.70 -0.11 116.25 120.82 1orw h VAL 724 Ca 0.44 -1.22 -0.06 0.00 0.82 0.00 0.00 66.70 66.68 1orw h VAL 724 Cb 0.55 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1orw h VAL 724 CO -0.21 0.37 -0.27 0.44 0.02 0.00 0.00 177.57 177.92 1orw h ASP 725 N 0.24 0.00 0.53 0.57 3.32 0.17 -2.74 116.42 118.51 1orw h ASP 725 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1orw h ASP 725 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1orw h ASP 725 CO 0.05 0.27 -0.30 0.00 -1.72 0.00 0.00 179.24 177.54 1orw n ALA 726 N -2.21 3.10 -1.05 3.45 0.00 -0.39 -4.90 120.51 118.51 1orw n ALA 726 Ca 0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 53.44 53.13 1orw n ALA 726 Cb 0.51 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.73 1orw n ALA 726 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orw n GLY 727 N 1.43 0.53 3.76 0.00 0.00 -0.78 -4.92 105.19 105.21 1orw n GLY 727 Ca 0.08 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.85 1orw n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1orw s VAL 728 N -2.05 4.64 0.01 1.61 1.01 -0.14 -5.02 120.40 120.47 1orw s VAL 728 Ca 0.00 1.59 -0.01 0.00 0.00 0.00 0.00 61.98 63.56 1orw s VAL 728 Cb 0.00 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1orw s VAL 728 CO 0.00 0.43 0.14 -0.62 0.00 0.00 0.00 175.10 175.05 1orw s ASP 729 N -0.44 6.07 0.22 3.32 2.15 -1.26 -4.40 116.67 122.33 1orw s ASP 729 Ca 0.37 0.24 -0.21 0.00 0.43 0.00 0.00 52.55 53.37 1orw s ASP 729 Cb -0.21 -1.83 0.07 0.00 -0.30 0.00 0.00 42.92 40.65 1orw s ASP 729 CO 0.23 0.24 0.99 0.72 -0.17 0.00 0.00 175.17 177.18 1orw s PHE 730 N -1.32 0.07 0.15 -5.34 -0.71 -1.26 -4.75 117.98 104.82 1orw s PHE 730 Ca 0.27 -0.52 0.10 0.00 -1.04 0.00 0.00 56.93 55.74 1orw s PHE 730 Cb -0.12 0.72 -0.04 0.00 -1.21 0.00 0.00 43.02 42.37 1orw s PHE 730 CO 0.19 -1.04 -0.17 -0.65 -1.34 0.00 0.00 175.22 172.21 1orw s GLN 731 N -2.24 1.78 0.21 1.99 -0.21 -0.62 -5.04 119.66 115.53 1orw s GLN 731 Ca 0.20 -1.29 0.01 0.00 0.02 0.00 0.00 55.36 54.31 1orw s GLN 731 Cb -0.03 -2.06 -0.05 0.00 1.00 0.00 0.00 33.01 31.88 1orw s GLN 731 CO 0.06 0.45 0.05 0.95 -2.12 0.00 0.00 175.29 174.68 1orw s THR 732 N -1.41 0.57 -0.29 -0.19 -4.23 -1.26 -0.95 115.64 107.88 1orw s THR 732 Ca 0.20 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.73 1orw s THR 732 Cb -0.09 -2.36 0.18 0.00 1.34 0.00 0.00 72.50 71.57 1orw s THR 732 CO 0.11 -0.25 0.54 -0.32 -0.54 0.00 0.00 174.62 174.16 1orw s MET 733 N -3.98 0.51 0.07 3.99 1.75 -0.57 -4.91 119.30 116.17 1orw s MET 733 Ca 0.31 0.75 -0.04 0.00 -1.25 0.00 0.00 55.69 55.45 1orw s MET 733 Cb 0.07 0.22 -0.05 0.00 2.84 0.00 0.00 34.83 37.91 1orw s MET 733 CO 0.08 -0.75 0.29 1.67 -0.65 0.00 0.00 175.02 175.66 1orw s TRP 734 N 2.76 3.52 -0.32 4.11 -2.14 -1.26 -1.81 118.94 123.80 1orw s TRP 734 Ca 0.16 0.47 0.03 0.00 2.66 0.00 0.00 56.10 59.42 1orw s TRP 734 Cb -0.14 -1.93 0.10 0.00 -3.10 0.00 0.00 33.47 28.40 1orw s TRP 734 CO -0.22 0.54 0.04 0.71 -2.66 0.00 0.00 176.95 175.37 1orw s TYR 735 N -1.49 3.20 0.01 1.66 2.02 -0.90 -4.94 117.35 116.91 1orw s TYR 735 Ca 0.34 -2.61 -0.36 0.00 -0.37 0.00 0.00 57.07 54.07 1orw s TYR 735 Cb -0.13 -2.52 -0.15 0.00 -0.40 0.00 0.00 41.96 38.77 1orw s TYR 735 CO 0.23 -0.92 1.59 2.41 -1.57 0.00 0.00 175.55 177.29 1orw n THR 736 N 4.42 0.17 -0.77 -0.71 -1.04 -1.26 -1.95 114.28 113.13 1orw n THR 736 Ca 0.01 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1orw n THR 736 Cb 0.42 -1.32 0.00 0.00 -1.82 0.00 0.00 70.33 67.61 1orw n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1orw n ASP 737 N 4.12 -2.93 -4.88 8.00 8.00 -1.26 -4.89 116.55 122.71 1orw n ASP 737 Ca 0.20 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.40 1orw n ASP 737 Cb 0.23 -2.80 -0.01 0.00 -0.02 0.00 0.00 41.12 38.52 1orw n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1orw s GLU 738 N -1.39 3.69 0.00 -1.24 0.41 -1.02 -4.70 118.70 114.45 1orw s GLU 738 Ca 0.00 0.53 0.00 0.00 -0.41 0.00 0.00 54.97 55.09 1orw s GLU 738 Cb 0.00 -2.27 0.00 0.00 -1.78 0.00 0.00 34.13 30.08 1orw s GLU 738 CO 0.00 -0.25 0.00 -0.40 -0.49 0.00 0.00 175.26 174.12 1orw n ASP 739 N -1.96 0.64 -0.07 -0.19 5.68 -1.26 -1.45 116.55 117.94 1orw n ASP 739 Ca 0.03 0.00 0.21 0.00 -0.50 0.00 0.00 54.79 54.53 1orw n ASP 739 Cb 0.54 0.00 0.65 0.00 -1.14 0.00 0.00 41.12 41.18 1orw n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1orw h HIS 740 N 0.00 0.11 0.00 2.11 -0.00 -1.91 -1.75 115.15 113.71 1orw h HIS 740 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1orw h HIS 740 Cb 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 27.38 1orw h HIS 740 CO 0.00 0.04 -0.42 0.78 -0.00 0.00 0.00 177.93 178.33 1orw h GLY 741 N 0.09 0.00 -6.84 5.26 0.00 -1.99 -3.47 103.07 96.13 1orw h GLY 741 Ca 0.31 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 47.07 1orw h GLY 741 CO -0.03 0.00 -0.95 1.39 0.00 0.00 0.00 176.54 176.95 1orw n ILE 742 N -2.83 -2.10 0.03 2.60 5.41 -0.66 -4.85 119.36 116.96 1orw n ILE 742 Ca 0.03 -0.53 0.09 0.00 1.00 0.00 0.00 62.75 63.33 1orw n ILE 742 Cb 0.53 -1.85 -0.10 0.00 -0.71 0.00 0.00 39.64 37.50 1orw n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1orw n ALA 743 N -4.56 2.56 -1.39 -1.39 0.00 -1.26 -3.70 120.51 110.77 1orw n ALA 743 Ca -0.29 -0.47 -0.38 0.00 0.00 0.00 0.00 53.44 52.30 1orw n ALA 743 Cb 0.68 -0.85 0.04 0.00 0.00 0.00 0.00 19.45 19.32 1orw n ALA 743 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1orw n SER 744 N -2.48 -1.34 -0.03 0.00 3.41 -1.26 -4.50 113.62 107.41 1orw n SER 744 Ca -0.05 0.68 -0.09 0.00 -0.26 0.00 0.00 58.87 59.15 1orw n SER 744 Cb 0.62 -1.16 -0.06 0.00 -0.26 0.00 0.00 64.21 63.35 1orw n SER 744 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1orw h ASN 745 N 0.03 -1.09 -0.29 4.04 -0.26 -1.99 0.34 115.58 116.36 1orw h ASN 745 Ca -0.45 0.13 0.03 0.00 -0.56 0.00 0.00 56.30 55.45 1orw h ASN 745 Cb 1.39 0.43 -0.03 0.00 -1.06 0.00 0.00 38.32 39.05 1orw h ASN 745 CO 0.45 -0.28 0.11 0.24 -1.06 0.00 0.00 177.43 176.89 1orw h MET 746 N -0.32 0.23 -0.82 0.81 2.86 -1.99 -1.91 114.93 113.79 1orw h MET 746 Ca 0.03 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1orw h MET 746 Cb 0.40 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.96 1orw h MET 746 CO -0.30 0.15 0.53 0.00 1.06 0.00 0.00 176.91 178.35 1orw h ALA 747 N 1.18 1.08 0.32 6.32 0.00 -1.85 -0.18 119.26 126.13 1orw h ALA 747 Ca 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1orw h ALA 747 Cb 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1orw h ALA 747 CO -0.13 0.37 -0.22 1.25 0.00 0.00 0.00 179.25 180.51 1orw h HIS 748 N 1.04 -0.59 -0.86 0.00 6.17 0.04 -2.12 115.15 118.83 1orw h HIS 748 Ca 0.33 -0.00 0.03 0.00 0.71 0.00 0.00 60.37 61.43 1orw h HIS 748 Cb -0.01 0.22 -0.05 0.00 2.52 0.00 0.00 27.41 30.09 1orw h HIS 748 CO -0.02 -0.34 0.57 1.96 0.71 0.00 0.00 177.93 180.80 1orw h GLN 749 N -0.54 1.07 -0.34 5.26 4.20 -1.05 -3.08 115.11 120.63 1orw h GLN 749 Ca -0.03 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.59 1orw h GLN 749 Cb 0.46 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1orw h GLN 749 CO 0.01 0.71 0.10 1.25 -0.67 0.00 0.00 178.83 180.22 1orw h HIS 750 N 1.10 0.56 -0.33 2.96 2.76 -0.66 -2.50 115.15 119.04 1orw h HIS 750 Ca 0.33 -0.06 -0.10 0.00 -2.20 0.00 0.00 60.37 58.35 1orw h HIS 750 Cb -0.03 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 28.76 1orw h HIS 750 CO -0.00 0.56 -0.19 0.97 -1.30 0.00 0.00 177.93 177.97 1orw h ILE 751 N 0.40 1.26 -0.01 6.26 2.10 -1.31 -0.34 117.51 125.88 1orw h ILE 751 Ca 0.11 -1.23 -0.19 0.00 1.08 0.00 0.00 64.86 64.63 1orw h ILE 751 Cb 0.27 1.22 -0.01 0.00 -1.09 0.00 0.00 36.82 37.21 1orw h ILE 751 CO -0.00 0.40 -0.85 1.88 -1.08 0.00 0.00 178.15 178.50 1orw h TYR 752 N 0.55 0.32 -0.37 2.19 0.05 -1.55 -1.38 116.97 116.78 1orw h TYR 752 Ca 0.09 -0.17 -0.12 0.00 0.05 0.00 0.00 58.73 58.58 1orw h TYR 752 Cb 0.64 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.33 1orw h TYR 752 CO 0.03 0.97 -0.22 1.15 -1.05 0.00 0.00 178.16 179.03 1orw h THR 753 N 0.13 1.28 0.81 -2.88 2.02 -1.26 -1.12 112.91 111.89 1orw h THR 753 Ca -0.04 -1.37 -0.04 0.00 0.77 0.00 0.00 66.41 65.73 1orw h THR 753 Cb 1.47 1.35 0.01 0.00 -1.74 0.00 0.00 68.15 69.24 1orw h THR 753 CO 0.13 0.45 -0.39 -0.74 0.37 0.00 0.00 175.52 175.34 1orw h HIS 754 N 0.61 -1.01 -0.97 3.16 -0.00 -1.01 -1.89 115.15 114.04 1orw h HIS 754 Ca 0.08 -0.02 0.20 0.00 -0.00 0.00 0.00 60.37 60.63 1orw h HIS 754 Cb 0.79 0.33 -0.09 0.00 -0.00 0.00 0.00 27.41 28.44 1orw h HIS 754 CO 0.06 -0.63 0.62 0.52 -0.00 0.00 0.00 177.93 178.50 1orw h MET 755 N -1.15 0.56 -0.26 5.26 2.07 -1.29 0.41 114.93 120.53 1orw h MET 755 Ca -0.11 -0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.47 1orw h MET 755 Cb 0.84 -0.13 -0.01 0.00 -1.87 0.00 0.00 31.60 30.43 1orw h MET 755 CO 0.18 0.37 0.12 0.77 1.07 0.00 0.00 176.91 179.43 1orw h SER 756 N 0.58 0.34 -0.17 1.22 0.02 -1.01 0.69 113.55 115.21 1orw h SER 756 Ca 0.53 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.35 1orw h SER 756 Cb 1.08 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 1orw h SER 756 CO -0.28 0.37 0.07 0.45 -1.14 0.00 0.00 176.83 176.30 1orw h HIS 757 N 0.28 0.27 -0.73 3.45 3.86 -0.25 0.49 115.15 122.52 1orw h HIS 757 Ca 0.09 -0.02 0.12 0.00 -1.16 0.00 0.00 60.37 59.40 1orw h HIS 757 Cb 0.12 -0.08 -0.08 0.00 1.06 0.00 0.00 27.41 28.43 1orw h HIS 757 CO -0.02 0.34 0.33 0.35 0.86 0.00 0.00 177.93 179.78 1orw h PHE 758 N 0.12 0.57 0.19 2.45 3.57 -0.77 0.32 116.94 123.38 1orw h PHE 758 Ca 0.06 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1orw h PHE 758 Cb 0.18 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.78 1orw h PHE 758 CO -0.01 0.14 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.05 1orw h LEU 759 N 0.51 -0.21 -0.93 0.59 3.38 -0.45 -0.15 115.31 118.05 1orw h LEU 759 Ca 0.39 -0.22 0.15 0.00 0.09 0.00 0.00 57.88 58.29 1orw h LEU 759 Cb 0.51 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 41.23 1orw h LEU 759 CO -0.34 0.12 0.54 0.11 0.09 0.00 0.00 178.44 178.95 1orw h LYS 760 N -0.56 0.75 -0.20 1.13 1.57 -0.35 0.42 116.57 119.33 1orw h LYS 760 Ca -0.03 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1orw h LYS 760 Cb 0.42 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1orw h LYS 760 CO 0.04 0.50 0.12 0.37 -0.57 0.00 0.00 179.45 179.91 1orw h GLN 761 N 0.77 0.28 0.00 3.15 -0.00 -0.18 0.48 115.11 119.61 1orw h GLN 761 Ca 0.50 -0.03 -0.06 0.00 -0.00 0.00 0.00 58.65 59.07 1orw h GLN 761 Cb 0.67 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.08 1orw h GLN 761 CO -0.34 0.24 -0.28 0.00 0.00 0.00 0.00 178.83 178.45 1orw n PHE 763 N -4.19 0.31 -3.77 0.00 3.72 0.12 -4.94 117.46 108.71 1orw n PHE 763 Ca -0.02 -0.16 -0.25 0.00 -0.05 0.00 0.00 57.45 56.97 1orw n PHE 763 Cb 0.33 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.91 1orw n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1orw n SER 764 N 0.98 -3.43 -4.83 4.37 7.64 0.09 -4.96 113.62 113.47 1orw n SER 764 Ca 0.18 -0.76 -0.36 0.00 1.01 0.00 0.00 58.87 58.93 1orw n SER 764 Cb 0.49 -4.15 -0.07 0.00 -1.01 0.00 0.00 64.21 59.47 1orw n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1orw s LEU 765 N -7.00 4.33 0.00 -3.43 1.43 0.15 -5.02 118.68 109.13 1orw s LEU 765 Ca 0.36 0.39 0.14 0.00 -1.03 0.00 0.00 54.13 54.00 1orw s LEU 765 Cb -0.18 -2.08 0.84 0.00 0.03 0.00 0.00 46.19 44.80 1orw s LEU 765 CO 0.81 0.33 1.26 -0.81 0.23 0.00 0.00 176.35 178.17