#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 -1.49 4.33 1.85 -1.26 -5.00 116.66 115.08 1orw n ARG 40 Ca 0.00 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.55 1orw n ARG 40 Cb 0.00 -0.86 0.22 0.00 -1.05 0.00 0.00 32.46 30.77 1orw n ARG 40 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1orw s ARG 41 N -1.64 -0.53 0.15 2.89 0.52 -1.17 -4.70 118.95 114.45 1orw s ARG 41 Ca 0.36 -0.32 0.09 0.00 -0.52 0.00 0.00 55.73 55.34 1orw s ARG 41 Cb -0.18 -1.70 -0.04 0.00 0.52 0.00 0.00 34.95 33.55 1orw s ARG 41 CO 0.70 -3.21 -0.21 0.95 0.02 0.00 0.00 175.30 173.55 1orw s THR 42 N -3.47 1.91 -0.11 0.02 -4.23 -1.26 0.20 115.64 108.71 1orw s THR 42 Ca 0.74 -1.80 -0.29 0.00 -1.18 0.00 0.00 61.69 59.16 1orw s THR 42 Cb -0.06 -1.81 -0.05 0.00 1.34 0.00 0.00 72.50 71.92 1orw s THR 42 CO 0.55 -0.16 1.77 -0.47 -0.54 0.00 0.00 174.62 175.77 1orw s TYR 43 N -1.60 1.79 0.34 3.99 5.04 -1.26 -4.87 117.35 120.77 1orw s TYR 43 Ca 0.13 0.22 0.04 0.00 -2.44 0.00 0.00 57.07 55.03 1orw s TYR 43 Cb -0.08 -4.00 -0.01 0.00 0.35 0.00 0.00 41.96 38.21 1orw s TYR 43 CO 0.06 -3.91 0.50 0.95 -1.34 0.00 0.00 175.55 171.81 1orw s THR 44 N 5.02 4.39 0.21 4.34 -4.23 -1.26 -3.74 115.64 120.37 1orw s THR 44 Ca 0.79 -0.84 -0.10 0.00 -1.18 0.00 0.00 61.69 60.36 1orw s THR 44 Cb -0.32 -3.56 0.15 0.00 1.34 0.00 0.00 72.50 70.11 1orw s THR 44 CO 0.32 -0.27 1.85 0.25 -0.54 0.00 0.00 174.62 176.24 1orw h LEU 45 N 0.83 0.76 -1.61 4.79 5.85 -1.93 0.64 115.31 124.63 1orw h LEU 45 Ca -0.47 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 1orw h LEU 45 Cb 1.25 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1orw h LEU 45 CO 0.56 0.52 0.00 0.74 -0.34 0.00 0.00 178.44 179.93 1orw h THR 46 N 0.90 1.11 0.03 1.05 2.02 -1.97 0.48 112.91 116.53 1orw h THR 46 Ca 0.29 -0.43 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 1orw h THR 46 Cb 0.01 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 1orw h THR 46 CO -0.11 0.14 -0.02 0.44 0.37 0.00 0.00 175.52 176.35 1orw h ASP 47 N 0.24 -0.04 -0.03 4.18 3.32 -1.31 0.67 116.42 123.46 1orw h ASP 47 Ca 0.06 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 1orw h ASP 47 Cb 0.17 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1orw h ASP 47 CO 0.00 0.15 0.01 0.22 -1.72 0.00 0.00 179.24 177.90 1orw h TYR 48 N -0.22 0.04 0.00 4.55 3.20 -0.13 -1.88 116.97 122.53 1orw h TYR 48 Ca -0.00 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.79 1orw h TYR 48 Cb 0.20 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1orw h TYR 48 CO -0.02 0.13 -0.36 -0.07 -1.64 0.00 0.00 178.16 176.20 1orw h LEU 49 N -0.07 0.00 -3.13 2.82 3.38 -0.05 -3.03 115.31 115.23 1orw h LEU 49 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1orw h LEU 49 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1orw h LEU 49 CO -0.00 0.36 0.00 0.29 0.09 0.00 0.00 178.44 179.18 1orw n LYS 50 N -3.93 3.52 -4.11 1.13 4.76 0.22 -4.94 118.16 114.82 1orw n LYS 50 Ca -0.02 -2.77 -0.28 0.00 -2.87 0.00 0.00 58.31 52.37 1orw n LYS 50 Cb 0.42 -1.80 -0.09 0.00 -1.84 0.00 0.00 35.03 31.72 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 0.76 0.56 0.25 4.39 7.64 -0.74 -4.78 113.62 121.71 1orw n SER 51 Ca 0.23 -1.12 0.13 0.00 1.01 0.00 0.00 58.87 59.12 1orw n SER 51 Cb 0.83 -1.40 0.57 0.00 -1.01 0.00 0.00 64.21 63.21 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 -1.37 0.30 -3.65 0.44 1.35 -1.73 -3.33 112.91 104.92 1orw h THR 52 Ca -0.57 -0.81 -0.75 0.00 -0.55 0.00 0.00 66.41 63.73 1orw h THR 52 Cb 1.23 1.63 -0.31 0.00 -1.73 0.00 0.00 68.15 68.97 1orw h THR 52 CO 0.64 0.11 -0.06 -0.36 -0.25 0.00 0.00 175.52 175.61 1orw s PHE 53 N -3.68 3.69 0.35 4.73 0.08 -1.26 -5.06 117.98 116.82 1orw s PHE 53 Ca 0.01 -2.45 -0.27 0.00 0.12 0.00 0.00 56.93 54.34 1orw s PHE 53 Cb 0.10 -3.53 -0.09 0.00 -0.57 0.00 0.00 43.02 38.93 1orw s PHE 53 CO 0.59 -0.90 1.10 0.50 -0.10 0.00 0.00 175.22 176.41 1orw s ARG 54 N -0.25 4.35 -0.26 0.44 6.06 -1.25 -5.04 118.95 123.01 1orw s ARG 54 Ca 0.20 1.72 -0.02 0.00 -2.50 0.00 0.00 55.73 55.13 1orw s ARG 54 Cb -0.13 -2.86 0.03 0.00 0.06 0.00 0.00 34.95 32.04 1orw s ARG 54 CO -0.07 -0.02 -0.03 0.08 -2.50 0.00 0.00 175.30 172.75 1orw s VAL 55 N -1.38 3.06 0.43 7.11 1.01 -1.26 -4.69 120.40 124.68 1orw s VAL 55 Ca 0.52 -1.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1orw s VAL 55 Cb -0.29 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 1orw s VAL 55 CO 0.36 0.14 0.77 -0.54 0.00 0.00 0.00 175.10 175.84 1orw s LYS 56 N 1.34 3.69 0.31 2.72 1.02 -1.26 -5.09 119.74 122.46 1orw s LYS 56 Ca -0.00 0.36 0.04 0.00 0.02 0.00 0.00 55.97 56.40 1orw s LYS 56 Cb -0.17 -2.39 -0.03 0.00 -0.52 0.00 0.00 37.83 34.72 1orw s LYS 56 CO -0.03 -0.10 0.21 -0.59 -0.92 0.00 0.00 175.35 173.92 1orw s PHE 57 N -2.51 1.62 -0.33 3.18 -0.12 -1.26 -4.87 117.98 113.69 1orw s PHE 57 Ca 0.50 -1.50 -0.01 0.00 -0.05 0.00 0.00 56.93 55.86 1orw s PHE 57 Cb -0.10 -0.77 0.11 0.00 -0.63 0.00 0.00 43.02 41.63 1orw s PHE 57 CO 0.36 -0.68 0.16 -0.47 -0.05 0.00 0.00 175.22 174.54 1orw s TYR 58 N -3.59 0.98 -0.23 3.49 6.14 -1.26 -4.98 117.35 117.90 1orw s TYR 58 Ca 0.37 -1.48 -0.21 0.00 0.64 0.00 0.00 57.07 56.39 1orw s TYR 58 Cb 0.04 -1.23 -0.02 0.00 0.42 0.00 0.00 41.96 41.17 1orw s TYR 58 CO 0.21 -0.84 0.68 0.99 0.64 0.00 0.00 175.55 177.23 1orw s THR 59 N 1.49 4.97 0.31 4.34 2.01 -1.26 -5.05 115.64 122.44 1orw s THR 59 Ca 0.13 1.26 0.05 0.00 0.31 0.00 0.00 61.69 63.44 1orw s THR 59 Cb -0.19 -3.98 -0.06 0.00 0.01 0.00 0.00 72.50 68.27 1orw s THR 59 CO -0.19 0.04 0.00 -1.48 -0.69 0.00 0.00 174.62 172.30 1orw s LEU 60 N 2.33 2.39 -0.33 4.42 0.05 -1.26 -4.52 118.68 121.75 1orw s LEU 60 Ca 0.29 -1.29 -0.01 0.00 0.05 0.00 0.00 54.13 53.17 1orw s LEU 60 Cb -0.16 -0.55 0.11 0.00 -2.05 0.00 0.00 46.19 43.55 1orw s LEU 60 CO 0.09 -0.47 0.15 -1.10 -0.55 0.00 0.00 176.35 174.47 1orw s GLN 61 N -3.80 0.60 0.45 1.48 -0.21 0.35 -4.94 119.66 113.59 1orw s GLN 61 Ca 0.33 -1.11 -0.23 0.00 0.02 0.00 0.00 55.36 54.37 1orw s GLN 61 Cb 0.07 -1.63 -0.10 0.00 1.00 0.00 0.00 33.01 32.35 1orw s GLN 61 CO 0.14 -1.07 1.00 0.91 -2.12 0.00 0.00 175.29 174.15 1orw n TRP 62 N 4.59 1.12 -2.13 0.91 7.02 -1.26 -1.42 117.44 126.26 1orw n TRP 62 Ca 0.02 0.53 0.01 0.00 -1.02 0.00 0.00 57.50 57.03 1orw n TRP 62 Cb 0.40 -2.22 0.00 0.00 -2.42 0.00 0.00 31.31 27.07 1orw n TRP 62 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 1orw n ILE 63 N -0.69 0.00 0.00 -0.99 -5.35 -0.69 -4.85 119.36 106.79 1orw n ILE 63 Ca 0.10 -0.26 0.00 0.00 -0.27 0.00 0.00 62.75 62.32 1orw n ILE 63 Cb 0.41 0.57 0.00 0.00 -1.74 0.00 0.00 39.64 38.88 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 0.13 0.00 0.06 7.28 3.41 -1.24 -4.87 113.62 118.39 1orw n SER 64 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 1orw n SER 64 Cb 0.79 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 65.17 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 0.00 0.33 -0.18 4.04 5.68 -1.26 -3.17 116.55 121.98 1orw n ASP 65 Ca 0.00 0.57 0.00 0.00 -0.50 0.00 0.00 54.79 54.86 1orw n ASP 65 Cb 0.00 -0.64 0.00 0.00 -1.14 0.00 0.00 41.12 39.34 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 -1.85 0.00 -4.19 2.11 1.44 -1.26 -4.25 115.22 107.22 1orw n HIS 66 Ca 0.04 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.59 1orw n HIS 66 Cb 0.24 0.01 -0.11 0.00 0.12 0.00 0.00 29.99 30.25 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 0.87 0.01 -1.40 2.02 -1.25 -0.95 118.70 117.99 1orw s GLU 67 Ca 0.00 -1.16 -0.17 0.00 0.02 0.00 0.00 54.97 53.66 1orw s GLU 67 Cb 0.00 -0.60 0.03 0.00 0.10 0.00 0.00 34.13 33.66 1orw s GLU 67 CO 0.00 0.10 0.36 1.52 0.02 0.00 0.00 175.26 177.26 1orw s TYR 68 N -2.34 -0.22 -0.04 1.61 -0.85 -0.24 -1.70 117.35 113.57 1orw s TYR 68 Ca 0.06 0.27 -0.04 0.00 -0.52 0.00 0.00 57.07 56.84 1orw s TYR 68 Cb -0.04 0.15 -0.04 0.00 0.38 0.00 0.00 41.96 42.41 1orw s TYR 68 CO 0.01 -0.47 0.17 -0.51 -1.52 0.00 0.00 175.55 173.23 1orw s LEU 69 N -1.60 4.37 -0.13 -3.49 1.43 -0.51 -0.90 118.68 117.86 1orw s LEU 69 Ca -0.10 0.38 -0.06 0.00 -1.03 0.00 0.00 54.13 53.32 1orw s LEU 69 Cb -0.03 -2.48 0.05 0.00 0.03 0.00 0.00 46.19 43.76 1orw s LEU 69 CO 0.02 0.30 0.29 -0.47 0.23 0.00 0.00 176.35 176.71 1orw s TYR 70 N -1.25 -0.42 -0.36 0.29 5.04 -0.75 -0.50 117.35 119.40 1orw s TYR 70 Ca 0.24 0.95 -0.17 0.00 -2.44 0.00 0.00 57.07 55.65 1orw s TYR 70 Cb -0.12 0.08 -0.00 0.00 0.35 0.00 0.00 41.96 42.26 1orw s TYR 70 CO 0.15 -0.29 0.45 0.21 -1.34 0.00 0.00 175.55 174.73 1orw s LYS 71 N 1.61 3.50 -0.23 4.97 2.20 -1.26 -0.68 119.74 129.85 1orw s LYS 71 Ca -0.07 -0.36 -0.04 0.00 -0.36 0.00 0.00 55.97 55.14 1orw s LYS 71 Cb -0.10 -3.84 -0.00 0.00 -1.51 0.00 0.00 37.83 32.37 1orw s LYS 71 CO -0.09 -0.65 -0.03 -1.14 -0.36 0.00 0.00 175.35 173.07 1orw s GLN 72 N 2.23 3.29 0.00 4.03 0.74 -0.44 -4.72 119.66 124.80 1orw s GLN 72 Ca 0.15 -0.68 0.00 0.00 0.05 0.00 0.00 55.36 54.88 1orw s GLN 72 Cb -0.16 -3.05 0.00 0.00 1.10 0.00 0.00 33.01 30.90 1orw s GLN 72 CO 0.13 -0.24 0.00 0.39 -0.55 0.00 0.00 175.29 175.02 1orw n GLU 73 N 4.79 0.00 0.00 1.67 1.02 -1.26 -1.81 120.64 125.05 1orw n GLU 73 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 1orw n GLU 73 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 1orw n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1orw n ASN 74 N 2.01 0.00 -4.46 1.62 3.02 -1.26 -5.14 115.26 111.05 1orw n ASN 74 Ca 0.00 -0.02 -0.33 0.00 -0.03 0.00 0.00 54.58 54.19 1orw n ASN 74 Cb 0.00 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.04 1orw n ASN 74 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1orw s ASN 75 N 0.00 4.43 -0.19 6.41 -0.87 -0.75 -4.38 114.94 119.58 1orw s ASN 75 Ca 0.00 -0.19 -0.27 0.00 -1.57 0.00 0.00 52.86 50.83 1orw s ASN 75 Cb 0.00 -1.56 -0.00 0.00 -0.02 0.00 0.00 41.25 39.66 1orw s ASN 75 CO 0.00 0.21 0.93 -0.63 -2.57 0.00 0.00 177.10 175.04 1orw s ILE 76 N 0.10 4.79 -0.06 0.60 1.01 -1.16 -1.32 121.20 125.15 1orw s ILE 76 Ca -0.03 1.83 0.01 0.00 0.00 0.00 0.00 60.65 62.46 1orw s ILE 76 Cb -0.14 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 1orw s ILE 76 CO 0.04 -0.07 -0.08 -0.76 0.00 0.00 0.00 174.94 174.07 1orw s LEU 77 N 2.62 3.12 -0.38 2.97 1.43 0.15 0.12 118.68 128.70 1orw s LEU 77 Ca 0.41 -0.05 -0.14 0.00 -1.03 0.00 0.00 54.13 53.33 1orw s LEU 77 Cb -0.16 -1.68 0.01 0.00 0.03 0.00 0.00 46.19 44.39 1orw s LEU 77 CO 0.10 0.36 0.27 -0.22 0.23 0.00 0.00 176.35 177.09 1orw s LEU 78 N -0.84 4.87 -0.11 1.79 2.96 -0.72 -1.81 118.68 124.83 1orw s LEU 78 Ca 0.13 -0.76 -0.12 0.00 -0.22 0.00 0.00 54.13 53.16 1orw s LEU 78 Cb -0.11 -2.14 -0.05 0.00 0.50 0.00 0.00 46.19 44.40 1orw s LEU 78 CO 0.02 -0.37 0.26 -0.36 -1.32 0.00 0.00 176.35 174.58 1orw s PHE 79 N 1.68 3.57 -0.26 5.38 0.08 -0.07 -1.94 117.98 126.41 1orw s PHE 79 Ca 0.05 0.66 -0.09 0.00 0.12 0.00 0.00 56.93 57.67 1orw s PHE 79 Cb -0.18 -2.19 -0.03 0.00 -0.57 0.00 0.00 43.02 40.04 1orw s PHE 79 CO 0.10 0.50 0.11 1.21 -0.10 0.00 0.00 175.22 177.04 1orw s ASN 80 N -0.39 5.44 0.19 1.36 3.84 -0.24 -1.08 114.94 124.06 1orw s ASN 80 Ca 0.17 -0.17 0.25 0.00 0.21 0.00 0.00 52.86 53.33 1orw s ASN 80 Cb -0.13 -1.99 0.66 0.00 -0.55 0.00 0.00 41.25 39.23 1orw s ASN 80 CO 0.06 -0.05 1.64 0.00 -2.79 0.00 0.00 177.10 175.95 1orw n ALA 81 N 4.97 2.47 0.03 1.71 0.00 -0.13 -1.59 120.51 127.98 1orw n ALA 81 Ca -0.15 -0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.07 1orw n ALA 81 Cb 0.51 -1.38 -0.14 0.00 0.00 0.00 0.00 19.45 18.44 1orw n ALA 81 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1orw h GLU 82 N 0.00 0.14 -0.00 0.00 4.81 -1.94 -3.38 114.58 114.21 1orw h GLU 82 Ca 0.00 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1orw h GLU 82 Cb 0.75 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.22 1orw h GLU 82 CO 0.00 0.92 -0.40 0.66 -0.73 0.00 0.00 179.01 179.47 1orw n TYR 83 N -3.32 0.00 -0.27 0.92 4.01 -1.25 -5.00 117.16 112.26 1orw n TYR 83 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1orw n TYR 83 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.06 1orw n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1orw n GLY 84 N 1.13 2.06 3.87 2.72 0.00 -0.62 -5.00 105.19 109.36 1orw n GLY 84 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.46 6.56 0.25 1.61 4.22 -1.24 -4.82 114.94 118.06 1orw s ASN 85 Ca 0.00 1.16 0.03 0.00 -2.14 0.00 0.00 52.86 51.91 1orw s ASN 85 Cb 0.00 -2.33 -0.01 0.00 1.28 0.00 0.00 41.25 40.19 1orw s ASN 85 CO 0.00 -0.37 0.10 -1.54 -2.04 0.00 0.00 177.10 173.24 1orw n SER 86 N -1.17 0.96 0.00 3.54 3.41 -1.26 -1.08 113.62 118.02 1orw n SER 86 Ca 0.03 -2.35 0.00 0.00 -0.26 0.00 0.00 58.87 56.29 1orw n SER 86 Cb 0.54 0.68 0.00 0.00 -0.26 0.00 0.00 64.21 65.17 1orw n SER 86 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1orw n SER 87 N -1.78 0.00 -3.99 4.04 3.41 -0.82 -4.98 113.62 109.50 1orw n SER 87 Ca -0.03 0.00 -0.47 0.00 -0.26 0.00 0.00 58.87 58.11 1orw n SER 87 Cb 0.38 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.28 1orw n SER 87 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1orw n ILE 88 N 0.00 1.06 -0.03 -1.33 5.41 -1.26 -1.75 119.36 121.46 1orw n ILE 88 Ca 0.00 -0.27 -0.02 0.00 1.00 0.00 0.00 62.75 63.47 1orw n ILE 88 Cb 0.00 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 38.79 1orw n ILE 88 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 1orw n PHE 89 N 0.55 0.37 0.00 1.39 -0.00 0.32 -4.69 117.46 115.40 1orw n PHE 89 Ca 0.17 0.12 0.00 0.00 -0.00 0.00 0.00 57.45 57.74 1orw n PHE 89 Cb 0.16 -0.92 0.00 0.00 -0.00 0.00 0.00 39.48 38.72 1orw n PHE 89 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.76 178.23 1orw n LEU 90 N -2.69 0.00 -4.41 -2.13 -0.00 -1.11 -5.01 117.00 101.64 1orw n LEU 90 Ca -0.18 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.55 1orw n LEU 90 Cb 0.91 0.00 0.27 0.00 -0.00 0.00 0.00 43.42 44.60 1orw n LEU 90 CO 0.44 0.00 0.47 -1.61 -0.00 0.00 0.00 177.39 176.69 1orw s GLU 91 N 0.00 -1.68 0.39 1.47 2.02 -1.26 -3.00 118.70 116.64 1orw s GLU 91 Ca 0.00 0.67 0.09 0.00 0.02 0.00 0.00 54.97 55.75 1orw s GLU 91 Cb 0.00 -1.48 0.85 0.00 0.10 0.00 0.00 34.13 33.60 1orw s GLU 91 CO 0.00 -4.18 1.98 -0.97 0.02 0.00 0.00 175.26 172.11 1orw h ASN 92 N -2.95 0.54 0.00 -0.19 -0.73 -1.95 -3.33 115.58 106.98 1orw h ASN 92 Ca -0.59 0.00 -0.61 0.00 1.87 0.00 0.00 56.30 56.98 1orw h ASN 92 Cb 1.34 -0.11 0.01 0.00 0.27 0.00 0.00 38.32 39.83 1orw h ASN 92 CO 0.45 0.35 3.22 -1.54 -0.37 0.00 0.00 177.43 179.54 1orw n SER 93 N -4.48 6.04 0.00 1.15 3.41 -1.26 -2.94 113.62 115.54 1orw n SER 93 Ca 0.09 -2.58 0.00 0.00 -0.26 0.00 0.00 58.87 56.12 1orw n SER 93 Cb 0.25 -1.42 0.00 0.00 -0.26 0.00 0.00 64.21 62.78 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 4.35 0.00 -2.44 6.66 -1.04 -1.25 -5.01 114.28 115.55 1orw n THR 94 Ca 0.61 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 62.20 1orw n THR 94 Cb 0.26 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 68.78 1orw n THR 94 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1orw n PHE 95 N 0.00 2.67 -2.13 -1.42 3.72 -1.15 -4.98 117.46 114.17 1orw n PHE 95 Ca 0.00 -2.72 -0.40 0.00 -0.05 0.00 0.00 57.45 54.28 1orw n PHE 95 Cb 0.00 -1.69 -0.03 0.00 -0.94 0.00 0.00 39.48 36.82 1orw n PHE 95 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1orw s ASP 96 N -0.08 5.55 -0.45 4.37 1.01 -1.26 -4.91 116.67 120.89 1orw s ASP 96 Ca 0.41 0.38 -0.33 0.00 0.71 0.00 0.00 52.55 53.71 1orw s ASP 96 Cb 0.11 -2.53 -0.12 0.00 1.01 0.00 0.00 42.92 41.39 1orw s ASP 96 CO -0.01 -2.15 2.30 -1.84 0.21 0.00 0.00 175.17 173.68 1orw n GLU 97 N 9.03 0.95 -1.39 8.23 0.00 -1.26 -4.83 120.64 131.37 1orw n GLU 97 Ca 0.18 0.21 -0.34 0.00 0.00 0.00 0.00 57.16 57.21 1orw n GLU 97 Cb 0.51 -2.52 0.08 0.00 0.00 0.00 0.00 31.44 29.50 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 11.01 7.46 0.00 -1.84 4.77 -1.26 -4.77 117.00 132.37 1orw n LEU 98 Ca 0.44 -4.32 0.00 0.00 -0.03 0.00 0.00 56.01 52.09 1orw n LEU 98 Cb 0.26 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1orw n LEU 98 CO 0.77 1.52 0.00 0.61 -1.33 0.00 0.00 177.39 178.96 1orw n GLY 99 N -0.90 -2.31 0.00 -0.72 0.00 -1.26 -4.98 105.19 95.02 1orw n GLY 99 Ca 0.61 0.75 0.00 0.00 0.00 0.00 0.00 46.02 47.38 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 -1.13 1.61 4.02 -1.26 -5.14 117.16 115.26 1orw n TYR 100 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1orw n TYR 100 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1orw n TYR 100 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1orw n SER 101 N 0.00 0.00 0.00 7.72 2.88 -1.26 -4.85 113.62 118.11 1orw n SER 101 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1orw n SER 101 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1orw n SER 101 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1orw n THR 102 N 0.00 0.00 0.00 2.46 -2.24 -1.26 -4.60 114.28 108.64 1orw n THR 102 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1orw n THR 102 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1orw n THR 102 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1orw n ASN 103 N 0.00 0.00 0.00 3.42 6.94 -0.74 -4.81 115.26 120.07 1orw n ASN 103 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1orw n ASN 103 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 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 0.00 0.00 -4.21 0.53 2.03 -1.22 -4.83 116.55 108.85 1orw n ASP 104 Ca 0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 1orw n ASP 104 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 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 -1.68 1.16 -0.22 -0.67 -0.85 -1.26 -2.29 117.35 111.53 1orw s TYR 105 Ca 0.00 -1.26 -0.05 0.00 -0.52 0.00 0.00 57.07 55.24 1orw s TYR 105 Cb 0.00 -0.62 0.11 0.00 0.38 0.00 0.00 41.96 41.83 1orw s TYR 105 CO 0.00 -0.49 0.41 0.45 -1.52 0.00 0.00 175.55 174.39 1orw s SER 106 N -3.16 -0.10 -0.25 -0.18 0.15 -0.60 -4.97 113.70 104.59 1orw s SER 106 Ca 0.33 0.69 -0.11 0.00 0.70 0.00 0.00 55.95 57.56 1orw s SER 106 Cb 0.07 1.28 -0.05 0.00 -1.71 0.00 0.00 66.02 65.61 1orw s SER 106 CO 0.08 -0.26 0.21 -0.69 1.20 0.00 0.00 173.24 173.78 1orw s VAL 107 N 2.59 5.31 0.17 4.45 1.01 -1.26 0.81 120.40 133.48 1orw s VAL 107 Ca 0.05 0.25 -0.33 0.00 0.00 0.00 0.00 61.98 61.95 1orw s VAL 107 Cb -0.13 -3.55 -0.16 0.00 0.00 0.00 0.00 36.38 32.54 1orw s VAL 107 CO -0.14 0.29 1.18 -1.54 0.00 0.00 0.00 175.10 174.89 1orw n SER 108 N 4.65 1.40 -0.43 3.32 3.41 -0.90 -4.80 113.62 120.27 1orw n SER 108 Ca -0.14 1.14 0.36 0.00 -0.26 0.00 0.00 58.87 59.97 1orw n SER 108 Cb 0.52 -1.22 0.64 0.00 -0.26 0.00 0.00 64.21 63.89 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 3.50 0.11 0.00 4.33 0.13 -1.81 0.99 132.00 139.25 1orw h PRO 109 Ca -0.44 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1orw h PRO 109 Cb 1.34 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1orw h PRO 109 CO 0.71 0.07 0.00 -0.40 -0.23 0.00 0.00 178.00 178.15 1orw n ASP 110 N -4.68 0.00 -1.70 1.44 5.75 -1.15 -4.88 116.55 111.34 1orw n ASP 110 Ca 0.36 -1.04 -0.18 0.00 -0.01 0.00 0.00 54.79 53.92 1orw n ASP 110 Cb 1.38 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 41.41 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 -0.95 -1.49 0.06 0.11 1.74 0.34 -4.83 116.66 111.65 1orw n ARG 111 Ca 0.20 1.03 0.07 0.00 -0.77 0.00 0.00 57.85 58.38 1orw n ARG 111 Cb 0.09 -5.43 -0.05 0.00 -1.02 0.00 0.00 32.46 26.06 1orw n ARG 111 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1orw n GLN 112 N -2.34 0.62 -4.28 5.56 6.02 -1.26 -4.86 117.38 116.83 1orw n GLN 112 Ca -0.19 0.11 -0.15 0.00 -0.01 0.00 0.00 57.00 56.76 1orw n GLN 112 Cb 0.61 -1.78 -0.10 0.00 1.02 0.00 0.00 30.24 29.99 1orw n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1orw s PHE 113 N -3.23 1.41 -0.06 1.08 0.08 -1.26 -0.71 117.98 115.29 1orw s PHE 113 Ca -0.02 -1.20 -0.06 0.00 0.12 0.00 0.00 56.93 55.77 1orw s PHE 113 Cb 0.10 -0.80 0.02 0.00 -0.57 0.00 0.00 43.02 41.77 1orw s PHE 113 CO 0.81 -0.39 0.17 -1.50 -0.10 0.00 0.00 175.22 174.21 1orw s ILE 114 N -3.83 -0.00 -0.19 0.64 2.07 -0.92 -2.11 121.20 116.84 1orw s ILE 114 Ca 0.36 0.01 -0.07 0.00 -1.41 0.00 0.00 60.65 59.54 1orw s ILE 114 Cb 0.07 -0.24 -0.04 0.00 0.13 0.00 0.00 42.46 42.39 1orw s ILE 114 CO 0.12 0.00 0.05 -0.22 -1.91 0.00 0.00 174.94 172.99 1orw s LEU 115 N 0.16 3.65 -0.19 8.50 2.96 0.24 -1.51 118.68 132.50 1orw s LEU 115 Ca -0.01 -0.01 -0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1orw s LEU 115 Cb -0.02 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 1orw s LEU 115 CO -0.00 0.12 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.70 1orw s PHE 116 N 0.67 2.90 -0.10 5.38 0.40 -0.31 -1.55 117.98 125.36 1orw s PHE 116 Ca 0.03 -0.96 -0.03 0.00 -0.60 0.00 0.00 56.93 55.38 1orw s PHE 116 Cb -0.13 -2.01 -0.03 0.00 0.51 0.00 0.00 43.02 41.36 1orw s PHE 116 CO 0.02 -0.49 0.01 -2.00 0.70 0.00 0.00 175.22 173.46 1orw s GLU 117 N 1.14 3.09 0.30 0.44 2.12 -0.97 -1.35 118.70 123.47 1orw s GLU 117 Ca 0.01 -0.39 -0.18 0.00 0.36 0.00 0.00 54.97 54.77 1orw s GLU 117 Cb -0.14 -2.85 0.07 0.00 0.26 0.00 0.00 34.13 31.47 1orw s GLU 117 CO -0.02 0.67 0.91 1.52 -0.54 0.00 0.00 175.26 177.79 1orw s TYR 118 N -0.78 0.12 -1.07 5.30 1.13 -0.45 -1.79 117.35 119.81 1orw s TYR 118 Ca 0.12 -0.69 -0.05 0.00 -1.41 0.00 0.00 57.07 55.04 1orw s TYR 118 Cb -0.12 0.79 0.01 0.00 -1.10 0.00 0.00 41.96 41.54 1orw s TYR 118 CO 0.02 -1.30 0.73 -1.71 -2.51 0.00 0.00 175.55 170.78 1orw n ASN 119 N -1.40 -5.17 -4.67 -0.18 2.85 -1.26 0.41 115.26 105.83 1orw n ASN 119 Ca -0.06 -0.33 -0.42 0.00 -0.11 0.00 0.00 54.58 53.66 1orw n ASN 119 Cb 0.60 -3.87 -0.03 0.00 1.24 0.00 0.00 39.78 37.72 1orw n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1orw s TYR 120 N -3.16 2.09 -0.30 1.20 6.04 -1.26 -3.96 117.35 118.00 1orw s TYR 120 Ca 0.36 0.19 0.02 0.00 0.04 0.00 0.00 57.07 57.67 1orw s TYR 120 Cb -0.16 -3.96 0.07 0.00 -1.04 0.00 0.00 41.96 36.87 1orw s TYR 120 CO 0.45 -3.99 -0.02 0.08 -1.54 0.00 0.00 175.55 170.52 1orw s VAL 121 N 3.52 2.50 0.42 3.14 1.01 0.29 -4.98 120.40 126.30 1orw s VAL 121 Ca 0.75 -1.77 -0.24 0.00 0.00 0.00 0.00 61.98 60.72 1orw s VAL 121 Cb -0.37 -2.57 -0.08 0.00 0.00 0.00 0.00 36.38 33.36 1orw s VAL 121 CO 0.32 -0.24 1.13 -0.75 0.00 0.00 0.00 175.10 175.56 1orw s LYS 122 N 1.10 4.00 0.00 2.72 2.20 -1.26 -0.32 119.74 128.17 1orw s LYS 122 Ca -0.02 1.71 0.00 0.00 -0.36 0.00 0.00 55.97 57.30 1orw s LYS 122 Cb -0.20 -2.55 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 1orw s LYS 122 CO -0.05 -0.33 0.00 0.94 -0.36 0.00 0.00 175.35 175.56 1orw n GLN 123 N -0.14 0.00 0.00 4.03 7.27 -0.76 -4.89 117.38 122.88 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 0.48 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.13 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 0.00 0.00 -0.02 3.69 5.03 -1.22 -4.97 117.44 119.95 1orw n TRP 124 Ca 0.00 0.00 -0.11 0.00 3.03 0.00 0.00 57.50 60.42 1orw n TRP 124 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 31.31 30.23 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 0.16 0.00 -0.99 2.43 -1.98 -3.36 114.38 110.64 1orw h ARG 125 Ca 0.00 -0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 58.88 1orw h ARG 125 Cb 0.00 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 1orw h ARG 125 CO 0.00 0.19 -2.00 0.72 -1.51 0.00 0.00 179.97 177.37 1orw n HIS 126 N -4.96 0.00 -1.97 2.20 8.25 -1.26 -5.03 115.22 112.45 1orw n HIS 126 Ca -0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.08 1orw n HIS 126 Cb 0.07 -0.71 0.02 0.00 1.12 0.00 0.00 29.99 30.50 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 -4.98 5.49 0.00 0.41 1.04 -1.26 -4.70 113.70 109.70 1orw s SER 127 Ca -0.11 1.96 0.00 0.00 0.48 0.00 0.00 55.95 58.28 1orw s SER 127 Cb 0.05 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1orw s SER 127 CO 0.55 -1.37 0.00 0.00 0.98 0.00 0.00 173.24 173.41 1orw n TYR 128 N -2.04 0.00 -4.23 5.02 0.18 -1.26 -1.84 117.16 112.99 1orw n TYR 128 Ca 0.10 0.00 -0.23 0.00 1.88 0.00 0.00 57.90 59.65 1orw n TYR 128 Cb 0.52 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.42 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 3.80 0.24 -3.48 -4.23 0.56 -4.65 115.64 105.88 1orw s THR 129 Ca 0.00 -1.70 -0.22 0.00 -1.18 0.00 0.00 61.69 58.59 1orw s THR 129 Cb 0.00 -3.03 0.04 0.00 1.34 0.00 0.00 72.50 70.85 1orw s THR 129 CO 0.00 -0.34 0.81 0.00 -0.54 0.00 0.00 174.62 174.56 1orw s ALA 130 N -2.20 -1.36 0.08 3.99 0.00 -0.99 0.10 121.76 121.38 1orw s ALA 130 Ca 0.31 -0.18 0.05 0.00 0.00 0.00 0.00 51.96 52.15 1orw s ALA 130 Cb -0.07 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 1orw s ALA 130 CO 0.21 -1.04 -0.05 -1.12 0.00 0.00 0.00 175.76 173.77 1orw s SER 131 N -2.94 4.73 0.05 0.00 0.01 0.16 -2.40 113.70 113.31 1orw s SER 131 Ca 0.12 -0.24 0.05 0.00 1.31 0.00 0.00 55.95 57.19 1orw s SER 131 Cb -0.04 -1.05 -0.02 0.00 0.21 0.00 0.00 66.02 65.11 1orw s SER 131 CO 0.06 0.20 -0.14 -0.31 0.41 0.00 0.00 173.24 173.45 1orw s TYR 132 N -1.21 1.24 -0.07 2.43 1.51 -1.26 -1.34 117.35 118.65 1orw s TYR 132 Ca 0.22 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1orw s TYR 132 Cb -0.11 -0.73 0.01 0.00 -0.11 0.00 0.00 41.96 41.02 1orw s TYR 132 CO 0.14 0.04 -0.12 -0.51 -1.11 0.00 0.00 175.55 174.00 1orw s ASP 133 N -1.30 1.84 -0.18 2.29 1.01 -0.46 -4.39 116.67 115.49 1orw s ASP 133 Ca 0.01 -0.31 -0.12 0.00 0.71 0.00 0.00 52.55 52.84 1orw s ASP 133 Cb -0.08 -0.84 -0.05 0.00 1.01 0.00 0.00 42.92 42.96 1orw s ASP 133 CO 0.02 0.02 0.23 -0.63 0.21 0.00 0.00 175.17 175.01 1orw s ILE 134 N 0.76 5.35 -0.14 0.77 1.01 -1.26 -1.17 121.20 126.51 1orw s ILE 134 Ca -0.13 0.40 -0.01 0.00 0.00 0.00 0.00 60.65 60.92 1orw s ILE 134 Cb -0.16 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 1orw s ILE 134 CO 0.03 0.41 -0.12 -0.47 0.00 0.00 0.00 174.94 174.78 1orw s TYR 135 N 0.41 2.83 -0.19 3.97 5.04 -0.57 -0.63 117.35 128.21 1orw s TYR 135 Ca 0.13 -0.73 -0.29 0.00 -2.44 0.00 0.00 57.07 53.74 1orw s TYR 135 Cb -0.12 -1.88 -0.00 0.00 0.35 0.00 0.00 41.96 40.31 1orw s TYR 135 CO 0.01 -0.28 1.16 0.34 -1.34 0.00 0.00 175.55 175.44 1orw s ASP 136 N 0.53 7.02 0.00 4.32 -1.08 0.18 -2.16 116.67 125.47 1orw s ASP 136 Ca -0.08 1.55 0.29 0.00 -0.52 0.00 0.00 52.55 53.79 1orw s ASP 136 Cb -0.16 -2.54 1.22 0.00 -1.46 0.00 0.00 42.92 39.98 1orw s ASP 136 CO 0.04 -0.71 1.88 0.18 0.52 0.00 0.00 175.17 177.07 1orw n LEU 137 N 6.43 0.17 0.00 -1.34 4.77 0.12 -1.00 117.00 126.15 1orw n LEU 137 Ca 0.13 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1orw n LEU 137 Cb 0.45 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1orw n LEU 137 CO 0.54 0.04 0.00 0.59 -1.33 0.00 0.00 177.39 177.23 1orw n ASN 138 N -1.32 0.00 0.12 -1.43 3.02 -1.25 -4.23 115.26 110.17 1orw n ASN 138 Ca 0.10 0.04 0.09 0.00 -0.03 0.00 0.00 54.58 54.78 1orw n ASN 138 Cb 0.30 -0.06 0.45 0.00 -0.61 0.00 0.00 39.78 39.85 1orw n ASN 138 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1orw n LYS 139 N -1.05 0.12 -3.46 3.52 2.85 -1.26 -4.86 118.16 114.01 1orw n LYS 139 Ca 0.00 0.55 -0.22 0.00 -1.05 0.00 0.00 58.31 57.59 1orw n LYS 139 Cb 0.00 -1.83 0.05 0.00 -0.65 0.00 0.00 35.03 32.59 1orw n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1orw n ARG 140 N -2.07 -1.60 -3.89 -1.58 1.74 -0.17 -5.02 116.66 104.07 1orw n ARG 140 Ca -0.00 0.73 -0.10 0.00 -0.77 0.00 0.00 57.85 57.71 1orw n ARG 140 Cb 0.07 -4.82 -0.09 0.00 -1.02 0.00 0.00 32.46 26.60 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 -5.03 0.63 0.01 5.56 -0.21 -0.91 -4.94 119.66 114.77 1orw s GLN 141 Ca 0.40 -0.69 -0.28 0.00 0.02 0.00 0.00 55.36 54.80 1orw s GLN 141 Cb -0.10 0.25 -0.04 0.00 1.00 0.00 0.00 33.01 34.12 1orw s GLN 141 CO 0.81 -0.17 0.89 -1.17 -2.12 0.00 0.00 175.29 173.53 1orw s LEU 142 N -2.09 4.39 -0.04 2.90 0.20 -1.26 0.48 118.68 123.25 1orw s LEU 142 Ca -0.05 1.56 -0.30 0.00 0.69 0.00 0.00 54.13 56.03 1orw s LEU 142 Cb -0.01 -3.43 -0.05 0.00 -0.43 0.00 0.00 46.19 42.27 1orw s LEU 142 CO -0.04 -0.17 1.40 -0.63 -0.29 0.00 0.00 176.35 176.62 1orw s ILE 143 N 0.67 3.85 -0.10 6.68 1.09 0.19 -4.90 121.20 128.69 1orw s ILE 143 Ca 0.47 1.16 0.13 0.00 -1.10 0.00 0.00 60.65 61.31 1orw s ILE 143 Cb -0.21 -3.75 -0.18 0.00 -1.06 0.00 0.00 42.46 37.26 1orw s ILE 143 CO 0.26 -0.04 0.13 0.35 -0.10 0.00 0.00 174.94 175.54 1orw n THR 144 N 4.92 0.63 -3.29 2.92 -2.24 -1.26 -4.63 114.28 111.32 1orw n THR 144 Ca 0.14 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 61.05 1orw n THR 144 Cb 0.44 -0.38 -0.06 0.00 -2.10 0.00 0.00 70.33 68.23 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 -2.54 4.13 -1.35 -0.78 1.03 -1.26 -4.18 118.70 113.75 1orw s GLU 145 Ca -0.06 0.67 -0.07 0.00 0.03 0.00 0.00 54.97 55.54 1orw s GLU 145 Cb 0.06 -3.13 0.02 0.00 -0.80 0.00 0.00 34.13 30.28 1orw s GLU 145 CO 0.57 0.58 1.06 0.39 -1.33 0.00 0.00 175.26 176.53 1orw n GLU 146 N 1.40 -6.96 -0.73 -4.83 -0.58 -1.26 -4.64 120.64 103.04 1orw n GLU 146 Ca -0.09 0.77 -0.29 0.00 -0.42 0.00 0.00 57.16 57.14 1orw n GLU 146 Cb 0.51 -5.75 0.22 0.00 -0.57 0.00 0.00 31.44 25.85 1orw n GLU 146 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1orw s ARG 147 N -6.12 -0.27 -0.10 3.49 3.03 -1.26 -4.85 118.95 112.86 1orw s ARG 147 Ca 0.41 0.87 -0.22 0.00 2.03 0.00 0.00 55.73 58.83 1orw s ARG 147 Cb -0.19 -1.63 -0.04 0.00 -1.03 0.00 0.00 34.95 32.07 1orw s ARG 147 CO 0.76 -3.30 0.63 0.42 -1.13 0.00 0.00 175.30 172.67 1orw s ILE 148 N -2.61 5.08 0.55 4.99 1.01 -1.26 -5.03 121.20 123.93 1orw s ILE 148 Ca 0.67 1.27 -0.16 0.00 0.00 0.00 0.00 60.65 62.44 1orw s ILE 148 Cb -0.23 -3.96 -0.13 0.00 0.01 0.00 0.00 42.46 38.14 1orw s ILE 148 CO 0.62 0.25 -0.26 -2.65 0.00 0.00 0.00 174.94 172.90 1orw n PRO 149 N 3.94 0.00 -2.89 2.79 -0.02 -1.26 -4.55 135.00 133.01 1orw n PRO 149 Ca -0.03 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.05 1orw n PRO 149 Cb 0.51 -0.87 -0.06 0.00 -0.02 0.00 0.00 33.50 33.06 1orw n PRO 149 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1orw s ASN 150 N -0.87 7.46 -0.19 2.55 0.01 -1.26 -3.73 114.94 118.91 1orw s ASN 150 Ca 0.46 1.73 -0.01 0.00 -0.71 0.00 0.00 52.86 54.33 1orw s ASN 150 Cb -0.36 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 38.76 1orw s ASN 150 CO 0.62 0.15 0.16 0.59 -1.51 0.00 0.00 177.10 177.11 1orw n ASN 151 N 1.78 -2.61 -4.77 -1.22 3.02 -1.24 -5.01 115.26 105.22 1orw n ASN 151 Ca -0.04 -0.07 -0.39 0.00 -0.03 0.00 0.00 54.58 54.05 1orw n ASN 151 Cb 0.48 -1.12 -0.04 0.00 -0.61 0.00 0.00 39.78 38.49 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 -3.04 3.40 -0.10 3.41 2.01 -1.01 -4.62 115.64 115.69 1orw s THR 152 Ca 0.08 1.31 0.16 0.00 0.31 0.00 0.00 61.69 63.55 1orw s THR 152 Cb -0.04 -3.80 -0.18 0.00 0.01 0.00 0.00 72.50 68.49 1orw s THR 152 CO 0.10 0.24 0.69 0.00 -0.69 0.00 0.00 174.62 174.96 1orw n GLN 153 N 0.76 0.63 -3.64 4.92 6.02 0.34 -2.34 117.38 124.08 1orw n GLN 153 Ca 0.01 0.21 -0.08 0.00 -0.01 0.00 0.00 57.00 57.13 1orw n GLN 153 Cb 0.46 -1.77 -0.07 0.00 1.02 0.00 0.00 30.24 29.88 1orw n GLN 153 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 1orw s TRP 154 N -2.80 -0.50 0.07 1.08 -0.11 -1.15 -4.72 118.94 110.81 1orw s TRP 154 Ca -0.04 1.16 -0.01 0.00 1.22 0.00 0.00 56.10 58.43 1orw s TRP 154 Cb 0.08 0.37 -0.04 0.00 -1.50 0.00 0.00 33.47 32.38 1orw s TRP 154 CO 0.82 -0.24 -0.01 -1.50 -4.62 0.00 0.00 176.95 171.40 1orw s ILE 155 N 0.44 0.22 -0.28 5.86 2.07 -1.26 -0.19 121.20 128.05 1orw s ILE 155 Ca 0.01 -1.84 -0.26 0.00 -1.41 0.00 0.00 60.65 57.15 1orw s ILE 155 Cb -0.05 -1.63 0.17 0.00 0.13 0.00 0.00 42.46 41.08 1orw s ILE 155 CO -0.08 -0.89 1.32 0.28 -1.91 0.00 0.00 174.94 173.66 1orw s THR 156 N -3.93 0.00 0.54 4.00 -1.32 -1.00 -4.98 115.64 108.95 1orw s THR 156 Ca 0.11 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.42 1orw s THR 156 Cb 0.08 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 70.00 1orw s THR 156 CO -0.07 0.00 1.02 0.26 -2.21 0.00 0.00 174.62 173.61 1orw s TRP 157 N -0.14 3.22 1.00 9.09 0.52 -1.26 -2.08 118.94 129.30 1orw s TRP 157 Ca 0.06 1.50 -0.12 0.00 0.02 0.00 0.00 56.10 57.56 1orw s TRP 157 Cb -0.04 -2.90 0.19 0.00 -1.15 0.00 0.00 33.47 29.57 1orw s TRP 157 CO -0.12 -0.69 1.08 -1.54 0.02 0.00 0.00 176.95 175.71 1orw s SER 158 N -2.82 2.53 0.28 2.95 1.04 -0.30 -4.90 113.70 112.47 1orw s SER 158 Ca 0.62 1.31 -0.04 0.00 0.48 0.00 0.00 55.95 58.32 1orw s SER 158 Cb -0.13 -1.99 0.36 0.00 0.10 0.00 0.00 66.02 64.36 1orw s SER 158 CO 0.32 -3.20 1.93 -0.65 0.98 0.00 0.00 173.24 172.62 1orw h PRO 159 N -1.94 1.16 0.00 4.02 0.11 -1.80 -3.43 132.00 130.13 1orw h PRO 159 Ca -0.54 -0.09 -0.51 0.00 0.11 0.00 0.00 66.00 64.97 1orw h PRO 159 Cb 1.32 -0.25 -0.08 0.00 0.11 0.00 0.00 31.00 32.10 1orw h PRO 159 CO 0.56 0.79 -0.33 1.33 -0.21 0.00 0.00 178.00 180.14 1orw n VAL 160 N -4.38 0.00 -1.57 3.15 0.24 -1.26 -4.58 118.33 109.93 1orw n VAL 160 Ca 0.10 -1.86 0.00 0.00 -2.04 0.00 0.00 64.34 60.54 1orw n VAL 160 Cb 0.05 0.21 0.00 0.00 -1.47 0.00 0.00 33.84 32.62 1orw n VAL 160 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1orw n GLY 161 N -0.02 1.19 2.60 7.63 0.00 -1.26 -4.18 105.19 111.15 1orw n GLY 161 Ca -0.12 -0.50 -0.08 0.00 0.00 0.00 0.00 46.02 45.32 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 4.52 1.71 -1.81 1.61 1.44 -1.26 -2.93 115.22 118.51 1orw n HIS 162 Ca 0.00 -2.24 -0.31 0.00 -2.01 0.00 0.00 57.72 53.16 1orw n HIS 162 Cb 0.00 -0.27 0.02 0.00 0.12 0.00 0.00 29.99 29.86 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 -3.69 3.40 0.08 -1.40 1.02 -1.26 -4.66 119.74 113.22 1orw s LYS 163 Ca 0.34 0.84 0.05 0.00 0.02 0.00 0.00 55.97 57.22 1orw s LYS 163 Cb 0.36 -2.05 -0.03 0.00 -0.52 0.00 0.00 37.83 35.58 1orw s LYS 163 CO -0.02 -0.73 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.05 1orw s LEU 164 N -5.22 2.32 -0.16 3.17 1.43 -0.18 -1.15 118.68 118.89 1orw s LEU 164 Ca 0.56 -0.67 -0.05 0.00 -1.03 0.00 0.00 54.13 52.94 1orw s LEU 164 Cb -0.12 -0.43 0.08 0.00 0.03 0.00 0.00 46.19 45.75 1orw s LEU 164 CO 0.53 -0.14 0.32 0.00 0.23 0.00 0.00 176.35 177.28 1orw s ALA 165 N -1.65 -0.76 0.16 4.21 0.00 -0.88 -0.81 121.76 122.02 1orw s ALA 165 Ca -0.00 1.11 0.02 0.00 0.00 0.00 0.00 51.96 53.09 1orw s ALA 165 Cb -0.08 -1.14 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 1orw s ALA 165 CO 0.02 -0.71 -0.02 1.52 0.00 0.00 0.00 175.76 176.57 1orw s TYR 166 N 2.49 1.17 -0.14 0.00 -0.85 -0.09 -2.38 117.35 117.55 1orw s TYR 166 Ca 0.01 -0.96 0.01 0.00 -0.52 0.00 0.00 57.07 55.60 1orw s TYR 166 Cb -0.12 -0.66 -0.00 0.00 0.38 0.00 0.00 41.96 41.55 1orw s TYR 166 CO -0.10 -0.15 -0.16 0.08 -1.52 0.00 0.00 175.55 173.69 1orw s VAL 167 N -3.60 2.64 -0.04 -3.49 1.01 0.74 -0.64 120.40 117.02 1orw s VAL 167 Ca 0.21 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 1orw s VAL 167 Cb 0.05 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.36 1orw s VAL 167 CO 0.02 0.52 0.06 0.86 0.00 0.00 0.00 175.10 176.56 1orw s TRP 168 N 0.67 0.08 -1.20 5.22 -0.00 -0.59 -0.50 118.94 122.61 1orw s TRP 168 Ca -0.08 0.23 -0.01 0.00 -0.00 0.00 0.00 56.10 56.25 1orw s TRP 168 Cb -0.16 -0.49 0.00 0.00 -0.00 0.00 0.00 33.47 32.82 1orw s TRP 168 CO 0.02 -0.20 1.01 0.09 -0.00 0.00 0.00 176.95 177.86 1orw n ASN 169 N 5.30 -2.36 -0.52 5.86 5.03 -1.26 -2.73 115.26 124.57 1orw n ASN 169 Ca -0.03 -0.61 -0.06 0.00 0.87 0.00 0.00 54.58 54.75 1orw n ASN 169 Cb 0.50 -5.09 -0.03 0.00 -1.02 0.00 0.00 39.78 34.14 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 -3.10 -5.21 -4.41 6.41 5.03 -1.26 -4.41 115.26 108.31 1orw n ASN 170 Ca -0.27 0.16 -0.29 0.00 0.87 0.00 0.00 54.58 55.05 1orw n ASN 170 Cb 0.66 -3.59 -0.13 0.00 -1.02 0.00 0.00 39.78 35.71 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 -2.05 3.40 -0.11 6.41 1.01 -1.10 -1.68 116.67 122.54 1orw s ASP 171 Ca 0.00 -0.76 -0.14 0.00 0.71 0.00 0.00 52.55 52.36 1orw s ASP 171 Cb 0.00 -0.26 -0.05 0.00 1.01 0.00 0.00 42.92 43.62 1orw s ASP 171 CO 0.00 0.17 0.35 -0.63 0.21 0.00 0.00 175.17 175.27 1orw s ILE 172 N -1.19 5.23 0.06 0.77 1.01 -1.26 -1.55 121.20 124.27 1orw s ILE 172 Ca 0.16 0.68 0.07 0.00 0.00 0.00 0.00 60.65 61.55 1orw s ILE 172 Cb -0.10 -3.67 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 1orw s ILE 172 CO 0.07 0.43 -0.19 -0.31 0.00 0.00 0.00 174.94 174.95 1orw s TYR 173 N 0.05 1.62 -0.03 3.97 1.51 0.19 0.25 117.35 124.90 1orw s TYR 173 Ca 0.20 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.91 1orw s TYR 173 Cb -0.14 -0.93 -0.00 0.00 -0.11 0.00 0.00 41.96 40.77 1orw s TYR 173 CO 0.07 0.11 -0.13 0.08 -1.11 0.00 0.00 175.55 174.57 1orw s VAL 174 N -0.96 1.12 -0.25 0.71 1.01 -0.50 -0.91 120.40 120.62 1orw s VAL 174 Ca 0.05 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1orw s VAL 174 Cb -0.09 -0.98 0.05 0.00 0.00 0.00 0.00 36.38 35.36 1orw s VAL 174 CO 0.02 0.33 -0.10 -0.54 0.00 0.00 0.00 175.10 174.81 1orw s LYS 175 N 0.10 2.48 0.52 2.72 1.02 0.01 -0.61 119.74 125.99 1orw s LYS 175 Ca -0.03 -1.19 0.31 0.00 0.02 0.00 0.00 55.97 55.07 1orw s LYS 175 Cb -0.10 -2.89 1.20 0.00 -0.52 0.00 0.00 37.83 35.52 1orw s LYS 175 CO 0.01 -0.49 1.93 -0.91 -0.92 0.00 0.00 175.35 174.97 1orw h ASN 176 N 7.87 0.00 -4.50 2.83 -0.26 -1.88 -0.44 115.58 119.19 1orw h ASN 176 Ca -0.26 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.33 1orw h ASN 176 Cb 1.07 0.00 -0.23 0.00 -1.06 0.00 0.00 38.32 38.10 1orw h ASN 176 CO 0.52 0.06 -0.42 -1.61 -1.06 0.00 0.00 177.43 174.91 1orw s GLU 177 N -3.65 0.44 0.53 0.81 0.41 -1.26 -4.58 118.70 111.40 1orw s GLU 177 Ca 0.01 -0.05 0.28 0.00 -0.41 0.00 0.00 54.97 54.80 1orw s GLU 177 Cb 0.09 0.19 1.47 0.00 -1.78 0.00 0.00 34.13 34.10 1orw s GLU 177 CO 0.57 -0.10 2.07 -1.35 -0.49 0.00 0.00 175.26 175.97 1orw h PRO 178 N 4.80 0.00 -0.50 0.39 0.11 -1.85 -2.61 132.00 132.35 1orw h PRO 178 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1orw h PRO 178 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1orw h PRO 178 CO 0.39 0.11 0.00 0.27 -0.21 0.00 0.00 178.00 178.56 1orw n ASN 179 N -3.57 4.24 -4.89 -2.05 6.94 -1.26 -4.78 115.26 109.89 1orw n ASN 179 Ca -0.02 -2.50 -0.20 0.00 -0.02 0.00 0.00 54.58 51.84 1orw n ASN 179 Cb 0.24 -0.50 -0.03 0.00 -2.36 0.00 0.00 39.78 37.13 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 -1.93 3.44 -0.01 -4.53 2.01 -0.98 -4.78 118.68 111.90 1orw s LEU 180 Ca 0.44 -0.69 -0.22 0.00 0.01 0.00 0.00 54.13 53.67 1orw s LEU 180 Cb 0.29 -2.13 -0.05 0.00 0.01 0.00 0.00 46.19 44.31 1orw s LEU 180 CO 0.19 -0.63 0.65 -0.44 1.01 0.00 0.00 176.35 177.13 1orw s SER 181 N -4.14 7.02 0.80 2.29 0.01 -1.26 -4.81 113.70 113.61 1orw s SER 181 Ca 0.48 1.22 -0.11 0.00 1.31 0.00 0.00 55.95 58.84 1orw s SER 181 Cb -0.04 -2.40 0.08 0.00 0.21 0.00 0.00 66.02 63.87 1orw s SER 181 CO 0.28 0.02 1.12 -0.94 0.41 0.00 0.00 173.24 174.14 1orw s SER 182 N 0.13 4.04 -0.23 2.44 1.04 -1.26 -4.84 113.70 115.01 1orw s SER 182 Ca 0.34 2.02 -0.06 0.00 0.48 0.00 0.00 55.95 58.73 1orw s SER 182 Cb -0.18 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.37 1orw s SER 182 CO 0.18 -2.35 0.03 -1.58 0.98 0.00 0.00 173.24 170.50 1orw s GLN 183 N -4.62 3.58 0.07 4.02 2.00 0.23 -4.85 119.66 120.08 1orw s GLN 183 Ca 0.65 -0.52 -0.31 0.00 -2.00 0.00 0.00 55.36 53.18 1orw s GLN 183 Cb -0.21 -3.20 -0.07 0.00 0.80 0.00 0.00 33.01 30.34 1orw s GLN 183 CO 0.54 -0.15 1.34 0.50 -0.50 0.00 0.00 175.29 177.01 1orw s ARG 184 N 1.46 4.34 -0.19 1.67 3.52 -1.26 -1.42 118.95 127.07 1orw s ARG 184 Ca 0.05 1.96 -0.04 0.00 -0.13 0.00 0.00 55.73 57.57 1orw s ARG 184 Cb -0.15 -3.36 -0.22 0.00 -1.56 0.00 0.00 34.95 29.67 1orw s ARG 184 CO 0.01 -0.42 0.08 -0.89 -0.81 0.00 0.00 175.30 173.27 1orw n ILE 185 N 4.13 1.64 -4.37 4.11 2.08 0.70 -4.96 119.36 122.69 1orw n ILE 185 Ca 0.11 -0.59 -0.28 0.00 0.56 0.00 0.00 62.75 62.55 1orw n ILE 185 Cb 0.44 -1.62 -0.12 0.00 -0.75 0.00 0.00 39.64 37.59 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 2.47 0.00 1.39 -4.23 -1.20 -4.94 115.64 106.60 1orw s THR 186 Ca -0.29 -1.76 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 1orw s THR 186 Cb 0.08 -2.13 0.00 0.00 1.34 0.00 0.00 72.50 71.79 1orw s THR 186 CO 0.68 0.03 0.67 0.79 -0.54 0.00 0.00 174.62 176.25 1orw n TRP 187 N 0.68 0.00 0.58 3.99 7.02 -1.26 -4.51 117.44 123.93 1orw n TRP 187 Ca -0.16 -0.23 0.12 0.00 -1.02 0.00 0.00 57.50 56.22 1orw n TRP 187 Cb 0.54 -0.02 0.18 0.00 -2.42 0.00 0.00 31.31 29.59 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 0.36 -1.48 -0.99 -2.24 -1.26 -4.97 114.28 103.48 1orw n THR 188 Ca 0.00 -0.27 -0.56 0.00 -2.27 0.00 0.00 64.05 60.95 1orw n THR 188 Cb 0.26 -0.14 -0.07 0.00 -2.10 0.00 0.00 70.33 68.28 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 1.34 -0.63 3.62 3.38 0.00 -1.26 -4.70 105.19 106.94 1orw n GLY 189 Ca 0.03 0.65 -0.03 0.00 0.00 0.00 0.00 46.02 46.68 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 -0.24 0.57 0.24 1.61 2.20 -0.83 -4.93 119.74 118.36 1orw s LYS 190 Ca 0.84 1.24 -0.30 0.00 -0.36 0.00 0.00 55.97 57.40 1orw s LYS 190 Cb -1.18 0.55 -0.15 0.00 -1.51 0.00 0.00 37.83 35.54 1orw s LYS 190 CO 0.57 -0.16 1.05 -1.91 -0.36 0.00 0.00 175.35 174.53 1orw n GLU 191 N 4.93 1.23 -1.86 4.03 2.13 -1.26 -0.64 120.64 129.20 1orw n GLU 191 Ca -0.14 0.43 -0.12 0.00 0.66 0.00 0.00 57.16 57.99 1orw n GLU 191 Cb 0.53 -1.84 -0.03 0.00 0.27 0.00 0.00 31.44 30.38 1orw n GLU 191 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1orw n ASN 192 N 1.56 -3.39 0.02 4.31 5.03 -1.26 -4.61 115.26 116.92 1orw n ASN 192 Ca 0.12 0.25 0.00 0.00 0.87 0.00 0.00 54.58 55.82 1orw n ASN 192 Cb 0.29 -3.06 0.00 0.00 -1.02 0.00 0.00 39.78 35.99 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 -2.51 0.00 -3.92 2.41 0.31 -0.42 -4.74 118.33 109.46 1orw n VAL 193 Ca -0.13 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 63.93 1orw n VAL 193 Cb 0.49 -0.31 -0.17 0.00 -0.91 0.00 0.00 33.84 32.94 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 -2.00 1.13 -0.18 2.52 -1.09 0.19 -0.29 121.20 121.48 1orw s ILE 194 Ca 0.00 -0.46 -0.02 0.00 -2.23 0.00 0.00 60.65 57.94 1orw s ILE 194 Cb 0.00 -1.19 -0.01 0.00 -1.58 0.00 0.00 42.46 39.68 1orw s ILE 194 CO 0.00 0.29 -0.08 -0.31 -1.23 0.00 0.00 174.94 173.62 1orw s TYR 195 N 1.65 2.91 -0.23 3.97 1.51 -0.45 -1.96 117.35 124.75 1orw s TYR 195 Ca 0.03 -0.79 -0.01 0.00 -1.01 0.00 0.00 57.07 55.29 1orw s TYR 195 Cb -0.14 -1.99 0.02 0.00 -0.11 0.00 0.00 41.96 39.75 1orw s TYR 195 CO -0.08 -0.38 -0.10 -0.80 -1.11 0.00 0.00 175.55 173.07 1orw s ASN 196 N 0.95 4.00 0.00 2.29 0.01 -0.68 -0.80 114.94 120.72 1orw s ASN 196 Ca -0.01 -0.80 0.00 0.00 -0.71 0.00 0.00 52.86 51.34 1orw s ASN 196 Cb -0.15 -1.61 0.00 0.00 0.41 0.00 0.00 41.25 39.90 1orw s ASN 196 CO -0.00 -0.08 0.00 0.61 -1.51 0.00 0.00 177.10 176.12 1orw n GLY 197 N 4.65 1.69 3.05 0.66 0.00 -0.81 -4.25 105.19 110.18 1orw n GLY 197 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.72 0.38 0.69 1.61 -7.23 -1.26 -0.64 120.40 111.24 1orw s VAL 198 Ca 0.00 -1.23 -0.11 0.00 -1.81 0.00 0.00 61.98 58.82 1orw s VAL 198 Cb 0.00 -0.75 0.00 0.00 0.56 0.00 0.00 36.38 36.19 1orw s VAL 198 CO 0.00 -0.56 1.08 0.42 -0.31 0.00 0.00 175.10 175.73 1orw s THR 199 N -2.03 3.72 0.39 5.32 -4.23 0.12 -4.77 115.64 114.15 1orw s THR 199 Ca -0.07 0.56 -0.03 0.00 -1.18 0.00 0.00 61.69 60.97 1orw s THR 199 Cb -0.06 -3.55 0.08 0.00 1.34 0.00 0.00 72.50 70.31 1orw s THR 199 CO -0.02 -0.73 0.53 -0.90 -0.54 0.00 0.00 174.62 172.96 1orw n ASP 200 N -2.96 0.42 -0.17 3.99 5.75 -1.26 -4.79 116.55 117.54 1orw n ASP 200 Ca 0.07 -1.42 -0.06 0.00 -0.01 0.00 0.00 54.79 53.36 1orw n ASP 200 Cb 0.57 -0.37 0.03 0.00 -1.03 0.00 0.00 41.12 40.31 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 -0.81 0.60 0.00 2.11 7.01 -1.99 -2.08 115.95 120.80 1orw h TRP 201 Ca -0.17 0.02 -0.14 0.00 2.11 0.00 0.00 58.89 60.70 1orw h TRP 201 Cb 0.57 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.41 1orw h TRP 201 CO 0.00 0.36 -0.69 -0.24 -2.79 0.00 0.00 178.44 175.08 1orw h VAL 202 N 0.64 1.49 0.02 2.65 3.04 -1.94 -2.49 116.25 119.66 1orw h VAL 202 Ca 0.19 -2.36 -0.21 0.00 -1.01 0.00 0.00 66.70 63.31 1orw h VAL 202 Cb -0.03 2.28 -0.01 0.00 -2.01 0.00 0.00 31.29 31.51 1orw h VAL 202 CO -0.06 0.67 -0.94 1.88 -1.01 0.00 0.00 177.57 178.11 1orw h TYR 203 N 0.00 0.35 0.31 3.17 -1.99 -1.91 -1.31 116.97 115.59 1orw h TYR 203 Ca -0.01 -0.20 -0.02 0.00 2.00 0.00 0.00 58.73 60.51 1orw h TYR 203 Cb 1.22 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 39.92 1orw h TYR 203 CO 0.00 1.04 -0.15 1.49 -0.00 0.00 0.00 178.16 180.54 1orw h GLU 204 N 0.11 -0.40 -0.05 4.88 4.81 -1.33 0.88 114.58 123.48 1orw h GLU 204 Ca -0.06 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1orw h GLU 204 Cb 1.59 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 31.06 1orw h GLU 204 CO 0.15 -0.20 -0.06 1.49 -0.73 0.00 0.00 179.01 179.66 1orw h GLU 205 N -0.52 0.14 -0.00 1.92 4.57 -1.50 -0.07 114.58 119.11 1orw h GLU 205 Ca -0.04 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1orw h GLU 205 Cb 0.39 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1orw h GLU 205 CO 0.07 0.61 -0.40 0.39 -1.18 0.00 0.00 179.01 178.50 1orw n GLU 206 N -4.73 2.68 0.02 1.92 -0.58 -0.50 -4.54 120.64 114.92 1orw n GLU 206 Ca -0.08 -0.31 -0.02 0.00 -0.42 0.00 0.00 57.16 56.34 1orw n GLU 206 Cb 0.31 -1.08 -0.01 0.00 -0.57 0.00 0.00 31.44 30.09 1orw n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1orw n VAL 207 N -0.78 0.90 0.06 2.62 0.31 -1.09 -4.86 118.33 115.49 1orw n VAL 207 Ca 0.03 0.23 0.10 0.00 -0.01 0.00 0.00 64.34 64.70 1orw n VAL 207 Cb 0.21 -1.64 -0.06 0.00 -0.91 0.00 0.00 33.84 31.44 1orw n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1orw n PHE 208 N -3.46 0.65 -3.69 3.52 3.01 0.28 -4.96 117.46 112.81 1orw n PHE 208 Ca -0.03 0.19 -0.28 0.00 1.01 0.00 0.00 57.45 58.34 1orw n PHE 208 Cb 0.23 -0.83 0.03 0.00 -0.01 0.00 0.00 39.48 38.90 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 -2.56 -5.07 -3.64 4.37 7.64 -0.10 -4.92 113.62 109.33 1orw n SER 209 Ca -0.03 -0.64 -0.05 0.00 1.01 0.00 0.00 58.87 59.17 1orw n SER 209 Cb 0.59 -4.06 -0.02 0.00 -1.01 0.00 0.00 64.21 59.72 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 -3.24 -1.77 -0.13 -0.43 0.00 -0.83 -4.98 121.76 110.39 1orw s ALA 210 Ca 0.58 0.54 -0.01 0.00 0.00 0.00 0.00 51.96 53.07 1orw s ALA 210 Cb -0.29 0.52 -0.24 0.00 0.00 0.00 0.00 23.12 23.11 1orw s ALA 210 CO 0.72 -0.89 0.33 0.98 0.00 0.00 0.00 175.76 176.89 1orw n TYR 211 N -0.37 1.01 -1.73 0.00 9.36 -1.26 -4.01 117.16 120.15 1orw n TYR 211 Ca -0.07 0.24 -0.42 0.00 3.32 0.00 0.00 57.90 60.97 1orw n TYR 211 Cb 0.61 -1.14 -0.01 0.00 -0.63 0.00 0.00 39.34 38.17 1orw n TYR 211 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1orw n SER 212 N -3.35 3.51 -1.93 2.98 2.88 -1.26 0.13 113.62 116.57 1orw n SER 212 Ca -0.31 1.18 0.02 0.00 -1.33 0.00 0.00 58.87 58.43 1orw n SER 212 Cb 1.05 -1.56 0.03 0.00 -0.75 0.00 0.00 64.21 62.98 1orw n SER 212 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1orw n ALA 213 N 1.37 2.48 -2.85 -1.46 0.00 0.19 -4.60 120.51 115.64 1orw n ALA 213 Ca 0.06 -2.41 -0.13 0.00 0.00 0.00 0.00 53.44 50.96 1orw n ALA 213 Cb 0.36 -0.77 -0.13 0.00 0.00 0.00 0.00 19.45 18.91 1orw n ALA 213 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1orw s LEU 214 N -1.27 2.11 -0.06 0.00 0.05 -1.23 -1.70 118.68 116.58 1orw s LEU 214 Ca 0.31 -0.27 -0.02 0.00 0.05 0.00 0.00 54.13 54.20 1orw s LEU 214 Cb 0.36 -0.11 0.03 0.00 -2.05 0.00 0.00 46.19 44.42 1orw s LEU 214 CO -0.12 -0.09 0.03 0.26 -0.55 0.00 0.00 176.35 175.88 1orw s TRP 215 N -0.67 0.38 0.48 3.48 0.51 0.18 -4.96 118.94 118.34 1orw s TRP 215 Ca -0.05 0.02 -0.19 0.00 -2.12 0.00 0.00 56.10 53.76 1orw s TRP 215 Cb -0.05 -0.65 -0.09 0.00 -0.81 0.00 0.00 33.47 31.87 1orw s TRP 215 CO -0.00 -0.27 0.99 -1.58 -0.51 0.00 0.00 176.95 175.57 1orw s TRP 216 N 2.07 3.27 0.47 -1.98 0.52 -1.26 -0.25 118.94 121.77 1orw s TRP 216 Ca 0.05 1.55 -0.14 0.00 0.02 0.00 0.00 56.10 57.58 1orw s TRP 216 Cb -0.12 -2.89 -0.07 0.00 -1.15 0.00 0.00 33.47 29.24 1orw s TRP 216 CO -0.04 -0.41 0.90 -1.54 0.02 0.00 0.00 176.95 175.87 1orw s SER 217 N -2.47 6.56 0.14 2.95 1.04 0.13 -4.90 113.70 117.16 1orw s SER 217 Ca 0.62 1.38 -0.17 0.00 0.48 0.00 0.00 55.95 58.26 1orw s SER 217 Cb -0.11 -2.43 0.08 0.00 0.10 0.00 0.00 66.02 63.66 1orw s SER 217 CO 0.22 -0.52 1.12 -2.65 0.98 0.00 0.00 173.24 172.38 1orw n PRO 218 N -1.53 -0.23 -0.31 4.02 -0.02 -1.26 0.21 135.00 135.87 1orw n PRO 218 Ca 0.05 1.10 0.08 0.00 -2.02 0.00 0.00 63.50 62.71 1orw n PRO 218 Cb 0.54 -1.63 0.23 0.00 -0.02 0.00 0.00 33.50 32.62 1orw n PRO 218 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1orw n ASN 219 N -5.00 2.91 -0.32 2.55 5.15 -1.26 -4.13 115.26 115.16 1orw n ASN 219 Ca 0.05 -2.09 -0.04 0.00 -0.60 0.00 0.00 54.58 51.89 1orw n ASN 219 Cb 0.25 -0.38 -0.02 0.00 -0.53 0.00 0.00 39.78 39.10 1orw n ASN 219 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1orw n GLY 220 N 1.17 0.69 0.11 8.20 0.00 0.13 -4.77 105.19 110.73 1orw n GLY 220 Ca 0.17 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.56 2.61 2.02 -1.92 -3.46 112.91 109.96 1orw h THR 221 Ca -0.09 -1.25 -0.67 0.00 0.77 0.00 0.00 66.41 65.18 1orw h THR 221 Cb 0.38 1.94 -0.17 0.00 -1.74 0.00 0.00 68.15 68.56 1orw h THR 221 CO 0.13 0.36 -0.77 -0.36 0.37 0.00 0.00 175.52 175.24 1orw s PHE 222 N -4.31 2.62 -0.17 3.16 0.08 -1.26 -1.86 117.98 116.23 1orw s PHE 222 Ca -0.15 -0.22 -0.00 0.00 0.12 0.00 0.00 56.93 56.68 1orw s PHE 222 Cb 0.04 -1.36 0.04 0.00 -0.57 0.00 0.00 43.02 41.17 1orw s PHE 222 CO 0.73 0.42 -0.06 -1.17 -0.10 0.00 0.00 175.22 175.04 1orw s LEU 223 N -2.27 1.74 0.08 -0.37 2.96 -0.70 0.23 118.68 120.35 1orw s LEU 223 Ca 0.20 -0.70 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 1orw s LEU 223 Cb -0.10 -0.98 -0.04 0.00 0.50 0.00 0.00 46.19 45.56 1orw s LEU 223 CO 0.12 -0.17 0.16 0.00 -1.32 0.00 0.00 176.35 175.14 1orw s ALA 224 N 1.58 3.80 0.20 5.97 0.00 0.65 -0.99 121.76 132.98 1orw s ALA 224 Ca 0.01 -0.95 -0.16 0.00 0.00 0.00 0.00 51.96 50.86 1orw s ALA 224 Cb -0.15 -1.64 0.02 0.00 0.00 0.00 0.00 23.12 21.35 1orw s ALA 224 CO -0.08 0.75 0.49 1.52 0.00 0.00 0.00 175.76 178.45 1orw s TYR 225 N -1.50 -0.00 0.01 0.00 1.13 -0.58 0.50 117.35 116.92 1orw s TYR 225 Ca 0.32 -0.35 0.07 0.00 -1.41 0.00 0.00 57.07 55.70 1orw s TYR 225 Cb -0.12 0.32 -0.03 0.00 -1.10 0.00 0.00 41.96 41.03 1orw s TYR 225 CO 0.25 -0.91 -0.22 0.00 -2.51 0.00 0.00 175.55 172.17 1orw s ALA 226 N -3.90 2.40 -0.12 9.51 0.00 -0.69 -0.83 121.76 128.13 1orw s ALA 226 Ca 0.12 -1.16 -0.00 0.00 0.00 0.00 0.00 51.96 50.91 1orw s ALA 226 Cb -0.01 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 22.44 1orw s ALA 226 CO -0.01 0.55 -0.11 -1.14 0.00 0.00 0.00 175.76 175.05 1orw s GLN 227 N -1.05 3.28 -0.01 0.00 0.74 0.21 -1.92 119.66 120.91 1orw s GLN 227 Ca 0.12 -0.65 0.04 0.00 0.05 0.00 0.00 55.36 54.93 1orw s GLN 227 Cb -0.10 -2.65 -0.03 0.00 1.10 0.00 0.00 33.01 31.33 1orw s GLN 227 CO 0.02 0.30 -0.13 -0.06 -0.55 0.00 0.00 175.29 174.87 1orw s PHE 228 N 0.13 2.71 -0.20 1.67 0.08 0.02 -1.18 117.98 121.22 1orw s PHE 228 Ca -0.05 -0.15 0.01 0.00 0.12 0.00 0.00 56.93 56.85 1orw s PHE 228 Cb -0.15 -1.58 0.04 0.00 -0.57 0.00 0.00 43.02 40.76 1orw s PHE 228 CO 0.04 0.25 -0.11 1.21 -0.10 0.00 0.00 175.22 176.51 1orw s ASN 229 N -1.09 3.38 -0.03 1.36 3.84 -0.82 -1.34 114.94 120.24 1orw s ASN 229 Ca 0.14 -0.87 0.18 0.00 0.21 0.00 0.00 52.86 52.52 1orw s ASN 229 Cb -0.11 -1.25 0.57 0.00 -0.55 0.00 0.00 41.25 39.91 1orw s ASN 229 CO 0.03 -0.13 1.48 0.47 -2.79 0.00 0.00 177.10 176.17 1orw n ASP 230 N 4.68 3.88 -0.33 -4.21 9.92 0.60 -2.26 116.55 128.83 1orw n ASP 230 Ca -0.15 -2.14 0.18 0.00 -0.53 0.00 0.00 54.79 52.15 1orw n ASP 230 Cb 0.47 -0.45 0.36 0.00 -0.64 0.00 0.00 41.12 40.86 1orw n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1orw h THR 231 N 3.58 0.03 -0.56 -3.53 2.02 -1.85 0.93 112.91 113.53 1orw h THR 231 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1orw h THR 231 Cb 1.05 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1orw h THR 231 CO 0.06 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.33 1orw n GLU 232 N -5.42 2.62 -2.78 6.66 1.02 -1.26 -4.92 120.64 116.56 1orw n GLU 232 Ca 0.26 -2.46 -0.42 0.00 -0.02 0.00 0.00 57.16 54.52 1orw n GLU 232 Cb 0.87 -1.52 -0.03 0.00 -0.02 0.00 0.00 31.44 30.73 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 -1.19 4.76 1.10 2.62 1.01 0.32 -4.64 120.40 124.39 1orw s VAL 233 Ca 0.43 1.81 -0.18 0.00 0.00 0.00 0.00 61.98 64.04 1orw s VAL 233 Cb 0.23 -4.22 0.11 0.00 0.00 0.00 0.00 36.38 32.51 1orw s VAL 233 CO 0.31 -0.11 0.11 -2.65 0.00 0.00 0.00 175.10 172.76 1orw n PRO 234 N 6.06 -1.49 -5.15 2.72 -0.02 -1.26 -4.69 135.00 131.16 1orw n PRO 234 Ca 0.09 -0.41 -0.32 0.00 -2.02 0.00 0.00 63.50 60.83 1orw n PRO 234 Cb 0.47 -1.74 -0.16 0.00 -0.02 0.00 0.00 33.50 32.05 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 -1.58 2.23 0.10 2.45 1.43 -1.26 -2.19 118.68 119.86 1orw s LEU 235 Ca 0.57 -0.46 -0.14 0.00 -1.03 0.00 0.00 54.13 53.07 1orw s LEU 235 Cb -0.14 -1.43 -0.07 0.00 0.03 0.00 0.00 46.19 44.59 1orw s LEU 235 CO 0.66 0.24 0.51 -0.51 0.23 0.00 0.00 176.35 177.48 1orw s ILE 236 N -0.11 4.90 0.01 -0.59 1.10 0.67 -4.88 121.20 122.29 1orw s ILE 236 Ca -0.04 0.83 0.01 0.00 -0.51 0.00 0.00 60.65 60.93 1orw s ILE 236 Cb -0.14 -3.74 -0.01 0.00 0.15 0.00 0.00 42.46 38.72 1orw s ILE 236 CO 0.04 0.34 -0.03 -1.61 -2.11 0.00 0.00 174.94 171.57 1orw s GLU 237 N -1.70 0.25 0.13 3.50 2.02 -1.26 -1.26 118.70 120.39 1orw s GLU 237 Ca 0.34 -0.26 -0.19 0.00 0.02 0.00 0.00 54.97 54.88 1orw s GLU 237 Cb -0.16 -0.14 0.05 0.00 0.10 0.00 0.00 34.13 33.98 1orw s GLU 237 CO 0.18 0.03 0.49 1.52 0.02 0.00 0.00 175.26 177.50 1orw s TYR 238 N -0.46 -0.36 0.31 1.61 1.13 -0.75 -4.98 117.35 113.86 1orw s TYR 238 Ca -0.03 0.11 -0.27 0.00 -1.41 0.00 0.00 57.07 55.46 1orw s TYR 238 Cb -0.04 0.39 -0.10 0.00 -1.10 0.00 0.00 41.96 41.11 1orw s TYR 238 CO -0.00 -0.76 0.95 -1.12 -2.51 0.00 0.00 175.55 172.11 1orw s SER 239 N -2.73 7.38 -0.22 -0.18 0.01 -1.26 -0.23 113.70 116.47 1orw s SER 239 Ca 0.02 1.86 -0.01 0.00 1.31 0.00 0.00 55.95 59.12 1orw s SER 239 Cb 0.01 -2.59 0.06 0.00 0.21 0.00 0.00 66.02 63.71 1orw s SER 239 CO -0.12 -0.04 0.01 0.12 0.41 0.00 0.00 173.24 173.63 1orw s PHE 240 N -1.54 1.56 -0.09 2.43 5.36 -0.45 -4.74 117.98 120.51 1orw s PHE 240 Ca 0.49 -1.24 0.26 0.00 -0.96 0.00 0.00 56.93 55.48 1orw s PHE 240 Cb -0.20 -1.27 0.82 0.00 -0.34 0.00 0.00 43.02 42.02 1orw s PHE 240 CO 0.25 -0.69 1.78 1.88 -1.46 0.00 0.00 175.22 176.99 1orw h TYR 241 N 8.13 0.00 -0.90 10.12 -1.99 -1.95 -2.53 116.97 127.85 1orw h TYR 241 Ca -0.16 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.57 1orw h TYR 241 Cb 1.10 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.83 1orw h TYR 241 CO 0.36 0.10 0.00 0.45 -0.00 0.00 0.00 178.16 179.07 1orw n SER 242 N -3.17 -2.69 -4.76 3.88 2.88 -1.26 -4.68 113.62 103.82 1orw n SER 242 Ca 0.02 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.17 1orw n SER 242 Cb 0.45 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 1orw n SER 242 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1orw s ASP 243 N -4.00 6.05 0.51 -3.46 -1.08 -1.26 -4.86 116.67 108.56 1orw s ASP 243 Ca 0.00 2.55 0.42 0.00 -0.52 0.00 0.00 52.55 55.00 1orw s ASP 243 Cb 0.00 -2.62 1.63 0.00 -1.46 0.00 0.00 42.92 40.47 1orw s ASP 243 CO 0.00 -1.02 1.58 -0.08 0.52 0.00 0.00 175.17 176.17 1orw h GLU 244 N 2.20 0.01 0.00 4.34 4.81 -2.05 0.39 114.58 124.28 1orw h GLU 244 Ca -0.50 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1orw h GLU 244 Cb 1.26 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1orw h GLU 244 CO 0.61 0.01 0.00 -1.13 -0.73 0.00 0.00 179.01 177.76 1orw n SER 245 N -4.28 0.00 -4.67 1.04 3.41 -1.26 -4.73 113.62 103.12 1orw n SER 245 Ca 0.42 0.19 -0.43 0.00 -0.26 0.00 0.00 58.87 58.79 1orw n SER 245 Cb 1.80 -0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 65.34 1orw n SER 245 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1orw s LEU 246 N -2.77 4.21 0.12 1.04 0.20 0.14 -4.93 118.68 116.69 1orw s LEU 246 Ca 0.19 1.68 -0.05 0.00 0.69 0.00 0.00 54.13 56.64 1orw s LEU 246 Cb 0.17 -3.55 -0.12 0.00 -0.43 0.00 0.00 46.19 42.26 1orw s LEU 246 CO 0.43 -0.65 1.28 -0.61 -0.29 0.00 0.00 176.35 176.51 1orw h GLN 247 N 7.72 0.40 -5.64 1.98 4.15 -1.88 -3.44 115.11 118.41 1orw h GLN 247 Ca -0.29 -0.46 -0.68 0.00 0.77 0.00 0.00 58.65 58.00 1orw h GLN 247 Cb 1.12 0.14 -0.30 0.00 0.21 0.00 0.00 27.48 28.64 1orw h GLN 247 CO 0.93 1.13 -0.85 0.71 -1.93 0.00 0.00 178.83 178.82 1orw s TYR 248 N -3.20 2.58 0.62 3.99 1.51 -1.26 -5.11 117.35 116.49 1orw s TYR 248 Ca -0.06 -0.78 -0.18 0.00 -1.01 0.00 0.00 57.07 55.04 1orw s TYR 248 Cb 0.09 -1.69 -0.02 0.00 -0.11 0.00 0.00 41.96 40.22 1orw s TYR 248 CO 0.87 -0.26 1.19 -2.14 -1.11 0.00 0.00 175.55 174.11 1orw s PRO 249 N 0.09 2.82 0.29 -1.71 0.02 -1.26 -5.01 135.00 130.24 1orw s PRO 249 Ca -0.10 1.76 0.04 0.00 0.02 0.00 0.00 61.00 62.72 1orw s PRO 249 Cb -0.16 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.42 1orw s PRO 249 CO 0.06 -1.30 0.43 -1.59 -0.33 0.00 0.00 177.00 174.26 1orw s LYS 250 N -3.51 3.37 -0.27 5.54 -2.85 -0.95 -4.92 119.74 116.14 1orw s LYS 250 Ca 0.76 -0.72 -0.03 0.00 -1.00 0.00 0.00 55.97 54.97 1orw s LYS 250 Cb -0.29 -2.82 0.02 0.00 -2.06 0.00 0.00 37.83 32.69 1orw s LYS 250 CO 0.36 0.27 -0.01 0.99 0.10 0.00 0.00 175.35 177.06 1orw s THR 251 N -2.11 3.21 0.07 3.79 2.01 -1.26 -1.34 115.64 120.01 1orw s THR 251 Ca 0.38 -0.97 -0.30 0.00 0.31 0.00 0.00 61.69 61.11 1orw s THR 251 Cb -0.09 -2.67 -0.05 0.00 0.01 0.00 0.00 72.50 69.70 1orw s THR 251 CO 0.31 0.13 1.03 -0.69 -0.69 0.00 0.00 174.62 174.71 1orw s VAL 252 N 1.37 4.46 -0.14 3.82 1.01 0.68 -4.88 120.40 126.71 1orw s VAL 252 Ca 0.00 1.88 0.01 0.00 0.00 0.00 0.00 61.98 63.88 1orw s VAL 252 Cb -0.17 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.02 1orw s VAL 252 CO -0.02 0.21 -0.17 -0.13 0.00 0.00 0.00 175.10 175.00 1orw s ARG 253 N 0.53 2.52 -0.02 2.72 0.52 -1.26 -1.80 118.95 122.15 1orw s ARG 253 Ca 0.51 -0.66 0.03 0.00 -0.52 0.00 0.00 55.73 55.09 1orw s ARG 253 Cb -0.25 -2.19 -0.00 0.00 0.52 0.00 0.00 34.95 33.04 1orw s ARG 253 CO 0.30 -0.15 -0.09 0.42 0.02 0.00 0.00 175.30 175.80 1orw s ILE 254 N 1.21 0.78 -0.65 1.52 1.01 -0.39 -4.96 121.20 119.72 1orw s ILE 254 Ca -0.00 -0.39 -0.27 0.00 0.00 0.00 0.00 60.65 59.99 1orw s ILE 254 Cb -0.14 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.66 1orw s ILE 254 CO -0.07 0.23 1.58 -2.84 0.00 0.00 0.00 174.94 173.84 1orw s PRO 255 N 0.01 2.95 -0.21 2.79 0.02 -1.26 -0.24 135.00 139.06 1orw s PRO 255 Ca -0.00 0.29 -0.00 0.00 0.02 0.00 0.00 61.00 61.30 1orw s PRO 255 Cb -0.06 -4.27 0.05 0.00 0.02 0.00 0.00 34.50 30.24 1orw s PRO 255 CO 0.00 -2.38 -0.05 -0.47 -0.33 0.00 0.00 177.00 173.77 1orw s TYR 256 N 7.36 2.06 -0.36 6.54 6.14 -0.93 -4.59 117.35 133.57 1orw s TYR 256 Ca 0.53 -1.47 -0.25 0.00 0.64 0.00 0.00 57.07 56.52 1orw s TYR 256 Cb -0.11 -1.45 0.01 0.00 0.42 0.00 0.00 41.96 40.83 1orw s TYR 256 CO 0.19 -0.72 0.88 -1.25 0.64 0.00 0.00 175.55 175.30 1orw s PRO 257 N 1.51 3.83 0.62 4.97 0.04 -1.26 -4.62 135.00 140.09 1orw s PRO 257 Ca -0.03 0.52 -0.08 0.00 0.04 0.00 0.00 61.00 61.45 1orw s PRO 257 Cb -0.18 -3.80 0.01 0.00 0.04 0.00 0.00 34.50 30.57 1orw s PRO 257 CO -0.07 -0.91 0.95 0.15 0.04 0.00 0.00 177.00 177.17 1orw s LYS 258 N 3.35 2.95 0.04 4.56 1.02 -1.26 0.50 119.74 130.89 1orw s LYS 258 Ca 0.36 0.15 -0.38 0.00 0.02 0.00 0.00 55.97 56.13 1orw s LYS 258 Cb -0.12 -2.20 -0.19 0.00 -0.52 0.00 0.00 37.83 34.80 1orw s LYS 258 CO 0.18 -0.77 1.06 0.00 -0.92 0.00 0.00 175.35 174.90 1orw n ALA 259 N -2.69 -3.00 0.00 5.17 0.00 -0.05 -0.54 120.51 119.39 1orw n ALA 259 Ca 0.05 0.56 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1orw n ALA 259 Cb 0.57 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.21 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 1.74 2.64 3.42 0.00 0.00 -1.26 -4.92 105.19 106.81 1orw n GLY 260 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 1orw n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orw n ALA 261 N -0.03 -3.04 -2.19 4.61 0.00 0.30 -4.90 120.51 115.26 1orw n ALA 261 Ca 0.00 -1.07 -0.42 0.00 0.00 0.00 0.00 53.44 51.94 1orw n ALA 261 Cb 0.00 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 17.58 1orw n ALA 261 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1orw s GLU 262 N -4.01 4.26 0.55 0.00 2.56 -1.26 -4.89 118.70 115.91 1orw s GLU 262 Ca 0.63 2.00 -0.04 0.00 0.00 0.00 0.00 54.97 57.56 1orw s GLU 262 Cb -0.20 -3.64 0.01 0.00 2.00 0.00 0.00 34.13 32.29 1orw s GLU 262 CO 0.65 -0.63 0.83 -0.80 -0.56 0.00 0.00 175.26 174.75 1orw s ASN 263 N 2.12 5.63 0.55 -1.70 0.01 -1.26 -4.34 114.94 115.95 1orw s ASN 263 Ca 0.65 0.56 -0.16 0.00 -0.71 0.00 0.00 52.86 53.20 1orw s ASN 263 Cb -0.32 -1.62 -0.06 0.00 0.41 0.00 0.00 41.25 39.67 1orw s ASN 263 CO 0.26 -0.98 1.02 -2.16 -1.51 0.00 0.00 177.10 173.74 1orw s PRO 264 N -4.87 3.64 0.48 -0.60 0.04 -1.26 -4.73 135.00 127.70 1orw s PRO 264 Ca 0.53 1.08 0.08 0.00 0.04 0.00 0.00 61.00 62.73 1orw s PRO 264 Cb -0.10 -2.09 0.04 0.00 0.04 0.00 0.00 34.50 32.39 1orw s PRO 264 CO 0.43 -0.53 0.62 0.95 0.04 0.00 0.00 177.00 178.51 1orw s THR 265 N -2.53 2.60 0.04 1.26 -4.23 -0.96 -4.93 115.64 106.90 1orw s THR 265 Ca 0.61 -1.06 -0.16 0.00 -1.18 0.00 0.00 61.69 59.91 1orw s THR 265 Cb -0.13 -2.66 0.03 0.00 1.34 0.00 0.00 72.50 71.08 1orw s THR 265 CO 0.34 0.00 0.36 0.54 -0.54 0.00 0.00 174.62 175.31 1orw s VAL 266 N -2.49 0.07 0.05 2.29 0.11 -1.26 -1.93 120.40 117.23 1orw s VAL 266 Ca 0.56 -0.57 0.01 0.00 -2.93 0.00 0.00 61.98 59.04 1orw s VAL 266 Cb -0.07 -0.95 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 1orw s VAL 266 CO 0.34 -0.32 -0.05 -0.54 -3.33 0.00 0.00 175.10 171.21 1orw s LYS 267 N -2.53 0.57 -0.02 1.54 1.02 -0.33 -4.97 119.74 115.02 1orw s LYS 267 Ca -0.05 -1.00 0.04 0.00 0.02 0.00 0.00 55.97 54.99 1orw s LYS 267 Cb -0.01 -0.03 -0.01 0.00 -0.52 0.00 0.00 37.83 37.27 1orw s LYS 267 CO -0.03 -0.04 -0.15 0.12 -0.92 0.00 0.00 175.35 174.33 1orw s PHE 268 N -2.68 1.41 0.13 3.18 5.36 -1.26 -0.62 117.98 123.49 1orw s PHE 268 Ca -0.01 -0.32 0.04 0.00 -0.96 0.00 0.00 56.93 55.67 1orw s PHE 268 Cb -0.01 -0.93 -0.04 0.00 -0.34 0.00 0.00 43.02 41.70 1orw s PHE 268 CO -0.04 -0.08 -0.10 -0.06 -1.46 0.00 0.00 175.22 173.48 1orw s PHE 269 N -0.15 1.17 -0.22 10.12 0.40 -0.01 -1.88 117.98 127.41 1orw s PHE 269 Ca 0.02 -0.76 -0.02 0.00 -0.60 0.00 0.00 56.93 55.57 1orw s PHE 269 Cb -0.08 -0.61 0.07 0.00 0.51 0.00 0.00 43.02 42.90 1orw s PHE 269 CO 0.00 0.03 0.03 0.08 0.70 0.00 0.00 175.22 176.07 1orw s VAL 270 N -3.17 0.74 -0.01 -0.44 1.01 -0.16 -1.53 120.40 116.84 1orw s VAL 270 Ca 0.13 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 61.12 1orw s VAL 270 Cb 0.02 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 1orw s VAL 270 CO -0.00 -0.27 0.56 -0.69 0.00 0.00 0.00 175.10 174.70 1orw s VAL 271 N 1.75 4.93 -0.68 2.92 1.01 -0.16 -2.15 120.40 128.02 1orw s VAL 271 Ca -0.00 1.17 -0.18 0.00 0.00 0.00 0.00 61.98 62.97 1orw s VAL 271 Cb -0.17 -3.89 0.13 0.00 0.00 0.00 0.00 36.38 32.44 1orw s VAL 271 CO -0.11 0.44 0.77 -0.62 0.00 0.00 0.00 175.10 175.58 1orw s ASP 272 N -0.29 6.35 0.25 3.32 3.68 -0.52 -1.72 116.67 127.74 1orw s ASP 272 Ca 0.29 -1.76 0.21 0.00 2.13 0.00 0.00 52.55 53.43 1orw s ASP 272 Cb -0.18 -2.30 0.98 0.00 -1.45 0.00 0.00 42.92 39.97 1orw s ASP 272 CO 0.16 -1.00 1.64 0.35 0.13 0.00 0.00 175.17 176.45 1orw n THR 273 N 5.26 0.99 0.27 1.71 -2.24 -0.78 -3.12 114.28 116.36 1orw n THR 273 Ca -0.01 0.44 0.11 0.00 -2.27 0.00 0.00 64.05 62.32 1orw n THR 273 Cb 0.44 -1.39 0.73 0.00 -2.10 0.00 0.00 70.33 68.01 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 0.00 -0.01 -0.78 3.08 -1.91 -2.33 114.38 112.43 1orw h ARG 274 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1orw h ARG 274 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1orw h ARG 274 CO 0.00 0.00 -0.36 0.25 -1.07 0.00 0.00 179.97 178.79 1orw n THR 275 N -4.31 0.00 -1.68 2.04 -2.24 -1.18 -4.93 114.28 101.97 1orw n THR 275 Ca -0.03 -0.22 -0.50 0.00 -2.27 0.00 0.00 64.05 61.04 1orw n THR 275 Cb 0.10 0.91 -0.05 0.00 -2.10 0.00 0.00 70.33 69.18 1orw n THR 275 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1orw n LEU 276 N -0.21 3.23 -3.68 3.22 4.77 -0.88 -4.81 117.00 118.65 1orw n LEU 276 Ca 0.11 0.97 -0.14 0.00 -0.03 0.00 0.00 56.01 56.92 1orw n LEU 276 Cb 0.42 -1.33 -0.08 0.00 -2.33 0.00 0.00 43.42 40.10 1orw n LEU 276 CO 0.27 -0.14 0.20 -0.44 -1.33 0.00 0.00 177.39 175.95 1orw s SER 277 N 4.12 -0.47 0.46 -1.43 0.01 -1.26 -5.03 113.70 110.10 1orw s SER 277 Ca 0.94 0.72 0.25 0.00 1.31 0.00 0.00 55.95 59.17 1orw s SER 277 Cb -0.76 0.75 1.28 0.00 0.21 0.00 0.00 66.02 67.50 1orw s SER 277 CO 0.54 -0.34 1.81 1.55 0.41 0.00 0.00 173.24 177.22 1orw h PRO 278 N 4.45 0.22 -0.51 12.44 0.13 -1.95 -1.10 132.00 145.67 1orw h PRO 278 Ca -0.28 -0.01 -0.21 0.00 -0.87 0.00 0.00 66.00 64.63 1orw h PRO 278 Cb 1.17 -0.05 -0.12 0.00 0.13 0.00 0.00 31.00 32.12 1orw h PRO 278 CO 0.28 0.14 0.13 0.09 -0.23 0.00 0.00 178.00 178.41 1orw n ASN 279 N -4.43 3.39 -4.50 1.44 3.02 -1.26 -4.97 115.26 107.94 1orw n ASN 279 Ca 0.23 -3.50 -0.24 0.00 -0.03 0.00 0.00 54.58 51.04 1orw n ASN 279 Cb 0.96 -0.67 -0.10 0.00 -0.61 0.00 0.00 39.78 39.35 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 -3.13 2.77 0.26 5.41 0.00 -0.42 -5.14 121.76 121.51 1orw s ALA 280 Ca 0.48 -2.00 -0.08 0.00 0.00 0.00 0.00 51.96 50.36 1orw s ALA 280 Cb 0.41 -0.04 -0.07 0.00 0.00 0.00 0.00 23.12 23.43 1orw s ALA 280 CO 0.06 0.09 0.57 -1.54 0.00 0.00 0.00 175.76 174.93 1orw s SER 281 N -3.55 6.56 -0.29 0.00 1.04 -1.26 -4.67 113.70 111.53 1orw s SER 281 Ca 0.31 0.88 -0.29 0.00 0.48 0.00 0.00 55.95 57.33 1orw s SER 281 Cb 0.01 -2.21 -0.02 0.00 0.10 0.00 0.00 66.02 63.91 1orw s SER 281 CO 0.15 -0.14 1.64 -0.69 0.98 0.00 0.00 173.24 175.19 1orw s VAL 282 N -1.94 3.66 -0.13 5.02 1.01 -1.26 -4.79 120.40 121.96 1orw s VAL 282 Ca 0.47 0.70 -0.29 0.00 0.00 0.00 0.00 61.98 62.85 1orw s VAL 282 Cb -0.11 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 1orw s VAL 282 CO 0.25 -0.42 1.03 -0.89 0.00 0.00 0.00 175.10 175.07 1orw s THR 283 N 5.85 4.72 0.24 3.92 2.01 -1.26 -5.01 115.64 126.11 1orw s THR 283 Ca 0.73 2.00 -0.10 0.00 0.31 0.00 0.00 61.69 64.63 1orw s THR 283 Cb -0.22 -4.29 -0.01 0.00 0.01 0.00 0.00 72.50 67.99 1orw s THR 283 CO 0.31 -0.04 0.40 -0.44 -0.69 0.00 0.00 174.62 174.17 1orw s SER 284 N 1.16 0.01 -0.09 3.53 0.01 -1.26 -1.44 113.70 115.62 1orw s SER 284 Ca 0.48 -1.06 -0.08 0.00 1.31 0.00 0.00 55.95 56.61 1orw s SER 284 Cb -0.18 0.55 0.02 0.00 0.21 0.00 0.00 66.02 66.62 1orw s SER 284 CO 0.16 -1.09 0.23 -0.47 0.41 0.00 0.00 173.24 172.48 1orw s TYR 285 N -4.00 -0.26 -0.26 2.43 5.04 -0.92 -4.96 117.35 114.43 1orw s TYR 285 Ca 0.26 0.63 -0.11 0.00 -2.44 0.00 0.00 57.07 55.41 1orw s TYR 285 Cb 0.01 0.08 -0.05 0.00 0.35 0.00 0.00 41.96 42.35 1orw s TYR 285 CO 0.10 -0.13 0.18 -1.14 -1.34 0.00 0.00 175.55 173.22 1orw s GLN 286 N 0.23 4.00 -0.26 4.97 0.74 -1.26 -0.99 119.66 127.09 1orw s GLN 286 Ca -0.01 -0.30 -0.14 0.00 0.05 0.00 0.00 55.36 54.96 1orw s GLN 286 Cb -0.02 -3.61 -0.04 0.00 1.10 0.00 0.00 33.01 30.43 1orw s GLN 286 CO -0.01 -0.09 0.34 0.42 -0.55 0.00 0.00 175.29 175.41 1orw s ILE 287 N 1.49 5.21 0.10 -2.34 1.01 -0.79 -5.01 121.20 120.87 1orw s ILE 287 Ca 0.07 0.53 -0.05 0.00 0.00 0.00 0.00 60.65 61.20 1orw s ILE 287 Cb -0.15 -3.67 -0.05 0.00 0.01 0.00 0.00 42.46 38.59 1orw s ILE 287 CO 0.08 0.20 0.34 -0.69 0.00 0.00 0.00 174.94 174.87 1orw s VAL 288 N 1.82 5.21 1.01 2.92 1.01 -1.26 -4.17 120.40 126.94 1orw s VAL 288 Ca 0.14 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.05 1orw s VAL 288 Cb -0.15 -3.62 0.19 0.00 0.00 0.00 0.00 36.38 32.80 1orw s VAL 288 CO 0.09 0.13 1.08 -2.16 0.00 0.00 0.00 175.10 174.25 1orw s PRO 289 N -2.40 0.35 0.58 2.72 0.04 -1.26 -4.98 135.00 130.05 1orw s PRO 289 Ca 0.37 0.96 -0.18 0.00 0.04 0.00 0.00 61.00 62.19 1orw s PRO 289 Cb -0.13 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.68 1orw s PRO 289 CO 0.23 -2.90 1.11 -2.14 0.04 0.00 0.00 177.00 173.34 1orw s PRO 290 N -4.71 3.19 0.26 0.56 0.02 -1.26 -4.60 135.00 128.47 1orw s PRO 290 Ca 0.66 1.48 -0.08 0.00 0.02 0.00 0.00 61.00 63.08 1orw s PRO 290 Cb -0.22 -2.00 0.44 0.00 0.02 0.00 0.00 34.50 32.75 1orw s PRO 290 CO 0.60 -0.95 1.59 0.00 -0.33 0.00 0.00 177.00 177.91 1orw h ALA 291 N 0.75 0.68 0.00 -1.55 0.00 -1.98 0.56 119.26 117.73 1orw h ALA 291 Ca -0.49 0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1orw h ALA 291 Cb 1.25 0.63 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1orw h ALA 291 CO 0.56 -0.42 0.20 0.66 0.00 0.00 0.00 179.25 180.25 1orw h SER 292 N 0.01 0.00 0.00 0.00 4.64 -2.02 -2.08 113.55 114.11 1orw h SER 292 Ca 0.45 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.53 1orw h SER 292 Cb 0.73 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.78 1orw h SER 292 CO -0.88 0.00 -1.88 0.52 -0.87 0.00 0.00 176.83 173.72 1orw n VAL 293 N -2.44 0.88 -0.33 0.95 0.31 0.18 -4.53 118.33 113.34 1orw n VAL 293 Ca -0.02 -0.31 0.17 0.00 -0.01 0.00 0.00 64.34 64.18 1orw n VAL 293 Cb 0.24 -1.21 0.40 0.00 -0.91 0.00 0.00 33.84 32.36 1orw n VAL 293 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1orw h LEU 294 N -0.15 0.64 -0.51 7.52 3.38 -0.51 -2.55 115.31 123.14 1orw h LEU 294 Ca -0.36 0.09 0.09 0.00 0.09 0.00 0.00 57.88 57.80 1orw h LEU 294 Cb 1.49 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 42.13 1orw h LEU 294 CO -0.10 0.19 -0.15 -0.38 0.09 0.00 0.00 178.44 178.08 1orw n ILE 295 N -4.72 -0.23 -2.81 1.22 5.41 -0.82 -4.68 119.36 112.73 1orw n ILE 295 Ca 0.24 1.17 0.00 0.00 1.00 0.00 0.00 62.75 65.16 1orw n ILE 295 Cb 0.69 -1.59 0.00 0.00 -0.71 0.00 0.00 39.64 38.04 1orw n ILE 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1orw n GLY 296 N -1.29 5.33 3.73 7.39 0.00 -0.96 -5.11 105.19 114.28 1orw n GLY 296 Ca 0.07 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1orw n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1orw s ASP 297 N 1.00 6.52 0.33 1.61 1.11 -1.26 -4.92 116.67 121.06 1orw s ASP 297 Ca 0.00 2.74 0.08 0.00 0.18 0.00 0.00 52.55 55.55 1orw s ASP 297 Cb 0.00 -2.61 -0.03 0.00 1.07 0.00 0.00 42.92 41.35 1orw s ASP 297 CO 0.00 -0.85 0.28 -1.38 1.18 0.00 0.00 175.17 174.41 1orw s HIS 298 N 0.71 1.78 0.05 4.23 -3.43 -1.26 0.10 115.29 117.46 1orw s HIS 298 Ca 0.68 -1.68 0.02 0.00 -0.80 0.00 0.00 55.06 53.28 1orw s HIS 298 Cb -0.45 -0.72 -0.03 0.00 -1.43 0.00 0.00 32.58 29.95 1orw s HIS 298 CO 0.37 -0.88 -0.06 0.71 -2.00 0.00 0.00 174.74 172.87 1orw s TYR 299 N -3.42 0.63 -0.27 0.38 2.02 0.77 -4.78 117.35 112.68 1orw s TYR 299 Ca 0.41 -0.61 -0.12 0.00 -0.37 0.00 0.00 57.07 56.37 1orw s TYR 299 Cb 0.02 -0.38 -0.05 0.00 -0.40 0.00 0.00 41.96 41.15 1orw s TYR 299 CO 0.28 -0.13 0.25 -1.17 -1.57 0.00 0.00 175.55 173.21 1orw s LEU 300 N -1.89 4.04 0.00 -1.29 2.96 -1.26 -1.87 118.68 119.36 1orw s LEU 300 Ca -0.06 0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 1orw s LEU 300 Cb -0.06 -2.23 -0.01 0.00 0.50 0.00 0.00 46.19 44.39 1orw s LEU 300 CO -0.01 -0.09 0.09 0.00 -1.32 0.00 0.00 176.35 175.02 1orw s GLY 302 N -0.94 -0.54 -0.06 0.00 0.00 -0.98 -4.83 107.32 99.97 1orw s GLY 302 Ca 0.00 1.71 -0.00 0.00 0.00 0.00 0.00 44.72 46.43 1orw s GLY 302 CO 0.02 1.41 -0.03 0.14 0.00 0.00 0.00 173.10 174.64 1orw s VAL 303 N -0.21 0.50 -0.05 1.40 1.01 -1.26 -1.03 120.40 120.75 1orw s VAL 303 Ca -0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 1orw s VAL 303 Cb -0.03 -0.58 0.03 0.00 0.00 0.00 0.00 36.38 35.79 1orw s VAL 303 CO 0.04 0.25 -0.00 -0.89 0.00 0.00 0.00 175.10 174.50 1orw s THR 304 N 1.45 0.32 -0.26 3.92 2.01 0.18 -5.00 115.64 118.26 1orw s THR 304 Ca -0.03 0.09 -0.26 0.00 0.31 0.00 0.00 61.69 61.80 1orw s THR 304 Cb -0.13 -0.44 0.00 0.00 0.01 0.00 0.00 72.50 71.93 1orw s THR 304 CO -0.03 0.22 0.89 0.26 -0.69 0.00 0.00 174.62 175.27 1orw s TRP 305 N 1.53 3.28 -0.14 4.92 0.52 -1.26 0.23 118.94 128.02 1orw s TRP 305 Ca -0.02 1.16 -0.13 0.00 0.02 0.00 0.00 56.10 57.13 1orw s TRP 305 Cb -0.13 -3.19 -0.10 0.00 -1.15 0.00 0.00 33.47 28.90 1orw s TRP 305 CO -0.03 -0.48 0.16 0.28 0.02 0.00 0.00 176.95 176.90 1orw h VAL 306 N 5.49 0.58 -4.12 4.03 2.07 -1.16 -3.48 116.25 119.66 1orw h VAL 306 Ca -0.22 -1.54 -0.21 0.00 0.82 0.00 0.00 66.70 65.55 1orw h VAL 306 Cb 1.08 1.19 -0.10 0.00 -1.52 0.00 0.00 31.29 31.95 1orw h VAL 306 CO 0.91 0.20 -0.27 0.42 0.02 0.00 0.00 177.57 178.85 1orw s THR 307 N -2.06 0.00 0.54 2.57 -4.23 0.22 -4.79 115.64 107.89 1orw s THR 307 Ca -0.14 -1.64 0.20 0.00 -1.18 0.00 0.00 61.69 58.93 1orw s THR 307 Cb 0.01 -2.47 0.30 0.00 1.34 0.00 0.00 72.50 71.68 1orw s THR 307 CO 0.33 0.00 2.16 -0.33 -0.54 0.00 0.00 174.62 176.24 1orw h GLU 308 N 2.26 0.00 -0.56 3.99 4.39 -1.96 -1.12 114.58 121.57 1orw h GLU 308 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 1orw h GLU 308 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1orw h GLU 308 CO 0.40 0.00 0.00 0.39 -1.16 0.00 0.00 179.01 178.64 1orw n GLU 309 N -4.34 3.18 -3.70 2.33 1.02 -1.26 -4.92 120.64 112.95 1orw n GLU 309 Ca -0.02 -2.62 -0.11 0.00 -0.02 0.00 0.00 57.16 54.39 1orw n GLU 309 Cb 0.13 -1.65 -0.12 0.00 -0.02 0.00 0.00 31.44 29.79 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 -1.50 0.29 0.12 3.49 3.52 -0.42 -0.98 118.95 123.47 1orw s ARG 310 Ca 0.43 0.74 0.07 0.00 -0.13 0.00 0.00 55.73 56.84 1orw s ARG 310 Cb 0.26 -0.01 -0.04 0.00 -1.56 0.00 0.00 34.95 33.60 1orw s ARG 310 CO 0.23 -0.19 -0.18 -1.50 -0.81 0.00 0.00 175.30 172.85 1orw s ILE 311 N 1.66 1.59 -0.17 4.11 2.07 -0.33 -0.56 121.20 129.58 1orw s ILE 311 Ca -0.07 -1.65 0.01 0.00 -1.41 0.00 0.00 60.65 57.52 1orw s ILE 311 Cb -0.10 -1.57 0.03 0.00 0.13 0.00 0.00 42.46 40.95 1orw s ILE 311 CO -0.11 -0.22 -0.13 -0.55 -1.91 0.00 0.00 174.94 172.02 1orw s SER 312 N -2.21 2.94 -0.07 4.50 0.15 0.14 -0.42 113.70 118.74 1orw s SER 312 Ca 0.08 -0.63 -0.00 0.00 0.70 0.00 0.00 55.95 56.10 1orw s SER 312 Cb -0.08 -1.20 -0.03 0.00 -1.71 0.00 0.00 66.02 63.00 1orw s SER 312 CO 0.04 -0.09 -0.02 -0.76 1.20 0.00 0.00 173.24 173.62 1orw s LEU 313 N 1.45 3.43 -0.24 3.45 1.02 -0.46 -0.64 118.68 126.69 1orw s LEU 313 Ca 0.03 0.06 0.02 0.00 0.02 0.00 0.00 54.13 54.26 1orw s LEU 313 Cb -0.14 -1.81 0.06 0.00 0.02 0.00 0.00 46.19 44.32 1orw s LEU 313 CO -0.10 0.36 -0.10 -1.58 0.02 0.00 0.00 176.35 174.95 1orw s GLN 314 N -0.97 2.08 0.24 1.70 0.74 -0.20 -0.80 119.66 122.45 1orw s GLN 314 Ca 0.14 -1.17 0.07 0.00 0.05 0.00 0.00 55.36 54.45 1orw s GLN 314 Cb -0.11 -2.74 -0.04 0.00 1.10 0.00 0.00 33.01 31.22 1orw s GLN 314 CO 0.03 -0.55 0.14 -1.58 -0.55 0.00 0.00 175.29 172.79 1orw s TRP 315 N 1.22 3.03 -0.07 1.67 0.52 -0.42 -0.73 118.94 124.17 1orw s TRP 315 Ca -0.07 -0.12 -0.04 0.00 0.02 0.00 0.00 56.10 55.90 1orw s TRP 315 Cb -0.19 -1.38 0.03 0.00 -1.15 0.00 0.00 33.47 30.78 1orw s TRP 315 CO -0.06 0.54 0.16 0.96 0.02 0.00 0.00 176.95 178.57 1orw s ILE 316 N -2.08 -0.03 0.92 2.03 -4.36 -0.78 -0.57 121.20 116.34 1orw s ILE 316 Ca 0.32 0.10 -0.11 0.00 -0.26 0.00 0.00 60.65 60.71 1orw s ILE 316 Cb -0.08 -0.25 0.15 0.00 1.25 0.00 0.00 42.46 43.53 1orw s ILE 316 CO 0.23 0.04 1.11 -0.13 0.24 0.00 0.00 174.94 176.44 1orw s ARG 317 N 0.75 0.97 0.48 0.37 0.52 -0.86 -0.16 118.95 121.02 1orw s ARG 317 Ca -0.06 1.28 0.14 0.00 -0.52 0.00 0.00 55.73 56.57 1orw s ARG 317 Cb -0.07 -1.74 1.13 0.00 0.52 0.00 0.00 34.95 34.79 1orw s ARG 317 CO -0.04 -2.58 2.10 -0.09 0.02 0.00 0.00 175.30 174.71 1orw h ARG 318 N -1.82 0.20 -0.55 3.54 2.43 -0.65 -1.79 114.38 115.75 1orw h ARG 318 Ca -0.47 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 58.66 1orw h ARG 318 Cb 1.27 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.75 1orw h ARG 318 CO 0.46 0.13 0.21 0.00 -1.51 0.00 0.00 179.97 179.26 1orw h ALA 319 N 1.88 1.34 -0.90 2.80 0.00 -1.90 -3.45 119.26 119.02 1orw h ALA 319 Ca 0.09 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1orw h ALA 319 Cb 0.10 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.67 1orw h ALA 319 CO -0.02 0.49 -0.08 1.04 0.00 0.00 0.00 179.25 180.69 1orw n GLN 320 N -4.33 -0.57 -0.14 0.00 6.02 -0.67 -4.59 117.38 113.11 1orw n GLN 320 Ca 0.04 0.13 0.02 0.00 -0.01 0.00 0.00 57.00 57.18 1orw n GLN 320 Cb 0.17 -3.46 0.03 0.00 1.02 0.00 0.00 30.24 28.00 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 1.23 0.96 -3.47 1.08 0.23 -1.26 -1.91 115.26 112.11 1orw n ASN 321 Ca -0.02 -1.91 -0.16 0.00 -0.53 0.00 0.00 54.58 51.97 1orw n ASN 321 Cb 0.52 -0.13 -0.12 0.00 -2.08 0.00 0.00 39.78 37.97 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 -0.82 -0.42 0.31 -2.53 6.14 -1.26 -1.70 117.35 117.07 1orw s TYR 322 Ca 0.06 0.43 0.11 0.00 0.64 0.00 0.00 57.07 58.31 1orw s TYR 322 Cb 0.06 -0.24 -0.05 0.00 0.42 0.00 0.00 41.96 42.14 1orw s TYR 322 CO 0.01 -0.61 -0.12 0.45 0.64 0.00 0.00 175.55 175.92 1orw s SER 323 N 2.39 3.81 -0.21 4.32 0.15 0.83 -2.03 113.70 122.96 1orw s SER 323 Ca 0.08 -1.04 -0.23 0.00 0.70 0.00 0.00 55.95 55.46 1orw s SER 323 Cb -0.15 -0.40 0.06 0.00 -1.71 0.00 0.00 66.02 63.82 1orw s SER 323 CO -0.13 -0.08 0.63 -0.51 1.20 0.00 0.00 173.24 174.35 1orw s ILE 324 N -2.52 0.00 -0.20 6.45 2.07 0.26 -1.87 121.20 125.39 1orw s ILE 324 Ca 0.32 -0.02 -0.04 0.00 -1.41 0.00 0.00 60.65 59.50 1orw s ILE 324 Cb -0.02 -0.88 -0.02 0.00 0.13 0.00 0.00 42.46 41.67 1orw s ILE 324 CO 0.17 -0.01 -0.03 -0.63 -1.91 0.00 0.00 174.94 172.52 1orw s ILE 325 N 0.12 3.57 -0.25 2.00 1.01 -0.50 -1.30 121.20 125.85 1orw s ILE 325 Ca -0.02 -0.44 -0.03 0.00 0.00 0.00 0.00 60.65 60.17 1orw s ILE 325 Cb -0.04 -2.61 0.02 0.00 0.01 0.00 0.00 42.46 39.83 1orw s ILE 325 CO 0.02 0.43 -0.03 -0.62 0.00 0.00 0.00 174.94 174.74 1orw s ASP 326 N 1.19 4.45 -0.42 3.58 2.15 0.02 -0.53 116.67 127.11 1orw s ASP 326 Ca 0.03 -0.74 -0.12 0.00 0.43 0.00 0.00 52.55 52.14 1orw s ASP 326 Cb -0.14 -1.72 0.05 0.00 -0.30 0.00 0.00 42.92 40.81 1orw s ASP 326 CO -0.00 -0.12 0.29 -0.63 -0.17 0.00 0.00 175.17 174.54 1orw s ILE 327 N 1.39 4.77 -0.05 4.11 1.01 -1.05 -1.36 121.20 130.02 1orw s ILE 327 Ca 0.02 -1.05 -0.11 0.00 0.00 0.00 0.00 60.65 59.51 1orw s ILE 327 Cb -0.16 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 1orw s ILE 327 CO -0.03 -0.43 0.29 0.00 0.00 0.00 0.00 174.94 174.77 1orw s ASP 329 N -1.11 4.11 -0.17 0.00 1.01 -0.43 -1.18 116.67 118.90 1orw s ASP 329 Ca 0.21 -0.18 -0.29 0.00 0.71 0.00 0.00 52.55 53.00 1orw s ASP 329 Cb -0.15 -0.92 -0.00 0.00 1.01 0.00 0.00 42.92 42.86 1orw s ASP 329 CO 0.10 0.34 1.10 -0.47 0.21 0.00 0.00 175.17 176.45 1orw s TYR 330 N -0.70 3.24 -0.52 4.23 5.04 -0.15 -0.21 117.35 128.28 1orw s TYR 330 Ca 0.11 1.36 -0.22 0.00 -2.44 0.00 0.00 57.07 55.88 1orw s TYR 330 Cb -0.11 -3.33 0.05 0.00 0.35 0.00 0.00 41.96 38.92 1orw s TYR 330 CO 0.01 -0.81 0.77 0.34 -1.34 0.00 0.00 175.55 174.52 1orw s ASP 331 N 1.39 6.29 0.28 4.32 3.68 -0.52 -4.93 116.67 127.19 1orw s ASP 331 Ca 0.49 -0.58 0.01 0.00 2.13 0.00 0.00 52.55 54.60 1orw s ASP 331 Cb -0.18 -2.36 0.56 0.00 -1.45 0.00 0.00 42.92 39.48 1orw s ASP 331 CO 0.12 -1.03 1.84 -0.33 0.13 0.00 0.00 175.17 175.90 1orw h GLU 332 N 9.12 0.97 0.00 4.34 5.08 -1.94 0.27 114.58 132.42 1orw h GLU 332 Ca -0.27 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1orw h GLU 332 Cb 1.08 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1orw h GLU 332 CO 1.01 0.64 0.00 -1.13 -1.00 0.00 0.00 179.01 178.53 1orw n SER 333 N -4.62 0.10 0.00 1.42 3.41 -1.26 -3.97 113.62 108.70 1orw n SER 333 Ca 0.19 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 1orw n SER 333 Cb 0.36 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 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 -1.60 0.00 -1.07 6.66 -2.24 -0.83 -5.03 114.28 110.18 1orw n THR 334 Ca 0.06 -0.20 -0.02 0.00 -2.27 0.00 0.00 64.05 61.61 1orw n THR 334 Cb 0.29 0.91 -0.01 0.00 -2.10 0.00 0.00 70.33 69.42 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 0.54 0.54 3.55 3.38 0.00 0.89 -5.02 105.19 109.07 1orw n GLY 335 Ca 0.00 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 1orw n GLY 335 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1orw s ARG 336 N -1.31 2.45 -0.65 1.61 1.70 -1.24 -4.83 118.95 116.67 1orw s ARG 336 Ca 0.00 -0.77 -0.24 0.00 -0.47 0.00 0.00 55.73 54.25 1orw s ARG 336 Cb 0.00 -2.42 0.06 0.00 -0.57 0.00 0.00 34.95 32.02 1orw s ARG 336 CO 0.00 0.59 1.02 -1.58 -1.08 0.00 0.00 175.30 174.25 1orw s TRP 337 N -0.94 2.62 0.22 5.89 0.52 -1.26 -1.43 118.94 124.56 1orw s TRP 337 Ca 0.16 -0.35 -0.30 0.00 0.02 0.00 0.00 56.10 55.62 1orw s TRP 337 Cb -0.11 -4.32 -0.08 0.00 -1.15 0.00 0.00 33.47 27.81 1orw s TRP 337 CO 0.06 -1.68 0.95 0.42 0.02 0.00 0.00 176.95 176.72 1orw s ILE 338 N 4.36 4.12 0.43 2.03 1.01 0.71 -4.75 121.20 129.11 1orw s ILE 338 Ca 0.26 2.06 0.08 0.00 0.00 0.00 0.00 60.65 63.06 1orw s ILE 338 Cb -0.14 -4.31 0.01 0.00 0.01 0.00 0.00 42.46 38.02 1orw s ILE 338 CO 0.13 0.46 0.57 -0.55 0.00 0.00 0.00 174.94 175.55 1orw s SER 339 N -0.97 5.60 -0.28 3.58 0.15 -1.26 -1.31 113.70 119.22 1orw s SER 339 Ca 0.42 -0.46 -0.19 0.00 0.70 0.00 0.00 55.95 56.43 1orw s SER 339 Cb -0.26 -0.62 0.08 0.00 -1.71 0.00 0.00 66.02 63.52 1orw s SER 339 CO 0.32 -0.77 0.73 -0.55 1.20 0.00 0.00 173.24 174.16 1orw s SER 340 N -4.35 -0.85 0.32 5.45 0.15 -1.26 -5.00 113.70 108.16 1orw s SER 340 Ca 0.55 1.43 0.02 0.00 0.70 0.00 0.00 55.95 58.65 1orw s SER 340 Cb -0.09 1.38 0.57 0.00 -1.71 0.00 0.00 66.02 66.17 1orw s SER 340 CO 0.33 -0.23 1.93 0.58 1.20 0.00 0.00 173.24 177.05 1orw h VAL 341 N 4.70 1.08 -0.17 4.45 2.07 -1.98 0.59 116.25 127.00 1orw h VAL 341 Ca -0.30 -0.33 0.05 0.00 0.82 0.00 0.00 66.70 66.94 1orw h VAL 341 Cb 1.21 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1orw h VAL 341 CO 0.13 0.18 0.13 0.00 0.02 0.00 0.00 177.57 178.03 1orw h ALA 342 N 1.53 2.09 -0.56 1.67 0.00 -1.95 -2.38 119.26 119.65 1orw h ALA 342 Ca 0.35 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.12 1orw h ALA 342 Cb 0.16 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1orw h ALA 342 CO -0.12 -0.21 0.14 0.54 0.00 0.00 0.00 179.25 179.60 1orw n ARG 343 N -4.38 3.44 -4.43 0.00 1.74 0.18 -3.82 116.66 109.39 1orw n ARG 343 Ca 0.01 -3.06 -0.31 0.00 -0.77 0.00 0.00 57.85 53.72 1orw n ARG 343 Cb 0.26 -2.09 -0.10 0.00 -1.02 0.00 0.00 32.46 29.50 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 -2.97 2.39 -0.18 5.56 -0.21 -0.90 -2.54 119.66 120.81 1orw s GLN 344 Ca 0.51 -0.83 -0.02 0.00 0.02 0.00 0.00 55.36 55.04 1orw s GLN 344 Cb 0.41 -2.41 0.05 0.00 1.00 0.00 0.00 33.01 32.06 1orw s GLN 344 CO 0.11 0.57 0.00 -1.01 -2.12 0.00 0.00 175.29 172.84 1orw s HIS 345 N -1.05 1.27 0.07 0.91 3.76 0.32 -4.89 115.29 115.68 1orw s HIS 345 Ca 0.18 -0.91 -0.24 0.00 -0.15 0.00 0.00 55.06 53.94 1orw s HIS 345 Cb -0.11 -1.12 -0.06 0.00 1.11 0.00 0.00 32.58 32.40 1orw s HIS 345 CO 0.09 -0.59 0.73 0.42 -0.85 0.00 0.00 174.74 174.54 1orw s ILE 346 N 1.77 4.68 -0.06 0.60 1.01 -1.26 -1.41 121.20 126.52 1orw s ILE 346 Ca -0.00 1.57 0.01 0.00 0.00 0.00 0.00 60.65 62.23 1orw s ILE 346 Cb -0.16 -4.08 0.02 0.00 0.01 0.00 0.00 42.46 38.25 1orw s ILE 346 CO -0.07 0.42 -0.07 -0.70 0.00 0.00 0.00 174.94 174.51 1orw s GLU 347 N -0.38 1.21 0.34 2.79 2.12 -0.78 -5.00 118.70 119.00 1orw s GLU 347 Ca 0.36 -0.22 0.04 0.00 0.36 0.00 0.00 54.97 55.52 1orw s GLU 347 Cb -0.21 -1.14 -0.03 0.00 0.26 0.00 0.00 34.13 33.01 1orw s GLU 347 CO 0.23 -0.08 0.18 0.96 -0.54 0.00 0.00 175.26 176.00 1orw s ILE 348 N 0.99 0.33 -0.04 -3.70 -4.36 -1.26 -0.12 121.20 113.05 1orw s ILE 348 Ca -0.09 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.28 1orw s ILE 348 Cb -0.14 -2.46 0.03 0.00 1.25 0.00 0.00 42.46 41.14 1orw s ILE 348 CO 0.00 0.00 0.07 -0.55 0.24 0.00 0.00 174.94 174.70 1orw s SER 349 N -3.45 0.49 -0.00 4.36 0.15 -0.69 -4.87 113.70 109.69 1orw s SER 349 Ca 0.33 0.13 0.21 0.00 0.70 0.00 0.00 55.95 57.33 1orw s SER 349 Cb 0.04 -0.01 -0.18 0.00 -1.71 0.00 0.00 66.02 64.16 1orw s SER 349 CO 0.19 -0.19 0.89 0.35 1.20 0.00 0.00 173.24 175.69 1orw n THR 350 N 4.71 0.01 0.54 6.45 -2.24 -1.26 -4.32 114.28 118.16 1orw n THR 350 Ca -0.17 -0.07 0.06 0.00 -2.27 0.00 0.00 64.05 61.60 1orw n THR 350 Cb 0.50 0.79 -0.01 0.00 -2.10 0.00 0.00 70.33 69.51 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 -1.61 0.00 0.00 4.28 -2.24 -1.26 -5.06 114.28 108.38 1orw n THR 351 Ca 0.03 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1orw n THR 351 Cb 0.36 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 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 1.03 1.04 3.72 3.38 0.00 -1.26 -4.87 105.19 108.23 1orw n GLY 352 Ca 0.05 0.25 -0.23 0.00 0.00 0.00 0.00 46.02 46.09 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 1.68 2.83 -0.03 1.61 -2.14 -1.26 -4.68 118.94 116.94 1orw s TRP 353 Ca 0.00 -0.23 -0.30 0.00 2.66 0.00 0.00 56.10 58.23 1orw s TRP 353 Cb 0.00 -1.37 -0.04 0.00 -3.10 0.00 0.00 33.47 28.96 1orw s TRP 353 CO 0.00 0.51 1.22 0.08 -2.66 0.00 0.00 176.95 176.10 1orw s VAL 354 N -2.29 4.19 0.00 -0.66 1.01 -0.80 -4.83 120.40 117.02 1orw s VAL 354 Ca 0.34 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1orw s VAL 354 Cb -0.06 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1orw s VAL 354 CO 0.22 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1orw n GLY 355 N 3.36 -1.97 0.00 4.51 0.00 -1.26 -3.64 105.19 106.19 1orw n GLY 355 Ca 0.11 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1orw n GLY 355 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1orw n ARG 356 N -0.10 0.00 0.00 1.61 1.74 -1.26 -4.72 116.66 113.93 1orw n ARG 356 Ca 0.00 0.32 0.03 0.00 -0.77 0.00 0.00 57.85 57.43 1orw n ARG 356 Cb 0.00 -0.82 -0.03 0.00 -1.02 0.00 0.00 32.46 30.59 1orw n ARG 356 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1orw n PHE 357 N -2.14 0.00 -3.63 -1.55 3.72 -1.26 -4.88 117.46 107.72 1orw n PHE 357 Ca 0.00 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.37 1orw n PHE 357 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 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 -1.48 0.15 0.55 -1.08 1.70 -1.26 -4.98 118.95 112.55 1orw s ARG 358 Ca 0.03 -0.00 -0.21 0.00 -0.47 0.00 0.00 55.73 55.08 1orw s ARG 358 Cb 0.05 0.07 -0.06 0.00 -0.57 0.00 0.00 34.95 34.44 1orw s ARG 358 CO 0.24 -0.06 1.11 -0.35 -1.08 0.00 0.00 175.30 175.16 1orw n PRO 359 N 0.34 1.24 -2.03 3.89 -0.04 -1.24 -4.54 135.00 132.62 1orw n PRO 359 Ca -0.00 0.46 -0.37 0.00 -0.04 0.00 0.00 63.50 63.55 1orw n PRO 359 Cb 0.58 -2.28 0.02 0.00 -0.04 0.00 0.00 33.50 31.78 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 -1.39 2.78 0.47 0.55 0.00 -1.26 -4.98 121.76 117.91 1orw s ALA 360 Ca 0.72 1.08 -0.15 0.00 0.00 0.00 0.00 51.96 53.61 1orw s ALA 360 Cb -0.44 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.14 1orw s ALA 360 CO 0.49 -1.05 0.91 -1.21 0.00 0.00 0.00 175.76 174.91 1orw s GLU 361 N -2.99 3.93 0.22 0.00 0.41 -1.26 -4.85 118.70 114.17 1orw s GLU 361 Ca 0.71 0.81 -0.08 0.00 -0.41 0.00 0.00 54.97 56.00 1orw s GLU 361 Cb -0.33 -2.23 -0.07 0.00 -1.78 0.00 0.00 34.13 29.73 1orw s GLU 361 CO 0.38 -0.16 0.51 -1.25 -0.49 0.00 0.00 175.26 174.25 1orw s PRO 362 N -3.87 3.74 -0.27 0.39 0.04 -1.26 -4.44 135.00 129.32 1orw s PRO 362 Ca 0.57 0.16 0.03 0.00 0.04 0.00 0.00 61.00 61.79 1orw s PRO 362 Cb -0.10 -2.69 0.07 0.00 0.04 0.00 0.00 34.50 31.82 1orw s PRO 362 CO 0.29 0.33 -0.07 -1.01 0.04 0.00 0.00 177.00 176.59 1orw s HIS 363 N -1.83 3.20 0.46 0.56 3.76 0.87 -4.95 115.29 117.36 1orw s HIS 363 Ca 0.46 -2.36 -0.15 0.00 -0.15 0.00 0.00 55.06 52.86 1orw s HIS 363 Cb -0.11 -2.06 -0.08 0.00 1.11 0.00 0.00 32.58 31.44 1orw s HIS 363 CO 0.23 -0.88 0.89 -0.06 -0.85 0.00 0.00 174.74 174.08 1orw s PHE 364 N 1.12 3.44 1.00 1.40 0.40 -1.26 -0.76 117.98 123.31 1orw s PHE 364 Ca -0.04 1.33 -0.16 0.00 -0.60 0.00 0.00 56.93 57.46 1orw s PHE 364 Cb -0.20 -2.67 0.20 0.00 0.51 0.00 0.00 43.02 40.86 1orw s PHE 364 CO -0.06 -0.23 1.21 0.95 0.70 0.00 0.00 175.22 177.80 1orw s THR 365 N -2.45 1.90 0.14 0.64 -4.23 -0.61 -4.91 115.64 106.12 1orw s THR 365 Ca 0.56 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.93 1orw s THR 365 Cb -0.10 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 70.93 1orw s THR 365 CO 0.28 0.00 1.63 0.28 -0.54 0.00 0.00 174.62 176.27 1orw h SER 366 N -1.80 0.70 0.61 3.99 0.02 -1.91 -2.22 113.55 112.94 1orw h SER 366 Ca -0.46 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.24 1orw h SER 366 Cb 1.28 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1orw h SER 366 CO 0.45 0.77 0.00 -0.90 -1.14 0.00 0.00 176.83 176.01 1orw n ASP 367 N -4.49 0.00 -0.48 3.07 5.75 -1.26 -4.88 116.55 114.26 1orw n ASP 367 Ca 0.00 0.39 -0.06 0.00 -0.01 0.00 0.00 54.79 55.11 1orw n ASP 367 Cb 0.23 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 39.84 1orw n ASP 367 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1orw n GLY 368 N 0.50 0.70 0.13 6.12 0.00 -0.84 -4.85 105.19 106.96 1orw n GLY 368 Ca 0.06 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.71 0.60 -3.76 1.61 5.03 -1.26 -4.76 115.26 112.01 1orw n ASN 369 Ca -0.06 -0.57 -0.09 0.00 0.87 0.00 0.00 54.58 54.73 1orw n ASN 369 Cb 0.44 -0.01 -0.03 0.00 -1.02 0.00 0.00 39.78 39.15 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 -2.56 -0.27 0.24 6.41 1.04 -1.26 -0.97 113.70 116.33 1orw s SER 370 Ca 0.25 -0.50 -0.15 0.00 0.48 0.00 0.00 55.95 56.03 1orw s SER 370 Cb 0.20 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.93 1orw s SER 370 CO 0.51 -1.11 0.52 0.72 0.98 0.00 0.00 173.24 174.86 1orw s PHE 371 N -3.88 0.19 0.00 5.02 -0.12 0.43 -1.57 117.98 118.05 1orw s PHE 371 Ca 0.10 -0.56 0.06 0.00 -0.05 0.00 0.00 56.93 56.47 1orw s PHE 371 Cb -0.02 0.30 -0.02 0.00 -0.63 0.00 0.00 43.02 42.66 1orw s PHE 371 CO -0.01 -1.01 -0.18 0.71 -0.05 0.00 0.00 175.22 174.68 1orw s TYR 372 N -3.97 1.62 -0.10 3.49 1.51 0.06 -0.18 117.35 119.79 1orw s TYR 372 Ca 0.18 -0.32 -0.17 0.00 -1.01 0.00 0.00 57.07 55.75 1orw s TYR 372 Cb -0.01 -1.02 0.04 0.00 -0.11 0.00 0.00 41.96 40.85 1orw s TYR 372 CO 0.06 0.00 0.41 0.21 -1.11 0.00 0.00 175.55 175.13 1orw s LYS 373 N -0.63 0.62 0.20 -0.62 2.20 -0.76 -0.09 119.74 120.67 1orw s LYS 373 Ca 0.07 0.28 -0.30 0.00 -0.36 0.00 0.00 55.97 55.65 1orw s LYS 373 Cb -0.07 0.29 -0.08 0.00 -1.51 0.00 0.00 37.83 36.46 1orw s LYS 373 CO -0.00 -0.13 0.99 0.42 -0.36 0.00 0.00 175.35 176.27 1orw s ILE 374 N -0.49 4.06 0.30 5.43 1.01 -1.26 -1.36 121.20 128.89 1orw s ILE 374 Ca -0.06 1.93 -0.09 0.00 0.00 0.00 0.00 60.65 62.42 1orw s ILE 374 Cb -0.03 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.21 1orw s ILE 374 CO 0.03 0.40 0.51 0.27 0.00 0.00 0.00 174.94 176.14 1orw s ILE 375 N -0.73 0.00 -0.01 2.92 -4.36 -0.43 -4.50 121.20 114.09 1orw s ILE 375 Ca 0.44 -1.44 -0.21 0.00 -0.26 0.00 0.00 60.65 59.18 1orw s ILE 375 Cb -0.27 -2.45 -0.05 0.00 1.25 0.00 0.00 42.46 40.94 1orw s ILE 375 CO 0.33 0.00 0.62 -0.44 0.24 0.00 0.00 174.94 175.69 1orw s SER 376 N -3.11 6.99 0.78 4.36 0.01 -1.26 -0.50 113.70 120.97 1orw s SER 376 Ca 0.25 1.18 -0.05 0.00 1.31 0.00 0.00 55.95 58.64 1orw s SER 376 Cb -0.01 -2.38 0.14 0.00 0.21 0.00 0.00 66.02 63.98 1orw s SER 376 CO 0.13 0.06 0.90 -0.46 0.41 0.00 0.00 173.24 174.29 1orw n ASN 377 N 2.90 0.76 0.12 2.44 0.23 -0.11 -4.85 115.26 116.75 1orw n ASN 377 Ca -0.06 -1.75 0.20 0.00 -0.53 0.00 0.00 54.58 52.44 1orw n ASN 377 Cb 0.51 -0.63 0.75 0.00 -2.08 0.00 0.00 39.78 38.33 1orw n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1orw h GLU 378 N 0.00 0.00 -0.01 -3.83 3.07 -1.98 0.99 114.58 112.82 1orw h GLU 378 Ca -0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 1orw h GLU 378 Cb 0.98 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1orw h GLU 378 CO 0.27 0.00 -0.30 0.39 -1.40 0.00 0.00 179.01 177.98 1orw n GLU 379 N -3.61 0.97 -0.54 2.33 1.02 -1.26 -4.95 120.64 114.60 1orw n GLU 379 Ca 0.06 -0.64 0.00 0.00 -0.02 0.00 0.00 57.16 56.56 1orw n GLU 379 Cb 0.59 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 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 1.35 0.71 3.81 0.62 0.00 0.34 -4.83 105.19 107.20 1orw n GLY 380 Ca 0.12 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 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 3.39 -0.46 1.61 1.51 -1.26 0.18 117.35 120.32 1orw s TYR 381 Ca 0.00 0.31 -0.29 0.00 -1.01 0.00 0.00 57.07 56.08 1orw s TYR 381 Cb 0.00 -1.81 0.02 0.00 -0.11 0.00 0.00 41.96 40.06 1orw s TYR 381 CO 0.00 0.60 1.21 0.15 -1.11 0.00 0.00 175.55 176.40 1orw s LYS 382 N -1.48 3.68 0.15 -0.62 3.01 -1.26 -0.94 119.74 122.28 1orw s LYS 382 Ca 0.20 0.66 0.02 0.00 -1.01 0.00 0.00 55.97 55.84 1orw s LYS 382 Cb -0.12 -3.94 -0.04 0.00 -1.01 0.00 0.00 37.83 32.72 1orw s LYS 382 CO 0.11 -1.43 -0.01 -1.01 0.51 0.00 0.00 175.35 173.51 1orw s HIS 383 N 4.71 1.09 0.07 3.18 3.76 0.35 1.00 115.29 129.44 1orw s HIS 383 Ca 0.51 -1.00 -0.30 0.00 -0.15 0.00 0.00 55.06 54.12 1orw s HIS 383 Cb -0.09 -0.62 -0.06 0.00 1.11 0.00 0.00 32.58 32.93 1orw s HIS 383 CO 0.32 -0.22 1.15 0.42 -0.85 0.00 0.00 174.74 175.57 1orw s ILE 384 N -3.68 4.13 0.03 0.60 1.01 -1.26 -1.31 121.20 120.72 1orw s ILE 384 Ca 0.20 1.57 0.09 0.00 0.00 0.00 0.00 60.65 62.51 1orw s ILE 384 Cb 0.06 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.50 1orw s ILE 384 CO 0.01 0.14 -0.25 0.00 0.00 0.00 0.00 174.94 174.84 1orw s HIS 386 N -0.74 3.25 0.20 0.00 2.46 0.81 -1.82 115.29 119.44 1orw s HIS 386 Ca 0.11 0.06 0.11 0.00 0.47 0.00 0.00 55.06 55.81 1orw s HIS 386 Cb -0.10 -2.21 -0.04 0.00 -0.13 0.00 0.00 32.58 30.09 1orw s HIS 386 CO 0.01 0.00 -0.23 -0.06 -2.47 0.00 0.00 174.74 171.99 1orw s PHE 387 N 1.00 2.26 -0.17 3.88 0.40 0.75 -0.90 117.98 125.19 1orw s PHE 387 Ca 0.06 -0.36 -0.05 0.00 -0.60 0.00 0.00 56.93 55.98 1orw s PHE 387 Cb -0.14 -1.11 -0.03 0.00 0.51 0.00 0.00 43.02 42.26 1orw s PHE 387 CO 0.04 0.51 -0.01 -0.65 0.70 0.00 0.00 175.22 175.80 1orw s GLN 388 N -2.75 3.70 0.26 0.44 -0.21 -1.26 -0.42 119.66 119.42 1orw s GLN 388 Ca 0.21 -0.49 0.13 0.00 0.02 0.00 0.00 55.36 55.23 1orw s GLN 388 Cb -0.07 -3.01 0.91 0.00 1.00 0.00 0.00 33.01 31.83 1orw s GLN 388 CO 0.10 0.18 1.15 2.41 -2.12 0.00 0.00 175.29 177.01 1orw n THR 389 N 3.75 -0.31 -1.75 -0.19 -1.04 -0.14 -1.39 114.28 113.22 1orw n THR 389 Ca -0.17 1.51 -0.13 0.00 -2.04 0.00 0.00 64.05 63.22 1orw n THR 389 Cb 0.52 -2.40 0.11 0.00 -1.82 0.00 0.00 70.33 66.74 1orw n THR 389 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1orw n ASP 390 N -4.72 3.79 -3.90 8.00 5.68 -1.26 -4.31 116.55 119.82 1orw n ASP 390 Ca 0.26 -3.81 -0.13 0.00 -0.50 0.00 0.00 54.79 50.62 1orw n ASP 390 Cb 0.87 -0.50 -0.14 0.00 -1.14 0.00 0.00 41.12 40.21 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 -3.45 0.13 0.18 0.11 -0.14 -0.48 -4.81 119.74 111.26 1orw s LYS 391 Ca 0.47 -0.11 0.24 0.00 -1.36 0.00 0.00 55.97 55.22 1orw s LYS 391 Cb 0.41 -0.08 0.42 0.00 -1.68 0.00 0.00 37.83 36.90 1orw s LYS 391 CO -0.00 0.02 1.43 0.66 -0.76 0.00 0.00 175.35 176.70 1orw h SER 392 N 5.96 0.00 -3.10 2.83 4.64 -1.86 -3.38 113.55 118.64 1orw h SER 392 Ca -0.26 -0.12 -0.60 0.00 -0.47 0.00 0.00 61.79 60.34 1orw h SER 392 Cb 1.21 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.24 1orw h SER 392 CO 0.50 0.06 -0.17 0.54 -0.87 0.00 0.00 176.83 176.88 1orw s ASN 393 N -4.59 6.81 0.44 4.97 2.20 -1.26 -5.00 114.94 118.52 1orw s ASN 393 Ca 0.07 0.96 0.06 0.00 -0.94 0.00 0.00 52.86 53.01 1orw s ASN 393 Cb 0.12 -2.27 -0.05 0.00 -2.00 0.00 0.00 41.25 37.05 1orw s ASN 393 CO 0.69 0.26 0.09 0.00 -2.94 0.00 0.00 177.10 175.20 1orw s THR 395 N -2.72 1.32 0.35 0.00 2.01 -0.08 -4.88 115.64 111.64 1orw s THR 395 Ca 0.30 -0.60 -0.28 0.00 0.31 0.00 0.00 61.69 61.42 1orw s THR 395 Cb 0.05 -1.35 -0.11 0.00 0.01 0.00 0.00 72.50 71.11 1orw s THR 395 CO 0.16 0.31 1.40 -0.36 -0.69 0.00 0.00 174.62 175.44 1orw s PHE 396 N 1.57 2.80 -0.87 4.92 0.08 -1.26 -0.14 117.98 125.09 1orw s PHE 396 Ca 0.03 1.28 0.09 0.00 0.12 0.00 0.00 56.93 58.45 1orw s PHE 396 Cb -0.14 -3.87 0.19 0.00 -0.57 0.00 0.00 43.02 38.64 1orw s PHE 396 CO -0.09 -2.47 1.08 0.44 -0.10 0.00 0.00 175.22 174.08 1orw n ILE 397 N 0.63 0.69 -3.72 0.64 -5.35 0.68 -4.87 119.36 108.07 1orw n ILE 397 Ca 0.01 -0.85 -0.11 0.00 -0.27 0.00 0.00 62.75 61.53 1orw n ILE 397 Cb 0.40 0.71 -0.06 0.00 -1.74 0.00 0.00 39.64 38.95 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 -0.92 0.09 0.17 7.28 -4.23 -1.25 -4.91 115.64 111.86 1orw s THR 398 Ca 0.16 -0.71 -0.20 0.00 -1.18 0.00 0.00 61.69 59.76 1orw s THR 398 Cb 0.09 -1.11 0.05 0.00 1.34 0.00 0.00 72.50 72.87 1orw s THR 398 CO 0.12 -0.39 0.55 -1.59 -0.54 0.00 0.00 174.62 172.77 1orw s LYS 399 N -3.29 1.28 0.00 3.99 0.00 -1.26 -4.64 119.74 115.82 1orw s LYS 399 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 55.97 55.34 1orw s LYS 399 Cb 0.01 0.55 0.00 0.00 0.00 0.00 0.00 37.83 38.40 1orw s LYS 399 CO -0.08 -0.55 0.00 0.41 0.00 0.00 0.00 175.35 175.13 1orw n GLY 400 N -0.34 3.24 2.34 0.59 0.00 -1.26 -4.91 105.19 104.85 1orw n GLY 400 Ca -0.15 -1.51 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.74 6.59 -3.51 4.61 0.00 -1.26 -4.76 120.51 120.44 1orw n ALA 401 Ca 0.00 -2.93 -0.09 0.00 0.00 0.00 0.00 53.44 50.42 1orw n ALA 401 Cb 0.00 -2.40 -0.02 0.00 0.00 0.00 0.00 19.45 17.03 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 -0.58 0.20 0.02 0.00 1.48 -1.26 -5.02 118.94 113.77 1orw s TRP 402 Ca 0.61 -0.64 0.04 0.00 -1.06 0.00 0.00 56.10 55.05 1orw s TRP 402 Cb 0.32 0.47 -0.02 0.00 -1.16 0.00 0.00 33.47 33.08 1orw s TRP 402 CO -0.13 -1.21 -0.12 -1.21 -4.06 0.00 0.00 176.95 170.22 1orw s GLU 403 N -3.54 0.91 -0.10 3.25 2.02 -1.26 -4.44 118.70 115.54 1orw s GLU 403 Ca 0.18 -0.59 -0.30 0.00 0.02 0.00 0.00 54.97 54.29 1orw s GLU 403 Cb -0.03 -0.89 -0.03 0.00 0.10 0.00 0.00 34.13 33.28 1orw s GLU 403 CO 0.10 0.23 1.28 0.08 0.02 0.00 0.00 175.26 176.97 1orw s VAL 404 N -0.59 4.17 0.17 2.63 1.01 0.28 -3.29 120.40 124.77 1orw s VAL 404 Ca 0.02 1.46 -0.07 0.00 0.00 0.00 0.00 61.98 63.40 1orw s VAL 404 Cb -0.06 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1orw s VAL 404 CO 0.00 -0.07 1.51 0.40 0.00 0.00 0.00 175.10 176.94 1orw h ILE 405 N 5.25 1.29 0.00 2.22 1.08 0.71 -3.45 117.51 124.62 1orw h ILE 405 Ca -0.31 -1.63 0.00 0.00 -0.39 0.00 0.00 64.86 62.53 1orw h ILE 405 Cb 1.14 1.53 0.00 0.00 -3.07 0.00 0.00 36.82 36.42 1orw h ILE 405 CO 0.93 0.53 0.00 0.61 -0.69 0.00 0.00 178.15 179.53 1orw n GLY 406 N 0.14 1.29 3.76 5.37 0.00 -1.20 -5.00 105.19 109.55 1orw n GLY 406 Ca -0.02 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1orw n GLY 406 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1orw s ILE 407 N -2.00 4.39 -0.16 -0.61 1.01 -1.26 -1.89 121.20 120.67 1orw s ILE 407 Ca 0.00 1.80 -0.03 0.00 0.00 0.00 0.00 60.65 62.42 1orw s ILE 407 Cb 0.00 -4.19 -0.09 0.00 0.01 0.00 0.00 42.46 38.19 1orw s ILE 407 CO 0.00 0.47 -0.18 -0.62 0.00 0.00 0.00 174.94 174.62 1orw n GLU 408 N 1.90 0.37 -3.75 2.79 -0.58 0.10 -4.96 120.64 116.51 1orw n GLU 408 Ca -0.04 0.12 -0.11 0.00 -0.42 0.00 0.00 57.16 56.71 1orw n GLU 408 Cb 0.49 -1.21 -0.07 0.00 -0.57 0.00 0.00 31.44 30.08 1orw n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1orw s ALA 409 N -2.31 -0.68 -0.07 0.62 0.00 -1.05 -4.90 121.76 113.37 1orw s ALA 409 Ca -0.22 -0.03 -0.03 0.00 0.00 0.00 0.00 51.96 51.68 1orw s ALA 409 Cb 0.07 0.36 0.04 0.00 0.00 0.00 0.00 23.12 23.59 1orw s ALA 409 CO 0.33 -0.44 0.16 -1.17 0.00 0.00 0.00 175.76 174.64 1orw s LEU 410 N -2.17 0.61 0.00 0.00 2.96 -1.26 -1.17 118.68 117.65 1orw s LEU 410 Ca -0.04 0.34 0.00 0.00 -0.22 0.00 0.00 54.13 54.21 1orw s LEU 410 Cb -0.00 0.41 0.00 0.00 0.50 0.00 0.00 46.19 47.10 1orw s LEU 410 CO -0.04 -0.16 0.00 0.35 -1.32 0.00 0.00 176.35 175.18 1orw n THR 411 N 4.30 0.00 0.32 3.68 -2.24 -0.35 -4.92 114.28 115.07 1orw n THR 411 Ca -0.25 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.65 1orw n THR 411 Cb 0.52 0.00 0.14 0.00 -2.10 0.00 0.00 70.33 68.89 1orw n THR 411 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1orw h SER 412 N 0.00 0.00 0.00 3.42 4.64 -2.01 -3.38 113.55 116.22 1orw h SER 412 Ca 0.00 -0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 61.07 1orw h SER 412 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1orw h SER 412 CO 0.00 0.03 -1.73 0.47 -0.87 0.00 0.00 176.83 174.72 1orw n ASP 413 N -2.60 2.80 -4.44 4.97 8.00 -1.26 -4.86 116.55 119.16 1orw n ASP 413 Ca 0.03 -0.05 -0.22 0.00 0.71 0.00 0.00 54.79 55.26 1orw n ASP 413 Cb 0.50 0.12 -0.10 0.00 -0.02 0.00 0.00 41.12 41.62 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 -2.26 2.00 -0.05 1.24 1.51 -1.26 0.15 117.35 118.68 1orw s TYR 414 Ca -0.13 -0.70 0.00 0.00 -1.01 0.00 0.00 57.07 55.23 1orw s TYR 414 Cb 0.04 -1.16 0.02 0.00 -0.11 0.00 0.00 41.96 40.75 1orw s TYR 414 CO 0.34 0.29 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.87 1orw s LEU 415 N -3.47 1.14 -0.14 -1.29 0.20 -0.84 -1.21 118.68 113.07 1orw s LEU 415 Ca 0.30 -0.11 -0.03 0.00 0.69 0.00 0.00 54.13 54.98 1orw s LEU 415 Cb 0.04 -0.42 -0.03 0.00 -0.43 0.00 0.00 46.19 45.35 1orw s LEU 415 CO 0.13 -0.09 -0.02 -0.31 -0.29 0.00 0.00 176.35 175.76 1orw s TYR 416 N 1.18 3.07 0.30 5.38 1.51 -0.31 -1.38 117.35 127.09 1orw s TYR 416 Ca -0.07 -0.13 0.05 0.00 -1.01 0.00 0.00 57.07 55.91 1orw s TYR 416 Cb -0.14 -1.92 -0.03 0.00 -0.11 0.00 0.00 41.96 39.76 1orw s TYR 416 CO -0.01 0.12 0.24 1.52 -1.11 0.00 0.00 175.55 176.30 1orw s TYR 417 N 0.02 1.62 -0.02 2.71 -0.85 0.03 0.01 117.35 120.88 1orw s TYR 417 Ca 0.01 -1.58 0.06 0.00 -0.52 0.00 0.00 57.07 55.05 1orw s TYR 417 Cb -0.13 -0.70 -0.02 0.00 0.38 0.00 0.00 41.96 41.49 1orw s TYR 417 CO 0.02 -0.79 -0.22 0.42 -1.52 0.00 0.00 175.55 173.47 1orw s ILE 418 N -3.60 1.71 0.24 -3.49 -1.09 -0.79 -0.48 121.20 113.69 1orw s ILE 418 Ca 0.40 -0.92 -0.14 0.00 -2.23 0.00 0.00 60.65 57.76 1orw s ILE 418 Cb 0.03 -1.42 0.00 0.00 -1.58 0.00 0.00 42.46 39.50 1orw s ILE 418 CO 0.23 0.48 0.50 -0.94 -1.23 0.00 0.00 174.94 173.99 1orw s SER 419 N -0.46 -0.13 -0.28 3.58 1.04 -1.01 0.13 113.70 116.57 1orw s SER 419 Ca 0.07 -0.83 0.10 0.00 0.48 0.00 0.00 55.95 55.78 1orw s SER 419 Cb -0.09 0.60 0.52 0.00 0.10 0.00 0.00 66.02 67.15 1orw s SER 419 CO -0.00 -1.14 1.48 -0.46 0.98 0.00 0.00 173.24 174.10 1orw n ASN 420 N -0.38 2.88 0.21 7.02 6.94 -1.21 -1.79 115.26 128.93 1orw n ASN 420 Ca -0.03 -3.59 -0.15 0.00 -0.02 0.00 0.00 54.58 50.79 1orw n ASN 420 Cb 0.62 -0.63 -0.08 0.00 -2.36 0.00 0.00 39.78 37.33 1orw n ASN 420 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1orw h GLU 421 N 1.18 -0.46 -6.03 -3.83 4.81 -1.84 -3.29 114.58 105.12 1orw h GLU 421 Ca 0.20 0.03 -0.84 0.00 -0.13 0.00 0.00 59.36 58.62 1orw h GLU 421 Cb 1.69 0.10 0.02 0.00 0.63 0.00 0.00 28.75 31.19 1orw h GLU 421 CO 0.40 -0.28 0.60 1.58 -0.73 0.00 0.00 179.01 180.58 1orw n HIS 422 N -5.28 1.59 -1.22 0.92 -0.00 -1.26 0.25 115.22 110.23 1orw n HIS 422 Ca -0.10 1.03 -0.07 0.00 0.46 0.00 0.00 57.72 59.03 1orw n HIS 422 Cb 0.22 -2.24 -0.03 0.00 -0.12 0.00 0.00 29.99 27.82 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 3.69 -1.68 -1.99 1.57 5.02 -1.26 -2.59 118.16 120.92 1orw n LYS 423 Ca 0.28 0.74 -0.21 0.00 -2.02 0.00 0.00 58.31 57.11 1orw n LYS 423 Cb -0.00 -5.12 -0.05 0.00 -0.02 0.00 0.00 35.03 29.84 1orw n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1orw n GLY 424 N 0.24 0.77 3.48 0.72 0.00 0.14 -4.96 105.19 105.59 1orw n GLY 424 Ca -0.07 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 1orw n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1orw s MET 425 N -4.38 3.12 0.28 1.61 -1.94 -1.07 -4.93 119.30 111.99 1orw s MET 425 Ca 0.00 -0.75 0.20 0.00 -1.71 0.00 0.00 55.69 53.43 1orw s MET 425 Cb 0.00 -4.00 1.03 0.00 2.01 0.00 0.00 34.83 33.87 1orw s MET 425 CO 0.00 -0.96 1.61 -0.35 -0.01 0.00 0.00 175.02 175.31 1orw n PRO 426 N 5.81 0.13 -1.16 2.03 -0.04 -1.26 -1.81 135.00 138.70 1orw n PRO 426 Ca -0.06 0.58 -0.20 0.00 -0.04 0.00 0.00 63.50 63.78 1orw n PRO 426 Cb 0.47 -1.90 0.20 0.00 -0.04 0.00 0.00 33.50 32.23 1orw n PRO 426 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1orw n GLY 427 N -1.06 4.46 3.29 0.55 0.00 -1.26 -4.89 105.19 106.27 1orw n GLY 427 Ca -0.01 -1.10 -0.17 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.41 1.22 -0.02 -0.02 0.00 -0.75 -2.47 107.32 103.87 1orw s GLY 428 Ca 0.56 -1.49 0.00 0.00 0.00 0.00 0.00 44.72 43.79 1orw s GLY 428 CO 0.10 -1.57 0.01 0.50 0.00 0.00 0.00 173.10 172.14 1orw s ARG 429 N -3.29 0.14 0.04 2.90 1.81 -0.48 -3.89 118.95 116.17 1orw s ARG 429 Ca 0.16 0.11 0.00 0.00 -1.72 0.00 0.00 55.73 54.29 1orw s ARG 429 Cb -0.02 -0.35 -0.03 0.00 -0.45 0.00 0.00 34.95 34.11 1orw s ARG 429 CO 0.04 -0.14 -0.04 -0.80 -0.68 0.00 0.00 175.30 173.69 1orw s ASN 430 N 0.95 0.44 -0.04 0.23 0.01 -0.74 -0.44 114.94 115.36 1orw s ASN 430 Ca -0.09 -0.67 -0.18 0.00 -0.71 0.00 0.00 52.86 51.22 1orw s ASN 430 Cb -0.12 0.12 -0.05 0.00 0.41 0.00 0.00 41.25 41.60 1orw s ASN 430 CO -0.02 -0.37 0.49 -0.22 -1.51 0.00 0.00 177.10 175.46 1orw s LEU 431 N -1.95 4.39 0.12 0.60 2.96 -1.26 -2.42 118.68 121.13 1orw s LEU 431 Ca -0.08 0.97 0.05 0.00 -0.22 0.00 0.00 54.13 54.85 1orw s LEU 431 Cb -0.04 -2.73 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 1orw s LEU 431 CO -0.03 0.14 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.71 1orw s TYR 432 N -0.20 1.28 -0.04 5.38 1.51 0.37 -1.10 117.35 124.55 1orw s TYR 432 Ca 0.27 -0.63 0.02 0.00 -1.01 0.00 0.00 57.07 55.72 1orw s TYR 432 Cb -0.17 -0.67 0.01 0.00 -0.11 0.00 0.00 41.96 41.02 1orw s TYR 432 CO 0.13 0.10 -0.10 0.50 -1.11 0.00 0.00 175.55 175.07 1orw s ARG 433 N -3.00 1.19 -0.03 -0.62 3.52 -0.30 -0.79 118.95 118.92 1orw s ARG 433 Ca 0.10 -0.34 0.05 0.00 -0.13 0.00 0.00 55.73 55.42 1orw s ARG 433 Cb -0.02 -1.07 -0.01 0.00 -1.56 0.00 0.00 34.95 32.29 1orw s ARG 433 CO 0.02 0.09 -0.18 -1.50 -0.81 0.00 0.00 175.30 172.91 1orw s ILE 434 N 0.36 1.48 -0.08 4.11 2.07 -0.48 -0.80 121.20 127.86 1orw s ILE 434 Ca -0.07 -0.77 -0.30 0.00 -1.41 0.00 0.00 60.65 58.11 1orw s ILE 434 Cb -0.11 -1.25 -0.02 0.00 0.13 0.00 0.00 42.46 41.21 1orw s ILE 434 CO 0.01 0.42 1.00 -1.58 -1.91 0.00 0.00 174.94 172.88 1orw s GLN 435 N -0.18 4.46 0.59 3.50 0.74 -0.61 -1.99 119.66 126.18 1orw s GLN 435 Ca 0.01 1.39 0.34 0.00 0.05 0.00 0.00 55.36 57.15 1orw s GLN 435 Cb -0.10 -3.52 1.87 0.00 1.10 0.00 0.00 33.01 32.36 1orw s GLN 435 CO 0.01 -0.24 2.23 -0.07 -0.55 0.00 0.00 175.29 176.66 1orw h LEU 436 N 7.68 0.00 -2.55 3.68 4.07 -0.63 -2.17 115.31 125.39 1orw h LEU 436 Ca -0.34 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.62 1orw h LEU 436 Cb 1.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 1orw h LEU 436 CO 0.83 0.03 0.00 -0.46 -1.08 0.00 0.00 178.44 177.76 1orw n ASN 437 N -3.53 3.72 -3.03 -0.43 0.23 -1.26 -4.74 115.26 106.23 1orw n ASN 437 Ca -0.02 -2.00 0.03 0.00 -0.53 0.00 0.00 54.58 52.06 1orw n ASN 437 Cb 0.13 -0.44 -0.00 0.00 -2.08 0.00 0.00 39.78 37.39 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 -1.07 -0.87 0.00 0.53 2.15 -0.82 -5.00 116.67 111.59 1orw s ASP 438 Ca 0.46 -0.24 0.04 0.00 0.43 0.00 0.00 52.55 53.23 1orw s ASP 438 Cb 0.24 1.26 0.23 0.00 -0.30 0.00 0.00 42.92 44.35 1orw s ASP 438 CO 0.32 -0.12 0.58 -1.22 -0.17 0.00 0.00 175.17 174.57 1orw n TYR 439 N 4.43 0.00 0.01 -5.34 4.01 -1.23 -0.80 117.16 118.24 1orw n TYR 439 Ca 0.08 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.67 1orw n TYR 439 Cb 0.59 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.48 1orw n TYR 439 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1orw h THR 440 N 0.00 0.90 -1.38 -0.72 2.02 -1.93 -3.41 112.91 108.39 1orw h THR 440 Ca 0.00 -2.65 -0.69 0.00 0.77 0.00 0.00 66.41 63.84 1orw h THR 440 Cb 0.00 2.56 -0.12 0.00 -1.74 0.00 0.00 68.15 68.85 1orw h THR 440 CO 0.00 0.72 1.79 -0.54 0.37 0.00 0.00 175.52 177.86 1orw s LYS 441 N -2.60 3.95 -0.09 6.66 1.02 0.02 -4.93 119.74 123.77 1orw s LYS 441 Ca -0.11 -2.06 0.04 0.00 0.02 0.00 0.00 55.97 53.86 1orw s LYS 441 Cb 0.07 -5.34 -0.01 0.00 -0.52 0.00 0.00 37.83 32.04 1orw s LYS 441 CO 0.82 -2.08 -0.21 0.54 -0.92 0.00 0.00 175.35 173.50 1orw s VAL 442 N 3.42 2.34 0.00 3.17 0.11 -1.26 -1.58 120.40 126.61 1orw s VAL 442 Ca 0.48 -0.94 0.04 0.00 -2.93 0.00 0.00 61.98 58.63 1orw s VAL 442 Cb 0.01 -1.90 -0.01 0.00 -1.53 0.00 0.00 36.38 32.95 1orw s VAL 442 CO 0.03 0.56 -0.12 -0.89 -3.33 0.00 0.00 175.10 171.34 1orw s THR 443 N 0.08 0.96 -0.38 5.04 2.01 0.02 -4.97 115.64 118.40 1orw s THR 443 Ca -0.09 -0.64 -0.20 0.00 0.31 0.00 0.00 61.69 61.06 1orw s THR 443 Cb -0.15 -0.83 0.01 0.00 0.01 0.00 0.00 72.50 71.54 1orw s THR 443 CO 0.06 0.18 0.62 0.00 -0.69 0.00 0.00 174.62 174.78 1orw n LEU 445 N 6.06 0.14 0.00 0.00 4.77 -0.26 -4.27 117.00 123.44 1orw n LEU 445 Ca -0.02 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1orw n LEU 445 Cb 0.48 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1orw n LEU 445 CO 0.50 0.03 -0.16 -1.54 -1.33 0.00 0.00 177.39 174.88 1orw n SER 446 N -1.35 1.63 -0.23 -1.43 3.41 -1.23 -4.85 113.62 109.58 1orw n SER 446 Ca 0.10 -0.09 -0.01 0.00 -0.26 0.00 0.00 58.87 58.61 1orw n SER 446 Cb 0.30 0.52 0.06 0.00 -0.26 0.00 0.00 64.21 64.83 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 -5.46 2.33 0.08 0.00 4.71 -1.26 -3.93 120.64 117.11 1orw n GLU 448 Ca 0.08 -3.08 -0.17 0.00 -0.01 0.00 0.00 57.16 53.98 1orw n GLU 448 Cb 0.35 -2.03 -0.09 0.00 -1.01 0.00 0.00 31.44 28.65 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 1.26 0.64 -5.00 -4.62 3.38 -1.82 -3.40 115.31 105.75 1orw h LEU 449 Ca 0.40 -0.57 -0.23 0.00 0.09 0.00 0.00 57.88 57.58 1orw h LEU 449 Cb 2.29 -0.20 -0.15 0.00 0.09 0.00 0.00 40.66 42.69 1orw h LEU 449 CO 0.75 1.39 -0.38 0.59 0.09 0.00 0.00 178.44 180.88 1orw n ASN 450 N -3.72 -2.11 -0.41 -0.43 4.13 -1.26 -5.04 115.26 106.42 1orw n ASN 450 Ca -0.09 -3.07 0.30 0.00 1.68 0.00 0.00 54.58 53.40 1orw n ASN 450 Cb 0.93 1.49 0.47 0.00 -1.54 0.00 0.00 39.78 41.12 1orw n ASN 450 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1orw n PRO 451 N -0.09 0.00 -0.05 3.52 -0.04 -1.25 -0.39 135.00 136.70 1orw n PRO 451 Ca 0.01 0.62 -0.22 0.00 -0.04 0.00 0.00 63.50 63.87 1orw n PRO 451 Cb 0.77 -1.43 -0.13 0.00 -0.04 0.00 0.00 33.50 32.67 1orw n PRO 451 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1orw n GLU 452 N -3.09 0.68 0.09 0.54 -0.58 -1.26 -4.47 120.64 112.55 1orw n GLU 452 Ca 0.25 0.36 -0.15 0.00 -0.42 0.00 0.00 57.16 57.21 1orw n GLU 452 Cb 1.15 -1.70 -0.14 0.00 -0.57 0.00 0.00 31.44 30.19 1orw n GLU 452 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1orw h ARG 453 N -0.35 0.23 -4.82 3.49 2.43 -1.08 -3.40 114.38 110.88 1orw h ARG 453 Ca -0.43 -0.38 -0.65 0.00 -0.81 0.00 0.00 59.98 57.71 1orw h ARG 453 Cb 1.76 0.14 -0.36 0.00 -0.42 0.00 0.00 29.97 31.09 1orw h ARG 453 CO -0.05 1.17 -0.82 0.00 -1.51 0.00 0.00 179.97 178.76 1orw n GLN 455 N 4.56 -0.17 -3.62 0.00 6.02 0.91 -4.29 117.38 120.80 1orw n GLN 455 Ca -0.16 -0.22 -0.29 0.00 -0.01 0.00 0.00 57.00 56.31 1orw n GLN 455 Cb 0.46 -0.65 -0.14 0.00 1.02 0.00 0.00 30.24 30.93 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 -0.03 1.20 0.31 1.08 6.14 -1.08 -1.38 117.35 123.60 1orw s TYR 456 Ca 0.00 -1.67 0.08 0.00 0.64 0.00 0.00 57.07 56.12 1orw s TYR 456 Cb 0.00 -1.36 -0.04 0.00 0.42 0.00 0.00 41.96 40.97 1orw s TYR 456 CO 0.00 -0.83 0.11 0.71 0.64 0.00 0.00 175.55 176.18 1orw s TYR 457 N 1.30 2.75 0.02 4.97 1.51 0.41 -0.92 117.35 127.39 1orw s TYR 457 Ca 0.13 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 55.89 1orw s TYR 457 Cb -0.20 -1.50 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 1orw s TYR 457 CO -0.15 0.42 -0.03 -1.54 -1.11 0.00 0.00 175.55 173.14 1orw s SER 458 N -3.81 0.28 0.24 2.29 1.04 -0.15 -4.55 113.70 109.05 1orw s SER 458 Ca 0.36 -0.35 0.11 0.00 0.48 0.00 0.00 55.95 56.55 1orw s SER 458 Cb -0.04 0.05 -0.05 0.00 0.10 0.00 0.00 66.02 66.08 1orw s SER 458 CO 0.22 -0.18 -0.19 0.00 0.98 0.00 0.00 173.24 174.07 1orw s ALA 459 N -0.97 2.47 -0.30 5.32 0.00 -1.26 -0.75 121.76 126.26 1orw s ALA 459 Ca -0.10 -1.76 -0.02 0.00 0.00 0.00 0.00 51.96 50.08 1orw s ALA 459 Cb -0.07 -0.22 0.12 0.00 0.00 0.00 0.00 23.12 22.95 1orw s ALA 459 CO -0.00 0.24 0.19 0.45 0.00 0.00 0.00 175.76 176.64 1orw s SER 460 N -3.27 2.97 0.64 0.00 0.15 -0.72 -4.97 113.70 108.50 1orw s SER 460 Ca 0.26 -1.37 -0.10 0.00 0.70 0.00 0.00 55.95 55.44 1orw s SER 460 Cb -0.04 -0.15 -0.02 0.00 -1.71 0.00 0.00 66.02 64.10 1orw s SER 460 CO 0.12 -0.40 1.02 -0.36 1.20 0.00 0.00 173.24 174.82 1orw s PHE 461 N 1.93 3.48 0.37 3.44 0.40 -1.26 -0.90 117.98 125.43 1orw s PHE 461 Ca 0.11 1.10 -0.02 0.00 -0.60 0.00 0.00 56.93 57.52 1orw s PHE 461 Cb -0.17 -2.81 0.08 0.00 0.51 0.00 0.00 43.02 40.62 1orw s PHE 461 CO -0.28 -0.85 0.50 -1.13 0.70 0.00 0.00 175.22 174.17 1orw n SER 462 N -2.79 0.50 -4.77 1.36 3.41 0.23 -4.93 113.62 106.63 1orw n SER 462 Ca 0.06 -1.47 -0.34 0.00 -0.26 0.00 0.00 58.87 56.86 1orw n SER 462 Cb 0.56 -0.34 0.03 0.00 -0.26 0.00 0.00 64.21 64.19 1orw n SER 462 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1orw s ASN 463 N -2.99 5.37 0.00 4.04 0.02 -1.19 -1.89 114.94 118.30 1orw s ASN 463 Ca 0.32 2.07 0.00 0.00 -1.02 0.00 0.00 52.86 54.23 1orw s ASN 463 Cb -0.02 -2.56 0.00 0.00 0.02 0.00 0.00 41.25 38.69 1orw s ASN 463 CO 0.22 -1.45 0.00 0.29 0.02 0.00 0.00 177.10 176.17 1orw n LYS 464 N -1.96 -0.17 -3.73 -0.60 4.76 -1.26 -3.04 118.16 112.16 1orw n LYS 464 Ca 0.11 0.03 -0.23 0.00 -2.87 0.00 0.00 58.31 55.35 1orw n LYS 464 Cb 0.52 -3.96 0.02 0.00 -1.84 0.00 0.00 35.03 29.77 1orw n LYS 464 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1orw n ALA 465 N 0.99 -2.09 1.19 7.82 0.00 -0.79 -4.90 120.51 122.73 1orw n ALA 465 Ca 0.00 -0.19 0.12 0.00 0.00 0.00 0.00 53.44 53.38 1orw n ALA 465 Cb 0.03 -2.20 0.26 0.00 0.00 0.00 0.00 19.45 17.55 1orw n ALA 465 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1orw n LYS 466 N -4.25 1.25 -3.52 0.00 5.02 -1.17 -4.75 118.16 110.74 1orw n LYS 466 Ca -0.27 -0.88 -0.13 0.00 -2.02 0.00 0.00 58.31 55.00 1orw n LYS 466 Cb 0.67 -1.48 -0.04 0.00 -0.02 0.00 0.00 35.03 34.16 1orw n LYS 466 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1orw s TYR 467 N -2.35 -0.46 -0.03 2.13 2.02 -1.26 -2.33 117.35 115.06 1orw s TYR 467 Ca 0.25 0.42 -0.17 0.00 -0.37 0.00 0.00 57.07 57.20 1orw s TYR 467 Cb 0.19 0.42 0.03 0.00 -0.40 0.00 0.00 41.96 42.20 1orw s TYR 467 CO 0.48 -0.72 0.37 1.52 -1.57 0.00 0.00 175.55 175.63 1orw s TYR 468 N -2.94 -0.27 -0.04 2.71 1.13 -0.80 -0.60 117.35 116.53 1orw s TYR 468 Ca -0.03 0.46 -0.13 0.00 -1.41 0.00 0.00 57.07 55.97 1orw s TYR 468 Cb -0.00 0.15 -0.05 0.00 -1.10 0.00 0.00 41.96 40.95 1orw s TYR 468 CO -0.06 -0.41 0.34 -1.14 -2.51 0.00 0.00 175.55 171.78 1orw s GLN 469 N -1.17 3.84 -0.14 -3.49 0.74 -0.08 -0.82 119.66 118.53 1orw s GLN 469 Ca -0.12 0.27 -0.02 0.00 0.05 0.00 0.00 55.36 55.54 1orw s GLN 469 Cb -0.04 -3.23 -0.02 0.00 1.10 0.00 0.00 33.01 30.81 1orw s GLN 469 CO 0.05 0.67 -0.08 -0.51 -0.55 0.00 0.00 175.29 174.88 1orw s LEU 470 N -0.94 3.04 -0.21 3.68 1.43 0.19 -1.75 118.68 124.12 1orw s LEU 470 Ca 0.21 -0.19 -0.01 0.00 -1.03 0.00 0.00 54.13 53.12 1orw s LEU 470 Cb -0.15 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.38 1orw s LEU 470 CO 0.11 0.19 -0.13 -0.13 0.23 0.00 0.00 176.35 176.62 1orw s ARG 471 N 0.23 2.99 -0.19 1.70 0.52 0.07 -1.78 118.95 122.47 1orw s ARG 471 Ca -0.05 -0.86 -0.05 0.00 -0.52 0.00 0.00 55.73 54.26 1orw s ARG 471 Cb -0.14 -2.79 -0.02 0.00 0.52 0.00 0.00 34.95 32.51 1orw s ARG 471 CO 0.04 -0.28 -0.01 0.00 0.02 0.00 0.00 175.30 175.06 1orw n PHE 473 N 4.15 0.29 -1.27 0.00 3.01 -0.10 -1.40 117.46 122.14 1orw n PHE 473 Ca -0.17 -0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.07 1orw n PHE 473 Cb 0.52 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.98 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 0.92 -0.80 0.22 1.37 0.00 -1.25 0.14 105.19 105.78 1orw n GLY 474 Ca 0.12 -1.55 0.15 0.00 0.00 0.00 0.00 46.02 44.75 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 2.96 0.00 -7.32 1.61 0.13 -0.65 0.27 132.00 128.99 1orw h PRO 475 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 1orw h PRO 475 Cb 0.00 0.00 0.10 0.00 0.13 0.00 0.00 31.00 31.23 1orw h PRO 475 CO 0.00 0.00 0.21 0.20 -0.23 0.00 0.00 178.00 178.18 1orw s GLY 476 N -3.83 1.76 0.35 1.56 0.00 0.14 -4.41 107.32 102.89 1orw s GLY 476 Ca 0.00 -1.44 -0.25 0.00 0.00 0.00 0.00 44.72 43.03 1orw s GLY 476 CO 0.40 -0.86 0.75 1.04 0.00 0.00 0.00 173.10 174.44 1orw n LEU 477 N -3.08 0.77 -4.60 0.66 4.77 -1.26 -4.63 117.00 109.63 1orw n LEU 477 Ca 0.14 1.04 -0.39 0.00 -0.03 0.00 0.00 56.01 56.76 1orw n LEU 477 Cb 0.60 -1.18 0.03 0.00 -2.33 0.00 0.00 43.42 40.54 1orw n LEU 477 CO 0.45 -2.24 0.52 -2.65 -1.33 0.00 0.00 177.39 172.14 1orw n PRO 478 N 0.61 1.10 -3.67 3.23 -0.02 -1.26 -4.72 135.00 130.27 1orw n PRO 478 Ca 0.11 0.41 -0.15 0.00 -2.02 0.00 0.00 63.50 61.85 1orw n PRO 478 Cb 0.35 -2.07 -0.14 0.00 -0.02 0.00 0.00 33.50 31.62 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 -1.03 -0.11 -0.17 2.45 2.96 -0.50 -4.35 118.68 117.93 1orw s LEU 479 Ca 0.69 0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 55.02 1orw s LEU 479 Cb -0.48 0.49 -0.02 0.00 0.50 0.00 0.00 46.19 46.68 1orw s LEU 479 CO 0.53 -0.23 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.97 1orw s TYR 480 N 2.24 2.98 0.01 5.38 1.51 0.24 -1.53 117.35 128.18 1orw s TYR 480 Ca 0.01 -0.52 0.00 0.00 -1.01 0.00 0.00 57.07 55.55 1orw s TYR 480 Cb -0.12 -1.99 -0.01 0.00 -0.11 0.00 0.00 41.96 39.72 1orw s TYR 480 CO -0.07 -0.21 -0.03 0.95 -1.11 0.00 0.00 175.55 175.08 1orw s THR 481 N 0.72 0.13 0.09 -0.71 -4.23 -0.74 -0.38 115.64 110.53 1orw s THR 481 Ca -0.02 -0.57 -0.06 0.00 -1.18 0.00 0.00 61.69 59.85 1orw s THR 481 Cb -0.15 -0.21 -0.05 0.00 1.34 0.00 0.00 72.50 73.43 1orw s THR 481 CO 0.02 -0.28 0.36 -0.22 -0.54 0.00 0.00 174.62 173.96 1orw s LEU 482 N -0.89 4.31 0.05 4.79 0.20 -0.92 0.56 118.68 126.79 1orw s LEU 482 Ca -0.09 0.63 -0.02 0.00 0.69 0.00 0.00 54.13 55.34 1orw s LEU 482 Cb -0.06 -3.08 -0.04 0.00 -0.43 0.00 0.00 46.19 42.58 1orw s LEU 482 CO -0.00 0.13 -0.01 -1.00 -0.29 0.00 0.00 176.35 175.17 1orw s HIS 483 N -1.51 0.49 -0.05 5.38 3.76 -0.00 -1.89 115.29 121.47 1orw s HIS 483 Ca 0.36 -1.03 -0.06 0.00 -0.15 0.00 0.00 55.06 54.18 1orw s HIS 483 Cb -0.13 -0.36 -0.04 0.00 1.11 0.00 0.00 32.58 33.16 1orw s HIS 483 CO 0.21 -0.39 0.20 0.45 -0.85 0.00 0.00 174.74 174.36 1orw s SER 484 N -2.91 6.44 0.12 1.40 0.15 -0.85 -1.91 113.70 116.14 1orw s SER 484 Ca 0.07 0.50 0.06 0.00 0.70 0.00 0.00 55.95 57.28 1orw s SER 484 Cb 0.08 -2.07 -0.21 0.00 -1.71 0.00 0.00 66.02 62.10 1orw s SER 484 CO -0.10 0.33 1.27 0.28 1.20 0.00 0.00 173.24 176.22 1orw h SER 485 N 4.45 0.02 0.11 5.45 0.02 -1.76 -0.97 113.55 120.87 1orw h SER 485 Ca -0.52 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.40 1orw h SER 485 Cb 1.21 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1orw h SER 485 CO 0.63 1.02 -0.05 0.77 -1.14 0.00 0.00 176.83 178.05 1orw h SER 486 N 0.00 -0.12 0.51 3.07 4.64 -1.92 -3.34 113.55 116.39 1orw h SER 486 Ca -0.02 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1orw h SER 486 Cb 1.78 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 1orw h SER 486 CO 0.13 0.50 -0.28 -1.54 -0.87 0.00 0.00 176.83 174.78 1orw n SER 487 N -4.84 0.49 -1.51 4.97 3.41 -1.26 -4.92 113.62 109.96 1orw n SER 487 Ca -0.07 -0.30 -0.14 0.00 -0.26 0.00 0.00 58.87 58.11 1orw n SER 487 Cb 0.26 0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 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 -1.23 -3.67 -4.90 4.04 10.43 -0.37 -4.93 116.55 115.92 1orw n ASP 488 Ca 0.09 0.32 -0.28 0.00 2.57 0.00 0.00 54.79 57.48 1orw n ASP 488 Cb 0.32 -3.38 -0.02 0.00 1.84 0.00 0.00 41.12 39.88 1orw n ASP 488 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1orw s LYS 489 N -3.36 3.65 -1.07 -1.24 1.02 -1.25 -4.82 119.74 112.66 1orw s LYS 489 Ca 0.00 0.17 -0.17 0.00 0.02 0.00 0.00 55.97 56.00 1orw s LYS 489 Cb 0.00 -2.50 0.14 0.00 -0.52 0.00 0.00 37.83 34.95 1orw s LYS 489 CO 0.00 0.03 1.30 -2.00 -0.92 0.00 0.00 175.35 173.76 1orw s GLU 490 N -3.99 3.83 0.60 1.68 2.12 -1.26 -2.00 118.70 119.68 1orw s GLU 490 Ca 0.47 -2.10 0.29 0.00 0.36 0.00 0.00 54.97 53.98 1orw s GLU 490 Cb -0.10 -5.03 1.24 0.00 0.26 0.00 0.00 34.13 30.49 1orw s GLU 490 CO 0.34 -1.81 1.60 -0.07 -0.54 0.00 0.00 175.26 174.78 1orw h LEU 491 N 10.31 0.00 0.00 2.70 -0.00 -1.71 -3.45 115.31 123.16 1orw h LEU 491 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.12 1orw h LEU 491 Cb 0.95 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.61 1orw h LEU 491 CO 1.20 0.00 0.00 -2.11 -0.00 0.00 0.00 178.44 177.53 1orw n ARG 492 N -3.50 0.00 -3.81 1.13 1.85 -1.22 -4.99 116.66 106.11 1orw n ARG 492 Ca 0.17 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.66 1orw n ARG 492 Cb 1.15 0.00 -0.12 0.00 -1.05 0.00 0.00 32.46 32.44 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 4.36 -0.07 8.89 1.01 -1.26 -2.18 120.40 129.15 1orw s VAL 493 Ca 0.00 -0.16 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 1orw s VAL 493 Cb 0.00 -3.02 -0.28 0.00 0.00 0.00 0.00 36.38 33.08 1orw s VAL 493 CO 0.00 0.36 0.58 -0.07 0.00 0.00 0.00 175.10 175.97 1orw h LEU 494 N 8.00 0.46 -7.05 3.92 3.38 -1.07 -3.47 115.31 119.47 1orw h LEU 494 Ca -0.38 -0.81 -0.00 0.00 0.09 0.00 0.00 57.88 56.78 1orw h LEU 494 Cb 1.18 -0.15 -0.22 0.00 0.09 0.00 0.00 40.66 41.55 1orw h LEU 494 CO 0.59 1.70 -0.09 -0.70 0.09 0.00 0.00 178.44 180.03 1orw s GLU 495 N -2.58 0.60 0.00 1.13 2.56 -0.91 -4.97 118.70 114.53 1orw s GLU 495 Ca -0.16 1.17 0.03 0.00 0.00 0.00 0.00 54.97 56.00 1orw s GLU 495 Cb 0.06 0.24 -0.00 0.00 2.00 0.00 0.00 34.13 36.43 1orw s GLU 495 CO 0.82 -0.17 0.36 -0.40 -0.56 0.00 0.00 175.26 175.32 1orw n ASP 496 N 4.56 0.72 -1.08 -1.70 5.68 -1.26 -0.59 116.55 122.87 1orw n ASP 496 Ca -0.19 -0.86 -0.14 0.00 -0.50 0.00 0.00 54.79 53.10 1orw n ASP 496 Cb 0.56 0.46 -0.06 0.00 -1.14 0.00 0.00 41.12 40.94 1orw n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1orw n ASN 497 N -0.40 -5.63 -0.30 -1.12 3.02 -1.26 -4.81 115.26 104.75 1orw n ASN 497 Ca 0.01 0.35 0.25 0.00 -0.03 0.00 0.00 54.58 55.16 1orw n ASN 497 Cb 0.06 -4.37 0.57 0.00 -0.61 0.00 0.00 39.78 35.42 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 0.33 -0.95 6.41 4.64 -1.94 0.23 113.55 122.27 1orw h SER 498 Ca -0.29 0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.10 1orw h SER 498 Cb 1.23 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 1orw h SER 498 CO 0.42 0.07 0.63 0.00 -0.87 0.00 0.00 176.83 177.08 1orw h ALA 499 N 1.58 1.20 -0.07 5.18 0.00 -1.99 -1.48 119.26 123.68 1orw h ALA 499 Ca 0.56 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.26 1orw h ALA 499 Cb 1.61 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1orw h ALA 499 CO -0.21 0.59 -0.59 1.25 0.00 0.00 0.00 179.25 180.30 1orw h LEU 500 N 1.28 0.27 -0.21 0.00 5.85 -0.87 -2.97 115.31 118.66 1orw h LEU 500 Ca 0.35 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.96 1orw h LEU 500 Cb -0.15 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 1orw h LEU 500 CO -0.08 0.80 -0.07 -0.78 -0.34 0.00 0.00 178.44 177.97 1orw h ASP 501 N 0.18 -0.25 0.48 1.25 3.58 -0.32 -1.01 116.42 120.33 1orw h ASP 501 Ca -0.00 0.07 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 1orw h ASP 501 Cb 1.08 0.15 -0.01 0.00 1.72 0.00 0.00 39.33 42.28 1orw h ASP 501 CO 0.09 -0.09 -0.35 0.11 -2.88 0.00 0.00 179.24 176.12 1orw h LYS 502 N -0.03 -0.76 -1.30 0.28 1.57 -1.39 -2.46 116.57 112.48 1orw h LYS 502 Ca 0.11 0.05 0.46 0.00 -1.87 0.00 0.00 60.65 59.40 1orw h LYS 502 Cb 0.19 0.17 -0.14 0.00 0.08 0.00 0.00 32.23 32.53 1orw h LYS 502 CO -0.24 -0.51 0.82 -0.12 -0.57 0.00 0.00 179.45 178.84 1orw n MET 503 N -4.52 -0.04 0.02 3.15 1.56 -1.05 -1.23 117.12 115.02 1orw n MET 503 Ca -0.10 1.24 -0.07 0.00 -0.27 0.00 0.00 57.70 58.50 1orw n MET 503 Cb 0.34 -2.41 -0.13 0.00 2.15 0.00 0.00 33.22 33.17 1orw n MET 503 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 1orw h LEU 504 N 0.00 0.00 -2.70 -0.89 3.38 -0.83 -3.33 115.31 110.94 1orw h LEU 504 Ca 0.86 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.83 1orw h LEU 504 Cb 2.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.45 1orw h LEU 504 CO -0.49 0.98 0.00 0.06 0.09 0.00 0.00 178.44 179.08 1orw h GLN 505 N 0.00 0.00 -0.01 1.13 3.07 -0.72 0.18 115.11 118.77 1orw h GLN 505 Ca -0.14 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.60 1orw h GLN 505 Cb 1.88 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.44 1orw h GLN 505 CO 0.10 0.00 -0.16 -3.47 0.09 0.00 0.00 178.83 175.39 1orw n ASP 506 N -3.05 1.03 -4.47 0.06 -0.08 -1.24 -4.90 116.55 103.89 1orw n ASP 506 Ca -0.02 -1.00 -0.26 0.00 -1.51 0.00 0.00 54.79 51.99 1orw n ASP 506 Cb 0.11 0.06 -0.11 0.00 2.34 0.00 0.00 41.12 43.52 1orw n ASP 506 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1orw s VAL 507 N -2.35 2.62 -1.21 5.18 -7.23 0.05 -3.06 120.40 114.39 1orw s VAL 507 Ca 0.29 -1.99 -0.16 0.00 -1.81 0.00 0.00 61.98 58.32 1orw s VAL 507 Cb 0.20 -2.29 0.14 0.00 0.56 0.00 0.00 36.38 34.99 1orw s VAL 507 CO 0.46 -0.16 1.51 -1.10 -0.31 0.00 0.00 175.10 175.49 1orw s GLN 508 N -2.86 4.02 0.51 4.82 -0.21 0.55 -4.92 119.66 121.56 1orw s GLN 508 Ca 0.23 -2.32 -0.20 0.00 0.02 0.00 0.00 55.36 53.09 1orw s GLN 508 Cb -0.08 -5.20 -0.07 0.00 1.00 0.00 0.00 33.01 28.66 1orw s GLN 508 CO 0.12 -1.92 1.09 -1.64 -2.12 0.00 0.00 175.29 170.82 1orw s MET 509 N 2.51 3.57 0.59 2.91 -1.94 -1.26 -4.39 119.30 121.29 1orw s MET 509 Ca 0.45 1.52 -0.05 0.00 -1.71 0.00 0.00 55.69 55.91 1orw s MET 509 Cb -0.01 -2.08 0.02 0.00 2.01 0.00 0.00 34.83 34.77 1orw s MET 509 CO 0.02 -0.65 0.88 -1.25 -0.01 0.00 0.00 175.02 174.01 1orw s PRO 510 N -3.21 2.77 0.04 2.03 0.04 -1.26 -4.42 135.00 130.99 1orw s PRO 510 Ca 0.70 -0.18 0.06 0.00 0.04 0.00 0.00 61.00 61.63 1orw s PRO 510 Cb -0.21 -2.31 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 1orw s PRO 510 CO 0.25 -0.75 -0.15 -1.54 0.04 0.00 0.00 177.00 174.84 1orw s SER 511 N -4.34 4.00 -0.26 6.66 1.04 -0.01 -4.88 113.70 115.90 1orw s SER 511 Ca 0.55 -0.37 -0.07 0.00 0.48 0.00 0.00 55.95 56.54 1orw s SER 511 Cb -0.10 -0.71 -0.02 0.00 0.10 0.00 0.00 66.02 65.29 1orw s SER 511 CO 0.44 0.25 0.06 -0.75 0.98 0.00 0.00 173.24 174.22 1orw s LYS 512 N -1.50 3.46 -0.05 4.02 2.20 -1.26 0.79 119.74 127.39 1orw s LYS 512 Ca 0.16 -0.61 0.03 0.00 -0.36 0.00 0.00 55.97 55.19 1orw s LYS 512 Cb -0.11 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.88 1orw s LYS 512 CO 0.06 -0.27 -0.12 0.21 -0.36 0.00 0.00 175.35 174.88 1orw s LYS 513 N 1.57 2.55 -0.17 4.03 2.20 -0.74 -4.96 119.74 124.21 1orw s LYS 513 Ca 0.05 -0.67 0.00 0.00 -0.36 0.00 0.00 55.97 55.00 1orw s LYS 513 Cb -0.16 -2.43 0.01 0.00 -1.51 0.00 0.00 37.83 33.74 1orw s LYS 513 CO 0.02 0.63 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.97 1orw s LEU 514 N -0.81 2.33 0.00 5.43 1.02 -1.26 -1.51 118.68 123.87 1orw s LEU 514 Ca 0.12 -0.56 0.00 0.00 0.02 0.00 0.00 54.13 53.72 1orw s LEU 514 Cb -0.11 -1.53 0.00 0.00 0.02 0.00 0.00 46.19 44.57 1orw s LEU 514 CO 0.01 0.04 0.00 -0.67 0.02 0.00 0.00 176.35 175.75 1orw n ASP 515 N 4.39 0.57 -3.90 2.29 4.64 -0.64 -4.98 116.55 118.92 1orw n ASP 515 Ca -0.20 0.00 -0.11 0.00 -1.38 0.00 0.00 54.79 53.11 1orw n ASP 515 Cb 0.51 0.00 -0.11 0.00 -1.04 0.00 0.00 41.12 40.48 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 -0.30 0.08 0.13 5.18 1.01 -1.26 -2.20 120.40 123.03 1orw s VAL 516 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1orw s VAL 516 Cb 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 1orw s VAL 516 CO 0.00 -0.37 -0.02 0.27 0.00 0.00 0.00 175.10 174.98 1orw s ILE 517 N -1.22 0.60 -0.10 2.22 -4.36 -0.75 -4.97 121.20 112.62 1orw s ILE 517 Ca -0.13 -1.94 0.01 0.00 -0.26 0.00 0.00 60.65 58.32 1orw s ILE 517 Cb -0.07 -1.88 -0.02 0.00 1.25 0.00 0.00 42.46 41.73 1orw s ILE 517 CO 0.01 -0.68 -0.12 0.20 0.24 0.00 0.00 174.94 174.59 1orw s ASN 518 N -3.09 4.18 -0.02 4.36 -0.87 -1.26 -0.70 114.94 117.54 1orw s ASN 518 Ca 0.18 -0.22 0.00 0.00 -1.57 0.00 0.00 52.86 51.24 1orw s ASN 518 Cb 0.06 -1.30 0.03 0.00 -0.02 0.00 0.00 41.25 40.02 1orw s ASN 518 CO -0.01 0.26 0.03 -0.76 -2.57 0.00 0.00 177.10 174.04 1orw s LEU 519 N -0.18 1.09 -1.65 0.60 1.43 0.97 -4.82 118.68 116.12 1orw s LEU 519 Ca 0.01 0.04 -0.02 0.00 -1.03 0.00 0.00 54.13 53.12 1orw s LEU 519 Cb -0.13 -0.07 0.00 0.00 0.03 0.00 0.00 46.19 46.02 1orw s LEU 519 CO 0.03 -0.13 0.28 1.41 0.23 0.00 0.00 176.35 178.18 1orw n HIS 520 N 4.16 -1.42 -0.88 0.29 8.25 -1.26 -1.09 115.22 123.28 1orw n HIS 520 Ca -0.28 0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1orw n HIS 520 Cb 0.50 -4.17 0.00 0.00 1.12 0.00 0.00 29.99 27.44 1orw n HIS 520 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1orw n GLY 521 N -1.25 0.54 3.65 -1.41 0.00 -1.26 -4.99 105.19 100.46 1orw n GLY 521 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.51 3.76 -0.26 2.61 2.01 -0.25 -5.09 115.64 115.92 1orw s THR 522 Ca 0.00 -1.14 -0.10 0.00 0.31 0.00 0.00 61.69 60.76 1orw s THR 522 Cb 0.00 -2.80 -0.05 0.00 0.01 0.00 0.00 72.50 69.67 1orw s THR 522 CO 0.00 0.09 0.16 -1.59 -0.69 0.00 0.00 174.62 172.58 1orw s LYS 523 N -2.36 3.94 0.04 4.92 -2.85 -1.26 -0.02 119.74 122.15 1orw s LYS 523 Ca 0.24 -0.33 0.07 0.00 -1.00 0.00 0.00 55.97 54.95 1orw s LYS 523 Cb -0.11 -3.55 -0.03 0.00 -2.06 0.00 0.00 37.83 32.07 1orw s LYS 523 CO 0.17 -0.09 -0.17 -0.06 0.10 0.00 0.00 175.35 175.30 1orw s PHE 524 N 1.48 2.60 0.29 1.78 0.40 0.12 -4.94 117.98 119.71 1orw s PHE 524 Ca 0.07 -0.23 -0.16 0.00 -0.60 0.00 0.00 56.93 56.01 1orw s PHE 524 Cb -0.15 -1.48 -0.09 0.00 0.51 0.00 0.00 43.02 41.81 1orw s PHE 524 CO 0.08 0.27 0.72 -1.58 0.70 0.00 0.00 175.22 175.41 1orw s TRP 525 N -0.94 3.44 0.15 0.36 0.52 -1.26 -1.82 118.94 119.40 1orw s TRP 525 Ca 0.15 1.24 -0.03 0.00 0.02 0.00 0.00 56.10 57.48 1orw s TRP 525 Cb -0.11 -2.54 -0.03 0.00 -1.15 0.00 0.00 33.47 29.64 1orw s TRP 525 CO 0.06 0.16 0.14 1.52 0.02 0.00 0.00 176.95 178.85 1orw s TYR 526 N -1.86 0.77 0.01 -1.98 -0.85 -0.94 -2.31 117.35 110.19 1orw s TYR 526 Ca 0.51 -1.12 -0.04 0.00 -0.52 0.00 0.00 57.07 55.90 1orw s TYR 526 Cb -0.12 -0.36 -0.01 0.00 0.38 0.00 0.00 41.96 41.85 1orw s TYR 526 CO 0.18 -0.60 0.07 1.14 -1.52 0.00 0.00 175.55 174.82 1orw s GLN 527 N -4.04 0.39 -0.02 -3.49 -2.07 -0.63 -1.63 119.66 108.16 1orw s GLN 527 Ca 0.24 -0.44 0.02 0.00 -1.82 0.00 0.00 55.36 53.37 1orw s GLN 527 Cb 0.06 0.15 0.00 0.00 -1.09 0.00 0.00 33.01 32.14 1orw s GLN 527 CO 0.03 -0.08 -0.08 -1.64 -1.32 0.00 0.00 175.29 172.20 1orw s MET 528 N -1.30 0.88 -0.35 9.60 -1.94 -0.57 -1.44 119.30 124.18 1orw s MET 528 Ca -0.14 -0.27 -0.17 0.00 -1.71 0.00 0.00 55.69 53.40 1orw s MET 528 Cb -0.08 -0.83 -0.01 0.00 2.01 0.00 0.00 34.83 35.92 1orw s MET 528 CO 0.00 0.10 0.45 0.42 -0.01 0.00 0.00 175.02 175.98 1orw s ILE 529 N 0.21 5.08 -0.14 2.53 -1.09 -0.02 -1.80 121.20 125.98 1orw s ILE 529 Ca -0.03 0.20 -0.10 0.00 -2.23 0.00 0.00 60.65 58.49 1orw s ILE 529 Cb -0.08 -3.90 -0.05 0.00 -1.58 0.00 0.00 42.46 36.85 1orw s ILE 529 CO 0.00 -0.16 0.19 -0.76 -1.23 0.00 0.00 174.94 172.98 1orw s LEU 530 N 2.22 4.32 0.94 2.97 1.43 0.24 -2.73 118.68 128.07 1orw s LEU 530 Ca 0.16 0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 53.61 1orw s LEU 530 Cb -0.16 -2.18 0.12 0.00 0.03 0.00 0.00 46.19 44.00 1orw s LEU 530 CO 0.12 0.28 0.93 -2.65 0.23 0.00 0.00 176.35 175.27 1orw n PRO 531 N 2.68 -0.50 -1.85 1.29 -0.02 -1.26 -0.83 135.00 134.51 1orw n PRO 531 Ca -0.17 -0.09 -0.41 0.00 -2.02 0.00 0.00 63.50 60.82 1orw n PRO 531 Cb 0.53 -2.23 -0.01 0.00 -0.02 0.00 0.00 33.50 31.78 1orw n PRO 531 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1orw s PRO 532 N -4.35 4.15 -1.35 0.52 0.02 -1.26 -2.37 135.00 130.35 1orw s PRO 532 Ca 0.64 2.52 -0.03 0.00 0.02 0.00 0.00 61.00 64.15 1orw s PRO 532 Cb -0.22 -2.99 0.02 0.00 0.02 0.00 0.00 34.50 31.32 1orw s PRO 532 CO 0.61 -0.50 0.77 0.72 -0.33 0.00 0.00 177.00 178.26 1orw n HIS 533 N 0.83 -2.01 -1.51 6.54 8.25 -1.26 -4.60 115.22 121.46 1orw n HIS 533 Ca 0.02 0.86 -0.23 0.00 -0.26 0.00 0.00 57.72 58.11 1orw n HIS 533 Cb 0.39 -4.33 -0.20 0.00 1.12 0.00 0.00 29.99 26.97 1orw n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1orw n PHE 534 N -4.37 0.18 0.00 4.41 7.35 -1.00 -4.82 117.46 119.21 1orw n PHE 534 Ca -0.23 0.03 0.00 0.00 -0.76 0.00 0.00 57.45 56.49 1orw n PHE 534 Cb 0.65 -0.89 0.00 0.00 0.35 0.00 0.00 39.48 39.59 1orw n PHE 534 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1orw n ASP 535 N 7.41 0.00 0.00 -2.13 9.92 -1.26 -4.93 116.55 125.56 1orw n ASP 535 Ca 0.65 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.91 1orw n ASP 535 Cb 0.17 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.65 1orw n ASP 535 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 1orw n LYS 536 N 0.00 0.00 0.00 -1.24 0.00 -1.26 -4.88 118.16 110.78 1orw n LYS 536 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 58.31 58.33 1orw n LYS 536 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 35.03 35.04 1orw n LYS 536 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1orw n SER 537 N 0.00 1.26 -4.70 -5.58 2.88 -1.26 -4.59 113.62 101.62 1orw n SER 537 Ca 0.00 -1.13 -0.32 0.00 -1.33 0.00 0.00 58.87 56.09 1orw n SER 537 Cb 0.00 0.04 0.13 0.00 -0.75 0.00 0.00 64.21 63.63 1orw n SER 537 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1orw s LYS 538 N -0.35 1.58 -0.23 -1.46 2.20 -1.26 -4.44 119.74 115.78 1orw s LYS 538 Ca 0.04 1.56 -0.09 0.00 -0.36 0.00 0.00 55.97 57.12 1orw s LYS 538 Cb 0.03 -1.79 -0.04 0.00 -1.51 0.00 0.00 37.83 34.52 1orw s LYS 538 CO 0.05 -2.22 0.12 0.15 -0.36 0.00 0.00 175.35 173.09 1orw s LYS 539 N -4.44 3.96 0.12 4.03 1.02 -1.26 -4.06 119.74 119.11 1orw s LYS 539 Ca 0.68 -0.33 0.10 0.00 0.02 0.00 0.00 55.97 56.44 1orw s LYS 539 Cb -0.24 -3.42 -0.04 0.00 -0.52 0.00 0.00 37.83 33.61 1orw s LYS 539 CO 0.53 0.06 -0.21 0.71 -0.92 0.00 0.00 175.35 175.52 1orw s TYR 540 N 1.02 2.47 0.44 3.18 1.51 0.18 -4.74 117.35 121.42 1orw s TYR 540 Ca 0.06 -0.30 -0.23 0.00 -1.01 0.00 0.00 57.07 55.59 1orw s TYR 540 Cb -0.14 -1.32 -0.08 0.00 -0.11 0.00 0.00 41.96 40.32 1orw s TYR 540 CO 0.04 0.37 1.09 -1.25 -1.11 0.00 0.00 175.55 174.69 1orw s PRO 541 N -2.11 3.91 -0.01 -1.71 0.04 -1.26 -0.43 135.00 133.42 1orw s PRO 541 Ca 0.17 1.59 0.04 0.00 0.04 0.00 0.00 61.00 62.83 1orw s PRO 541 Cb -0.10 -2.39 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1orw s PRO 541 CO 0.09 -0.38 -0.10 -1.17 0.04 0.00 0.00 177.00 175.48 1orw s LEU 542 N -2.99 2.99 -0.12 -3.56 0.20 -0.49 -1.63 118.68 113.09 1orw s LEU 542 Ca 0.62 -0.18 -0.01 0.00 0.69 0.00 0.00 54.13 55.25 1orw s LEU 542 Cb -0.24 -1.70 0.03 0.00 -0.43 0.00 0.00 46.19 43.86 1orw s LEU 542 CO 0.29 0.30 -0.04 -0.22 -0.29 0.00 0.00 176.35 176.39 1orw s LEU 543 N -1.19 1.10 -0.04 -0.68 2.96 0.01 -0.08 118.68 120.75 1orw s LEU 543 Ca 0.15 -0.36 -0.20 0.00 -0.22 0.00 0.00 54.13 53.49 1orw s LEU 543 Cb -0.11 -0.72 -0.05 0.00 0.50 0.00 0.00 46.19 45.82 1orw s LEU 543 CO 0.05 -0.17 0.59 -0.63 -1.32 0.00 0.00 176.35 174.86 1orw s ILE 544 N 1.78 5.00 -0.25 6.68 -1.09 0.85 -0.47 121.20 133.70 1orw s ILE 544 Ca 0.04 1.21 -0.02 0.00 -2.23 0.00 0.00 60.65 59.65 1orw s ILE 544 Cb -0.13 -3.92 0.02 0.00 -1.58 0.00 0.00 42.46 36.84 1orw s ILE 544 CO -0.07 0.37 -0.05 -0.70 -1.23 0.00 0.00 174.94 173.26 1orw s GLU 545 N 0.14 2.94 0.11 2.79 2.12 0.60 -1.50 118.70 125.90 1orw s GLU 545 Ca 0.31 -0.91 0.09 0.00 0.36 0.00 0.00 54.97 54.82 1orw s GLU 545 Cb -0.17 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.18 1orw s GLU 545 CO 0.16 -0.37 -0.23 0.54 -0.54 0.00 0.00 175.26 174.82 1orw s VAL 546 N 1.36 1.89 0.08 3.70 0.11 -0.12 -4.39 120.40 123.03 1orw s VAL 546 Ca 0.01 -1.61 0.00 0.00 -2.93 0.00 0.00 61.98 57.45 1orw s VAL 546 Cb -0.16 -1.70 0.00 0.00 -1.53 0.00 0.00 36.38 32.99 1orw s VAL 546 CO -0.04 -0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.72 1orw n TYR 547 N 1.04 -0.43 -1.23 1.54 9.36 -1.26 -4.25 117.16 121.92 1orw n TYR 547 Ca -0.19 0.08 -0.09 0.00 3.32 0.00 0.00 57.90 61.02 1orw n TYR 547 Cb 0.53 0.20 -0.04 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 -2.94 -0.14 -0.92 2.98 0.00 -1.26 -3.46 120.51 114.77 1orw n ALA 548 Ca 0.00 0.15 -0.30 0.00 0.00 0.00 0.00 53.44 53.29 1orw n ALA 548 Cb 0.00 -1.68 0.17 0.00 0.00 0.00 0.00 19.45 17.95 1orw n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1orw s GLY 549 N -2.26 1.62 0.36 0.00 0.00 -1.26 -4.76 107.32 101.02 1orw s GLY 549 Ca 0.00 0.08 -0.28 0.00 0.00 0.00 0.00 44.72 44.51 1orw s GLY 549 CO 0.00 0.60 1.44 -1.55 0.00 0.00 0.00 173.10 173.60 1orw n PRO 550 N -4.22 2.53 -1.79 2.90 -0.04 -1.26 -2.24 135.00 130.88 1orw n PRO 550 Ca 0.07 0.89 -0.20 0.00 -0.04 0.00 0.00 63.50 64.22 1orw n PRO 550 Cb 0.54 -2.58 -0.07 0.00 -0.04 0.00 0.00 33.50 31.35 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 -2.61 4.62 -0.28 0.00 1.04 -0.95 -3.80 113.70 111.71 1orw s SER 552 Ca 0.00 0.18 0.02 0.00 0.48 0.00 0.00 55.95 56.62 1orw s SER 552 Cb 0.00 -0.75 0.17 0.00 0.10 0.00 0.00 66.02 65.54 1orw s SER 552 CO 0.00 -1.69 0.45 -1.58 0.98 0.00 0.00 173.24 171.39 1orw s GLN 553 N -5.21 0.44 0.08 4.02 0.74 -1.26 0.33 119.66 118.81 1orw s GLN 553 Ca 0.62 0.32 0.16 0.00 0.05 0.00 0.00 55.36 56.52 1orw s GLN 553 Cb -0.09 -0.18 -0.12 0.00 1.10 0.00 0.00 33.01 33.72 1orw s GLN 553 CO 0.44 -0.95 0.88 0.87 -0.55 0.00 0.00 175.29 175.99 1orw h LYS 554 N 8.13 0.00 -5.53 1.67 1.79 -1.98 -3.45 116.57 117.19 1orw h LYS 554 Ca -0.10 0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.75 1orw h LYS 554 Cb 1.14 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 31.67 1orw h LYS 554 CO 0.25 0.33 0.18 0.08 -1.08 0.00 0.00 179.45 179.20 1orw s VAL 555 N -2.91 4.92 0.37 0.50 1.01 -1.26 -4.97 120.40 118.06 1orw s VAL 555 Ca -0.02 0.90 -0.13 0.00 0.00 0.00 0.00 61.98 62.72 1orw s VAL 555 Cb 0.09 -4.02 0.04 0.00 0.00 0.00 0.00 36.38 32.49 1orw s VAL 555 CO 0.81 -0.15 0.72 1.51 0.00 0.00 0.00 175.10 177.98 1orw s ASP 556 N 1.64 0.18 -0.45 3.32 1.47 -1.26 -4.46 116.67 117.10 1orw s ASP 556 Ca 0.26 -1.18 0.04 0.00 1.18 0.00 0.00 52.55 52.85 1orw s ASP 556 Cb -0.15 0.80 0.59 0.00 -0.34 0.00 0.00 42.92 43.83 1orw s ASP 556 CO 0.12 -1.58 1.83 0.35 0.68 0.00 0.00 175.17 176.56 1orw n THR 557 N -0.53 3.13 -3.27 2.11 -2.24 -1.03 -4.97 114.28 107.48 1orw n THR 557 Ca -0.06 -2.34 -0.38 0.00 -2.27 0.00 0.00 64.05 59.00 1orw n THR 557 Cb 0.60 -0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 68.20 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 -3.59 5.11 0.07 2.28 1.01 -1.26 -0.90 120.40 123.12 1orw s VAL 558 Ca 0.56 1.06 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 1orw s VAL 558 Cb 0.47 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 1orw s VAL 558 CO 0.06 0.35 1.23 0.12 0.00 0.00 0.00 175.10 176.86 1orw s PHE 559 N 0.42 3.40 0.02 5.22 5.36 0.38 -4.90 117.98 127.88 1orw s PHE 559 Ca 0.28 1.24 0.00 0.00 -0.96 0.00 0.00 56.93 57.49 1orw s PHE 559 Cb -0.16 -3.47 -0.02 0.00 -0.34 0.00 0.00 43.02 39.03 1orw s PHE 559 CO 0.13 -1.48 -0.03 1.03 -1.46 0.00 0.00 175.22 173.40 1orw s ARG 560 N 1.04 0.26 -0.51 10.12 0.52 -1.26 -4.90 118.95 124.22 1orw s ARG 560 Ca 0.60 -0.47 0.04 0.00 -0.52 0.00 0.00 55.73 55.38 1orw s ARG 560 Cb -0.31 0.04 0.13 0.00 0.52 0.00 0.00 34.95 35.33 1orw s ARG 560 CO 0.30 -0.03 0.25 -1.17 0.02 0.00 0.00 175.30 174.67 1orw s LEU 561 N -1.10 4.31 0.00 2.53 2.96 -1.26 -4.92 118.68 121.21 1orw s LEU 561 Ca -0.11 -2.99 0.01 0.00 -0.22 0.00 0.00 54.13 50.81 1orw s LEU 561 Cb -0.07 -1.64 -0.00 0.00 0.50 0.00 0.00 46.19 44.98 1orw s LEU 561 CO -0.01 -0.23 0.02 -1.54 -1.32 0.00 0.00 176.35 173.27 1orw n SER 562 N 3.13 2.06 0.25 3.68 3.41 -1.26 -4.99 113.62 119.91 1orw n SER 562 Ca 0.05 -1.85 0.08 0.00 -0.26 0.00 0.00 58.87 56.89 1orw n SER 562 Cb 0.32 0.22 0.63 0.00 -0.26 0.00 0.00 64.21 65.12 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 1.15 0.01 -0.38 7.33 7.01 -1.98 -1.42 115.95 127.68 1orw h TRP 563 Ca -0.15 0.00 -0.07 0.00 2.11 0.00 0.00 58.89 60.78 1orw h TRP 563 Cb 0.48 -0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.53 1orw h TRP 563 CO 0.00 0.02 -0.05 0.00 -2.79 0.00 0.00 178.44 175.61 1orw h ALA 564 N 1.98 0.52 -0.50 2.65 0.00 -1.98 -0.94 119.26 120.99 1orw h ALA 564 Ca 0.00 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 54.72 1orw h ALA 564 Cb 0.02 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 17.58 1orw h ALA 564 CO 0.00 0.35 -0.14 1.15 0.00 0.00 0.00 179.25 180.60 1orw h THR 565 N 0.52 0.47 -0.59 0.00 2.02 -1.62 0.14 112.91 113.85 1orw h THR 565 Ca 0.10 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.21 1orw h THR 565 Cb 0.55 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1orw h THR 565 CO 0.03 0.00 0.08 0.22 0.37 0.00 0.00 175.52 176.22 1orw h TYR 566 N -0.02 1.05 -0.33 3.16 3.20 -1.28 -0.13 116.97 122.62 1orw h TYR 566 Ca 0.24 -0.15 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 1orw h TYR 566 Cb 0.39 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 1orw h TYR 566 CO -0.44 0.91 0.19 -0.07 -1.64 0.00 0.00 178.16 177.11 1orw h LEU 567 N 0.88 0.39 0.00 2.82 3.38 0.43 -1.06 115.31 122.15 1orw h LEU 567 Ca 0.18 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1orw h LEU 567 Cb 0.44 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1orw h LEU 567 CO 0.01 0.31 -0.25 0.00 0.09 0.00 0.00 178.44 178.60 1orw h ALA 568 N 1.76 0.04 -0.22 1.53 0.00 -0.64 0.29 119.26 122.03 1orw h ALA 568 Ca 0.12 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1orw h ALA 568 Cb -0.00 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1orw h ALA 568 CO -0.02 0.16 0.12 1.03 0.00 0.00 0.00 179.25 180.55 1orw h SER 569 N -1.00 0.28 0.07 0.00 0.87 -0.99 -1.69 113.55 111.10 1orw h SER 569 Ca -0.06 -0.08 -0.37 0.00 -1.23 0.00 0.00 61.79 60.05 1orw h SER 569 Cb 0.71 -0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.55 1orw h SER 569 CO -0.03 0.27 -2.24 0.41 -0.53 0.00 0.00 176.83 174.71 1orw n THR 570 N -4.88 1.62 1.11 2.23 -1.04 -0.41 -4.47 114.28 108.44 1orw n THR 570 Ca -0.03 -0.63 0.12 0.00 -2.04 0.00 0.00 64.05 61.47 1orw n THR 570 Cb 0.07 -1.50 0.17 0.00 -1.82 0.00 0.00 70.33 67.24 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 -3.33 1.24 -3.65 -2.82 -0.58 -1.14 -4.98 120.64 105.39 1orw n GLU 571 Ca -0.38 -0.93 -0.21 0.00 -0.42 0.00 0.00 57.16 55.22 1orw n GLU 571 Cb 1.03 -1.48 0.05 0.00 -0.57 0.00 0.00 31.44 30.46 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 -0.06 -1.80 -4.49 1.62 4.13 -0.63 -4.92 115.26 109.10 1orw n ASN 572 Ca 0.11 -0.76 -0.33 0.00 1.68 0.00 0.00 54.58 55.28 1orw n ASN 572 Cb 0.44 -4.33 -0.13 0.00 -1.54 0.00 0.00 39.78 34.22 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 -3.56 3.40 0.08 2.41 1.01 0.03 -4.47 121.20 120.10 1orw s ILE 573 Ca 0.07 -0.57 -0.25 0.00 0.00 0.00 0.00 60.65 59.90 1orw s ILE 573 Cb -0.03 -2.40 -0.06 0.00 0.01 0.00 0.00 42.46 39.98 1orw s ILE 573 CO 0.79 0.56 0.76 -0.63 0.00 0.00 0.00 174.94 176.43 1orw s ILE 574 N -0.35 4.63 -0.26 2.92 1.01 -0.65 -3.57 121.20 124.92 1orw s ILE 574 Ca 0.04 1.63 0.02 0.00 0.00 0.00 0.00 60.65 62.35 1orw s ILE 574 Cb -0.12 -4.11 0.07 0.00 0.01 0.00 0.00 42.46 38.30 1orw s ILE 574 CO 0.02 0.42 -0.06 -0.69 0.00 0.00 0.00 174.94 174.63 1orw s VAL 575 N -0.39 1.91 0.34 2.92 1.01 -1.11 -0.81 120.40 124.27 1orw s VAL 575 Ca 0.37 -1.59 0.07 0.00 0.00 0.00 0.00 61.98 60.84 1orw s VAL 575 Cb -0.21 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 1orw s VAL 575 CO 0.24 -0.16 0.40 0.00 0.00 0.00 0.00 175.10 175.57 1orw s ALA 576 N 1.19 4.08 0.01 5.51 0.00 0.38 -0.84 121.76 132.09 1orw s ALA 576 Ca -0.04 -1.58 -0.16 0.00 0.00 0.00 0.00 51.96 50.18 1orw s ALA 576 Cb -0.19 -1.43 0.03 0.00 0.00 0.00 0.00 23.12 21.53 1orw s ALA 576 CO -0.07 -0.04 0.35 -1.12 0.00 0.00 0.00 175.76 174.89 1orw s SER 577 N -4.11 -0.22 -0.16 0.00 0.01 -0.52 -0.30 113.70 108.40 1orw s SER 577 Ca 0.44 0.04 -0.13 0.00 1.31 0.00 0.00 55.95 57.61 1orw s SER 577 Cb -0.08 0.36 0.04 0.00 0.21 0.00 0.00 66.02 66.56 1orw s SER 577 CO 0.29 -0.54 0.41 0.12 0.41 0.00 0.00 173.24 173.93 1orw s PHE 578 N -1.85 -0.49 -0.47 2.43 5.36 -1.26 -1.61 117.98 120.10 1orw s PHE 578 Ca -0.10 1.15 -0.07 0.00 -0.96 0.00 0.00 56.93 56.95 1orw s PHE 578 Cb -0.03 0.18 0.12 0.00 -0.34 0.00 0.00 43.02 42.95 1orw s PHE 578 CO 0.02 -0.25 0.32 -0.51 -1.46 0.00 0.00 175.22 173.34 1orw s ASP 579 N 0.51 5.59 0.00 6.13 1.01 -0.98 -4.86 116.67 124.07 1orw s ASP 579 Ca -0.02 -1.98 0.00 0.00 0.71 0.00 0.00 52.55 51.25 1orw s ASP 579 Cb -0.04 -1.96 0.00 0.00 1.01 0.00 0.00 42.92 41.92 1orw s ASP 579 CO -0.03 -0.65 0.00 0.61 0.21 0.00 0.00 175.17 175.32 1orw n GLY 580 N 4.78 1.61 3.77 0.21 0.00 -1.26 -4.29 105.19 110.00 1orw n GLY 580 Ca -0.06 -1.72 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 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 3.04 4.22 0.00 1.61 0.52 -1.26 -2.65 118.95 124.42 1orw s ARG 581 Ca 0.00 2.19 0.00 0.00 -0.52 0.00 0.00 55.73 57.40 1orw s ARG 581 Cb 0.00 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.52 1orw s ARG 581 CO 0.00 -0.29 0.00 0.41 0.02 0.00 0.00 175.30 175.44 1orw n GLY 582 N 0.74 2.65 3.24 -3.53 0.00 0.15 -3.80 105.19 104.65 1orw n GLY 582 Ca 0.01 -0.22 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 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 0.19 -2.90 -3.16 1.61 3.41 -1.09 0.24 113.62 111.93 1orw n SER 583 Ca 0.00 -0.41 -0.14 0.00 -0.26 0.00 0.00 58.87 58.06 1orw n SER 583 Cb 0.00 -0.99 -0.02 0.00 -0.26 0.00 0.00 64.21 62.93 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 1.86 3.78 2.69 5.00 0.00 0.15 -3.56 105.19 115.11 1orw n GLY 584 Ca 0.06 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.62 0.00 -0.34 1.61 4.01 -1.26 -4.82 117.16 115.74 1orw n TYR 585 Ca -0.08 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.69 1orw n TYR 585 Cb 0.28 -1.15 0.03 0.00 -0.31 0.00 0.00 39.34 38.19 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 -0.77 2.39 0.00 -0.72 6.02 -1.26 -4.43 117.38 118.62 1orw n GLN 586 Ca 0.00 -1.70 0.00 0.00 -0.01 0.00 0.00 57.00 55.29 1orw n GLN 586 Cb 0.27 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.44 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 -0.69 2.50 0.25 1.08 0.00 -1.26 -4.68 105.19 102.38 1orw n GLY 587 Ca 0.04 -1.79 0.09 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.95 1.61 3.32 -0.59 -2.55 116.42 117.26 1orw h ASP 588 Ca 0.00 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.18 1orw h ASP 588 Cb 0.00 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.46 1orw h ASP 588 CO 0.00 0.11 0.58 0.50 -1.72 0.00 0.00 179.24 178.70 1orw h LYS 589 N 0.00 0.87 0.20 3.56 3.64 -1.87 0.11 116.57 123.08 1orw h LYS 589 Ca -0.00 -0.05 -0.35 0.00 -1.27 0.00 0.00 60.65 58.98 1orw h LYS 589 Cb 0.21 -0.20 0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1orw h LYS 589 CO 0.01 0.57 -1.71 0.82 -2.27 0.00 0.00 179.45 176.87 1orw h ILE 590 N 0.89 0.99 -0.42 2.00 2.04 -1.74 -3.32 117.51 117.95 1orw h ILE 590 Ca 0.48 -2.54 -0.14 0.00 1.00 0.00 0.00 64.86 63.66 1orw h ILE 590 Cb 0.52 2.81 -0.01 0.00 -0.74 0.00 0.00 36.82 39.40 1orw h ILE 590 CO -0.28 0.85 -0.27 -0.03 0.00 0.00 0.00 178.15 178.41 1orw h MET 591 N 0.12 0.91 -0.23 2.37 4.05 -1.06 0.43 114.93 121.51 1orw h MET 591 Ca -0.33 -0.41 0.00 0.00 -0.28 0.00 0.00 59.70 58.68 1orw h MET 591 Cb 2.11 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 32.90 1orw h MET 591 CO 0.20 1.07 0.00 0.72 0.23 0.00 0.00 176.91 179.12 1orw n HIS 592 N -4.09 0.30 0.25 1.39 8.25 0.34 -3.92 115.22 117.74 1orw n HIS 592 Ca -0.01 -0.15 0.09 0.00 -0.26 0.00 0.00 57.72 57.39 1orw n HIS 592 Cb 0.48 0.00 0.63 0.00 1.12 0.00 0.00 29.99 32.22 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 3.63 1.64 -0.66 -1.41 0.00 -1.63 -2.35 119.26 118.48 1orw h ALA 593 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1orw h ALA 593 Cb 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1orw h ALA 593 CO 0.00 0.14 0.00 0.44 0.00 0.00 0.00 179.25 179.83 1orw n ILE 594 N -4.16 0.91 -1.66 0.00 -5.35 -1.25 -4.92 119.36 102.92 1orw n ILE 594 Ca -0.02 -0.95 -0.46 0.00 -0.27 0.00 0.00 62.75 61.04 1orw n ILE 594 Cb 0.19 0.59 -0.04 0.00 -1.74 0.00 0.00 39.64 38.64 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 1.57 2.97 -1.08 7.28 4.05 -0.89 -0.96 115.26 128.19 1orw n ASN 595 Ca 0.23 1.09 -0.14 0.00 0.45 0.00 0.00 54.58 56.21 1orw n ASN 595 Cb 0.61 -1.41 -0.06 0.00 1.23 0.00 0.00 39.78 40.15 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 3.20 -1.39 -2.70 1.20 1.74 0.59 -4.83 116.66 114.47 1orw n ARG 596 Ca 0.16 0.98 -0.05 0.00 -0.77 0.00 0.00 57.85 58.18 1orw n ARG 596 Cb 0.28 -5.27 0.10 0.00 -1.02 0.00 0.00 32.46 26.55 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 -1.77 1.31 -1.70 5.56 1.85 -0.14 -4.88 116.66 116.90 1orw n ARG 597 Ca -0.14 -1.99 -0.39 0.00 -1.00 0.00 0.00 57.85 54.33 1orw n ARG 597 Cb 0.57 -0.22 0.04 0.00 -1.05 0.00 0.00 32.46 31.80 1orw n ARG 597 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1orw n LEU 598 N -0.87 4.78 0.00 2.89 4.77 -1.21 -2.57 117.00 124.79 1orw n LEU 598 Ca -0.06 0.95 0.00 0.00 -0.03 0.00 0.00 56.01 56.87 1orw n LEU 598 Cb 0.85 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1orw n LEU 598 CO -0.04 -0.97 0.00 0.61 -1.33 0.00 0.00 177.39 175.66 1orw n GLY 599 N 0.92 0.55 0.00 -0.72 0.00 -1.26 -4.85 105.19 99.83 1orw n GLY 599 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.00 0.00 -0.06 2.61 -2.24 -1.06 -4.61 114.28 106.91 1orw n THR 600 Ca 0.00 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 1orw n THR 600 Cb 0.00 -0.30 -0.01 0.00 -2.10 0.00 0.00 70.33 67.92 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 -0.09 -0.50 4.78 0.04 -1.92 0.18 116.94 119.43 1orw h PHE 601 Ca 0.00 0.02 0.05 0.00 2.80 0.00 0.00 57.97 60.84 1orw h PHE 601 Cb 0.00 0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.20 1orw h PHE 601 CO 0.00 -0.09 0.33 1.05 -0.60 0.00 0.00 178.31 179.01 1orw h GLU 602 N 0.03 0.46 0.01 1.51 9.09 -1.91 0.56 114.58 124.34 1orw h GLU 602 Ca 0.13 -0.03 -0.00 0.00 0.05 0.00 0.00 59.36 59.51 1orw h GLU 602 Cb 0.18 -0.10 0.00 0.00 -1.65 0.00 0.00 28.75 27.18 1orw h GLU 602 CO -0.25 0.31 -0.01 0.28 0.05 0.00 0.00 179.01 179.39 1orw h VAL 603 N 0.48 1.50 -0.63 -1.06 2.07 -1.66 -3.01 116.25 113.94 1orw h VAL 603 Ca 0.21 -1.65 0.06 0.00 0.82 0.00 0.00 66.70 66.14 1orw h VAL 603 Cb 0.24 2.60 -0.05 0.00 -1.52 0.00 0.00 31.29 32.55 1orw h VAL 603 CO -0.06 0.42 0.34 -0.33 0.02 0.00 0.00 177.57 177.96 1orw h GLU 604 N -0.74 0.61 0.00 1.57 5.08 0.11 -1.49 114.58 119.71 1orw h GLU 604 Ca -0.00 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1orw h GLU 604 Cb 0.70 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1orw h GLU 604 CO 0.00 0.40 -0.20 -0.44 -1.00 0.00 0.00 179.01 177.77 1orw h ASP 605 N 0.62 0.00 -0.12 1.42 3.32 0.00 -1.43 116.42 120.24 1orw h ASP 605 Ca 0.29 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.29 1orw h ASP 605 Cb 0.20 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1orw h ASP 605 CO -0.19 0.20 -0.04 1.56 -1.72 0.00 0.00 179.24 179.05 1orw h GLN 606 N 0.00 0.37 0.00 3.56 1.08 -1.12 -1.96 115.11 117.03 1orw h GLN 606 Ca -0.00 -0.07 -0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1orw h GLN 606 Cb 0.38 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1orw h GLN 606 CO 0.03 0.43 -0.00 0.82 -0.95 0.00 0.00 178.83 179.15 1orw h ILE 607 N 0.35 1.64 -1.01 2.54 2.04 -1.18 -2.62 117.51 119.28 1orw h ILE 607 Ca 0.08 -2.06 0.12 0.00 1.00 0.00 0.00 64.86 63.99 1orw h ILE 607 Cb 0.30 3.01 -0.08 0.00 -0.74 0.00 0.00 36.82 39.30 1orw h ILE 607 CO 0.01 0.52 0.64 -0.08 0.00 0.00 0.00 178.15 179.24 1orw h GLU 608 N -0.91 0.99 -0.16 2.37 4.81 -1.25 0.13 114.58 120.56 1orw h GLU 608 Ca -0.00 -0.06 -0.18 0.00 -0.13 0.00 0.00 59.36 58.99 1orw h GLU 608 Cb 0.86 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 30.03 1orw h GLU 608 CO 0.00 0.65 -0.59 0.00 -0.73 0.00 0.00 179.01 178.34 1orw h ALA 609 N 1.53 0.29 -0.27 2.92 0.00 -1.45 -2.13 119.26 120.15 1orw h ALA 609 Ca 0.49 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1orw h ALA 609 Cb 0.46 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1orw h ALA 609 CO -0.26 0.53 -0.06 1.15 0.00 0.00 0.00 179.25 180.61 1orw h THR 610 N 0.37 1.19 0.08 0.00 2.02 -1.01 0.18 112.91 115.75 1orw h THR 610 Ca -0.03 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.34 1orw h THR 610 Cb 1.22 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 1orw h THR 610 CO 0.12 0.27 -0.10 -0.09 0.37 0.00 0.00 175.52 176.09 1orw h ARG 611 N 0.40 -0.21 -0.42 6.66 2.43 -0.60 0.05 114.38 122.69 1orw h ARG 611 Ca 0.08 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1orw h ARG 611 Cb 0.37 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1orw h ARG 611 CO 0.02 -0.14 0.14 1.96 -1.51 0.00 0.00 179.97 180.44 1orw h GLN 612 N -0.22 0.65 -1.00 0.20 4.20 -0.69 -2.33 115.11 115.92 1orw h GLN 612 Ca 0.01 -0.13 0.23 0.00 0.06 0.00 0.00 58.65 58.82 1orw h GLN 612 Cb 0.22 -0.10 -0.10 0.00 0.30 0.00 0.00 27.48 27.81 1orw h GLN 612 CO -0.05 0.63 0.63 0.74 -0.67 0.00 0.00 178.83 180.11 1orw h PHE 613 N 0.54 0.85 0.00 2.96 0.04 0.00 0.81 116.94 122.14 1orw h PHE 613 Ca 0.14 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.91 1orw h PHE 613 Cb 0.24 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 38.14 1orw h PHE 613 CO 0.01 0.13 -0.14 0.66 -0.60 0.00 0.00 178.31 178.37 1orw h SER 614 N 0.56 0.00 -0.74 2.17 4.64 -0.47 -2.76 113.55 116.95 1orw h SER 614 Ca 0.58 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.90 1orw h SER 614 Cb 1.20 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 1orw h SER 614 CO -0.34 0.14 0.45 0.07 -0.87 0.00 0.00 176.83 176.28 1orw h LYS 615 N 0.00 1.00 -6.81 4.77 2.10 0.97 -3.42 116.57 115.17 1orw h LYS 615 Ca -0.00 -0.09 -0.56 0.00 -2.00 0.00 0.00 60.65 58.00 1orw h LYS 615 Cb 0.71 -0.21 0.12 0.00 -0.90 0.00 0.00 32.23 31.95 1orw h LYS 615 CO 0.02 0.70 0.54 -1.33 -2.00 0.00 0.00 179.45 177.38 1orw n MET 616 N -4.52 2.12 0.04 0.07 2.81 -1.04 -4.91 117.12 111.69 1orw n MET 616 Ca 0.07 0.75 0.08 0.00 -1.81 0.00 0.00 57.70 56.78 1orw n MET 616 Cb 0.05 -2.40 0.34 0.00 -0.71 0.00 0.00 33.22 30.50 1orw n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1orw n GLY 617 N 0.74 -1.03 0.91 3.03 0.00 -1.26 -3.13 105.19 104.45 1orw n GLY 617 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1orw n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1orw n PHE 618 N -1.74 0.33 -3.66 1.61 1.16 -1.26 -4.50 117.46 109.40 1orw n PHE 618 Ca 0.03 -0.16 -0.36 0.00 -1.87 0.00 0.00 57.45 55.08 1orw n PHE 618 Cb 0.17 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 37.95 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 -1.67 5.36 -1.03 1.97 1.01 -1.18 0.51 120.40 125.38 1orw s VAL 619 Ca 0.35 0.24 -0.18 0.00 0.00 0.00 0.00 61.98 62.39 1orw s VAL 619 Cb 0.21 -3.51 0.13 0.00 0.00 0.00 0.00 36.38 33.21 1orw s VAL 619 CO 0.30 0.37 1.26 -0.62 0.00 0.00 0.00 175.10 176.41 1orw s ASP 620 N 0.80 6.74 0.17 3.32 2.15 0.43 -4.74 116.67 125.53 1orw s ASP 620 Ca 0.09 -2.26 0.05 0.00 0.43 0.00 0.00 52.55 50.87 1orw s ASP 620 Cb -0.13 -2.42 0.29 0.00 -0.30 0.00 0.00 42.92 40.36 1orw s ASP 620 CO 0.03 -1.03 0.97 -0.90 -0.17 0.00 0.00 175.17 174.07 1orw n ASP 621 N 6.60 0.14 -0.11 -0.34 5.75 -1.26 0.23 116.55 127.56 1orw n ASP 621 Ca 0.29 0.37 0.14 0.00 -0.01 0.00 0.00 54.79 55.58 1orw n ASP 621 Cb 0.47 -0.32 0.55 0.00 -1.03 0.00 0.00 41.12 40.79 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 -1.62 0.57 -3.23 0.11 5.02 -1.26 -4.42 118.16 113.33 1orw n LYS 622 Ca -0.00 -0.22 -0.25 0.00 -2.02 0.00 0.00 58.31 55.82 1orw n LYS 622 Cb 0.34 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.78 1orw n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1orw n ARG 623 N -1.03 0.61 -4.88 1.97 1.74 0.13 -4.92 116.66 110.29 1orw n ARG 623 Ca 0.13 -3.22 -0.32 0.00 -0.77 0.00 0.00 57.85 53.66 1orw n ARG 623 Cb 0.30 -1.31 -0.17 0.00 -1.02 0.00 0.00 32.46 30.27 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 -0.94 2.11 0.37 0.55 1.01 -1.26 -1.39 121.20 121.64 1orw s ILE 624 Ca 0.35 -0.98 0.06 0.00 0.00 0.00 0.00 60.65 60.08 1orw s ILE 624 Cb 0.14 -1.83 -0.07 0.00 0.01 0.00 0.00 42.46 40.71 1orw s ILE 624 CO -0.13 0.55 0.01 0.00 0.00 0.00 0.00 174.94 175.38 1orw s ALA 625 N 0.62 2.85 0.03 9.38 0.00 0.88 -0.81 121.76 134.70 1orw s ALA 625 Ca -0.12 -2.19 -0.03 0.00 0.00 0.00 0.00 51.96 49.62 1orw s ALA 625 Cb -0.16 0.31 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 1orw s ALA 625 CO 0.03 -0.16 0.04 -1.50 0.00 0.00 0.00 175.76 174.16 1orw s ILE 626 N -2.90 0.13 0.12 0.00 2.07 -1.06 -0.11 121.20 119.45 1orw s ILE 626 Ca 0.35 -1.04 -0.24 0.00 -1.41 0.00 0.00 60.65 58.31 1orw s ILE 626 Cb 0.09 -0.64 0.07 0.00 0.13 0.00 0.00 42.46 42.11 1orw s ILE 626 CO 0.17 -0.57 0.63 -1.66 -1.91 0.00 0.00 174.94 171.60 1orw s TRP 627 N -2.09 -0.54 -0.20 3.50 1.48 -0.56 -1.80 118.94 118.73 1orw s TRP 627 Ca -0.10 0.43 -0.34 0.00 -1.06 0.00 0.00 56.10 55.03 1orw s TRP 627 Cb -0.05 0.54 0.14 0.00 -1.16 0.00 0.00 33.47 32.95 1orw s TRP 627 CO -0.03 -0.80 1.21 0.20 -4.06 0.00 0.00 176.95 173.48 1orw s GLY 628 N -2.53 -0.25 -0.05 3.67 0.00 -1.04 -0.95 107.32 106.17 1orw s GLY 628 Ca -0.00 1.77 0.04 0.00 0.00 0.00 0.00 44.72 46.52 1orw s GLY 628 CO -0.10 0.63 -0.16 0.86 0.00 0.00 0.00 173.10 174.33 1orw s TRP 629 N -2.18 2.65 0.00 1.90 -0.11 -1.26 -1.87 118.94 118.07 1orw s TRP 629 Ca 0.09 -0.25 0.00 0.00 1.22 0.00 0.00 56.10 57.16 1orw s TRP 629 Cb -0.01 -1.63 0.00 0.00 -1.50 0.00 0.00 33.47 30.33 1orw s TRP 629 CO -0.05 0.11 0.00 0.45 -4.62 0.00 0.00 176.95 172.85 1orw n SER 630 N 2.44 0.00 0.26 5.86 2.88 0.68 -1.00 113.62 124.74 1orw n SER 630 Ca -0.17 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.48 1orw n SER 630 Cb 0.52 0.00 0.74 0.00 -0.75 0.00 0.00 64.21 64.72 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 0.00 0.00 0.66 5.03 -1.87 0.71 116.97 121.51 1orw h TYR 631 Ca 0.00 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.20 1orw h TYR 631 Cb 0.00 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.26 1orw h TYR 631 CO 0.00 0.00 -0.52 0.78 -1.32 0.00 0.00 178.16 177.10 1orw h GLY 632 N 0.00 0.00 1.06 1.82 0.00 -1.09 -1.23 103.07 103.63 1orw h GLY 632 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 1orw h GLY 632 CO -0.00 0.00 -0.37 -1.33 0.00 0.00 0.00 176.54 174.84 1orw h GLY 633 N 1.81 0.91 0.94 4.60 0.00 0.50 -0.06 103.07 111.77 1orw h GLY 633 Ca -0.01 -0.95 -0.04 0.00 0.00 0.00 0.00 47.33 46.33 1orw h GLY 633 CO 0.07 0.86 -0.44 -1.82 0.00 0.00 0.00 176.54 175.20 1orw h TYR 634 N 0.62 -1.16 -0.56 5.60 3.20 -0.78 -1.41 116.97 122.48 1orw h TYR 634 Ca 0.05 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 1orw h TYR 634 Cb 0.96 0.40 -0.03 0.00 1.54 0.00 0.00 36.73 39.60 1orw h TYR 634 CO 0.07 -0.69 0.34 0.28 -1.64 0.00 0.00 178.16 176.52 1orw h VAL 635 N -1.18 1.16 -0.40 1.81 2.07 -1.25 0.14 116.25 118.59 1orw h VAL 635 Ca -0.11 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 67.10 1orw h VAL 635 Cb 0.92 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1orw h VAL 635 CO 0.16 0.16 0.20 0.74 0.02 0.00 0.00 177.57 178.85 1orw h THR 636 N 0.77 0.98 -0.13 2.57 2.02 -0.85 0.15 112.91 118.41 1orw h THR 636 Ca 0.20 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.22 1orw h THR 636 Cb -0.04 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1orw h THR 636 CO -0.04 0.07 -0.00 0.28 0.37 0.00 0.00 175.52 176.20 1orw h SER 637 N 0.41 0.22 -0.70 4.18 0.02 -0.07 -1.01 113.55 116.60 1orw h SER 637 Ca 0.17 -0.32 0.07 0.00 -0.84 0.00 0.00 61.79 60.87 1orw h SER 637 Cb 0.08 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 62.50 1orw h SER 637 CO -0.12 0.48 0.38 0.24 -1.14 0.00 0.00 176.83 176.68 1orw h MET 638 N -0.05 0.68 -0.08 3.45 2.86 -0.56 0.56 114.93 121.79 1orw h MET 638 Ca 0.04 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1orw h MET 638 Cb 0.37 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.87 1orw h MET 638 CO 0.01 0.45 0.02 0.28 1.06 0.00 0.00 176.91 178.73 1orw h VAL 639 N 0.70 1.17 0.00 -2.22 2.07 -0.91 -0.49 116.25 116.57 1orw h VAL 639 Ca 0.32 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1orw h VAL 639 Cb 0.22 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1orw h VAL 639 CO -0.20 0.15 -0.06 -0.07 0.02 0.00 0.00 177.57 177.42 1orw h LEU 640 N -0.06 0.00 -0.20 2.57 3.38 -0.51 -0.75 115.31 119.73 1orw h LEU 640 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1orw h LEU 640 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1orw h LEU 640 CO -0.00 0.06 -0.33 0.61 0.09 0.00 0.00 178.44 178.87 1orw n GLY 641 N -1.02 -1.01 0.26 0.83 0.00 0.19 -3.99 105.19 100.45 1orw n GLY 641 Ca -0.02 -0.34 0.17 0.00 0.00 0.00 0.00 46.02 45.83 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 3.31 1.00 -5.42 4.61 0.00 0.46 -3.43 119.26 119.79 1orw h ALA 642 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 1orw h ALA 642 Cb 0.48 0.00 0.14 0.00 0.00 0.00 0.00 17.79 18.41 1orw h ALA 642 CO 0.00 0.00 -0.65 0.41 0.00 0.00 0.00 179.25 179.01 1orw n GLY 643 N -0.01 -0.38 0.13 0.00 0.00 -1.26 -4.88 105.19 98.79 1orw n GLY 643 Ca 0.01 0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1orw n GLY 643 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1orw n SER 644 N -2.75 0.65 0.00 1.61 3.41 -1.26 -4.92 113.62 110.35 1orw n SER 644 Ca -0.08 -0.55 0.00 0.00 -0.26 0.00 0.00 58.87 57.98 1orw n SER 644 Cb 0.59 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1orw n SER 644 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1orw n GLY 645 N 1.36 0.84 0.11 5.00 0.00 -1.26 -4.82 105.19 106.41 1orw n GLY 645 Ca 0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.97 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 1.35 -2.84 1.61 2.07 -1.96 -3.46 116.25 113.03 1orw h VAL 646 Ca 0.00 -2.95 -0.66 0.00 0.82 0.00 0.00 66.70 63.90 1orw h VAL 646 Cb 0.00 2.87 -0.08 0.00 -1.52 0.00 0.00 31.29 32.55 1orw h VAL 646 CO 0.00 0.86 -0.52 -0.36 0.02 0.00 0.00 177.57 177.57 1orw s PHE 647 N -2.64 3.48 -0.13 1.57 0.40 -1.26 -4.59 117.98 114.81 1orw s PHE 647 Ca -0.06 0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 56.64 1orw s PHE 647 Cb 0.07 -1.87 -0.25 0.00 0.51 0.00 0.00 43.02 41.48 1orw s PHE 647 CO 0.87 0.66 0.32 1.17 0.70 0.00 0.00 175.22 178.94 1orw n LYS 648 N 1.72 0.74 -3.84 0.44 4.81 0.01 -4.86 118.16 117.16 1orw n LYS 648 Ca -0.17 0.25 -0.09 0.00 -0.87 0.00 0.00 58.31 57.42 1orw n LYS 648 Cb 0.54 -1.69 -0.04 0.00 0.02 0.00 0.00 35.03 33.85 1orw n LYS 648 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1orw s GLY 650 N -2.92 0.68 -0.15 0.00 0.00 -0.27 -2.56 107.32 102.09 1orw s GLY 650 Ca 0.13 -0.95 -0.06 0.00 0.00 0.00 0.00 44.72 43.84 1orw s GLY 650 CO 0.01 -0.59 0.33 -0.42 0.00 0.00 0.00 173.10 172.43 1orw s ILE 651 N -3.40 -0.39 -0.08 0.90 1.01 -0.74 -2.07 121.20 116.44 1orw s ILE 651 Ca 0.22 0.20 0.03 0.00 0.00 0.00 0.00 60.65 61.10 1orw s ILE 651 Cb -0.02 -0.53 -0.02 0.00 0.01 0.00 0.00 42.46 41.90 1orw s ILE 651 CO 0.12 0.08 -0.16 0.00 0.00 0.00 0.00 174.94 174.99 1orw s ALA 652 N 2.19 2.55 -0.16 9.38 0.00 -0.62 -2.51 121.76 132.58 1orw s ALA 652 Ca -0.03 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 50.98 1orw s ALA 652 Cb -0.11 -0.99 0.02 0.00 0.00 0.00 0.00 23.12 22.03 1orw s ALA 652 CO -0.10 0.42 -0.19 0.08 0.00 0.00 0.00 175.76 175.97 1orw s VAL 653 N -0.23 1.92 -1.41 0.00 1.01 -0.78 -1.27 120.40 119.64 1orw s VAL 653 Ca 0.00 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 1orw s VAL 653 Cb -0.13 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.51 1orw s VAL 653 CO 0.03 0.52 0.36 0.00 0.00 0.00 0.00 175.10 176.01 1orw n ALA 654 N 4.53 -2.10 -1.94 5.51 0.00 0.16 -0.23 120.51 126.45 1orw n ALA 654 Ca -0.20 -0.32 -0.33 0.00 0.00 0.00 0.00 53.44 52.59 1orw n ALA 654 Cb 0.50 -1.61 -0.06 0.00 0.00 0.00 0.00 19.45 18.28 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 -6.76 4.13 0.45 0.00 0.04 -1.26 -2.99 135.00 128.62 1orw s PRO 655 Ca 0.07 0.94 -0.21 0.00 0.04 0.00 0.00 61.00 61.84 1orw s PRO 655 Cb -0.03 -2.27 -0.09 0.00 0.04 0.00 0.00 34.50 32.14 1orw s PRO 655 CO 0.92 0.03 1.01 0.08 0.04 0.00 0.00 177.00 179.08 1orw s VAL 656 N -2.13 3.96 0.00 -0.36 1.01 -1.23 -4.57 120.40 117.08 1orw s VAL 656 Ca 0.59 1.27 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1orw s VAL 656 Cb -0.09 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.74 1orw s VAL 656 CO 0.16 -0.21 0.00 -1.54 0.00 0.00 0.00 175.10 173.50 1orw n SER 657 N -0.70 3.27 -3.52 3.32 3.41 -1.26 -4.11 113.62 114.03 1orw n SER 657 Ca 0.08 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.58 1orw n SER 657 Cb 0.52 0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 64.71 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 -1.64 0.27 0.51 4.33 2.20 -1.26 0.22 119.74 124.38 1orw s LYS 658 Ca 0.00 0.68 0.24 0.00 -0.36 0.00 0.00 55.97 56.53 1orw s LYS 658 Cb 0.00 -0.25 1.31 0.00 -1.51 0.00 0.00 37.83 37.38 1orw s LYS 658 CO 0.00 -0.46 1.70 -1.49 -0.36 0.00 0.00 175.35 174.75 1orw h TRP 659 N 8.22 0.00 0.00 4.03 4.06 -1.88 -0.12 115.95 130.26 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 1.13 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.29 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 -2.54 0.11 0.10 0.49 1.02 -1.26 -2.43 120.64 116.12 1orw n GLU 660 Ca -0.02 0.16 0.12 0.00 -0.02 0.00 0.00 57.16 57.40 1orw n GLU 660 Cb 0.30 -1.64 0.08 0.00 -0.02 0.00 0.00 31.44 30.16 1orw n GLU 660 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1orw h TYR 661 N 0.00 0.00 -3.74 -0.32 0.05 -1.39 -3.32 116.97 108.25 1orw h TYR 661 Ca 0.00 0.00 -0.47 0.00 0.05 0.00 0.00 58.73 58.31 1orw h TYR 661 Cb 0.51 0.00 0.06 0.00 1.01 0.00 0.00 36.73 38.32 1orw h TYR 661 CO 0.00 0.00 0.21 -0.47 -1.05 0.00 0.00 178.16 176.85 1orw s TYR 662 N -3.27 3.17 0.65 4.88 5.04 -1.02 -4.83 117.35 121.97 1orw s TYR 662 Ca 0.03 0.62 -0.16 0.00 -2.44 0.00 0.00 57.07 55.12 1orw s TYR 662 Cb 0.11 -2.88 -0.00 0.00 0.35 0.00 0.00 41.96 39.54 1orw s TYR 662 CO 0.75 -1.00 1.14 0.16 -1.34 0.00 0.00 175.55 175.27 1orw s ASP 663 N -4.36 4.98 0.09 4.32 1.47 -1.26 -0.87 116.67 121.03 1orw s ASP 663 Ca 0.56 2.14 -0.35 0.00 1.18 0.00 0.00 52.55 56.08 1orw s ASP 663 Cb -0.11 -2.57 -0.16 0.00 -0.34 0.00 0.00 42.92 39.74 1orw s ASP 663 CO 0.45 -1.72 1.54 0.77 0.68 0.00 0.00 175.17 176.89 1orw h SER 664 N 0.19 -1.40 -0.56 2.11 4.64 -0.12 -2.31 113.55 116.10 1orw h SER 664 Ca -0.48 0.12 0.11 0.00 -0.47 0.00 0.00 61.79 61.07 1orw h SER 664 Cb 1.26 0.47 -0.11 0.00 -0.31 0.00 0.00 62.40 63.72 1orw h SER 664 CO 0.53 -0.63 -0.24 0.58 -0.87 0.00 0.00 176.83 176.20 1orw h VAL 665 N -0.93 0.28 0.11 0.95 2.07 -1.94 0.43 116.25 117.23 1orw h VAL 665 Ca -0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1orw h VAL 665 Cb 0.83 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1orw h VAL 665 CO -0.11 0.00 -0.05 0.22 0.02 0.00 0.00 177.57 177.65 1orw h TYR 666 N -0.11 -0.14 0.19 1.57 5.03 -1.91 -3.08 116.97 118.52 1orw h TYR 666 Ca 0.25 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.55 1orw h TYR 666 Cb 0.50 0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.83 1orw h TYR 666 CO -0.55 0.34 -0.09 1.15 -1.32 0.00 0.00 178.16 177.69 1orw h THR 667 N -0.74 0.85 -0.03 1.81 2.02 -1.24 -2.75 112.91 112.83 1orw h THR 667 Ca -0.02 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 66.99 1orw h THR 667 Cb 0.55 0.96 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1orw h THR 667 CO 0.03 0.04 0.04 -0.33 0.37 0.00 0.00 175.52 175.67 1orw h GLU 668 N -0.35 0.00 -0.15 6.66 5.08 -0.28 0.14 114.58 125.68 1orw h GLU 668 Ca -0.03 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 1orw h GLU 668 Cb 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1orw h GLU 668 CO 0.04 0.00 -0.34 -0.09 -1.00 0.00 0.00 179.01 177.62 1orw h ARG 669 N 0.00 0.30 0.00 2.33 2.43 -1.39 -1.90 114.38 116.15 1orw h ARG 669 Ca 0.01 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1orw h ARG 669 Cb 0.09 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1orw h ARG 669 CO -0.00 0.61 -1.59 0.66 -1.51 0.00 0.00 179.97 178.14 1orw n TYR 670 N -4.08 0.00 0.00 2.20 4.01 -0.67 -4.66 117.16 113.97 1orw n TYR 670 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1orw n TYR 670 Cb 0.44 -0.31 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 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 -1.98 -0.65 0.00 -0.72 2.81 0.40 0.22 117.12 117.19 1orw n MET 671 Ca -0.04 -0.59 0.00 0.00 -1.81 0.00 0.00 57.70 55.26 1orw n MET 671 Cb 0.38 -1.00 0.00 0.00 -0.71 0.00 0.00 33.22 31.89 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 -0.03 0.53 3.80 3.03 0.00 -0.71 -4.59 105.19 107.20 1orw n GLY 672 Ca 0.00 -0.91 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 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 4.55 0.00 0.99 1.43 -1.26 -4.37 118.68 120.03 1orw s LEU 673 Ca 0.00 1.43 0.00 0.00 -1.03 0.00 0.00 54.13 54.53 1orw s LEU 673 Cb 0.00 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 43.13 1orw s LEU 673 CO 0.00 0.24 1.80 -0.81 0.23 0.00 0.00 176.35 177.81 1orw n PRO 674 N 1.64 0.94 -4.11 1.29 -0.04 -1.26 -1.23 135.00 132.22 1orw n PRO 674 Ca -0.08 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.13 1orw n PRO 674 Cb 0.50 -1.03 -0.06 0.00 -0.04 0.00 0.00 33.50 32.87 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 0.12 4.35 0.52 0.52 -4.23 -1.26 -4.38 115.64 111.27 1orw s THR 675 Ca 0.00 -1.21 0.30 0.00 -1.18 0.00 0.00 61.69 59.59 1orw s THR 675 Cb 0.00 -3.25 0.33 0.00 1.34 0.00 0.00 72.50 70.93 1orw s THR 675 CO 0.00 -0.16 2.18 1.55 -0.54 0.00 0.00 174.62 177.65 1orw h PRO 676 N 2.25 0.00 0.00 3.99 0.13 -1.94 0.35 132.00 136.78 1orw h PRO 676 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1orw h PRO 676 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1orw h PRO 676 CO 0.62 0.05 0.00 0.39 -0.23 0.00 0.00 178.00 178.83 1orw n GLU 677 N -3.71 0.08 0.00 0.86 4.71 -1.26 -4.75 120.64 116.57 1orw n GLU 677 Ca -0.02 0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 1orw n GLU 677 Cb 0.15 -1.60 0.00 0.00 -1.01 0.00 0.00 31.44 28.98 1orw n GLU 677 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1orw n ASP 678 N -1.75 0.00 -0.87 1.62 -0.08 -0.03 -5.03 116.55 110.41 1orw n ASP 678 Ca 0.07 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.36 1orw n ASP 678 Cb 0.37 0.00 0.20 0.00 2.34 0.00 0.00 41.12 44.03 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 2.43 0.04 1.67 4.05 -0.37 -4.74 115.26 118.35 1orw n ASN 679 Ca 0.00 -3.65 0.20 0.00 0.45 0.00 0.00 54.58 51.58 1orw n ASN 679 Cb 0.00 -0.58 0.71 0.00 1.23 0.00 0.00 39.78 41.15 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 0.99 0.00 0.10 1.20 5.85 -1.20 -2.69 115.31 119.56 1orw h LEU 680 Ca 0.12 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1orw h LEU 680 Cb 1.40 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.43 1orw h LEU 680 CO 0.23 0.00 -0.05 0.44 -0.34 0.00 0.00 178.44 178.72 1orw h ASP 681 N 0.00 -0.11 0.85 1.25 3.32 -1.85 -1.68 116.42 118.19 1orw h ASP 681 Ca 0.22 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1orw h ASP 681 Cb 0.93 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1orw h ASP 681 CO -0.00 0.05 0.00 1.88 -1.72 0.00 0.00 179.24 179.45 1orw h TYR 682 N -0.28 0.00 0.16 4.55 -1.99 -1.82 -2.23 116.97 115.36 1orw h TYR 682 Ca -0.01 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 1orw h TYR 682 Cb 0.23 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.96 1orw h TYR 682 CO -0.03 0.00 -0.08 1.88 -0.00 0.00 0.00 178.16 179.94 1orw h TYR 683 N 0.00 -0.20 -0.80 4.88 0.05 -1.34 -3.21 116.97 116.35 1orw h TYR 683 Ca 0.00 -0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.92 1orw h TYR 683 Cb 0.42 0.07 -0.10 0.00 1.01 0.00 0.00 36.73 38.13 1orw h TYR 683 CO 0.00 0.24 0.37 -0.09 -1.05 0.00 0.00 178.16 177.63 1orw h ARG 684 N -0.87 0.51 -0.37 4.88 2.43 -0.75 -2.50 114.38 117.71 1orw h ARG 684 Ca -0.02 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1orw h ARG 684 Cb 0.52 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1orw h ARG 684 CO 0.04 0.34 0.00 0.27 -1.51 0.00 0.00 179.97 179.11 1orw n ASN 685 N -4.94 2.18 -0.42 -3.80 6.94 -0.90 -3.96 115.26 110.36 1orw n ASN 685 Ca 0.16 -1.95 0.06 0.00 -0.02 0.00 0.00 54.58 52.83 1orw n ASN 685 Cb 0.43 -0.25 0.14 0.00 -2.36 0.00 0.00 39.78 37.75 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 0.68 2.83 -4.87 0.53 3.41 -0.94 -5.00 113.62 110.26 1orw n SER 686 Ca 0.15 -2.56 -0.30 0.00 -0.26 0.00 0.00 58.87 55.89 1orw n SER 686 Cb 0.36 -0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 63.97 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 -1.98 4.72 0.25 6.66 -4.23 -1.25 -4.83 115.64 114.99 1orw s THR 687 Ca 0.25 0.77 0.05 0.00 -1.18 0.00 0.00 61.69 61.59 1orw s THR 687 Cb 0.19 -3.78 -0.02 0.00 1.34 0.00 0.00 72.50 70.23 1orw s THR 687 CO 0.07 -0.77 1.60 0.58 -0.54 0.00 0.00 174.62 175.56 1orw h VAL 688 N 0.57 1.37 -0.99 2.29 2.07 -0.57 -3.17 116.25 117.81 1orw h VAL 688 Ca -0.46 -1.86 0.06 0.00 0.82 0.00 0.00 66.70 65.26 1orw h VAL 688 Cb 1.19 1.92 -0.07 0.00 -1.52 0.00 0.00 31.29 32.81 1orw h VAL 688 CO 0.62 0.55 0.64 0.24 0.02 0.00 0.00 177.57 179.64 1orw h MET 689 N 0.18 1.13 0.00 1.57 2.86 -1.93 -0.70 114.93 118.04 1orw h MET 689 Ca 0.00 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1orw h MET 689 Cb 1.03 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 32.44 1orw h MET 689 CO 0.09 0.75 0.24 0.66 1.06 0.00 0.00 176.91 179.70 1orw h SER 690 N 1.16 0.00 -0.28 1.22 4.64 -1.90 -0.04 113.55 118.36 1orw h SER 690 Ca 0.43 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1orw h SER 690 Cb 0.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1orw h SER 690 CO -0.17 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.33 1orw n ARG 691 N -2.65 3.02 -0.37 4.77 1.74 -0.27 -4.78 116.66 118.12 1orw n ARG 691 Ca -0.02 -2.86 -0.00 0.00 -0.77 0.00 0.00 57.85 54.20 1orw n ARG 691 Cb 0.28 -1.87 0.14 0.00 -1.02 0.00 0.00 32.46 29.99 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 1.91 1.30 -0.53 7.54 0.00 -1.05 -2.89 119.26 125.53 1orw h ALA 692 Ca 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 54.97 1orw h ALA 692 Cb 1.47 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1orw h ALA 692 CO 0.24 0.53 0.37 1.49 0.00 0.00 0.00 179.25 181.88 1orw h GLU 693 N 1.24 0.24 0.00 0.00 4.57 -1.86 -1.22 114.58 117.55 1orw h GLU 693 Ca 0.39 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.56 1orw h GLU 693 Cb -0.00 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.53 1orw h GLU 693 CO -0.12 0.16 0.00 0.09 -1.18 0.00 0.00 179.01 177.96 1orw n ASN 694 N -4.45 0.68 0.17 1.04 5.03 -1.09 -3.06 115.26 113.59 1orw n ASN 694 Ca 0.09 0.59 0.13 0.00 0.87 0.00 0.00 54.58 56.26 1orw n ASN 694 Cb 0.43 -0.76 0.61 0.00 -1.02 0.00 0.00 39.78 39.03 1orw n ASN 694 CO 0.00 0.00 0.00 -0.26 -1.83 0.00 0.00 177.26 175.17 1orw h PHE 695 N 0.00 0.00 0.00 3.10 -1.00 -1.33 -1.33 116.94 116.37 1orw h PHE 695 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1orw h PHE 695 Cb 0.61 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.17 1orw h PHE 695 CO 0.00 0.00 0.00 0.87 -1.61 0.00 0.00 178.31 177.57 1orw h LYS 696 N 0.00 0.00 -0.49 1.51 1.57 -1.70 -1.88 116.57 115.57 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 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1orw h LYS 696 CO 0.00 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.92 1orw n GLN 697 N -2.60 2.22 -3.63 3.15 1.13 -0.50 -4.94 117.38 112.21 1orw n GLN 697 Ca -0.01 -1.68 -0.12 0.00 -1.94 0.00 0.00 57.00 53.26 1orw n GLN 697 Cb 0.10 -1.43 -0.05 0.00 0.11 0.00 0.00 30.24 28.98 1orw n GLN 697 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1orw s VAL 698 N -1.47 0.06 -0.24 5.09 -7.23 -0.71 -4.91 120.40 111.00 1orw s VAL 698 Ca 0.31 -0.47 -0.21 0.00 -1.81 0.00 0.00 61.98 59.79 1orw s VAL 698 Cb 0.17 -1.07 -0.02 0.00 0.56 0.00 0.00 36.38 36.02 1orw s VAL 698 CO 0.19 -0.26 0.68 -1.61 -0.31 0.00 0.00 175.10 173.79 1orw s GLU 699 N -3.24 4.16 -0.05 4.82 2.02 -0.76 -4.97 118.70 120.67 1orw s GLU 699 Ca -0.01 0.66 0.05 0.00 0.02 0.00 0.00 54.97 55.70 1orw s GLU 699 Cb 0.01 -3.63 -0.02 0.00 0.10 0.00 0.00 34.13 30.59 1orw s GLU 699 CO -0.08 -0.39 -0.20 -0.47 0.02 0.00 0.00 175.26 174.14 1orw s TYR 700 N 2.42 2.55 -0.21 1.61 5.04 -1.26 -1.11 117.35 126.40 1orw s TYR 700 Ca 0.29 -0.42 0.01 0.00 -2.44 0.00 0.00 57.07 54.51 1orw s TYR 700 Cb -0.16 -1.61 0.05 0.00 0.35 0.00 0.00 41.96 40.59 1orw s TYR 700 CO 0.09 -0.01 -0.08 -1.17 -1.34 0.00 0.00 175.55 173.03 1orw s LEU 701 N -0.45 2.36 -0.17 6.97 0.20 -0.88 -1.02 118.68 125.69 1orw s LEU 701 Ca 0.05 -0.98 -0.04 0.00 0.69 0.00 0.00 54.13 53.86 1orw s LEU 701 Cb -0.12 -1.20 -0.03 0.00 -0.43 0.00 0.00 46.19 44.41 1orw s LEU 701 CO 0.01 -0.18 -0.03 -0.22 -0.29 0.00 0.00 176.35 175.65 1orw s LEU 702 N 1.40 3.24 -0.02 -0.68 2.96 -0.75 -1.60 118.68 123.23 1orw s LEU 702 Ca -0.03 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.75 1orw s LEU 702 Cb -0.17 -1.79 -0.00 0.00 0.50 0.00 0.00 46.19 44.72 1orw s LEU 702 CO -0.07 0.13 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.33 1orw s ILE 703 N 0.62 1.02 -0.01 6.68 1.01 -0.39 -1.47 121.20 128.65 1orw s ILE 703 Ca -0.02 -0.52 -0.15 0.00 0.00 0.00 0.00 60.65 59.96 1orw s ILE 703 Cb -0.14 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.48 1orw s ILE 703 CO 0.02 0.30 0.32 -2.28 0.00 0.00 0.00 174.94 173.30 1orw s HIS 704 N -0.07 -0.19 -0.23 3.97 2.46 -0.83 0.40 115.29 120.81 1orw s HIS 704 Ca 0.01 0.26 -0.14 0.00 0.47 0.00 0.00 55.06 55.66 1orw s HIS 704 Cb -0.07 0.11 -0.04 0.00 -0.13 0.00 0.00 32.58 32.44 1orw s HIS 704 CO 0.00 -0.41 0.32 0.20 -2.47 0.00 0.00 174.74 172.38 1orw s GLY 705 N -1.38 2.02 0.65 1.59 0.00 -1.26 -1.27 107.32 107.67 1orw s GLY 705 Ca -0.13 -0.70 0.41 0.00 0.00 0.00 0.00 44.72 44.30 1orw s GLY 705 CO 0.04 0.71 2.32 -0.91 0.00 0.00 0.00 173.10 175.26 1orw h THR 706 N 5.09 0.12 -0.78 0.90 1.35 -1.43 -0.99 112.91 117.17 1orw h THR 706 Ca -0.36 0.00 -0.39 0.00 -0.55 0.00 0.00 66.41 65.11 1orw h THR 706 Cb 1.16 0.98 -0.23 0.00 -1.73 0.00 0.00 68.15 68.33 1orw h THR 706 CO 0.68 0.00 0.41 0.00 -0.25 0.00 0.00 175.52 176.36 1orw n ALA 707 N -2.13 5.14 -2.27 6.62 0.00 -0.39 -4.70 120.51 122.77 1orw n ALA 707 Ca -0.03 -2.93 -0.42 0.00 0.00 0.00 0.00 53.44 50.06 1orw n ALA 707 Cb 0.10 -1.22 -0.02 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.66 6.11 0.31 0.00 -1.08 -0.38 -4.22 116.67 115.75 1orw s ASP 708 Ca 0.53 0.72 0.25 0.00 -0.52 0.00 0.00 52.55 53.53 1orw s ASP 708 Cb 0.45 -2.54 0.66 0.00 -1.46 0.00 0.00 42.92 40.03 1orw s ASP 708 CO 0.08 -1.64 1.72 -2.24 0.52 0.00 0.00 175.17 173.61 1orw h ASP 709 N 11.55 0.00 0.00 -0.34 2.03 -1.92 -3.29 116.42 124.45 1orw h ASP 709 Ca -0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 1orw h ASP 709 Cb 1.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.62 1orw h ASP 709 CO 1.11 0.00 0.00 -3.20 -1.03 0.00 0.00 179.24 176.12 1orw n ASN 710 N -2.62 0.00 -4.22 4.15 2.85 -1.26 -4.66 115.26 109.50 1orw n ASN 710 Ca 0.05 0.32 -0.42 0.00 -0.11 0.00 0.00 54.58 54.42 1orw n ASN 710 Cb 0.45 -0.47 -0.07 0.00 1.24 0.00 0.00 39.78 40.93 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 -0.95 4.48 0.39 3.44 1.01 -1.26 -4.83 120.40 122.68 1orw s VAL 711 Ca 0.00 -2.14 -0.25 0.00 0.00 0.00 0.00 61.98 59.59 1orw s VAL 711 Cb 0.00 -3.89 -0.12 0.00 0.00 0.00 0.00 36.38 32.37 1orw s VAL 711 CO 0.00 -0.86 0.95 1.41 0.00 0.00 0.00 175.10 176.61 1orw n HIS 712 N 4.46 0.99 -0.16 5.22 8.25 -1.24 -4.69 115.22 128.05 1orw n HIS 712 Ca -0.01 0.60 0.28 0.00 -0.26 0.00 0.00 57.72 58.33 1orw n HIS 712 Cb 0.41 -2.20 0.72 0.00 1.12 0.00 0.00 29.99 30.04 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 1.55 0.00 -0.89 4.41 3.57 -1.79 -0.73 116.94 123.05 1orw h PHE 713 Ca -0.43 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.31 1orw h PHE 713 Cb 1.35 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.93 1orw h PHE 713 CO 0.44 0.00 0.14 0.37 -2.23 0.00 0.00 178.31 177.02 1orw h GLN 714 N 0.00 0.12 -0.42 1.11 4.15 -1.93 -0.22 115.11 117.91 1orw h GLN 714 Ca 0.41 -0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.90 1orw h GLN 714 Cb 1.75 -0.03 -0.07 0.00 0.21 0.00 0.00 27.48 29.35 1orw h GLN 714 CO -0.00 0.08 -0.02 1.96 -1.93 0.00 0.00 178.83 178.91 1orw h GLN 715 N 0.12 0.08 0.00 1.69 1.08 -1.46 0.00 115.11 116.62 1orw h GLN 715 Ca 0.55 -0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.69 1orw h GLN 715 Cb 1.11 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.52 1orw h GLN 715 CO -0.74 0.05 -0.26 0.77 -0.95 0.00 0.00 178.83 177.71 1orw h SER 716 N 0.08 0.00 -0.31 1.46 0.02 -1.26 -2.43 113.55 111.11 1orw h SER 716 Ca 0.21 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.02 1orw h SER 716 Cb 0.30 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 1orw h SER 716 CO -0.37 0.26 -0.34 0.00 -1.14 0.00 0.00 176.83 175.24 1orw h ALA 717 N 1.74 0.46 0.00 3.77 0.00 -0.04 -1.27 119.26 123.93 1orw h ALA 717 Ca -0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 1orw h ALA 717 Cb 0.95 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1orw h ALA 717 CO 0.03 0.53 -0.44 1.96 0.00 0.00 0.00 179.25 181.33 1orw h GLN 718 N 0.55 0.00 -0.05 0.00 1.08 -0.99 -2.76 115.11 112.94 1orw h GLN 718 Ca 0.05 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.19 1orw h GLN 718 Cb 0.93 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.36 1orw h GLN 718 CO 0.08 0.44 -0.20 1.25 -0.95 0.00 0.00 178.83 179.45 1orw h LEU 719 N 0.00 0.25 -1.22 1.46 5.85 -1.22 -2.72 115.31 117.71 1orw h LEU 719 Ca -0.00 -0.64 -0.07 0.00 0.84 0.00 0.00 57.88 58.00 1orw h LEU 719 Cb 0.99 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1orw h LEU 719 CO 0.06 0.86 -0.24 0.77 -0.34 0.00 0.00 178.44 179.54 1orw h SER 720 N -0.33 0.23 -0.19 1.25 4.64 -1.26 -2.54 113.55 115.35 1orw h SER 720 Ca -0.01 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 1orw h SER 720 Cb 0.84 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1orw h SER 720 CO 0.04 0.48 0.09 0.50 -0.87 0.00 0.00 176.83 177.07 1orw h LYS 721 N 0.22 0.28 -0.25 4.77 3.64 -1.53 0.14 116.57 123.84 1orw h LYS 721 Ca 0.04 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1orw h LYS 721 Cb 0.55 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.27 1orw h LYS 721 CO 0.04 0.32 -0.05 0.00 -2.27 0.00 0.00 179.45 177.49 1orw h ALA 722 N 0.94 0.18 -0.57 5.00 0.00 -1.14 0.50 119.26 124.17 1orw h ALA 722 Ca 0.07 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.11 1orw h ALA 722 Cb 0.14 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1orw h ALA 722 CO -0.01 -0.46 0.32 -0.07 0.00 0.00 0.00 179.25 179.03 1orw h LEU 723 N 0.02 0.49 -0.11 0.00 3.38 -1.24 0.25 115.31 118.10 1orw h LEU 723 Ca 0.12 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1orw h LEU 723 Cb 0.18 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1orw h LEU 723 CO -0.25 0.34 0.07 0.58 0.09 0.00 0.00 178.44 179.27 1orw h VAL 724 N 0.62 1.06 -0.58 1.22 2.07 0.08 -0.14 116.25 120.58 1orw h VAL 724 Ca 0.24 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.67 1orw h VAL 724 Cb 0.10 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1orw h VAL 724 CO -0.14 0.06 0.38 0.44 0.02 0.00 0.00 177.57 178.34 1orw h ASP 725 N 0.11 0.44 0.71 0.57 3.32 0.50 -1.11 116.42 120.96 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 0.03 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1orw h ASP 725 CO -0.01 0.28 -0.06 0.00 -1.72 0.00 0.00 179.24 177.74 1orw n ALA 726 N -2.50 2.55 -2.18 3.45 0.00 0.83 -4.93 120.51 117.72 1orw n ALA 726 Ca 0.08 -0.16 -0.06 0.00 0.00 0.00 0.00 53.44 53.30 1orw n ALA 726 Cb 0.28 -1.43 -0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 1.39 0.16 3.70 0.00 0.00 -0.22 -4.93 105.19 105.29 1orw n GLY 727 Ca 0.11 -0.61 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.38 5.30 0.11 1.61 1.01 -0.32 -5.02 120.40 120.70 1orw s VAL 728 Ca 0.02 0.51 -0.19 0.00 0.00 0.00 0.00 61.98 62.32 1orw s VAL 728 Cb -0.01 -3.63 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 1orw s VAL 728 CO 0.02 0.35 0.60 -0.62 0.00 0.00 0.00 175.10 175.46 1orw s ASP 729 N 0.68 7.06 0.36 3.32 2.15 -1.26 -4.56 116.67 124.41 1orw s ASP 729 Ca 0.15 1.29 -0.17 0.00 0.43 0.00 0.00 52.55 54.25 1orw s ASP 729 Cb -0.13 -2.37 0.05 0.00 -0.30 0.00 0.00 42.92 40.16 1orw s ASP 729 CO 0.04 0.22 0.77 0.72 -0.17 0.00 0.00 175.17 176.75 1orw s PHE 730 N -1.21 0.04 0.29 -5.34 -0.71 -1.26 -4.67 117.98 105.10 1orw s PHE 730 Ca 0.33 -0.66 0.11 0.00 -1.04 0.00 0.00 56.93 55.67 1orw s PHE 730 Cb -0.19 0.81 -0.05 0.00 -1.21 0.00 0.00 43.02 42.38 1orw s PHE 730 CO 0.20 -1.48 -0.12 -0.65 -1.34 0.00 0.00 175.22 171.83 1orw s GLN 731 N -2.73 1.90 0.10 1.99 -0.21 -0.18 -5.02 119.66 115.52 1orw s GLN 731 Ca 0.14 -1.68 -0.01 0.00 0.02 0.00 0.00 55.36 53.84 1orw s GLN 731 Cb -0.05 -1.89 -0.04 0.00 1.00 0.00 0.00 33.01 32.02 1orw s GLN 731 CO 0.10 0.31 0.02 0.99 -2.12 0.00 0.00 175.29 174.59 1orw s THR 732 N -2.46 0.21 -0.29 -0.19 2.01 -1.26 -1.81 115.64 111.83 1orw s THR 732 Ca 0.31 -1.88 -0.02 0.00 0.31 0.00 0.00 61.69 60.41 1orw s THR 732 Cb -0.04 -1.85 0.18 0.00 0.01 0.00 0.00 72.50 70.80 1orw s THR 732 CO 0.17 -0.67 0.58 -0.32 -0.69 0.00 0.00 174.62 173.69 1orw s MET 733 N -3.98 0.55 0.03 4.92 0.00 -0.54 -4.91 119.30 115.36 1orw s MET 733 Ca 0.17 1.00 -0.01 0.00 0.00 0.00 0.00 55.69 56.85 1orw s MET 733 Cb 0.07 0.49 -0.04 0.00 0.00 0.00 0.00 34.83 35.35 1orw s MET 733 CO -0.03 -0.60 0.20 1.67 0.00 0.00 0.00 175.02 176.27 1orw s TRP 734 N 2.83 3.53 -0.32 4.11 -2.14 -1.26 -1.97 118.94 123.74 1orw s TRP 734 Ca 0.19 0.31 0.03 0.00 2.66 0.00 0.00 56.10 59.29 1orw s TRP 734 Cb -0.15 -1.80 0.09 0.00 -3.10 0.00 0.00 33.47 28.51 1orw s TRP 734 CO -0.20 0.61 0.03 0.71 -2.66 0.00 0.00 176.95 175.44 1orw s TYR 735 N -1.43 3.24 -0.38 1.66 2.02 -0.40 -4.95 117.35 117.11 1orw s TYR 735 Ca 0.32 -2.61 -0.34 0.00 -0.37 0.00 0.00 57.07 54.07 1orw s TYR 735 Cb -0.13 -2.49 -0.11 0.00 -0.40 0.00 0.00 41.96 38.83 1orw s TYR 735 CO 0.24 -0.91 2.24 2.41 -1.57 0.00 0.00 175.55 177.95 1orw n THR 736 N 4.41 0.17 -0.90 -0.71 -1.04 -1.26 -1.90 114.28 113.04 1orw n THR 736 Ca -0.00 -0.30 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 1orw n THR 736 Cb 0.42 -1.73 0.00 0.00 -1.82 0.00 0.00 70.33 67.20 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 10.49 0.00 -4.79 8.00 8.00 -1.26 -4.95 116.55 132.04 1orw n ASP 737 Ca 0.42 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.56 1orw n ASP 737 Cb 0.26 -0.09 -0.05 0.00 -0.02 0.00 0.00 41.12 41.21 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 -0.03 4.28 0.00 -1.24 0.41 -0.83 -4.53 118.70 116.75 1orw s GLU 738 Ca 0.00 1.35 0.00 0.00 -0.41 0.00 0.00 54.97 55.91 1orw s GLU 738 Cb 0.00 -2.51 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 1orw s GLU 738 CO 0.00 -0.01 0.00 -0.40 -0.49 0.00 0.00 175.26 174.36 1orw n ASP 739 N -0.07 0.00 0.29 -0.19 5.68 -1.26 -1.27 116.55 119.73 1orw n ASP 739 Ca 0.05 0.00 0.14 0.00 -0.50 0.00 0.00 54.79 54.48 1orw n ASP 739 Cb 0.51 0.00 0.87 0.00 -1.14 0.00 0.00 41.12 41.36 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 0.00 0.00 2.11 -0.00 -1.90 -2.61 115.15 112.75 1orw h HIS 740 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 60.24 1orw h HIS 740 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.39 1orw h HIS 740 CO 0.00 0.03 -1.18 0.78 -0.00 0.00 0.00 177.93 177.56 1orw h GLY 741 N 0.20 0.00 -6.21 5.26 0.00 -1.98 -3.47 103.07 96.87 1orw h GLY 741 Ca -0.00 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.89 1orw h GLY 741 CO 0.00 0.00 -0.85 1.39 0.00 0.00 0.00 176.54 177.08 1orw n ILE 742 N -2.92 -4.15 1.08 2.60 5.41 -0.98 -4.87 119.36 115.53 1orw n ILE 742 Ca -0.06 -0.52 0.13 0.00 1.00 0.00 0.00 62.75 63.29 1orw n ILE 742 Cb 0.78 -3.49 0.34 0.00 -0.71 0.00 0.00 39.64 36.56 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 -4.30 3.26 -1.43 -1.39 0.00 -1.26 -3.62 120.51 111.77 1orw n ALA 743 Ca -0.30 -0.32 -0.32 0.00 0.00 0.00 0.00 53.44 52.50 1orw n ALA 743 Cb 0.68 -1.18 0.06 0.00 0.00 0.00 0.00 19.45 19.01 1orw n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1orw s SER 744 N -2.87 4.91 0.13 0.00 1.04 -1.26 -4.79 113.70 110.87 1orw s SER 744 Ca 0.15 1.94 -0.18 0.00 0.48 0.00 0.00 55.95 58.34 1orw s SER 744 Cb 0.18 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.74 1orw s SER 744 CO 0.63 -1.76 1.77 0.78 0.98 0.00 0.00 173.24 175.63 1orw h ASN 745 N -0.34 0.18 -0.51 7.02 -0.26 -1.99 0.11 115.58 119.80 1orw h ASN 745 Ca -0.46 0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.27 1orw h ASN 745 Cb 1.24 -0.02 -0.02 0.00 -1.06 0.00 0.00 38.32 38.46 1orw h ASN 745 CO 0.53 0.14 0.21 0.00 -1.06 0.00 0.00 177.43 177.25 1orw h MET 746 N 0.27 0.76 -0.09 0.81 -0.00 -1.97 -1.40 114.93 113.30 1orw h MET 746 Ca 0.11 -0.13 -0.01 0.00 -0.00 0.00 0.00 59.70 59.66 1orw h MET 746 Cb 0.04 -0.13 -0.00 0.00 -0.00 0.00 0.00 31.60 31.51 1orw h MET 746 CO -0.08 0.66 0.01 0.00 -0.00 0.00 0.00 176.91 177.50 1orw h ALA 747 N 1.06 0.12 -0.48 -3.00 0.00 -1.84 -0.73 119.26 114.38 1orw h ALA 747 Ca 0.17 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.01 1orw h ALA 747 Cb 0.18 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.84 1orw h ALA 747 CO -0.02 -0.22 -0.14 1.25 0.00 0.00 0.00 179.25 180.13 1orw h HIS 748 N -0.11 -0.32 -0.40 0.00 6.17 -0.65 0.11 115.15 119.95 1orw h HIS 748 Ca 0.03 0.05 -0.12 0.00 0.71 0.00 0.00 60.37 61.03 1orw h HIS 748 Cb 0.32 0.22 -0.01 0.00 2.52 0.00 0.00 27.41 30.45 1orw h HIS 748 CO 0.03 -0.23 -0.22 1.96 0.71 0.00 0.00 177.93 180.18 1orw h GLN 749 N -0.03 0.81 0.27 5.26 4.20 -1.16 -3.10 115.11 121.36 1orw h GLN 749 Ca 0.23 -0.33 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1orw h GLN 749 Cb 0.38 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1orw h GLN 749 CO -0.51 0.95 -0.13 1.25 -0.67 0.00 0.00 178.83 179.72 1orw h HIS 750 N 0.70 -0.34 -0.01 2.96 2.76 0.21 -0.85 115.15 120.58 1orw h HIS 750 Ca 0.10 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.28 1orw h HIS 750 Cb 0.74 0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.78 1orw h HIS 750 CO 0.04 -0.14 -0.13 0.97 -1.30 0.00 0.00 177.93 177.38 1orw h ILE 751 N -0.47 0.69 -0.57 6.26 2.10 -0.87 0.69 117.51 125.33 1orw h ILE 751 Ca -0.04 0.00 -0.05 0.00 1.08 0.00 0.00 64.86 65.85 1orw h ILE 751 Cb 0.35 0.69 -0.03 0.00 -1.09 0.00 0.00 36.82 36.74 1orw h ILE 751 CO 0.06 0.00 0.14 1.88 -1.08 0.00 0.00 178.15 179.15 1orw h TYR 752 N -0.21 0.91 -0.25 2.19 0.05 -1.59 1.56 116.97 119.64 1orw h TYR 752 Ca 0.05 -0.09 -0.03 0.00 0.05 0.00 0.00 58.73 58.71 1orw h TYR 752 Cb 0.27 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 1orw h TYR 752 CO -0.19 0.76 0.04 1.15 -1.05 0.00 0.00 178.16 178.87 1orw h THR 753 N 0.85 1.23 -0.69 -2.88 2.02 -0.66 0.19 112.91 112.97 1orw h THR 753 Ca 0.19 -0.79 -0.06 0.00 0.77 0.00 0.00 66.41 66.52 1orw h THR 753 Cb 0.30 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 1orw h THR 753 CO -0.00 0.25 0.21 -0.74 0.37 0.00 0.00 175.52 175.60 1orw h HIS 754 N 0.22 1.11 -0.30 3.16 -0.00 0.13 -2.06 115.15 117.42 1orw h HIS 754 Ca 0.07 -0.12 -0.10 0.00 -0.00 0.00 0.00 60.37 60.22 1orw h HIS 754 Cb 0.34 -0.32 -0.01 0.00 -0.00 0.00 0.00 27.41 27.41 1orw h HIS 754 CO 0.02 0.90 -0.25 0.52 -0.00 0.00 0.00 177.93 179.12 1orw h MET 755 N 1.01 0.59 -0.18 5.26 2.07 0.23 -2.95 114.93 120.96 1orw h MET 755 Ca 0.22 -0.23 -0.00 0.00 -2.07 0.00 0.00 59.70 57.62 1orw h MET 755 Cb 0.31 -0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 30.00 1orw h MET 755 CO -0.01 0.79 0.10 0.77 1.07 0.00 0.00 176.91 179.63 1orw h SER 756 N 0.51 0.21 -0.83 1.22 0.02 -0.11 -1.22 113.55 113.36 1orw h SER 756 Ca 0.07 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1orw h SER 756 Cb 0.70 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.15 1orw h SER 756 CO 0.05 0.21 0.53 0.45 -1.14 0.00 0.00 176.83 176.93 1orw h HIS 757 N 0.20 1.06 0.40 3.45 3.86 -1.36 -1.00 115.15 121.76 1orw h HIS 757 Ca 0.06 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1orw h HIS 757 Cb 0.04 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.16 1orw h HIS 757 CO -0.05 0.68 -0.19 0.35 0.86 0.00 0.00 177.93 179.58 1orw h PHE 758 N 1.13 -0.50 -0.84 2.45 3.57 -1.31 0.52 116.94 121.95 1orw h PHE 758 Ca 0.30 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.86 1orw h PHE 758 Cb -0.10 0.17 -0.06 0.00 2.79 0.00 0.00 35.95 38.75 1orw h PHE 758 CO 0.00 -0.24 0.51 1.25 -2.23 0.00 0.00 178.31 177.60 1orw h LEU 759 N -0.68 0.78 -0.86 0.59 6.46 -1.02 -0.57 115.31 120.01 1orw h LEU 759 Ca -0.06 0.02 -0.10 0.00 -0.12 0.00 0.00 57.88 57.63 1orw h LEU 759 Cb 0.49 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 1orw h LEU 759 CO 0.09 0.49 -0.24 0.11 -0.62 0.00 0.00 178.44 178.27 1orw h LYS 760 N 0.91 0.57 -0.00 1.25 1.57 -1.03 -0.49 116.57 119.35 1orw h LYS 760 Ca 0.38 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1orw h LYS 760 Cb 0.22 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 1orw h LYS 760 CO -0.19 0.77 -0.00 1.96 -0.57 0.00 0.00 179.45 181.42 1orw h GLN 761 N 0.51 0.00 0.00 3.15 1.08 -0.06 0.63 115.11 120.42 1orw h GLN 761 Ca 0.07 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1orw h GLN 761 Cb 0.69 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.12 1orw h GLN 761 CO 0.05 0.36 -0.01 0.00 -0.95 0.00 0.00 178.83 178.28 1orw n PHE 763 N -3.96 0.00 -2.39 0.00 3.01 -0.20 -4.96 117.46 108.95 1orw n PHE 763 Ca -0.03 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.26 1orw n PHE 763 Cb 0.10 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.56 1orw n PHE 763 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1orw n SER 764 N 0.92 -5.12 -4.85 4.37 7.64 0.45 -4.98 113.62 112.04 1orw n SER 764 Ca 0.13 -0.04 -0.37 0.00 1.01 0.00 0.00 58.87 59.60 1orw n SER 764 Cb 0.55 -4.18 -0.06 0.00 -1.01 0.00 0.00 64.21 59.51 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 -5.06 4.42 0.00 -3.43 1.43 0.19 -5.01 118.68 111.23 1orw s LEU 765 Ca 0.03 0.70 0.31 0.00 -1.03 0.00 0.00 54.13 54.14 1orw s LEU 765 Cb -0.01 -2.32 1.74 0.00 0.03 0.00 0.00 46.19 45.62 1orw s LEU 765 CO 0.03 0.36 2.13 -0.81 0.23 0.00 0.00 176.35 178.29