#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tkr n ARG 40 N 0.00 -2.72 -3.08 4.33 1.74 -1.26 -4.57 116.66 111.09 1tkr n ARG 40 Ca 0.00 1.82 -0.20 0.00 -0.77 0.00 0.00 57.85 58.71 1tkr n ARG 40 Cb 0.00 -3.32 0.05 0.00 -1.02 0.00 0.00 32.46 28.18 1tkr n ARG 40 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1tkr s LYS 41 N -2.26 2.33 0.50 5.56 0.00 -1.25 -4.81 119.74 119.82 1tkr s LYS 41 Ca 0.00 -1.64 0.08 0.00 0.00 0.00 0.00 55.97 54.41 1tkr s LYS 41 Cb 0.00 -2.62 0.04 0.00 0.00 0.00 0.00 37.83 35.25 1tkr s LYS 41 CO 0.00 -0.81 0.58 0.95 0.00 0.00 0.00 175.35 176.06 1tkr s THR 42 N -2.65 2.31 -0.87 3.79 -4.23 -1.26 -0.57 115.64 112.15 1tkr s THR 42 Ca 0.60 -1.18 -0.21 0.00 -1.18 0.00 0.00 61.69 59.72 1tkr s THR 42 Cb -0.06 -2.49 0.09 0.00 1.34 0.00 0.00 72.50 71.39 1tkr s THR 42 CO 0.38 0.00 1.16 -0.47 -0.54 0.00 0.00 174.62 175.15 1tkr s TYR 43 N -2.59 2.83 0.95 3.99 5.04 -1.26 -4.85 117.35 121.46 1tkr s TYR 43 Ca 0.52 -0.98 -0.12 0.00 -2.44 0.00 0.00 57.07 54.04 1tkr s TYR 43 Cb -0.05 -4.39 0.16 0.00 0.35 0.00 0.00 41.96 38.03 1tkr s TYR 43 CO 0.32 -1.66 1.10 0.95 -1.34 0.00 0.00 175.55 174.92 1tkr s THR 44 N 3.69 2.29 0.29 4.34 -4.23 -1.26 -4.13 115.64 116.62 1tkr s THR 44 Ca 0.33 0.09 -0.00 0.00 -1.18 0.00 0.00 61.69 60.93 1tkr s THR 44 Cb -0.07 -2.64 0.16 0.00 1.34 0.00 0.00 72.50 71.29 1tkr s THR 44 CO -0.03 -0.12 1.84 0.25 -0.54 0.00 0.00 174.62 176.02 1tkr h LEU 45 N -1.69 0.72 -0.30 4.79 5.85 -1.95 -2.63 115.31 120.10 1tkr h LEU 45 Ca -0.52 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.05 1tkr h LEU 45 Cb 1.31 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 1tkr h LEU 45 CO 0.58 0.72 0.10 0.74 -0.34 0.00 0.00 178.44 180.23 1tkr h THR 46 N 0.74 1.20 -0.65 1.05 2.02 -1.97 -0.29 112.91 115.01 1tkr h THR 46 Ca 0.16 -0.64 0.14 0.00 0.77 0.00 0.00 66.41 66.85 1tkr h THR 46 Cb 0.29 1.05 -0.12 0.00 -1.74 0.00 0.00 68.15 67.64 1tkr h THR 46 CO -0.00 0.21 -0.08 0.44 0.37 0.00 0.00 175.52 176.46 1tkr h ASP 47 N 0.33 -0.45 -0.18 4.18 3.32 -1.84 1.57 116.42 123.35 1tkr h ASP 47 Ca 0.10 0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 1tkr h ASP 47 Cb 0.24 0.35 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1tkr h ASP 47 CO -0.00 -0.18 -0.02 0.22 -1.72 0.00 0.00 179.24 177.54 1tkr h TYR 48 N 0.05 0.36 -0.23 4.55 3.20 -1.27 0.11 116.97 123.75 1tkr h TYR 48 Ca 0.33 -0.07 -0.14 0.00 3.14 0.00 0.00 58.73 61.99 1tkr h TYR 48 Cb 0.54 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1tkr h TYR 48 CO -0.46 0.56 -0.44 -0.07 -1.64 0.00 0.00 178.16 176.12 1tkr h LEU 49 N 0.06 0.59 -0.21 2.82 3.38 0.12 -2.85 115.31 119.22 1tkr h LEU 49 Ca 0.05 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1tkr h LEU 49 Cb 0.43 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1tkr h LEU 49 CO 0.01 0.95 -0.24 0.29 0.09 0.00 0.00 178.44 179.55 1tkr n LYS 50 N -4.01 0.46 -3.63 1.13 4.76 0.53 -4.95 118.16 112.45 1tkr n LYS 50 Ca -0.02 -0.21 -0.21 0.00 -2.87 0.00 0.00 58.31 55.00 1tkr n LYS 50 Cb 0.53 -1.50 0.04 0.00 -1.84 0.00 0.00 35.03 32.27 1tkr n LYS 50 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1tkr n ASN 51 N -1.09 -2.07 0.22 4.39 4.05 0.23 -4.86 115.26 116.14 1tkr n ASN 51 Ca 0.11 -0.80 0.14 0.00 0.45 0.00 0.00 54.58 54.47 1tkr n ASN 51 Cb 0.32 -4.22 0.45 0.00 1.23 0.00 0.00 39.78 37.56 1tkr n ASN 51 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 1tkr h THR 52 N -1.81 0.00 -3.71 -0.44 1.35 -1.41 -3.39 112.91 103.51 1tkr h THR 52 Ca -0.61 -0.66 -0.67 0.00 -0.55 0.00 0.00 66.41 63.92 1tkr h THR 52 Cb 1.35 1.63 -0.37 0.00 -1.73 0.00 0.00 68.15 69.03 1tkr h THR 52 CO 0.54 0.00 -0.71 -0.31 -0.25 0.00 0.00 175.52 174.79 1tkr s TYR 53 N -3.41 3.53 -0.13 4.73 2.02 -1.26 -5.11 117.35 117.72 1tkr s TYR 53 Ca 0.05 -2.54 -0.07 0.00 -0.37 0.00 0.00 57.07 54.14 1tkr s TYR 53 Cb 0.08 -2.60 -0.04 0.00 -0.40 0.00 0.00 41.96 39.00 1tkr s TYR 53 CO 0.58 -0.91 0.12 1.03 -1.57 0.00 0.00 175.55 174.80 1tkr s ARG 54 N 1.05 3.49 -0.48 -0.62 0.52 -1.26 -5.07 118.95 116.58 1tkr s ARG 54 Ca 0.03 -0.18 -0.26 0.00 -0.52 0.00 0.00 55.73 54.80 1tkr s ARG 54 Cb -0.20 -3.17 0.03 0.00 0.52 0.00 0.00 34.95 32.13 1tkr s ARG 54 CO -0.05 0.70 0.95 -0.51 0.02 0.00 0.00 175.30 176.41 1tkr s LEU 55 N -0.81 3.97 0.33 2.53 1.43 -1.26 -4.82 118.68 120.05 1tkr s LEU 55 Ca 0.14 0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 53.04 1tkr s LEU 55 Cb -0.12 -3.18 -0.11 0.00 0.03 0.00 0.00 46.19 42.81 1tkr s LEU 55 CO 0.03 -1.10 1.40 -0.54 0.23 0.00 0.00 176.35 176.37 1tkr s LYS 56 N 3.87 4.24 0.34 1.70 1.02 -1.26 -5.02 119.74 124.64 1tkr s LYS 56 Ca 0.37 2.38 0.02 0.00 0.02 0.00 0.00 55.97 58.76 1tkr s LYS 56 Cb -0.10 -3.04 0.02 0.00 -0.52 0.00 0.00 37.83 34.20 1tkr s LYS 56 CO 0.26 -0.37 0.20 1.28 -0.92 0.00 0.00 175.35 175.80 1tkr n LEU 57 N 0.95 0.00 -2.75 3.17 4.77 -1.26 -4.91 117.00 116.97 1tkr n LEU 57 Ca 0.02 -1.87 -0.07 0.00 -0.03 0.00 0.00 56.01 54.06 1tkr n LEU 57 Cb 0.40 0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.57 1tkr n LEU 57 CO 0.61 -0.42 0.19 0.00 -1.33 0.00 0.00 177.39 176.44 1tkr n TYR 58 N -1.20 -3.37 -2.76 -1.77 4.19 -1.26 -4.96 117.16 106.03 1tkr n TYR 58 Ca -0.04 -1.61 -0.43 0.00 3.31 0.00 0.00 57.90 59.14 1tkr n TYR 58 Cb 0.40 1.53 -0.03 0.00 0.49 0.00 0.00 39.34 41.73 1tkr n TYR 58 CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 1tkr s SER 59 N -0.96 6.86 0.30 2.98 0.01 -1.26 -5.03 113.70 116.59 1tkr s SER 59 Ca 0.31 0.97 0.10 0.00 1.31 0.00 0.00 55.95 58.64 1tkr s SER 59 Cb 0.17 -2.49 -0.06 0.00 0.21 0.00 0.00 66.02 63.85 1tkr s SER 59 CO -0.19 -0.74 -0.14 -1.48 0.41 0.00 0.00 173.24 171.10 1tkr s LEU 60 N 3.30 2.63 -0.21 2.44 0.05 -1.26 -4.43 118.68 121.19 1tkr s LEU 60 Ca 0.40 -1.11 -0.04 0.00 0.05 0.00 0.00 54.13 53.43 1tkr s LEU 60 Cb -0.13 -0.97 0.07 0.00 -2.05 0.00 0.00 46.19 43.11 1tkr s LEU 60 CO 0.12 -0.11 0.09 -0.60 -0.55 0.00 0.00 176.35 175.30 1tkr s ARG 61 N -3.58 0.25 0.20 1.48 3.00 -0.21 -4.92 118.95 115.16 1tkr s ARG 61 Ca 0.30 -0.32 -0.32 0.00 -1.00 0.00 0.00 55.73 54.40 1tkr s ARG 61 Cb -0.01 -1.75 -0.12 0.00 0.00 0.00 0.00 34.95 33.08 1tkr s ARG 61 CO 0.14 -0.76 1.72 -1.58 0.00 0.00 0.00 175.30 174.82 1tkr s TRP 62 N 2.04 2.85 -0.63 5.12 0.52 -1.26 -0.79 118.94 126.78 1tkr s TRP 62 Ca 0.03 0.33 0.16 0.00 0.02 0.00 0.00 56.10 56.65 1tkr s TRP 62 Cb -0.16 -4.12 -0.18 0.00 -1.15 0.00 0.00 33.47 27.85 1tkr s TRP 62 CO -0.16 -4.29 0.62 0.44 0.02 0.00 0.00 176.95 173.58 1tkr n ILE 63 N 4.06 0.00 -2.26 2.03 -5.35 -0.74 -4.91 119.36 112.19 1tkr n ILE 63 Ca 0.16 -0.17 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 1tkr n ILE 63 Cb 0.36 0.86 0.00 0.00 -1.74 0.00 0.00 39.64 39.12 1tkr n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1tkr n SER 64 N -1.48 0.00 -0.43 7.28 3.41 -1.15 -4.99 113.62 116.26 1tkr n SER 64 Ca 0.02 -0.16 0.14 0.00 -0.26 0.00 0.00 58.87 58.61 1tkr n SER 64 Cb 0.27 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 64.69 1tkr n SER 64 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1tkr n ASP 65 N -0.14 1.42 0.00 4.04 2.03 -1.26 -2.12 116.55 120.52 1tkr n ASP 65 Ca 0.00 -1.34 0.00 0.00 0.52 0.00 0.00 54.79 53.97 1tkr n ASP 65 Cb 0.00 0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 1tkr n ASP 65 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1tkr n HIS 66 N -0.02 0.00 -4.19 -0.67 -0.00 -1.26 -4.48 115.22 104.59 1tkr n HIS 66 Ca 0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.76 1tkr n HIS 66 Cb 0.36 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.25 1tkr n HIS 66 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1tkr s GLU 67 N -0.84 0.90 0.04 -0.41 2.02 -1.26 -1.64 118.70 117.52 1tkr s GLU 67 Ca 0.00 -1.31 -0.07 0.00 0.02 0.00 0.00 54.97 53.61 1tkr s GLU 67 Cb 0.00 -0.42 -0.01 0.00 0.10 0.00 0.00 34.13 33.80 1tkr s GLU 67 CO 0.00 0.04 0.13 1.52 0.02 0.00 0.00 175.26 176.97 1tkr s TYR 68 N -3.17 0.17 0.04 1.61 -0.85 -0.87 -1.80 117.35 112.48 1tkr s TYR 68 Ca 0.11 -0.47 -0.04 0.00 -0.52 0.00 0.00 57.07 56.16 1tkr s TYR 68 Cb 0.02 -0.11 -0.05 0.00 0.38 0.00 0.00 41.96 42.20 1tkr s TYR 68 CO -0.02 -0.40 0.25 -0.51 -1.52 0.00 0.00 175.55 173.35 1tkr s LEU 69 N -2.21 4.35 -0.28 -3.49 1.43 0.03 -0.27 118.68 118.23 1tkr s LEU 69 Ca -0.04 0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 53.46 1tkr s LEU 69 Cb -0.00 -2.85 0.10 0.00 0.03 0.00 0.00 46.19 43.47 1tkr s LEU 69 CO -0.05 0.20 0.12 -0.47 0.23 0.00 0.00 176.35 176.38 1tkr s TYR 70 N -1.42 0.45 -0.89 0.29 5.04 -0.70 -1.05 117.35 119.07 1tkr s TYR 70 Ca 0.32 -0.92 -0.25 0.00 -2.44 0.00 0.00 57.07 53.78 1tkr s TYR 70 Cb -0.13 -0.96 -0.06 0.00 0.35 0.00 0.00 41.96 41.15 1tkr s TYR 70 CO 0.21 -0.81 2.02 0.15 -1.34 0.00 0.00 175.55 175.79 1tkr s LYS 71 N 2.05 2.39 0.00 4.97 1.02 -1.26 -2.73 119.74 126.19 1tkr s LYS 71 Ca 0.08 -0.19 0.00 0.00 0.02 0.00 0.00 55.97 55.89 1tkr s LYS 71 Cb -0.16 -5.02 0.00 0.00 -0.52 0.00 0.00 37.83 32.13 1tkr s LYS 71 CO -0.33 -3.58 0.00 1.04 -0.92 0.00 0.00 175.35 171.56 1tkr n GLN 72 N 8.83 0.66 0.00 1.68 6.02 -0.85 -4.94 117.38 128.79 1tkr n GLN 72 Ca 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.40 1tkr n GLN 72 Cb 0.46 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.72 1tkr n GLN 72 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1tkr n GLU 73 N -0.24 0.00 -0.04 -1.09 0.00 -1.26 -4.51 120.64 113.50 1tkr n GLU 73 Ca 0.00 0.52 -0.03 0.00 0.00 0.00 0.00 57.16 57.65 1tkr n GLU 73 Cb 0.00 -1.23 -0.01 0.00 0.00 0.00 0.00 31.44 30.20 1tkr n GLU 73 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1tkr n ASN 74 N -1.61 0.84 -4.89 4.31 3.02 -1.26 -5.03 115.26 110.64 1tkr n ASN 74 Ca 0.00 0.31 -0.29 0.00 -0.03 0.00 0.00 54.58 54.57 1tkr n ASN 74 Cb 0.00 -0.64 0.08 0.00 -0.61 0.00 0.00 39.78 38.61 1tkr n ASN 74 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1tkr s ASN 75 N -4.66 4.70 -0.15 6.41 4.22 -1.25 -4.60 114.94 119.61 1tkr s ASN 75 Ca -0.09 0.89 -0.03 0.00 -2.14 0.00 0.00 52.86 51.49 1tkr s ASN 75 Cb 0.01 -1.47 -0.02 0.00 1.28 0.00 0.00 41.25 41.05 1tkr s ASN 75 CO 0.14 -1.79 -0.07 -0.63 -2.04 0.00 0.00 177.10 172.71 1tkr s ILE 76 N -3.50 3.58 0.37 0.54 1.01 -1.03 -2.00 121.20 120.17 1tkr s ILE 76 Ca 0.61 -0.47 0.08 0.00 0.00 0.00 0.00 60.65 60.87 1tkr s ILE 76 Cb -0.11 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 1tkr s ILE 76 CO 0.50 0.50 0.16 -0.76 0.00 0.00 0.00 174.94 175.34 1tkr s LEU 77 N 0.44 3.20 -0.04 2.97 1.43 -1.10 -0.40 118.68 125.17 1tkr s LEU 77 Ca -0.06 -0.89 0.06 0.00 -1.03 0.00 0.00 54.13 52.21 1tkr s LEU 77 Cb -0.15 -1.63 -0.01 0.00 0.03 0.00 0.00 46.19 44.44 1tkr s LEU 77 CO 0.04 -0.40 -0.21 0.54 0.23 0.00 0.00 176.35 176.54 1tkr s VAL 78 N -2.49 1.74 0.03 -1.59 0.11 -0.35 -1.71 120.40 116.13 1tkr s VAL 78 Ca 0.39 -0.91 0.07 0.00 -2.93 0.00 0.00 61.98 58.60 1tkr s VAL 78 Cb -0.00 -1.47 -0.03 0.00 -1.53 0.00 0.00 36.38 33.35 1tkr s VAL 78 CO 0.23 0.49 -0.18 -0.36 -3.33 0.00 0.00 175.10 171.95 1tkr s PHE 79 N -0.22 2.56 -0.53 1.54 0.08 0.63 -1.87 117.98 120.18 1tkr s PHE 79 Ca 0.00 -0.25 -0.15 0.00 0.12 0.00 0.00 56.93 56.65 1tkr s PHE 79 Cb -0.11 -1.48 0.13 0.00 -0.57 0.00 0.00 43.02 40.98 1tkr s PHE 79 CO 0.02 0.24 0.47 1.21 -0.10 0.00 0.00 175.22 177.06 1tkr s ASN 80 N -1.34 6.12 0.48 1.36 3.84 -0.80 -2.04 114.94 122.56 1tkr s ASN 80 Ca 0.14 -1.79 0.31 0.00 0.21 0.00 0.00 52.86 51.73 1tkr s ASN 80 Cb -0.10 -2.18 1.40 0.00 -0.55 0.00 0.00 41.25 39.81 1tkr s ASN 80 CO 0.05 -0.83 1.74 0.00 -2.79 0.00 0.00 177.10 175.26 1tkr h ALA 81 N 8.82 2.82 0.15 1.71 0.00 -1.63 0.13 119.26 131.26 1tkr h ALA 81 Ca -0.29 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1tkr h ALA 81 Cb 1.10 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1tkr h ALA 81 CO 1.01 -1.26 -0.14 1.49 0.00 0.00 0.00 179.25 180.34 1tkr h GLU 82 N 0.15 -0.31 0.00 0.00 4.57 -1.92 -3.37 114.58 113.69 1tkr h GLU 82 Ca 0.66 0.02 -0.23 0.00 -1.18 0.00 0.00 59.36 58.63 1tkr h GLU 82 Cb 2.22 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 30.84 1tkr h GLU 82 CO -0.19 -0.21 -1.86 0.66 -1.18 0.00 0.00 179.01 176.24 1tkr n TYR 83 N -5.27 0.00 0.00 0.92 4.01 -0.84 -5.03 117.16 110.95 1tkr n TYR 83 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 1tkr n TYR 83 Cb 0.18 -0.61 0.00 0.00 -0.31 0.00 0.00 39.34 38.60 1tkr n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tkr n GLY 84 N 2.38 1.60 3.75 2.72 0.00 0.39 -5.07 105.19 110.95 1tkr n GLY 84 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 1tkr n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tkr s ASN 85 N -1.78 4.79 0.28 1.61 4.22 -1.26 -4.71 114.94 118.09 1tkr s ASN 85 Ca 0.00 2.20 0.03 0.00 -2.14 0.00 0.00 52.86 52.95 1tkr s ASN 85 Cb 0.00 -2.57 -0.04 0.00 1.28 0.00 0.00 41.25 39.92 1tkr s ASN 85 CO 0.00 -1.85 0.20 -0.94 -2.04 0.00 0.00 177.10 172.46 1tkr s SER 86 N -2.19 1.13 0.09 3.54 1.04 -1.26 -1.90 113.70 114.15 1tkr s SER 86 Ca 0.71 -1.58 -0.05 0.00 0.48 0.00 0.00 55.95 55.51 1tkr s SER 86 Cb -0.25 0.45 -0.02 0.00 0.10 0.00 0.00 66.02 66.30 1tkr s SER 86 CO 0.41 -0.94 0.11 -0.44 0.98 0.00 0.00 173.24 173.36 1tkr s SER 87 N -3.30 0.26 0.60 7.02 0.01 -0.78 -4.98 113.70 112.52 1tkr s SER 87 Ca 0.39 -0.85 -0.09 0.00 1.31 0.00 0.00 55.95 56.71 1tkr s SER 87 Cb 0.05 0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.55 1tkr s SER 87 CO 0.20 -0.70 0.96 -0.69 0.41 0.00 0.00 173.24 173.42 1tkr s VAL 88 N -3.91 4.37 0.00 3.43 1.01 -1.26 -1.21 120.40 122.83 1tkr s VAL 88 Ca 0.09 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.57 1tkr s VAL 88 Cb 0.06 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1tkr s VAL 88 CO -0.08 -0.87 0.00 0.33 0.00 0.00 0.00 175.10 174.47 1tkr n PHE 89 N -2.65 0.00 0.00 5.22 -0.00 0.47 -4.73 117.46 115.77 1tkr n PHE 89 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.50 1tkr n PHE 89 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.03 1tkr n PHE 89 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.76 178.23 1tkr n LEU 90 N -1.29 0.00 0.00 -2.13 -0.00 -1.20 -4.99 117.00 107.38 1tkr n LEU 90 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1tkr n LEU 90 Cb 0.16 0.00 0.03 0.00 -0.00 0.00 0.00 43.42 43.61 1tkr n LEU 90 CO 0.00 0.00 0.34 -0.62 -0.00 0.00 0.00 177.39 177.11 1tkr n GLU 91 N 0.00 0.02 0.00 1.47 4.71 -1.26 -2.46 120.64 123.12 1tkr n GLU 91 Ca 0.00 0.13 0.00 0.00 -0.01 0.00 0.00 57.16 57.28 1tkr n GLU 91 Cb 0.00 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 28.93 1tkr n GLU 91 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 1tkr n ASN 92 N -1.14 0.00 0.00 1.62 2.85 -1.26 -3.87 115.26 113.46 1tkr n ASN 92 Ca 0.01 0.00 0.09 0.00 -0.11 0.00 0.00 54.58 54.56 1tkr n ASN 92 Cb 0.01 0.00 0.45 0.00 1.24 0.00 0.00 39.78 41.47 1tkr n ASN 92 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1tkr n SER 93 N 0.65 0.00 0.33 1.20 3.41 -1.26 -2.17 113.62 115.78 1tkr n SER 93 Ca 0.00 0.00 0.22 0.00 -0.26 0.00 0.00 58.87 58.84 1tkr n SER 93 Cb 0.00 -0.27 1.17 0.00 -0.26 0.00 0.00 64.21 64.85 1tkr n SER 93 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1tkr h THR 94 N 0.00 0.00 -0.01 6.66 2.02 -1.93 -1.58 112.91 118.08 1tkr h THR 94 Ca 0.00 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 1tkr h THR 94 Cb 0.16 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1tkr h THR 94 CO 0.00 0.00 -0.32 0.49 0.37 0.00 0.00 175.52 176.06 1tkr n PHE 95 N -3.07 0.03 0.31 3.16 3.72 -0.92 -4.73 117.46 115.96 1tkr n PHE 95 Ca -0.03 -1.33 0.19 0.00 -0.05 0.00 0.00 57.45 56.24 1tkr n PHE 95 Cb 0.09 -0.22 1.02 0.00 -0.94 0.00 0.00 39.48 39.43 1tkr n PHE 95 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1tkr h ASP 96 N 0.67 0.00 -1.21 4.37 3.32 -1.45 -1.57 116.42 120.55 1tkr h ASP 96 Ca 0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 1tkr h ASP 96 Cb 1.02 0.00 -0.42 0.00 0.22 0.00 0.00 39.33 40.15 1tkr h ASP 96 CO 0.01 0.00 -0.89 -1.84 -1.72 0.00 0.00 179.24 174.80 1tkr n GLU 97 N -3.23 2.78 0.12 3.56 0.28 -1.26 -4.70 120.64 118.19 1tkr n GLU 97 Ca -0.02 -4.08 0.05 0.00 -0.16 0.00 0.00 57.16 52.95 1tkr n GLU 97 Cb 0.20 -1.96 0.02 0.00 1.43 0.00 0.00 31.44 31.13 1tkr n GLU 97 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1tkr h PHE 98 N 2.63 0.00 0.00 -1.84 3.57 -1.63 -3.47 116.94 116.19 1tkr h PHE 98 Ca 0.18 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1tkr h PHE 98 Cb 1.10 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.84 1tkr h PHE 98 CO 0.72 0.36 0.00 0.41 -2.23 0.00 0.00 178.31 177.57 1tkr n GLY 99 N 1.24 1.25 3.17 2.40 0.00 -1.26 -5.02 105.19 106.97 1tkr n GLY 99 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1tkr n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1tkr s HIS 100 N -2.47 0.97 -0.02 1.61 3.76 -1.26 -5.13 115.29 112.75 1tkr s HIS 100 Ca 0.00 -0.79 -0.21 0.00 -0.15 0.00 0.00 55.06 53.91 1tkr s HIS 100 Cb 0.00 -0.54 -0.05 0.00 1.11 0.00 0.00 32.58 33.10 1tkr s HIS 100 CO 0.00 -0.07 0.61 0.45 -0.85 0.00 0.00 174.74 174.87 1tkr s SER 101 N -2.79 6.96 -0.21 1.40 0.15 -1.26 -5.04 113.70 112.91 1tkr s SER 101 Ca 0.09 1.15 -0.06 0.00 0.70 0.00 0.00 55.95 57.83 1tkr s SER 101 Cb 0.02 -2.37 -0.03 0.00 -1.71 0.00 0.00 66.02 61.93 1tkr s SER 101 CO -0.02 0.07 0.03 -0.63 1.20 0.00 0.00 173.24 173.88 1tkr s ILE 102 N -0.01 4.22 -2.01 6.45 1.01 -1.26 -4.31 121.20 125.29 1tkr s ILE 102 Ca 0.32 -0.22 0.20 0.00 0.00 0.00 0.00 60.65 60.94 1tkr s ILE 102 Cb -0.18 -2.92 0.04 0.00 0.01 0.00 0.00 42.46 39.42 1tkr s ILE 102 CO 0.17 0.42 1.03 -0.46 0.00 0.00 0.00 174.94 176.09 1tkr n ASN 103 N 4.22 2.10 -3.57 3.58 6.94 -0.62 -4.99 115.26 122.93 1tkr n ASN 103 Ca -0.17 -1.55 -0.16 0.00 -0.02 0.00 0.00 54.58 52.68 1tkr n ASN 103 Cb 0.52 0.33 -0.06 0.00 -2.36 0.00 0.00 39.78 38.20 1tkr n ASN 103 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 1tkr s ASP 104 N -2.05 -0.70 -0.19 0.53 1.01 -1.22 -5.01 116.67 109.04 1tkr s ASP 104 Ca 0.18 1.03 -0.00 0.00 0.71 0.00 0.00 52.55 54.47 1tkr s ASP 104 Cb 0.16 0.94 0.05 0.00 1.01 0.00 0.00 42.92 45.08 1tkr s ASP 104 CO 0.42 -0.45 -0.06 -0.31 0.21 0.00 0.00 175.17 174.98 1tkr s TYR 105 N -0.51 2.00 -0.33 4.23 1.51 -1.26 -0.80 117.35 122.19 1tkr s TYR 105 Ca -0.06 -1.36 -0.04 0.00 -1.01 0.00 0.00 57.07 54.60 1tkr s TYR 105 Cb -0.02 -1.44 0.05 0.00 -0.11 0.00 0.00 41.96 40.43 1tkr s TYR 105 CO 0.06 -0.69 0.06 0.45 -1.11 0.00 0.00 175.55 174.33 1tkr s SER 106 N 1.53 5.13 0.15 2.29 0.15 0.15 -4.91 113.70 118.20 1tkr s SER 106 Ca -0.01 -1.24 -0.28 0.00 0.70 0.00 0.00 55.95 55.11 1tkr s SER 106 Cb -0.16 -1.80 -0.07 0.00 -1.71 0.00 0.00 66.02 62.27 1tkr s SER 106 CO -0.07 -0.31 0.89 -0.63 1.20 0.00 0.00 173.24 174.32 1tkr s ILE 107 N 1.33 4.37 0.59 6.45 1.01 -1.26 0.78 121.20 134.47 1tkr s ILE 107 Ca -0.03 1.95 -0.19 0.00 0.00 0.00 0.00 60.65 62.38 1tkr s ILE 107 Cb -0.20 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 37.97 1tkr s ILE 107 CO 0.01 0.42 1.23 -0.94 0.00 0.00 0.00 174.94 175.65 1tkr s SER 108 N -0.58 5.18 0.29 3.58 1.04 0.42 -4.81 113.70 118.82 1tkr s SER 108 Ca 0.42 2.44 0.19 0.00 0.48 0.00 0.00 55.95 59.47 1tkr s SER 108 Cb -0.24 -2.60 1.02 0.00 0.10 0.00 0.00 66.02 64.30 1tkr s SER 108 CO 0.29 -1.61 1.57 -0.81 0.98 0.00 0.00 173.24 173.66 1tkr n PRO 109 N -1.53 0.12 -0.08 4.02 -0.04 -1.23 -0.90 135.00 135.36 1tkr n PRO 109 Ca 0.13 0.62 -0.12 0.00 -0.04 0.00 0.00 63.50 64.09 1tkr n PRO 109 Cb 0.49 -1.93 0.01 0.00 -0.04 0.00 0.00 33.50 32.02 1tkr n PRO 109 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1tkr h ASP 110 N 0.00 0.88 0.00 3.54 1.82 -1.59 -3.47 116.42 117.61 1tkr h ASP 110 Ca 0.00 -0.42 0.00 0.00 -0.39 0.00 0.00 57.03 56.22 1tkr h ASP 110 Cb 0.06 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 39.82 1tkr h ASP 110 CO 0.00 1.19 0.00 0.61 -1.61 0.00 0.00 179.24 179.43 1tkr n GLY 111 N 0.16 0.74 0.02 -0.78 0.00 -0.08 -4.92 105.19 100.33 1tkr n GLY 111 Ca -0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.08 1tkr n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tkr n GLN 112 N -2.44 0.64 -4.17 1.61 6.02 -1.26 -4.92 117.38 112.86 1tkr n GLN 112 Ca 0.00 -0.17 -0.15 0.00 -0.01 0.00 0.00 57.00 56.67 1tkr n GLN 112 Cb 0.00 -1.48 -0.11 0.00 1.02 0.00 0.00 30.24 29.67 1tkr n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1tkr s PHE 113 N -3.32 1.08 -0.10 1.08 0.08 -1.26 -0.89 117.98 114.65 1tkr s PHE 113 Ca -0.08 -0.60 0.01 0.00 0.12 0.00 0.00 56.93 56.39 1tkr s PHE 113 Cb 0.12 -0.59 0.02 0.00 -0.57 0.00 0.00 43.02 42.00 1tkr s PHE 113 CO 0.83 0.01 -0.11 0.42 -0.10 0.00 0.00 175.22 176.28 1tkr s ILE 114 N -2.10 1.17 -0.37 0.64 1.01 -0.70 -0.43 121.20 120.41 1tkr s ILE 114 Ca 0.03 -0.43 -0.18 0.00 0.00 0.00 0.00 60.65 60.06 1tkr s ILE 114 Cb -0.05 -1.12 0.00 0.00 0.01 0.00 0.00 42.46 41.31 1tkr s ILE 114 CO 0.01 0.38 0.52 -0.22 0.00 0.00 0.00 174.94 175.63 1tkr s LEU 115 N 1.19 4.42 -0.21 2.97 2.96 0.23 -1.15 118.68 129.09 1tkr s LEU 115 Ca -0.04 -0.13 -0.14 0.00 -0.22 0.00 0.00 54.13 53.60 1tkr s LEU 115 Cb -0.14 -2.58 -0.04 0.00 0.50 0.00 0.00 46.19 43.92 1tkr s LEU 115 CO -0.03 -0.53 0.31 -0.76 -1.32 0.00 0.00 176.35 174.02 1tkr s LEU 116 N 2.42 4.15 -0.19 -0.68 1.43 0.18 0.30 118.68 126.29 1tkr s LEU 116 Ca 0.18 0.37 -0.07 0.00 -1.03 0.00 0.00 54.13 53.59 1tkr s LEU 116 Cb -0.15 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 1tkr s LEU 116 CO 0.14 -0.02 0.04 -0.70 0.23 0.00 0.00 176.35 176.05 1tkr s GLU 117 N 1.18 3.88 0.31 1.70 2.12 0.02 -2.33 118.70 125.57 1tkr s GLU 117 Ca 0.15 -0.39 -0.01 0.00 0.36 0.00 0.00 54.97 55.07 1tkr s GLU 117 Cb -0.14 -3.17 -0.01 0.00 0.26 0.00 0.00 34.13 31.06 1tkr s GLU 117 CO 0.06 0.21 0.37 1.52 -0.54 0.00 0.00 175.26 176.88 1tkr s TYR 118 N 0.53 1.17 -1.28 5.30 1.13 -0.90 -1.58 117.35 121.72 1tkr s TYR 118 Ca 0.02 -1.34 -0.01 0.00 -1.41 0.00 0.00 57.07 54.34 1tkr s TYR 118 Cb -0.13 -0.28 0.00 0.00 -1.10 0.00 0.00 41.96 40.45 1tkr s TYR 118 CO 0.01 -0.98 0.81 0.09 -2.51 0.00 0.00 175.55 172.97 1tkr n ASN 119 N -1.16 -1.63 -4.71 -0.18 3.02 -1.26 -0.33 115.26 109.01 1tkr n ASN 119 Ca 0.02 -0.75 -0.42 0.00 -0.03 0.00 0.00 54.58 53.40 1tkr n ASN 119 Cb 0.62 -4.40 -0.03 0.00 -0.61 0.00 0.00 39.78 35.37 1tkr n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1tkr s TYR 120 N -3.56 3.23 -0.22 3.10 5.04 -1.26 -4.03 117.35 119.65 1tkr s TYR 120 Ca 0.03 1.06 -0.03 0.00 -2.44 0.00 0.00 57.07 55.70 1tkr s TYR 120 Cb -0.02 -3.57 0.07 0.00 0.35 0.00 0.00 41.96 38.80 1tkr s TYR 120 CO 0.79 -1.94 0.06 0.08 -1.34 0.00 0.00 175.55 173.20 1tkr s VAL 121 N 1.41 0.43 0.44 3.14 1.01 -0.18 -5.01 120.40 121.64 1tkr s VAL 121 Ca 0.62 -0.66 -0.24 0.00 0.00 0.00 0.00 61.98 61.70 1tkr s VAL 121 Cb -0.32 -1.07 -0.08 0.00 0.00 0.00 0.00 36.38 34.91 1tkr s VAL 121 CO 0.29 -0.35 1.15 -0.75 0.00 0.00 0.00 175.10 175.43 1tkr s LYS 122 N 1.88 3.89 0.00 2.72 2.20 -1.26 -0.88 119.74 128.29 1tkr s LYS 122 Ca 0.02 1.75 0.00 0.00 -0.36 0.00 0.00 55.97 57.38 1tkr s LYS 122 Cb -0.17 -2.49 0.00 0.00 -1.51 0.00 0.00 37.83 33.67 1tkr s LYS 122 CO -0.14 -0.44 0.00 0.94 -0.36 0.00 0.00 175.35 175.35 1tkr n GLN 123 N -0.30 0.00 0.00 4.03 7.27 -0.92 -4.89 117.38 122.57 1tkr n GLN 123 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.13 1tkr n GLN 123 Cb 0.48 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.13 1tkr n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1tkr n TRP 124 N 0.00 0.00 -0.04 3.69 5.03 -1.23 -4.97 117.44 119.92 1tkr n TRP 124 Ca 0.00 0.00 -0.09 0.00 3.03 0.00 0.00 57.50 60.44 1tkr n TRP 124 Cb 0.00 0.00 -0.03 0.00 -1.03 0.00 0.00 31.31 30.25 1tkr n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 1tkr h ARG 125 N 0.00 0.14 0.00 -0.99 9.65 -1.98 -3.37 114.38 117.82 1tkr h ARG 125 Ca 0.00 -0.01 -0.16 0.00 -1.10 0.00 0.00 59.98 58.71 1tkr h ARG 125 Cb 0.00 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.52 1tkr h ARG 125 CO 0.00 0.09 -1.62 0.72 2.80 0.00 0.00 179.97 181.97 1tkr n HIS 126 N -5.06 0.00 -1.06 2.20 8.25 -1.26 -5.06 115.22 113.22 1tkr n HIS 126 Ca -0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.11 1tkr n HIS 126 Cb 0.08 -0.42 0.13 0.00 1.12 0.00 0.00 29.99 30.90 1tkr n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1tkr s SER 127 N -4.87 3.59 0.00 0.41 1.04 -1.26 -4.79 113.70 107.81 1tkr s SER 127 Ca -0.13 2.26 0.00 0.00 0.48 0.00 0.00 55.95 58.56 1tkr s SER 127 Cb 0.04 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.58 1tkr s SER 127 CO 0.27 -2.67 0.00 0.00 0.98 0.00 0.00 173.24 171.82 1tkr n TYR 128 N -3.49 0.00 -4.32 5.02 0.18 -1.26 -2.17 117.16 111.12 1tkr n TYR 128 Ca 0.13 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.64 1tkr n TYR 128 Cb 0.51 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.38 1tkr n TYR 128 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1tkr s THR 129 N -2.00 3.05 0.14 -3.48 -4.23 -0.06 -4.60 115.64 104.46 1tkr s THR 129 Ca 0.00 -1.76 -0.25 0.00 -1.18 0.00 0.00 61.69 58.51 1tkr s THR 129 Cb 0.00 -2.51 0.07 0.00 1.34 0.00 0.00 72.50 71.39 1tkr s THR 129 CO 0.00 -0.14 0.79 0.00 -0.54 0.00 0.00 174.62 174.74 1tkr s ALA 130 N -1.76 -1.59 0.25 3.99 0.00 -0.79 -1.01 121.76 120.84 1tkr s ALA 130 Ca 0.25 0.36 -0.01 0.00 0.00 0.00 0.00 51.96 52.56 1tkr s ALA 130 Cb -0.08 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 1tkr s ALA 130 CO 0.15 -0.88 0.44 -1.12 0.00 0.00 0.00 175.76 174.35 1tkr s SER 131 N -2.77 6.37 0.07 0.00 0.01 0.55 -1.21 113.70 116.72 1tkr s SER 131 Ca 0.07 0.42 0.01 0.00 1.31 0.00 0.00 55.95 57.76 1tkr s SER 131 Cb -0.02 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.15 1tkr s SER 131 CO -0.04 -0.12 -0.05 -0.31 0.41 0.00 0.00 173.24 173.13 1tkr s TYR 132 N -2.00 0.70 -0.05 2.43 1.51 -1.26 -2.12 117.35 116.57 1tkr s TYR 132 Ca 0.39 -0.93 -0.18 0.00 -1.01 0.00 0.00 57.07 55.34 1tkr s TYR 132 Cb -0.10 -0.44 0.03 0.00 -0.11 0.00 0.00 41.96 41.34 1tkr s TYR 132 CO 0.31 -0.24 0.40 -0.51 -1.11 0.00 0.00 175.55 174.39 1tkr s ASP 133 N -2.83 -0.32 -0.08 2.29 1.01 -0.99 -4.55 116.67 111.20 1tkr s ASP 133 Ca 0.07 0.33 0.04 0.00 0.71 0.00 0.00 52.55 53.70 1tkr s ASP 133 Cb 0.05 0.45 -0.01 0.00 1.01 0.00 0.00 42.92 44.41 1tkr s ASP 133 CO -0.06 -0.43 -0.19 -0.63 0.21 0.00 0.00 175.17 174.07 1tkr s ILE 134 N -1.04 2.55 -0.26 0.77 1.01 -1.26 -0.64 121.20 122.32 1tkr s ILE 134 Ca -0.11 -0.88 -0.07 0.00 0.00 0.00 0.00 60.65 59.59 1tkr s ILE 134 Cb -0.04 -1.99 -0.01 0.00 0.01 0.00 0.00 42.46 40.43 1tkr s ILE 134 CO 0.05 0.56 0.07 -0.47 0.00 0.00 0.00 174.94 175.15 1tkr s TYR 135 N -0.15 3.09 -0.43 3.97 5.04 -0.30 -0.56 117.35 128.03 1tkr s TYR 135 Ca -0.03 -0.65 -0.27 0.00 -2.44 0.00 0.00 57.07 53.68 1tkr s TYR 135 Cb -0.14 -2.24 0.02 0.00 0.35 0.00 0.00 41.96 39.96 1tkr s TYR 135 CO 0.04 -0.45 1.03 0.34 -1.34 0.00 0.00 175.55 175.17 1tkr s ASP 136 N 1.57 6.65 0.26 4.32 -1.08 0.40 -1.72 116.67 127.06 1tkr s ASP 136 Ca 0.05 0.49 0.09 0.00 -0.52 0.00 0.00 52.55 52.66 1tkr s ASP 136 Cb -0.16 -2.51 0.31 0.00 -1.46 0.00 0.00 42.92 39.10 1tkr s ASP 136 CO 0.03 -1.07 1.59 -0.07 0.52 0.00 0.00 175.17 176.17 1tkr h LEU 137 N 10.66 0.04 -2.54 -1.34 3.38 -1.30 0.20 115.31 124.41 1tkr h LEU 137 Ca -0.23 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1tkr h LEU 137 Cb 1.07 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1tkr h LEU 137 CO 1.06 0.67 -0.01 0.78 0.09 0.00 0.00 178.44 181.03 1tkr h ASN 138 N 0.03 0.00 0.00 -0.43 2.35 -1.92 -2.41 115.58 113.20 1tkr h ASN 138 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1tkr h ASN 138 Cb 1.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1tkr h ASN 138 CO 0.09 0.01 0.00 2.29 -1.65 0.00 0.00 177.43 178.17 1tkr n LYS 139 N -3.63 0.45 -3.93 0.81 2.85 -1.16 -5.02 118.16 108.53 1tkr n LYS 139 Ca -0.03 -0.72 -0.30 0.00 -1.05 0.00 0.00 58.31 56.20 1tkr n LYS 139 Cb 0.09 -0.87 -0.01 0.00 -0.65 0.00 0.00 35.03 33.60 1tkr n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1tkr n ARG 140 N -0.15 -2.09 -3.77 -1.58 1.74 0.65 -4.97 116.66 106.48 1tkr n ARG 140 Ca 0.00 0.35 -0.13 0.00 -0.77 0.00 0.00 57.85 57.30 1tkr n ARG 140 Cb 0.16 -4.06 -0.09 0.00 -1.02 0.00 0.00 32.46 27.45 1tkr n ARG 140 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1tkr s GLN 141 N -6.59 0.61 0.12 5.56 2.00 -0.76 -4.99 119.66 115.60 1tkr s GLN 141 Ca 0.20 -0.13 -0.30 0.00 -2.00 0.00 0.00 55.36 53.13 1tkr s GLN 141 Cb -0.08 0.27 -0.06 0.00 0.80 0.00 0.00 33.01 33.93 1tkr s GLN 141 CO 0.90 -0.16 1.07 -0.51 -0.50 0.00 0.00 175.29 176.10 1tkr s LEU 142 N -1.12 4.46 0.01 3.68 1.43 -1.26 -0.46 118.68 125.42 1tkr s LEU 142 Ca -0.12 1.95 -0.30 0.00 -1.03 0.00 0.00 54.13 54.63 1tkr s LEU 142 Cb -0.05 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 1tkr s LEU 142 CO 0.03 -0.23 1.16 -0.63 0.23 0.00 0.00 176.35 176.91 1tkr s ILE 143 N 0.21 4.25 -0.10 -0.59 1.01 0.28 -4.90 121.20 121.36 1tkr s ILE 143 Ca 0.51 1.61 0.13 0.00 0.00 0.00 0.00 60.65 62.89 1tkr s ILE 143 Cb -0.27 -4.03 -0.18 0.00 0.01 0.00 0.00 42.46 37.99 1tkr s ILE 143 CO 0.32 0.08 0.12 0.35 0.00 0.00 0.00 174.94 175.81 1tkr n THR 144 N 4.14 0.67 -2.90 2.92 -2.24 -1.26 -4.60 114.28 111.01 1tkr n THR 144 Ca 0.09 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 61.00 1tkr n THR 144 Cb 0.47 -0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 68.21 1tkr n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1tkr s GLU 145 N -2.50 4.49 -1.51 -0.78 1.03 -1.26 -4.17 118.70 114.00 1tkr s GLU 145 Ca -0.06 1.17 -0.07 0.00 0.03 0.00 0.00 54.97 56.04 1tkr s GLU 145 Cb 0.05 -2.90 0.06 0.00 -0.80 0.00 0.00 34.13 30.54 1tkr s GLU 145 CO 0.56 0.36 0.56 0.39 -1.33 0.00 0.00 175.26 175.80 1tkr n GLU 146 N 0.78 -3.33 -1.24 -4.83 -0.58 -1.26 -4.70 120.64 105.47 1tkr n GLU 146 Ca -0.00 0.40 -0.29 0.00 -0.42 0.00 0.00 57.16 56.84 1tkr n GLU 146 Cb 0.50 -4.74 0.14 0.00 -0.57 0.00 0.00 31.44 26.77 1tkr n GLU 146 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1tkr s ARG 147 N -6.70 1.16 0.28 3.49 1.70 -1.26 -4.82 118.95 112.80 1tkr s ARG 147 Ca 0.28 0.73 -0.29 0.00 -0.47 0.00 0.00 55.73 55.98 1tkr s ARG 147 Cb -0.15 -1.80 -0.10 0.00 -0.57 0.00 0.00 34.95 32.33 1tkr s ARG 147 CO 0.90 -2.28 1.24 0.42 -1.08 0.00 0.00 175.30 174.49 1tkr s ILE 148 N -2.97 3.10 0.67 4.99 1.01 -1.26 -4.99 121.20 121.74 1tkr s ILE 148 Ca 0.64 1.05 -0.17 0.00 0.00 0.00 0.00 60.65 62.16 1tkr s ILE 148 Cb -0.18 -3.67 -0.00 0.00 0.01 0.00 0.00 42.46 38.62 1tkr s ILE 148 CO 0.57 0.23 1.16 -2.65 0.00 0.00 0.00 174.94 174.25 1tkr n PRO 149 N 1.36 0.86 -1.61 2.79 -0.02 -1.26 -4.58 135.00 132.55 1tkr n PRO 149 Ca 0.01 0.35 -0.31 0.00 -2.02 0.00 0.00 63.50 61.54 1tkr n PRO 149 Cb 0.43 -2.40 0.06 0.00 -0.02 0.00 0.00 33.50 31.57 1tkr n PRO 149 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1tkr s ASN 150 N -1.48 5.10 -1.38 2.55 0.01 -1.26 -3.60 114.94 114.87 1tkr s ASN 150 Ca 0.79 1.45 -0.03 0.00 -0.71 0.00 0.00 52.86 54.35 1tkr s ASN 150 Cb -0.37 -2.28 0.00 0.00 0.41 0.00 0.00 41.25 39.02 1tkr s ASN 150 CO 0.44 -1.60 0.46 0.59 -1.51 0.00 0.00 177.10 175.48 1tkr n ASN 151 N -3.21 -5.52 -4.76 -1.22 3.02 -1.19 -4.94 115.26 97.43 1tkr n ASN 151 Ca 0.07 -0.22 -0.40 0.00 -0.03 0.00 0.00 54.58 54.00 1tkr n ASN 151 Cb 0.55 -4.38 -0.04 0.00 -0.61 0.00 0.00 39.78 35.30 1tkr n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1tkr s THR 152 N -3.07 3.28 -0.25 3.41 2.01 -0.35 -4.66 115.64 116.01 1tkr s THR 152 Ca 0.23 1.27 0.22 0.00 0.31 0.00 0.00 61.69 63.72 1tkr s THR 152 Cb -0.10 -3.81 0.03 0.00 0.01 0.00 0.00 72.50 68.62 1tkr s THR 152 CO 0.28 0.30 1.10 1.56 -0.69 0.00 0.00 174.62 177.17 1tkr h GLN 153 N 3.80 0.00 -1.40 4.92 4.20 -1.43 -2.11 115.11 123.09 1tkr h GLN 153 Ca -0.47 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.37 1tkr h GLN 153 Cb 1.22 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 28.74 1tkr h GLN 153 CO 0.67 0.04 0.67 -0.46 -0.67 0.00 0.00 178.83 179.08 1tkr s TRP 154 N -3.29 -0.27 -0.08 2.96 -0.11 -1.18 -4.63 118.94 112.34 1tkr s TRP 154 Ca 0.00 0.50 -0.10 0.00 1.22 0.00 0.00 56.10 57.73 1tkr s TRP 154 Cb 0.09 0.46 0.02 0.00 -1.50 0.00 0.00 33.47 32.54 1tkr s TRP 154 CO 0.78 -0.23 0.26 0.08 -4.62 0.00 0.00 176.95 173.21 1tkr s VAL 155 N -0.89 0.01 -0.22 5.86 1.01 -1.26 -1.19 120.40 123.72 1tkr s VAL 155 Ca 0.02 -0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.78 1tkr s VAL 155 Cb -0.01 -0.40 0.08 0.00 0.00 0.00 0.00 36.38 36.05 1tkr s VAL 155 CO -0.03 -0.07 0.52 0.28 0.00 0.00 0.00 175.10 175.81 1tkr s THR 156 N -0.17 -0.30 0.89 3.92 -1.32 -0.73 -5.01 115.64 112.91 1tkr s THR 156 Ca -0.03 0.07 -0.11 0.00 -1.21 0.00 0.00 61.69 60.42 1tkr s THR 156 Cb -0.03 -0.78 0.13 0.00 -1.51 0.00 0.00 72.50 70.30 1tkr s THR 156 CO 0.01 0.03 1.11 0.26 -2.21 0.00 0.00 174.62 173.82 1tkr s TRP 157 N 1.96 2.02 0.87 9.09 0.52 -1.26 -2.52 118.94 129.61 1tkr s TRP 157 Ca -0.07 1.58 -0.12 0.00 0.02 0.00 0.00 56.10 57.51 1tkr s TRP 157 Cb -0.09 -3.20 0.11 0.00 -1.15 0.00 0.00 33.47 29.15 1tkr s TRP 157 CO -0.16 -2.51 1.10 -1.54 0.02 0.00 0.00 176.95 173.86 1tkr s SER 158 N -3.01 3.74 0.38 2.95 1.04 -0.74 -4.88 113.70 113.19 1tkr s SER 158 Ca 0.65 1.36 0.17 0.00 0.48 0.00 0.00 55.95 58.61 1tkr s SER 158 Cb -0.20 -2.05 0.76 0.00 0.10 0.00 0.00 66.02 64.63 1tkr s SER 158 CO 0.58 -2.45 1.79 -0.65 0.98 0.00 0.00 173.24 173.49 1tkr h PRO 159 N -1.42 0.00 0.00 4.02 0.11 -1.82 -3.41 132.00 129.47 1tkr h PRO 159 Ca -0.49 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 1tkr h PRO 159 Cb 1.29 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 1tkr h PRO 159 CO 0.57 0.37 -1.36 1.33 -0.21 0.00 0.00 178.00 178.70 1tkr n VAL 160 N -3.74 0.36 0.00 3.15 0.24 -1.26 -4.81 118.33 112.27 1tkr n VAL 160 Ca -0.01 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1tkr n VAL 160 Cb 0.45 -1.29 0.00 0.00 -1.47 0.00 0.00 33.84 31.53 1tkr n VAL 160 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tkr n GLY 161 N 2.80 0.66 2.15 7.63 0.00 -1.26 -4.01 105.19 113.16 1tkr n GLY 161 Ca -0.12 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 1tkr n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1tkr n HIS 162 N 0.00 -0.25 -1.77 1.61 1.44 -1.26 -2.28 115.22 112.71 1tkr n HIS 162 Ca 0.00 -1.36 -0.29 0.00 -2.01 0.00 0.00 57.72 54.06 1tkr n HIS 162 Cb 0.00 0.47 0.11 0.00 0.12 0.00 0.00 29.99 30.70 1tkr n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1tkr s LYS 163 N -1.10 1.57 -0.06 -1.40 1.02 -1.26 -4.50 119.74 114.00 1tkr s LYS 163 Ca 0.18 0.13 -0.04 0.00 0.02 0.00 0.00 55.97 56.25 1tkr s LYS 163 Cb 0.31 -1.90 0.03 0.00 -0.52 0.00 0.00 37.83 35.74 1tkr s LYS 163 CO -0.08 -1.87 0.16 -0.51 -0.92 0.00 0.00 175.35 172.12 1tkr s LEU 164 N -5.76 1.06 -0.14 3.17 1.43 -0.25 -1.79 118.68 116.40 1tkr s LEU 164 Ca 0.63 0.32 -0.00 0.00 -1.03 0.00 0.00 54.13 54.05 1tkr s LEU 164 Cb -0.12 0.47 0.03 0.00 0.03 0.00 0.00 46.19 46.60 1tkr s LEU 164 CO 0.51 -0.10 -0.09 0.00 0.23 0.00 0.00 176.35 176.89 1tkr s ALA 165 N 0.61 1.59 0.07 4.21 0.00 -1.05 -0.16 121.76 127.04 1tkr s ALA 165 Ca -0.04 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1tkr s ALA 165 Cb -0.06 -1.04 -0.03 0.00 0.00 0.00 0.00 23.12 21.99 1tkr s ALA 165 CO -0.03 -0.52 -0.10 1.52 0.00 0.00 0.00 175.76 176.63 1tkr s TYR 166 N 1.59 0.95 -0.16 0.00 -0.85 -0.47 -1.78 117.35 116.63 1tkr s TYR 166 Ca 0.03 -0.56 -0.04 0.00 -0.52 0.00 0.00 57.07 55.99 1tkr s TYR 166 Cb -0.14 -0.54 -0.02 0.00 0.38 0.00 0.00 41.96 41.64 1tkr s TYR 166 CO -0.09 -0.02 -0.04 0.08 -1.52 0.00 0.00 175.55 173.96 1tkr s VAL 167 N -1.81 3.80 -0.03 -3.49 1.01 -0.33 -0.79 120.40 118.76 1tkr s VAL 167 Ca -0.02 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1tkr s VAL 167 Cb -0.07 -2.67 0.02 0.00 0.00 0.00 0.00 36.38 33.66 1tkr s VAL 167 CO 0.00 0.48 -0.03 0.86 0.00 0.00 0.00 175.10 176.42 1tkr s TRP 168 N 0.53 0.55 -1.41 5.22 -0.00 0.06 -1.25 118.94 122.62 1tkr s TRP 168 Ca -0.03 -0.11 -0.07 0.00 -0.00 0.00 0.00 56.10 55.89 1tkr s TRP 168 Cb -0.14 -0.53 0.04 0.00 -0.00 0.00 0.00 33.47 32.84 1tkr s TRP 168 CO 0.03 -0.15 0.86 0.09 -0.00 0.00 0.00 176.95 177.78 1tkr n ASN 169 N 3.96 -3.10 -0.37 5.86 5.03 -1.26 -1.50 115.26 123.88 1tkr n ASN 169 Ca -0.25 -0.79 -0.05 0.00 0.87 0.00 0.00 54.58 54.36 1tkr n ASN 169 Cb 0.51 -4.03 -0.02 0.00 -1.02 0.00 0.00 39.78 35.23 1tkr n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1tkr n ASN 170 N -2.95 -5.71 -4.48 6.41 5.03 -1.26 -4.38 115.26 107.92 1tkr n ASN 170 Ca -0.13 0.12 -0.27 0.00 0.87 0.00 0.00 54.58 55.17 1tkr n ASN 170 Cb 0.60 -3.63 -0.11 0.00 -1.02 0.00 0.00 39.78 35.63 1tkr n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1tkr s ASP 171 N -2.19 3.74 0.00 6.41 1.01 -0.57 -1.73 116.67 123.35 1tkr s ASP 171 Ca 0.00 -0.77 -0.10 0.00 0.71 0.00 0.00 52.55 52.38 1tkr s ASP 171 Cb 0.00 -0.43 -0.05 0.00 1.01 0.00 0.00 42.92 43.45 1tkr s ASP 171 CO 0.00 0.11 0.33 -0.63 0.21 0.00 0.00 175.17 175.19 1tkr s ILE 172 N -1.73 5.19 0.04 0.77 1.01 -1.26 -0.76 121.20 124.44 1tkr s ILE 172 Ca 0.23 0.48 0.02 0.00 0.00 0.00 0.00 60.65 61.38 1tkr s ILE 172 Cb -0.08 -3.61 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 1tkr s ILE 172 CO 0.12 0.46 -0.07 -0.31 0.00 0.00 0.00 174.94 175.14 1tkr s TYR 173 N -1.21 0.63 -0.04 3.97 1.51 0.03 -0.90 117.35 121.34 1tkr s TYR 173 Ca 0.26 -0.47 0.02 0.00 -1.01 0.00 0.00 57.07 55.86 1tkr s TYR 173 Cb -0.14 -0.38 0.01 0.00 -0.11 0.00 0.00 41.96 41.34 1tkr s TYR 173 CO 0.14 -0.08 -0.06 0.08 -1.11 0.00 0.00 175.55 174.51 1tkr s VAL 174 N -1.29 0.63 -0.18 0.71 1.01 -0.11 -1.37 120.40 119.80 1tkr s VAL 174 Ca -0.09 -0.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 1tkr s VAL 174 Cb -0.09 -0.61 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 1tkr s VAL 174 CO 0.00 0.23 -0.09 -0.54 0.00 0.00 0.00 175.10 174.70 1tkr s LYS 175 N 0.59 3.35 0.22 2.72 1.02 0.78 -0.18 119.74 128.25 1tkr s LYS 175 Ca -0.09 -0.66 0.12 0.00 0.02 0.00 0.00 55.97 55.36 1tkr s LYS 175 Cb -0.12 -2.82 -0.01 0.00 -0.52 0.00 0.00 37.83 34.36 1tkr s LYS 175 CO 0.01 -0.03 1.40 0.82 -0.92 0.00 0.00 175.35 176.62 1tkr h ILE 176 N 5.60 1.18 -3.59 2.17 2.04 -1.85 -0.64 117.51 122.41 1tkr h ILE 176 Ca -0.36 -2.63 -0.28 0.00 1.00 0.00 0.00 64.86 62.58 1tkr h ILE 176 Cb 1.18 2.56 -0.32 0.00 -0.74 0.00 0.00 36.82 39.50 1tkr h ILE 176 CO 0.59 0.67 -0.73 -1.61 0.00 0.00 0.00 178.15 177.07 1tkr s GLU 177 N -2.90 0.01 0.37 2.37 0.41 -1.26 -4.51 118.70 113.19 1tkr s GLU 177 Ca 0.03 0.11 0.20 0.00 -0.41 0.00 0.00 54.97 54.90 1tkr s GLU 177 Cb 0.09 -0.19 1.33 0.00 -1.78 0.00 0.00 34.13 33.57 1tkr s GLU 177 CO 0.77 -0.11 1.58 -1.35 -0.49 0.00 0.00 175.26 175.67 1tkr h PRO 178 N 6.91 0.01 -0.02 0.39 0.11 -1.86 0.24 132.00 137.77 1tkr h PRO 178 Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1tkr h PRO 178 Cb 1.15 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1tkr h PRO 178 CO 0.49 0.01 -0.03 0.27 -0.21 0.00 0.00 178.00 178.53 1tkr n ASN 179 N -5.25 2.42 -4.94 -2.05 6.94 -1.26 -4.86 115.26 106.26 1tkr n ASN 179 Ca 0.38 -1.79 -0.25 0.00 -0.02 0.00 0.00 54.58 52.90 1tkr n ASN 179 Cb 1.27 0.03 0.02 0.00 -2.36 0.00 0.00 39.78 38.74 1tkr n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1tkr s LEU 180 N -2.04 3.43 0.84 -4.53 1.02 0.07 -4.50 118.68 112.98 1tkr s LEU 180 Ca 0.31 0.47 -0.11 0.00 0.02 0.00 0.00 54.13 54.82 1tkr s LEU 180 Cb 0.20 -3.33 0.10 0.00 0.02 0.00 0.00 46.19 43.19 1tkr s LEU 180 CO 0.33 -0.90 1.15 -2.84 0.02 0.00 0.00 176.35 174.11 1tkr s PRO 181 N -4.77 1.51 0.18 1.29 0.02 -1.26 -4.87 135.00 127.10 1tkr s PRO 181 Ca 0.51 1.52 -0.12 0.00 0.02 0.00 0.00 61.00 62.93 1tkr s PRO 181 Cb -0.10 -1.79 -0.07 0.00 0.02 0.00 0.00 34.50 32.56 1tkr s PRO 181 CO 0.41 -2.26 0.54 -1.12 -0.33 0.00 0.00 177.00 174.25 1tkr s SER 182 N -2.68 6.73 -0.27 2.53 0.01 -1.26 -4.66 113.70 114.10 1tkr s SER 182 Ca 0.67 0.99 -0.11 0.00 1.31 0.00 0.00 55.95 58.82 1tkr s SER 182 Cb -0.23 -2.26 -0.05 0.00 0.21 0.00 0.00 66.02 63.70 1tkr s SER 182 CO 0.55 0.03 0.20 -0.31 0.41 0.00 0.00 173.24 174.11 1tkr s TYR 183 N -1.62 3.25 -0.41 2.43 2.02 0.74 -4.86 117.35 118.90 1tkr s TYR 183 Ca 0.42 0.17 -0.29 0.00 -0.37 0.00 0.00 57.07 57.00 1tkr s TYR 183 Cb -0.13 -2.37 0.00 0.00 -0.40 0.00 0.00 41.96 39.06 1tkr s TYR 183 CO 0.20 -0.11 1.51 1.03 -1.57 0.00 0.00 175.55 176.61 1tkr s ARG 184 N 1.61 3.48 -0.02 -0.62 1.81 -1.26 -0.93 118.95 123.01 1tkr s ARG 184 Ca 0.08 1.02 -0.21 0.00 -1.72 0.00 0.00 55.73 54.90 1tkr s ARG 184 Cb -0.15 -4.08 -0.29 0.00 -0.45 0.00 0.00 34.95 29.97 1tkr s ARG 184 CO 0.09 -1.68 0.97 0.82 -0.68 0.00 0.00 175.30 174.82 1tkr h ILE 185 N 6.55 1.46 -3.68 1.52 1.08 -1.37 -3.37 117.51 119.71 1tkr h ILE 185 Ca -0.29 -2.41 -0.48 0.00 -0.39 0.00 0.00 64.86 61.28 1tkr h ILE 185 Cb 1.12 3.00 -0.20 0.00 -3.07 0.00 0.00 36.82 37.67 1tkr h ILE 185 CO 1.08 0.69 -0.79 0.28 -0.69 0.00 0.00 178.15 178.73 1tkr s THR 186 N -2.69 1.52 -0.04 -0.27 -1.32 -1.21 -4.67 115.64 106.97 1tkr s THR 186 Ca -0.13 -1.64 0.05 0.00 -1.21 0.00 0.00 61.69 58.76 1tkr s THR 186 Cb 0.02 -1.53 0.08 0.00 -1.51 0.00 0.00 72.50 69.56 1tkr s THR 186 CO 0.84 -0.25 0.93 0.79 -2.21 0.00 0.00 174.62 174.72 1tkr n TRP 187 N 0.77 0.00 0.80 9.09 7.02 -1.26 -4.38 117.44 129.48 1tkr n TRP 187 Ca -0.17 -0.40 0.09 0.00 -1.02 0.00 0.00 57.50 56.00 1tkr n TRP 187 Cb 0.55 -0.07 0.02 0.00 -2.42 0.00 0.00 31.31 29.39 1tkr n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1tkr n THR 188 N -0.52 0.00 -1.50 -0.99 -2.24 -1.26 -5.02 114.28 102.75 1tkr n THR 188 Ca 0.04 -0.35 -0.40 0.00 -2.27 0.00 0.00 64.05 61.07 1tkr n THR 188 Cb 0.53 1.25 0.02 0.00 -2.10 0.00 0.00 70.33 70.04 1tkr n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tkr n GLY 189 N 1.20 -1.17 3.61 3.38 0.00 -1.26 -4.76 105.19 106.18 1tkr n GLY 189 Ca 0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 1tkr n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1tkr s LYS 190 N -1.93 0.52 0.09 1.61 2.20 -1.02 -4.93 119.74 116.29 1tkr s LYS 190 Ca 0.66 1.03 -0.35 0.00 -0.36 0.00 0.00 55.97 56.95 1tkr s LYS 190 Cb -0.52 0.31 -0.15 0.00 -1.51 0.00 0.00 37.83 35.96 1tkr s LYS 190 CO 0.56 -0.13 1.51 -1.91 -0.36 0.00 0.00 175.35 175.01 1tkr n GLU 191 N 4.46 1.68 -0.94 4.03 2.13 -1.26 -1.55 120.64 129.18 1tkr n GLU 191 Ca -0.16 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.26 1tkr n GLU 191 Cb 0.56 -2.32 0.00 0.00 0.27 0.00 0.00 31.44 29.94 1tkr n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1tkr n ASP 192 N 3.35 -5.16 0.05 4.31 8.00 -1.26 -4.72 116.55 121.12 1tkr n ASP 192 Ca 0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.68 1tkr n ASP 192 Cb 0.24 -3.25 0.00 0.00 -0.02 0.00 0.00 41.12 38.08 1tkr n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1tkr n ILE 193 N -2.04 0.85 -5.13 0.53 2.08 -0.59 -4.65 119.36 110.41 1tkr n ILE 193 Ca 0.00 0.28 -0.32 0.00 0.56 0.00 0.00 62.75 63.27 1tkr n ILE 193 Cb 0.42 -1.33 -0.16 0.00 -0.75 0.00 0.00 39.64 37.82 1tkr n ILE 193 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1tkr s ILE 194 N -1.79 2.28 -0.26 1.39 1.09 -0.61 0.45 121.20 123.75 1tkr s ILE 194 Ca 0.00 -0.94 0.01 0.00 -1.10 0.00 0.00 60.65 58.62 1tkr s ILE 194 Cb 0.00 -1.89 0.05 0.00 -1.06 0.00 0.00 42.46 39.56 1tkr s ILE 194 CO 0.00 0.55 -0.08 -0.31 -0.10 0.00 0.00 174.94 175.00 1tkr s TYR 195 N 0.28 3.22 -0.30 3.97 1.51 0.30 -2.44 117.35 123.89 1tkr s TYR 195 Ca -0.15 -2.10 -0.12 0.00 -1.01 0.00 0.00 57.07 53.69 1tkr s TYR 195 Cb -0.17 -1.99 -0.04 0.00 -0.11 0.00 0.00 41.96 39.66 1tkr s TYR 195 CO 0.08 -0.84 0.21 -0.80 -1.11 0.00 0.00 175.55 173.08 1tkr s ASN 196 N 1.17 6.02 0.00 2.29 0.01 -0.70 -1.41 114.94 122.32 1tkr s ASN 196 Ca -0.06 -0.16 0.00 0.00 -0.71 0.00 0.00 52.86 51.92 1tkr s ASN 196 Cb -0.19 -2.12 0.00 0.00 0.41 0.00 0.00 41.25 39.35 1tkr s ASN 196 CO -0.04 -0.12 0.00 0.61 -1.51 0.00 0.00 177.10 176.04 1tkr n GLY 197 N 5.07 2.80 3.27 0.66 0.00 -0.83 -4.33 105.19 111.84 1tkr n GLY 197 Ca -0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 1tkr n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1tkr s ILE 198 N -3.10 1.43 0.46 -0.61 -4.36 -1.26 0.24 121.20 114.01 1tkr s ILE 198 Ca 0.00 -1.90 -0.01 0.00 -0.26 0.00 0.00 60.65 58.48 1tkr s ILE 198 Cb 0.00 -1.73 -0.01 0.00 1.25 0.00 0.00 42.46 41.98 1tkr s ILE 198 CO 0.00 -0.50 0.69 0.42 0.24 0.00 0.00 174.94 175.79 1tkr s THR 199 N -2.52 4.08 0.58 8.37 -4.23 -0.95 -4.67 115.64 116.30 1tkr s THR 199 Ca 0.14 -0.40 0.04 0.00 -1.18 0.00 0.00 61.69 60.29 1tkr s THR 199 Cb -0.03 -3.52 0.07 0.00 1.34 0.00 0.00 72.50 70.36 1tkr s THR 199 CO 0.04 -0.39 0.80 1.51 -0.54 0.00 0.00 174.62 176.04 1tkr s ASP 200 N -4.21 5.04 0.21 3.99 -4.77 -1.26 -4.83 116.67 110.84 1tkr s ASP 200 Ca 0.48 -0.39 -0.15 0.00 -3.30 0.00 0.00 52.55 49.19 1tkr s ASP 200 Cb -0.10 -0.31 0.22 0.00 -1.09 0.00 0.00 42.92 41.64 1tkr s ASP 200 CO 0.39 -1.32 1.60 -0.25 0.70 0.00 0.00 175.17 176.29 1tkr h TRP 201 N 0.04 -0.57 -0.25 2.11 7.01 -2.00 -0.75 115.95 121.53 1tkr h TRP 201 Ca -0.37 0.07 -0.15 0.00 2.11 0.00 0.00 58.89 60.54 1tkr h TRP 201 Cb 1.28 0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 28.69 1tkr h TRP 201 CO 0.23 -0.33 -0.46 -0.24 -2.79 0.00 0.00 178.44 174.85 1tkr h VAL 202 N -0.06 1.30 0.00 2.65 3.04 -1.95 -1.79 116.25 119.44 1tkr h VAL 202 Ca 0.30 -1.66 -0.07 0.00 -1.01 0.00 0.00 66.70 64.26 1tkr h VAL 202 Cb 0.53 1.60 -0.01 0.00 -2.01 0.00 0.00 31.29 31.39 1tkr h VAL 202 CO -0.71 0.53 -0.35 1.88 -1.01 0.00 0.00 177.57 177.91 1tkr h TYR 203 N 0.53 0.00 -0.19 3.17 -1.99 -1.81 -0.23 116.97 116.44 1tkr h TYR 203 Ca 0.03 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.64 1tkr h TYR 203 Cb 1.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.73 1tkr h TYR 203 CO 0.05 0.35 -0.35 1.49 -0.00 0.00 0.00 178.16 179.70 1tkr h GLU 204 N 0.00 0.58 0.12 4.88 4.81 -0.78 -0.40 114.58 123.79 1tkr h GLU 204 Ca -0.00 -0.36 -0.34 0.00 -0.13 0.00 0.00 59.36 58.52 1tkr h GLU 204 Cb 0.74 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1tkr h GLU 204 CO 0.05 0.97 -1.80 1.49 -0.73 0.00 0.00 179.01 178.99 1tkr h GLU 205 N 0.25 0.24 0.00 1.92 4.57 -1.24 -2.17 114.58 118.15 1tkr h GLU 205 Ca 0.01 -0.42 -0.13 0.00 -1.18 0.00 0.00 59.36 57.64 1tkr h GLU 205 Cb 0.94 0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 29.66 1tkr h GLU 205 CO 0.08 1.10 -1.89 0.39 -1.18 0.00 0.00 179.01 177.50 1tkr n GLU 206 N -3.42 0.98 -0.02 1.92 -0.58 -0.11 -4.56 120.64 114.85 1tkr n GLU 206 Ca -0.25 -0.08 -0.03 0.00 -0.42 0.00 0.00 57.16 56.39 1tkr n GLU 206 Cb 1.05 -1.39 -0.03 0.00 -0.57 0.00 0.00 31.44 30.50 1tkr n GLU 206 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 1tkr n VAL 207 N -2.31 0.30 0.26 2.62 3.14 -1.18 -4.81 118.33 116.35 1tkr n VAL 207 Ca -0.13 -0.16 0.03 0.00 -2.96 0.00 0.00 64.34 61.11 1tkr n VAL 207 Cb 0.70 -0.83 -0.02 0.00 -1.06 0.00 0.00 33.84 32.63 1tkr n VAL 207 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 1tkr n PHE 208 N -2.29 0.00 -4.37 1.45 3.72 -0.17 -4.92 117.46 110.88 1tkr n PHE 208 Ca -0.08 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 56.96 1tkr n PHE 208 Cb 0.63 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 39.09 1tkr n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1tkr n SER 209 N -0.70 -0.80 -3.57 4.37 7.64 -0.87 -4.85 113.62 114.83 1tkr n SER 209 Ca 0.02 -1.21 -0.06 0.00 1.01 0.00 0.00 58.87 58.63 1tkr n SER 209 Cb 0.11 -1.86 -0.02 0.00 -1.01 0.00 0.00 64.21 61.43 1tkr n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tkr s ALA 210 N -3.75 -1.90 -0.13 -0.43 0.00 -0.89 -4.99 121.76 109.66 1tkr s ALA 210 Ca 0.43 1.05 0.19 0.00 0.00 0.00 0.00 51.96 53.63 1tkr s ALA 210 Cb -0.25 0.29 -0.20 0.00 0.00 0.00 0.00 23.12 22.96 1tkr s ALA 210 CO 0.99 -0.73 0.57 0.98 0.00 0.00 0.00 175.76 177.58 1tkr n TYR 211 N -0.25 0.53 -2.20 0.00 9.36 -1.26 -4.25 117.16 119.09 1tkr n TYR 211 Ca -0.06 0.17 -0.41 0.00 3.32 0.00 0.00 57.90 60.92 1tkr n TYR 211 Cb 0.61 -0.93 -0.03 0.00 -0.63 0.00 0.00 39.34 38.36 1tkr n TYR 211 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1tkr s SER 212 N -5.41 6.88 -0.17 2.98 0.15 -1.26 -2.23 113.70 114.64 1tkr s SER 212 Ca -0.06 2.40 0.19 0.00 0.70 0.00 0.00 55.95 59.18 1tkr s SER 212 Cb 0.09 -2.61 0.46 0.00 -1.71 0.00 0.00 66.02 62.25 1tkr s SER 212 CO 0.84 -0.55 1.17 0.00 1.20 0.00 0.00 173.24 175.89 1tkr n ALA 213 N 2.77 3.16 -2.88 5.45 0.00 0.14 -4.73 120.51 124.43 1tkr n ALA 213 Ca 0.07 -2.91 -0.12 0.00 0.00 0.00 0.00 53.44 50.47 1tkr n ALA 213 Cb 0.43 -0.63 -0.13 0.00 0.00 0.00 0.00 19.45 19.12 1tkr n ALA 213 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1tkr s LEU 214 N -2.39 2.10 -0.16 0.00 0.05 -1.24 -1.79 118.68 115.24 1tkr s LEU 214 Ca 0.36 -0.22 -0.02 0.00 0.05 0.00 0.00 54.13 54.29 1tkr s LEU 214 Cb 0.37 -0.04 0.05 0.00 -2.05 0.00 0.00 46.19 44.52 1tkr s LEU 214 CO -0.08 -0.10 0.02 0.26 -0.55 0.00 0.00 176.35 175.91 1tkr s TRP 215 N -0.59 0.98 0.60 3.48 0.51 0.22 -4.98 118.94 119.17 1tkr s TRP 215 Ca -0.05 -0.70 -0.17 0.00 -2.12 0.00 0.00 56.10 53.06 1tkr s TRP 215 Cb -0.04 -0.99 -0.03 0.00 -0.81 0.00 0.00 33.47 31.60 1tkr s TRP 215 CO -0.00 -0.54 1.11 -1.58 -0.51 0.00 0.00 176.95 175.43 1tkr s TRP 216 N 1.87 2.68 0.54 -1.98 0.52 -1.26 -1.27 118.94 120.04 1tkr s TRP 216 Ca 0.01 1.55 -0.13 0.00 0.02 0.00 0.00 56.10 57.54 1tkr s TRP 216 Cb -0.16 -3.20 -0.06 0.00 -1.15 0.00 0.00 33.47 28.91 1tkr s TRP 216 CO -0.07 -1.57 0.96 -1.54 0.02 0.00 0.00 176.95 174.75 1tkr s SER 217 N -2.27 6.43 0.17 2.95 1.04 0.54 -4.90 113.70 117.66 1tkr s SER 217 Ca 0.69 1.41 -0.13 0.00 0.48 0.00 0.00 55.95 58.39 1tkr s SER 217 Cb -0.21 -2.45 0.17 0.00 0.10 0.00 0.00 66.02 63.63 1tkr s SER 217 CO 0.35 -0.67 1.14 -2.65 0.98 0.00 0.00 173.24 172.39 1tkr n PRO 218 N -2.05 -0.18 -0.25 4.02 -0.02 -1.26 0.42 135.00 135.68 1tkr n PRO 218 Ca 0.05 1.13 0.10 0.00 -2.02 0.00 0.00 63.50 62.77 1tkr n PRO 218 Cb 0.54 -1.68 0.26 0.00 -0.02 0.00 0.00 33.50 32.60 1tkr n PRO 218 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1tkr n ASN 219 N -5.08 2.99 -0.08 2.55 0.23 -1.26 -4.36 115.26 110.25 1tkr n ASN 219 Ca 0.07 -1.97 -0.01 0.00 -0.53 0.00 0.00 54.58 52.15 1tkr n ASN 219 Cb 0.29 -0.33 -0.00 0.00 -2.08 0.00 0.00 39.78 37.66 1tkr n ASN 219 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1tkr n GLY 220 N 1.40 0.49 0.06 4.83 0.00 0.17 -4.68 105.19 107.47 1tkr n GLY 220 Ca 0.19 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 1tkr n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1tkr h THR 221 N 0.00 1.39 -3.03 2.61 2.02 -1.93 -3.45 112.91 110.52 1tkr h THR 221 Ca -0.02 -1.16 -0.64 0.00 0.77 0.00 0.00 66.41 65.35 1tkr h THR 221 Cb 0.14 2.15 -0.08 0.00 -1.74 0.00 0.00 68.15 68.62 1tkr h THR 221 CO 0.03 0.31 -0.55 -0.36 0.37 0.00 0.00 175.52 175.31 1tkr s PHE 222 N -4.25 3.36 -0.33 3.16 0.08 -1.26 -1.41 117.98 117.33 1tkr s PHE 222 Ca -0.16 0.22 0.02 0.00 0.12 0.00 0.00 56.93 57.14 1tkr s PHE 222 Cb 0.02 -1.74 0.10 0.00 -0.57 0.00 0.00 43.02 40.83 1tkr s PHE 222 CO 0.68 0.57 0.06 -1.17 -0.10 0.00 0.00 175.22 175.26 1tkr s LEU 223 N -2.01 3.91 0.28 -0.37 2.96 0.38 -0.34 118.68 123.50 1tkr s LEU 223 Ca 0.27 -1.95 -0.23 0.00 -0.22 0.00 0.00 54.13 52.00 1tkr s LEU 223 Cb -0.12 -1.39 -0.09 0.00 0.50 0.00 0.00 46.19 45.09 1tkr s LEU 223 CO 0.18 -0.38 0.83 0.00 -1.32 0.00 0.00 176.35 175.67 1tkr s ALA 224 N 1.13 3.31 0.06 5.97 0.00 -0.40 -2.11 121.76 129.73 1tkr s ALA 224 Ca 0.10 0.34 -0.20 0.00 0.00 0.00 0.00 51.96 52.20 1tkr s ALA 224 Cb -0.18 -3.00 0.04 0.00 0.00 0.00 0.00 23.12 19.98 1tkr s ALA 224 CO -0.13 0.25 0.46 1.52 0.00 0.00 0.00 175.76 177.86 1tkr s TYR 225 N -1.59 -0.33 0.25 0.00 1.13 -0.42 0.70 117.35 117.10 1tkr s TYR 225 Ca 0.47 0.28 0.08 0.00 -1.41 0.00 0.00 57.07 56.49 1tkr s TYR 225 Cb -0.17 0.28 -0.04 0.00 -1.10 0.00 0.00 41.96 40.93 1tkr s TYR 225 CO 0.22 -0.63 0.07 0.00 -2.51 0.00 0.00 175.55 172.70 1tkr s ALA 226 N -2.69 3.33 -0.05 9.51 0.00 -0.74 -0.80 121.76 130.32 1tkr s ALA 226 Ca -0.04 -1.52 0.02 0.00 0.00 0.00 0.00 51.96 50.42 1tkr s ALA 226 Cb -0.00 -1.00 0.01 0.00 0.00 0.00 0.00 23.12 22.13 1tkr s ALA 226 CO -0.04 0.29 -0.09 -1.14 0.00 0.00 0.00 175.76 174.79 1tkr s GLN 227 N -3.63 1.22 -0.12 0.00 0.74 -0.30 -1.96 119.66 115.61 1tkr s GLN 227 Ca 0.31 -0.27 0.00 0.00 0.05 0.00 0.00 55.36 55.45 1tkr s GLN 227 Cb -0.07 -1.08 -0.02 0.00 1.10 0.00 0.00 33.01 32.94 1tkr s GLN 227 CO 0.22 0.01 -0.12 -0.06 -0.55 0.00 0.00 175.29 174.78 1tkr s PHE 228 N 0.66 2.82 -0.33 1.67 0.08 -0.50 -1.08 117.98 121.29 1tkr s PHE 228 Ca -0.11 -0.55 -0.04 0.00 0.12 0.00 0.00 56.93 56.35 1tkr s PHE 228 Cb -0.14 -1.83 0.05 0.00 -0.57 0.00 0.00 43.02 40.54 1tkr s PHE 228 CO 0.02 -0.14 0.07 1.21 -0.10 0.00 0.00 175.22 176.28 1tkr s ASN 229 N 0.21 5.13 -0.01 1.36 3.84 -0.25 -0.54 114.94 124.68 1tkr s ASN 229 Ca -0.08 -1.31 0.20 0.00 0.21 0.00 0.00 52.86 51.88 1tkr s ASN 229 Cb -0.15 -1.80 0.58 0.00 -0.55 0.00 0.00 41.25 39.33 1tkr s ASN 229 CO 0.05 -0.33 1.48 0.47 -2.79 0.00 0.00 177.10 175.98 1tkr n ASP 230 N 4.71 3.80 -0.03 -4.21 9.92 0.17 -1.72 116.55 129.19 1tkr n ASP 230 Ca -0.12 -2.04 -0.01 0.00 -0.53 0.00 0.00 54.79 52.10 1tkr n ASP 230 Cb 0.44 -0.44 -0.01 0.00 -0.64 0.00 0.00 41.12 40.47 1tkr n ASP 230 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1tkr n THR 231 N 1.36 -0.05 1.72 -3.53 -1.04 -1.25 -0.29 114.28 111.20 1tkr n THR 231 Ca 0.22 1.05 0.03 0.00 -2.04 0.00 0.00 64.05 63.31 1tkr n THR 231 Cb 0.60 -1.38 0.11 0.00 -1.82 0.00 0.00 70.33 67.84 1tkr n THR 231 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1tkr n GLU 232 N -2.91 1.21 -2.56 -2.82 1.02 -1.26 -4.86 120.64 108.46 1tkr n GLU 232 Ca 0.00 -0.32 -0.42 0.00 -0.02 0.00 0.00 57.16 56.40 1tkr n GLU 232 Cb 0.02 -1.11 -0.03 0.00 -0.02 0.00 0.00 31.44 30.30 1tkr n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1tkr s VAL 233 N -1.89 4.47 0.87 2.62 1.01 0.60 -4.71 120.40 123.38 1tkr s VAL 233 Ca 0.10 1.77 -0.12 0.00 0.00 0.00 0.00 61.98 63.73 1tkr s VAL 233 Cb 0.05 -4.14 0.11 0.00 0.00 0.00 0.00 36.38 32.40 1tkr s VAL 233 CO 0.07 0.02 1.11 -2.65 0.00 0.00 0.00 175.10 173.65 1tkr n PRO 234 N 4.97 -0.16 -4.83 2.72 -0.02 -1.26 -4.75 135.00 131.67 1tkr n PRO 234 Ca 0.10 0.03 -0.33 0.00 -2.02 0.00 0.00 63.50 61.28 1tkr n PRO 234 Cb 0.47 -2.36 -0.16 0.00 -0.02 0.00 0.00 33.50 31.44 1tkr n PRO 234 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1tkr s LEU 235 N -5.70 2.39 0.17 2.45 1.02 -1.26 -1.60 118.68 116.14 1tkr s LEU 235 Ca 0.69 -0.47 -0.30 0.00 0.02 0.00 0.00 54.13 54.07 1tkr s LEU 235 Cb -0.26 -1.52 -0.07 0.00 0.02 0.00 0.00 46.19 44.36 1tkr s LEU 235 CO 0.55 0.13 0.96 -0.51 0.02 0.00 0.00 176.35 177.50 1tkr s ILE 236 N 0.53 4.30 -0.05 -0.59 1.10 -0.65 -4.85 121.20 120.99 1tkr s ILE 236 Ca -0.11 2.07 0.02 0.00 -0.51 0.00 0.00 60.65 62.11 1tkr s ILE 236 Cb -0.16 -4.32 0.02 0.00 0.15 0.00 0.00 42.46 38.14 1tkr s ILE 236 CO 0.04 0.39 -0.09 -1.61 -2.11 0.00 0.00 174.94 171.57 1tkr s GLU 237 N -0.51 1.27 0.15 3.50 2.02 -1.26 -1.85 118.70 122.02 1tkr s GLU 237 Ca 0.45 -0.27 -0.02 0.00 0.02 0.00 0.00 54.97 55.14 1tkr s GLU 237 Cb -0.25 -1.12 -0.03 0.00 0.10 0.00 0.00 34.13 32.83 1tkr s GLU 237 CO 0.31 -0.01 0.11 1.52 0.02 0.00 0.00 175.26 177.21 1tkr s TYR 238 N 0.72 0.84 0.11 1.61 1.13 -0.50 -4.98 117.35 116.28 1tkr s TYR 238 Ca -0.13 -1.18 -0.15 0.00 -1.41 0.00 0.00 57.07 54.20 1tkr s TYR 238 Cb -0.15 -0.42 -0.07 0.00 -1.10 0.00 0.00 41.96 40.23 1tkr s TYR 238 CO 0.02 -0.58 0.54 -1.12 -2.51 0.00 0.00 175.55 171.90 1tkr s SER 239 N -3.06 6.88 -0.15 -0.18 0.01 -1.26 -0.33 113.70 115.62 1tkr s SER 239 Ca 0.26 1.11 0.00 0.00 1.31 0.00 0.00 55.95 58.63 1tkr s SER 239 Cb 0.07 -2.30 0.02 0.00 0.21 0.00 0.00 66.02 64.02 1tkr s SER 239 CO 0.04 0.17 -0.14 0.12 0.41 0.00 0.00 173.24 173.83 1tkr s PHE 240 N -1.34 2.14 -0.26 2.43 5.36 0.35 -4.69 117.98 121.98 1tkr s PHE 240 Ca 0.34 -1.19 0.23 0.00 -0.96 0.00 0.00 56.93 55.34 1tkr s PHE 240 Cb -0.16 -1.58 0.04 0.00 -0.34 0.00 0.00 43.02 40.98 1tkr s PHE 240 CO 0.19 -0.66 1.11 1.88 -1.46 0.00 0.00 175.22 176.28 1tkr h TYR 241 N 8.02 0.00 -0.67 10.12 -1.99 -1.95 -0.67 116.97 129.83 1tkr h TYR 241 Ca -0.38 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.35 1tkr h TYR 241 Cb 1.14 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.87 1tkr h TYR 241 CO 0.47 0.00 0.00 0.45 -0.00 0.00 0.00 178.16 179.08 1tkr n SER 242 N -2.72 -2.00 -4.73 3.88 2.88 -1.26 -4.72 113.62 104.96 1tkr n SER 242 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.21 1tkr n SER 242 Cb 0.55 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.10 1tkr n SER 242 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1tkr s ASP 243 N -4.00 4.21 0.31 -3.46 1.01 -1.26 -4.89 116.67 108.59 1tkr s ASP 243 Ca 0.00 2.27 0.07 0.00 0.71 0.00 0.00 52.55 55.61 1tkr s ASP 243 Cb 0.00 -2.58 0.81 0.00 1.01 0.00 0.00 42.92 42.16 1tkr s ASP 243 CO 0.00 -2.25 1.74 -0.08 0.21 0.00 0.00 175.17 174.79 1tkr h GLU 244 N -0.43 0.58 -0.77 8.23 4.81 -2.05 -1.42 114.58 123.53 1tkr h GLU 244 Ca -0.47 -0.04 0.13 0.00 -0.13 0.00 0.00 59.36 58.86 1tkr h GLU 244 Cb 1.28 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.48 1tkr h GLU 244 CO 0.50 0.39 0.51 0.66 -0.73 0.00 0.00 179.01 180.33 1tkr h SER 245 N 0.60 0.49 -2.32 1.04 4.64 -1.93 -3.42 113.55 112.65 1tkr h SER 245 Ca 0.61 0.02 -0.55 0.00 -0.47 0.00 0.00 61.79 61.40 1tkr h SER 245 Cb 1.10 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1tkr h SER 245 CO -0.46 0.26 1.28 -0.22 -0.87 0.00 0.00 176.83 176.83 1tkr s LEU 246 N -9.52 4.17 0.08 5.97 0.20 -0.54 -4.89 118.68 114.15 1tkr s LEU 246 Ca -0.09 2.41 -0.18 0.00 0.69 0.00 0.00 54.13 56.97 1tkr s LEU 246 Cb 0.21 -3.53 -0.09 0.00 -0.43 0.00 0.00 46.19 42.36 1tkr s LEU 246 CO 0.77 -1.27 1.47 -0.61 -0.29 0.00 0.00 176.35 176.42 1tkr h GLN 247 N 11.60 0.52 -5.82 1.98 4.15 -1.89 -3.44 115.11 122.21 1tkr h GLN 247 Ca -0.46 -0.21 -0.67 0.00 0.77 0.00 0.00 58.65 58.08 1tkr h GLN 247 Cb 1.23 -0.02 -0.24 0.00 0.21 0.00 0.00 27.48 28.66 1tkr h GLN 247 CO 0.95 0.75 -0.75 0.71 -1.93 0.00 0.00 178.83 178.56 1tkr s TYR 248 N -4.70 2.80 0.51 3.99 1.51 -1.26 -5.10 117.35 115.10 1tkr s TYR 248 Ca -0.13 -0.34 -0.22 0.00 -1.01 0.00 0.00 57.07 55.37 1tkr s TYR 248 Cb 0.08 -1.75 -0.06 0.00 -0.11 0.00 0.00 41.96 40.12 1tkr s TYR 248 CO 0.77 0.03 1.24 -2.14 -1.11 0.00 0.00 175.55 174.34 1tkr s PRO 249 N -0.22 3.40 0.00 -1.71 0.02 -1.26 -5.00 135.00 130.22 1tkr s PRO 249 Ca 0.01 1.93 -0.05 0.00 0.02 0.00 0.00 61.00 62.92 1tkr s PRO 249 Cb -0.13 -2.26 -0.04 0.00 0.02 0.00 0.00 34.50 32.09 1tkr s PRO 249 CO 0.03 -0.89 0.23 -1.59 -0.33 0.00 0.00 177.00 174.45 1tkr s LYS 250 N -2.90 3.51 -0.44 5.54 -2.85 -0.26 -4.91 119.74 117.43 1tkr s LYS 250 Ca 0.69 -0.19 -0.17 0.00 -1.00 0.00 0.00 55.97 55.30 1tkr s LYS 250 Cb -0.33 -3.08 0.04 0.00 -2.06 0.00 0.00 37.83 32.40 1tkr s LYS 250 CO 0.38 0.66 0.44 0.99 0.10 0.00 0.00 175.35 177.92 1tkr s THR 251 N -1.32 5.11 0.23 3.79 2.01 -1.26 -0.49 115.64 123.70 1tkr s THR 251 Ca 0.28 -0.56 -0.30 0.00 0.31 0.00 0.00 61.69 61.41 1tkr s THR 251 Cb -0.13 -4.09 -0.09 0.00 0.01 0.00 0.00 72.50 68.21 1tkr s THR 251 CO 0.17 -0.50 1.03 -0.69 -0.69 0.00 0.00 174.62 173.94 1tkr s VAL 252 N 2.05 3.86 -0.06 3.82 1.01 0.56 -4.88 120.40 126.75 1tkr s VAL 252 Ca 0.10 1.77 -0.03 0.00 0.00 0.00 0.00 61.98 63.83 1tkr s VAL 252 Cb -0.19 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.10 1tkr s VAL 252 CO 0.11 0.38 0.13 0.00 0.00 0.00 0.00 175.10 175.73 1tkr s ARG 253 N -0.98 0.06 -0.02 2.72 3.03 -1.26 -1.42 118.95 121.09 1tkr s ARG 253 Ca 0.45 0.40 0.01 0.00 2.03 0.00 0.00 55.73 58.61 1tkr s ARG 253 Cb -0.29 -0.22 0.01 0.00 -1.03 0.00 0.00 34.95 33.43 1tkr s ARG 253 CO 0.36 -0.20 -0.02 0.54 -1.13 0.00 0.00 175.30 174.84 1tkr s VAL 254 N 1.44 0.30 -0.19 4.99 0.11 -0.77 -4.97 120.40 121.31 1tkr s VAL 254 Ca -0.06 -0.06 -0.28 0.00 -2.93 0.00 0.00 61.98 58.65 1tkr s VAL 254 Cb -0.12 -0.32 -0.05 0.00 -1.53 0.00 0.00 36.38 34.36 1tkr s VAL 254 CO -0.06 0.13 2.15 -2.84 -3.33 0.00 0.00 175.10 171.16 1tkr s PRO 255 N 0.51 3.30 -0.10 1.54 0.02 -1.26 -1.64 135.00 137.36 1tkr s PRO 255 Ca -0.05 2.08 -0.03 0.00 0.02 0.00 0.00 61.00 63.02 1tkr s PRO 255 Cb -0.09 -4.33 0.04 0.00 0.02 0.00 0.00 34.50 30.15 1tkr s PRO 255 CO -0.01 -1.91 0.05 -0.47 -0.33 0.00 0.00 177.00 174.33 1tkr s TYR 256 N 7.63 0.36 -0.39 6.54 6.14 -0.63 -4.46 117.35 132.54 1tkr s TYR 256 Ca 0.97 -0.14 -0.26 0.00 0.64 0.00 0.00 57.07 58.29 1tkr s TYR 256 Cb -0.34 -0.68 0.02 0.00 0.42 0.00 0.00 41.96 41.38 1tkr s TYR 256 CO 0.36 -0.37 0.92 -1.25 0.64 0.00 0.00 175.55 175.85 1tkr s PRO 257 N 2.08 3.77 0.76 4.97 0.04 -1.26 -4.59 135.00 140.76 1tkr s PRO 257 Ca 0.03 0.47 -0.07 0.00 0.04 0.00 0.00 61.00 61.48 1tkr s PRO 257 Cb -0.14 -3.83 0.11 0.00 0.04 0.00 0.00 34.50 30.68 1tkr s PRO 257 CO -0.06 -1.00 1.06 0.15 0.04 0.00 0.00 177.00 177.20 1tkr s LYS 258 N 3.50 1.74 -0.42 4.56 1.02 -1.26 0.15 119.74 129.04 1tkr s LYS 258 Ca 0.37 -0.53 -0.43 0.00 0.02 0.00 0.00 55.97 55.41 1tkr s LYS 258 Cb -0.12 -2.16 -0.17 0.00 -0.52 0.00 0.00 37.83 34.87 1tkr s LYS 258 CO 0.20 -1.52 1.87 0.00 -0.92 0.00 0.00 175.35 174.98 1tkr n ALA 259 N -3.06 -0.27 -0.78 5.17 0.00 0.12 -1.17 120.51 120.52 1tkr n ALA 259 Ca 0.11 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1tkr n ALA 259 Cb 0.60 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.92 1tkr n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tkr n GLY 260 N 5.38 1.38 3.89 0.00 0.00 -1.26 -4.79 105.19 109.79 1tkr n GLY 260 Ca 0.38 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.10 1tkr n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkr s ALA 261 N -3.76 2.21 -0.15 4.61 0.00 -0.32 -4.95 121.76 119.40 1tkr s ALA 261 Ca 0.00 -0.98 -0.29 0.00 0.00 0.00 0.00 51.96 50.69 1tkr s ALA 261 Cb 0.00 -2.85 -0.04 0.00 0.00 0.00 0.00 23.12 20.23 1tkr s ALA 261 CO 0.00 -2.29 1.65 0.08 0.00 0.00 0.00 175.76 175.20 1tkr s VAL 262 N -3.70 3.63 0.62 0.00 1.01 -1.26 -4.88 120.40 115.81 1tkr s VAL 262 Ca 0.70 0.73 -0.08 0.00 0.00 0.00 0.00 61.98 63.33 1tkr s VAL 262 Cb -0.07 -3.57 -0.00 0.00 0.00 0.00 0.00 36.38 32.74 1tkr s VAL 262 CO 0.52 -0.17 0.97 0.20 0.00 0.00 0.00 175.10 176.61 1tkr s ASN 263 N 3.98 5.71 0.55 3.32 0.01 -1.26 -4.33 114.94 122.92 1tkr s ASN 263 Ca 0.73 0.97 -0.18 0.00 -0.71 0.00 0.00 52.86 53.67 1tkr s ASN 263 Cb -0.29 -1.95 -0.06 0.00 0.41 0.00 0.00 41.25 39.37 1tkr s ASN 263 CO 0.29 -1.06 1.05 -2.16 -1.51 0.00 0.00 177.10 173.71 1tkr s PRO 264 N -5.10 3.52 0.28 -0.60 0.04 -1.26 -4.82 135.00 127.05 1tkr s PRO 264 Ca 0.55 1.27 0.04 0.00 0.04 0.00 0.00 61.00 62.90 1tkr s PRO 264 Cb -0.11 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 1tkr s PRO 264 CO 0.48 -0.66 0.43 0.95 0.04 0.00 0.00 177.00 178.24 1tkr s THR 265 N -2.26 4.98 0.06 1.26 -4.23 -0.70 -4.90 115.64 109.84 1tkr s THR 265 Ca 0.65 -0.88 0.01 0.00 -1.18 0.00 0.00 61.69 60.29 1tkr s THR 265 Cb -0.16 -3.77 -0.03 0.00 1.34 0.00 0.00 72.50 69.88 1tkr s THR 265 CO 0.30 -0.34 -0.06 0.54 -0.54 0.00 0.00 174.62 174.53 1tkr s VAL 266 N -2.10 0.44 0.07 2.29 0.11 -1.26 -1.09 120.40 118.86 1tkr s VAL 266 Ca 0.38 -1.48 0.00 0.00 -2.93 0.00 0.00 61.98 57.95 1tkr s VAL 266 Cb -0.09 -1.08 -0.04 0.00 -1.53 0.00 0.00 36.38 33.64 1tkr s VAL 266 CO 0.31 -0.69 -0.05 -0.54 -3.33 0.00 0.00 175.10 170.80 1tkr s LYS 267 N -2.78 0.68 -0.00 1.54 1.02 -0.24 -4.97 119.74 115.00 1tkr s LYS 267 Ca -0.01 -1.22 0.05 0.00 0.02 0.00 0.00 55.97 54.82 1tkr s LYS 267 Cb -0.01 0.01 -0.01 0.00 -0.52 0.00 0.00 37.83 37.29 1tkr s LYS 267 CO -0.04 -0.06 -0.15 0.12 -0.92 0.00 0.00 175.35 174.30 1tkr s PHE 268 N -3.56 1.36 0.10 3.18 5.36 -1.26 -1.15 117.98 122.01 1tkr s PHE 268 Ca 0.07 -0.27 -0.00 0.00 -0.96 0.00 0.00 56.93 55.76 1tkr s PHE 268 Cb 0.05 -0.86 -0.04 0.00 -0.34 0.00 0.00 43.02 41.83 1tkr s PHE 268 CO -0.07 -0.01 0.01 -0.06 -1.46 0.00 0.00 175.22 173.63 1tkr s PHE 269 N -0.45 0.78 -0.05 10.12 0.40 0.02 -1.53 117.98 127.27 1tkr s PHE 269 Ca 0.05 -1.12 -0.02 0.00 -0.60 0.00 0.00 56.93 55.25 1tkr s PHE 269 Cb -0.06 -0.48 0.04 0.00 0.51 0.00 0.00 43.02 43.03 1tkr s PHE 269 CO -0.00 -0.39 0.09 0.08 0.70 0.00 0.00 175.22 175.70 1tkr s VAL 270 N -3.91 -0.13 -0.01 -0.44 1.01 0.32 -1.29 120.40 115.94 1tkr s VAL 270 Ca 0.17 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.55 1tkr s VAL 270 Cb 0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 36.38 36.24 1tkr s VAL 270 CO -0.03 0.14 -0.23 0.54 0.00 0.00 0.00 175.10 175.52 1tkr s VAL 271 N 1.85 2.30 -0.33 2.92 0.11 -0.90 -1.91 120.40 124.45 1tkr s VAL 271 Ca -0.00 -1.09 -0.21 0.00 -2.93 0.00 0.00 61.98 57.74 1tkr s VAL 271 Cb -0.12 -1.85 -0.00 0.00 -1.53 0.00 0.00 36.38 32.88 1tkr s VAL 271 CO -0.04 0.53 0.69 0.21 -3.33 0.00 0.00 175.10 173.16 1tkr s ASN 272 N -0.80 6.51 0.00 3.54 3.04 -1.26 -0.47 114.94 125.51 1tkr s ASN 272 Ca 0.11 0.36 0.29 0.00 0.04 0.00 0.00 52.86 53.67 1tkr s ASN 272 Cb -0.10 -2.35 1.38 0.00 -1.54 0.00 0.00 41.25 38.63 1tkr s ASN 272 CO 0.00 -0.59 1.94 0.35 -3.04 0.00 0.00 177.10 175.76 1tkr n THR 273 N 5.56 0.00 1.05 -5.21 -2.24 -0.50 -3.30 114.28 109.64 1tkr n THR 273 Ca 0.00 -0.08 0.12 0.00 -2.27 0.00 0.00 64.05 61.82 1tkr n THR 273 Cb 0.48 -0.10 0.08 0.00 -2.10 0.00 0.00 70.33 68.70 1tkr n THR 273 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1tkr n ASP 274 N -0.76 1.99 -2.51 3.42 8.00 -1.26 -4.42 116.55 121.01 1tkr n ASP 274 Ca 0.18 -1.48 -0.17 0.00 0.71 0.00 0.00 54.79 54.03 1tkr n ASP 274 Cb 0.25 0.35 0.02 0.00 -0.02 0.00 0.00 41.12 41.72 1tkr n ASP 274 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1tkr n SER 275 N 0.07 3.23 -4.17 -2.24 2.88 -1.21 -5.06 113.62 107.12 1tkr n SER 275 Ca 0.11 -3.15 -0.28 0.00 -1.33 0.00 0.00 58.87 54.22 1tkr n SER 275 Cb 0.46 -0.47 -0.16 0.00 -0.75 0.00 0.00 64.21 63.30 1tkr n SER 275 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1tkr s LEU 276 N -3.46 1.95 0.28 2.46 2.34 -1.26 -4.95 118.68 116.04 1tkr s LEU 276 Ca 0.39 -0.42 0.08 0.00 0.06 0.00 0.00 54.13 54.23 1tkr s LEU 276 Cb 0.41 -1.14 -0.04 0.00 -0.56 0.00 0.00 46.19 44.87 1tkr s LEU 276 CO -0.06 0.16 0.12 -0.94 -1.06 0.00 0.00 176.35 174.58 1tkr s SER 277 N 0.12 4.99 0.00 1.48 1.04 -1.26 -5.00 113.70 115.06 1tkr s SER 277 Ca -0.08 -0.51 0.14 0.00 0.48 0.00 0.00 55.95 55.99 1tkr s SER 277 Cb -0.14 -1.04 0.42 0.00 0.10 0.00 0.00 66.02 65.36 1tkr s SER 277 CO 0.04 -0.09 1.34 -1.54 0.98 0.00 0.00 173.24 173.97 1tkr n SER 278 N -1.08 2.22 -0.09 7.02 3.41 -1.26 -3.47 113.62 120.38 1tkr n SER 278 Ca -0.06 -1.97 0.03 0.00 -0.26 0.00 0.00 58.87 56.61 1tkr n SER 278 Cb 0.59 -0.26 -0.01 0.00 -0.26 0.00 0.00 64.21 64.27 1tkr n SER 278 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1tkr n VAL 279 N 0.71 0.00 -3.84 -3.33 0.31 -1.26 -5.00 118.33 105.92 1tkr n VAL 279 Ca 0.14 -0.42 -0.13 0.00 -0.01 0.00 0.00 64.34 63.93 1tkr n VAL 279 Cb 0.36 1.05 -0.14 0.00 -0.91 0.00 0.00 33.84 34.19 1tkr n VAL 279 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1tkr s THR 280 N -1.16 -0.01 0.47 2.52 2.01 -1.23 -5.14 115.64 113.11 1tkr s THR 280 Ca 0.04 0.04 -0.24 0.00 0.31 0.00 0.00 61.69 61.84 1tkr s THR 280 Cb 0.04 -0.08 -0.07 0.00 0.01 0.00 0.00 72.50 72.41 1tkr s THR 280 CO 0.17 0.02 1.29 0.20 -0.69 0.00 0.00 174.62 175.61 1tkr s ASN 281 N 0.24 5.88 0.60 3.53 0.01 -1.26 -4.31 114.94 119.62 1tkr s ASN 281 Ca -0.02 2.61 -0.19 0.00 -0.71 0.00 0.00 52.86 54.55 1tkr s ASN 281 Cb -0.03 -2.63 -0.03 0.00 0.41 0.00 0.00 41.25 38.97 1tkr s ASN 281 CO -0.01 -1.14 1.26 0.00 -1.51 0.00 0.00 177.10 175.70 1tkr s ALA 282 N -1.35 2.56 -0.30 0.60 0.00 -1.26 -4.96 121.76 117.04 1tkr s ALA 282 Ca 0.64 1.14 -0.06 0.00 0.00 0.00 0.00 51.96 53.68 1tkr s ALA 282 Cb -0.36 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.27 1tkr s ALA 282 CO 0.45 -1.33 0.07 0.99 0.00 0.00 0.00 175.76 175.94 1tkr s THR 283 N -1.46 3.79 -0.34 0.00 2.01 -1.26 -5.00 115.64 113.37 1tkr s THR 283 Ca 0.78 -0.85 -0.11 0.00 0.31 0.00 0.00 61.69 61.82 1tkr s THR 283 Cb -0.35 -3.00 0.01 0.00 0.01 0.00 0.00 72.50 69.16 1tkr s THR 283 CO 0.38 0.02 0.19 -0.44 -0.69 0.00 0.00 174.62 174.08 1tkr s SER 284 N 1.45 5.71 0.15 3.53 0.01 -1.26 -4.54 113.70 118.75 1tkr s SER 284 Ca 0.01 -0.70 -0.30 0.00 1.31 0.00 0.00 55.95 56.27 1tkr s SER 284 Cb -0.18 -2.04 -0.07 0.00 0.21 0.00 0.00 66.02 63.94 1tkr s SER 284 CO 0.02 -0.28 1.19 -0.63 0.41 0.00 0.00 173.24 173.94 1tkr s ILE 285 N 1.61 3.75 -0.11 1.44 1.09 -0.80 -4.77 121.20 123.41 1tkr s ILE 285 Ca 0.04 1.40 -0.12 0.00 -1.10 0.00 0.00 60.65 60.87 1tkr s ILE 285 Cb -0.18 -3.90 -0.05 0.00 -1.06 0.00 0.00 42.46 37.28 1tkr s ILE 285 CO 0.07 0.19 0.27 -1.58 -0.10 0.00 0.00 174.94 173.79 1tkr s GLN 286 N 0.15 3.93 -0.28 2.79 0.74 -1.26 -0.52 119.66 125.21 1tkr s GLN 286 Ca 0.54 0.09 -0.09 0.00 0.05 0.00 0.00 55.36 55.95 1tkr s GLN 286 Cb -0.31 -3.30 -0.03 0.00 1.10 0.00 0.00 33.01 30.47 1tkr s GLN 286 CO 0.34 0.52 0.13 0.42 -0.55 0.00 0.00 175.29 176.14 1tkr s ILE 287 N -0.37 4.68 0.00 -2.34 1.01 -0.58 -4.88 121.20 118.72 1tkr s ILE 287 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.67 1tkr s ILE 287 Cb -0.14 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.07 1tkr s ILE 287 CO 0.06 0.23 0.00 0.41 0.00 0.00 0.00 174.94 175.64 1tkr n THR 288 N 4.98 0.00 -2.62 2.92 -1.04 -1.26 -4.18 114.28 113.08 1tkr n THR 288 Ca -0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1tkr n THR 288 Cb 0.51 -0.30 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 1tkr n THR 288 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1tkr n ALA 289 N -3.00 0.00 -0.95 2.41 0.00 -1.26 -4.99 120.51 112.72 1tkr n ALA 289 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1tkr n ALA 289 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.59 1tkr n ALA 289 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1tkr s PRO 290 N 0.00 1.30 0.30 0.00 0.02 -1.26 -4.91 135.00 130.46 1tkr s PRO 290 Ca 0.00 1.25 0.07 0.00 0.02 0.00 0.00 61.00 62.34 1tkr s PRO 290 Cb 0.00 -1.78 0.47 0.00 0.02 0.00 0.00 34.50 33.21 1tkr s PRO 290 CO 0.00 -2.34 1.71 0.00 -0.33 0.00 0.00 177.00 176.04 1tkr h ALA 291 N -1.64 1.12 0.00 -1.55 0.00 -2.00 -1.59 119.26 113.60 1tkr h ALA 291 Ca -0.46 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.04 1tkr h ALA 291 Cb 1.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1tkr h ALA 291 CO 0.47 0.58 0.00 -1.13 0.00 0.00 0.00 179.25 179.18 1tkr n SER 292 N -4.03 0.00 -0.06 0.00 3.41 -1.26 -3.05 113.62 108.63 1tkr n SER 292 Ca -0.01 -0.13 -0.06 0.00 -0.26 0.00 0.00 58.87 58.40 1tkr n SER 292 Cb 0.48 -0.22 -0.08 0.00 -0.26 0.00 0.00 64.21 64.12 1tkr n SER 292 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 1tkr n MET 293 N -1.22 1.96 0.11 4.33 0.00 -0.66 -4.55 117.12 117.08 1tkr n MET 293 Ca 0.11 0.01 0.12 0.00 0.00 0.00 0.00 57.70 57.93 1tkr n MET 293 Cb 0.14 -1.28 0.47 0.00 0.00 0.00 0.00 33.22 32.55 1tkr n MET 293 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1tkr n LEU 294 N -2.47 0.63 0.05 -0.89 4.77 -0.83 -3.20 117.00 115.05 1tkr n LEU 294 Ca -0.19 0.63 0.10 0.00 -0.03 0.00 0.00 56.01 56.52 1tkr n LEU 294 Cb 0.84 -0.52 0.54 0.00 -2.33 0.00 0.00 43.42 41.95 1tkr n LEU 294 CO 0.22 -0.46 1.15 0.16 -1.33 0.00 0.00 177.39 177.12 1tkr h ILE 295 N 0.00 0.96 -1.51 -0.08 3.07 -1.80 -3.45 117.51 114.70 1tkr h ILE 295 Ca 0.00 -0.10 0.00 0.00 1.55 0.00 0.00 64.86 66.31 1tkr h ILE 295 Cb 0.42 0.66 0.00 0.00 -0.27 0.00 0.00 36.82 37.63 1tkr h ILE 295 CO 0.00 0.05 0.00 0.61 -1.05 0.00 0.00 178.15 177.76 1tkr n GLY 296 N -1.53 4.13 3.77 0.16 0.00 -1.20 -5.14 105.19 105.39 1tkr n GLY 296 Ca 0.04 -1.40 -0.37 0.00 0.00 0.00 0.00 46.02 44.30 1tkr n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tkr s ASP 297 N 0.08 5.92 0.29 1.61 1.01 -1.26 -4.96 116.67 119.36 1tkr s ASP 297 Ca 0.00 2.35 -0.03 0.00 0.71 0.00 0.00 52.55 55.58 1tkr s ASP 297 Cb 0.00 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.34 1tkr s ASP 297 CO 0.00 -1.09 0.43 0.00 0.21 0.00 0.00 175.17 174.72 1tkr n HIS 298 N -0.76 -1.39 -4.12 4.23 1.44 -1.26 -1.57 115.22 111.79 1tkr n HIS 298 Ca 0.09 -1.82 -0.08 0.00 -2.01 0.00 0.00 57.72 53.89 1tkr n HIS 298 Cb 0.48 0.49 -0.10 0.00 0.12 0.00 0.00 29.99 30.98 1tkr n HIS 298 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 1tkr s TYR 299 N -3.38 0.66 -0.39 -1.40 2.02 0.47 -4.77 117.35 110.56 1tkr s TYR 299 Ca 0.22 -1.02 -0.09 0.00 -0.37 0.00 0.00 57.07 55.80 1tkr s TYR 299 Cb -0.01 -0.44 0.06 0.00 -0.40 0.00 0.00 41.96 41.16 1tkr s TYR 299 CO 0.16 -0.31 0.21 -1.17 -1.57 0.00 0.00 175.55 172.87 1tkr s LEU 300 N -2.97 4.86 0.00 -1.29 2.96 -1.26 -2.09 118.68 118.89 1tkr s LEU 300 Ca 0.09 -1.29 0.13 0.00 -0.22 0.00 0.00 54.13 52.85 1tkr s LEU 300 Cb 0.07 -1.97 -0.08 0.00 0.50 0.00 0.00 46.19 44.71 1tkr s LEU 300 CO -0.08 -0.45 0.63 0.00 -1.32 0.00 0.00 176.35 175.13 1tkr s ASP 302 N -1.96 -0.64 -0.05 0.00 -1.08 -1.16 -4.87 116.67 106.92 1tkr s ASP 302 Ca 0.08 1.16 -0.02 0.00 -0.52 0.00 0.00 52.55 53.24 1tkr s ASP 302 Cb 0.10 1.15 0.04 0.00 -1.46 0.00 0.00 42.92 42.74 1tkr s ASP 302 CO 0.44 -0.27 0.09 0.54 0.52 0.00 0.00 175.17 176.49 1tkr s VAL 303 N 0.08 -0.11 -0.12 1.11 0.11 -1.26 -1.21 120.40 119.01 1tkr s VAL 303 Ca -0.01 0.30 -0.05 0.00 -2.93 0.00 0.00 61.98 59.30 1tkr s VAL 303 Cb -0.04 -0.18 0.06 0.00 -1.53 0.00 0.00 36.38 34.69 1tkr s VAL 303 CO 0.00 0.12 0.24 -0.89 -3.33 0.00 0.00 175.10 171.24 1tkr s THR 304 N 1.64 -0.32 0.42 5.04 2.01 -0.69 -5.02 115.64 118.72 1tkr s THR 304 Ca -0.03 0.27 -0.25 0.00 0.31 0.00 0.00 61.69 62.00 1tkr s THR 304 Cb -0.12 -0.40 -0.08 0.00 0.01 0.00 0.00 72.50 71.90 1tkr s THR 304 CO -0.04 0.11 1.19 0.26 -0.69 0.00 0.00 174.62 175.45 1tkr s TRP 305 N 2.18 2.97 -0.20 4.92 0.52 -1.26 -0.93 118.94 127.14 1tkr s TRP 305 Ca -0.00 1.53 -0.02 0.00 0.02 0.00 0.00 56.10 57.62 1tkr s TRP 305 Cb -0.12 -3.43 -0.12 0.00 -1.15 0.00 0.00 33.47 28.65 1tkr s TRP 305 CO -0.08 -1.49 -0.21 0.00 0.02 0.00 0.00 176.95 175.20 1tkr n ALA 306 N -0.08 1.58 -3.09 0.98 0.00 0.65 -4.86 120.51 115.69 1tkr n ALA 306 Ca 0.05 -0.86 -0.01 0.00 0.00 0.00 0.00 53.44 52.62 1tkr n ALA 306 Cb 0.46 0.09 -0.00 0.00 0.00 0.00 0.00 19.45 20.00 1tkr n ALA 306 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1tkr n THR 307 N -3.34 0.00 0.35 0.00 -2.24 -0.95 -4.50 114.28 103.61 1tkr n THR 307 Ca -0.37 -0.16 0.13 0.00 -2.27 0.00 0.00 64.05 61.37 1tkr n THR 307 Cb 0.86 0.09 0.56 0.00 -2.10 0.00 0.00 70.33 69.74 1tkr n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1tkr h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.97 -3.14 115.11 110.29 1tkr h GLN 308 Ca -0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1tkr h GLN 308 Cb 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1tkr h GLN 308 CO 0.03 0.00 -0.03 0.39 -0.95 0.00 0.00 178.83 178.27 1tkr n GLU 309 N -2.42 1.10 -4.84 1.46 1.02 -1.26 -4.86 120.64 110.85 1tkr n GLU 309 Ca 0.01 -0.95 -0.27 0.00 -0.02 0.00 0.00 57.16 55.93 1tkr n GLU 309 Cb 0.22 -0.71 -0.17 0.00 -0.02 0.00 0.00 31.44 30.76 1tkr n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1tkr s ARG 310 N -0.45 2.10 0.00 3.49 3.52 -1.19 -0.91 118.95 125.51 1tkr s ARG 310 Ca 0.01 -0.60 0.03 0.00 -0.13 0.00 0.00 55.73 55.04 1tkr s ARG 310 Cb 0.01 -1.70 -0.01 0.00 -1.56 0.00 0.00 34.95 31.69 1tkr s ARG 310 CO 0.00 0.13 -0.09 -1.50 -0.81 0.00 0.00 175.30 173.04 1tkr s ILE 311 N 0.39 0.68 -0.01 4.11 2.07 -0.32 -0.26 121.20 127.87 1tkr s ILE 311 Ca -0.13 -0.46 0.04 0.00 -1.41 0.00 0.00 60.65 58.69 1tkr s ILE 311 Cb -0.15 -0.59 -0.03 0.00 0.13 0.00 0.00 42.46 41.82 1tkr s ILE 311 CO 0.05 0.13 -0.10 -0.94 -1.91 0.00 0.00 174.94 172.16 1tkr s SER 312 N -0.38 4.38 -0.02 4.50 1.04 -0.10 -1.12 113.70 122.00 1tkr s SER 312 Ca 0.02 -0.19 0.02 0.00 0.48 0.00 0.00 55.95 56.29 1tkr s SER 312 Cb -0.04 -0.97 0.00 0.00 0.10 0.00 0.00 66.02 65.12 1tkr s SER 312 CO -0.00 0.30 -0.08 -0.76 0.98 0.00 0.00 173.24 173.67 1tkr s LEU 313 N -1.23 1.79 -0.19 2.42 1.02 -0.32 -1.70 118.68 120.48 1tkr s LEU 313 Ca 0.15 -0.17 -0.01 0.00 0.02 0.00 0.00 54.13 54.12 1tkr s LEU 313 Cb -0.11 -0.51 0.00 0.00 0.02 0.00 0.00 46.19 45.59 1tkr s LEU 313 CO 0.05 0.06 -0.12 -1.10 0.02 0.00 0.00 176.35 175.26 1tkr s GLN 314 N 0.18 3.22 0.06 1.70 -0.21 -0.35 0.93 119.66 125.20 1tkr s GLN 314 Ca -0.03 -0.72 0.04 0.00 0.02 0.00 0.00 55.36 54.67 1tkr s GLN 314 Cb -0.08 -2.76 -0.04 0.00 1.00 0.00 0.00 33.01 31.13 1tkr s GLN 314 CO 0.00 -0.12 -0.02 -1.58 -2.12 0.00 0.00 175.29 171.45 1tkr s TRP 315 N 1.19 2.97 -0.07 0.91 0.52 0.19 -1.89 118.94 122.77 1tkr s TRP 315 Ca 0.02 -0.02 0.00 0.00 0.02 0.00 0.00 56.10 56.12 1tkr s TRP 315 Cb -0.14 -1.56 0.02 0.00 -1.15 0.00 0.00 33.47 30.64 1tkr s TRP 315 CO -0.05 0.46 -0.05 -1.17 0.02 0.00 0.00 176.95 176.16 1tkr s LEU 316 N -2.05 1.17 0.80 2.99 2.96 -0.89 -0.13 118.68 123.54 1tkr s LEU 316 Ca 0.23 -0.17 -0.13 0.00 -0.22 0.00 0.00 54.13 53.84 1tkr s LEU 316 Cb -0.12 -0.57 0.08 0.00 0.50 0.00 0.00 46.19 46.08 1tkr s LEU 316 CO 0.15 -0.09 1.19 -0.13 -1.32 0.00 0.00 176.35 176.16 1tkr s ARG 317 N 1.28 1.69 0.42 1.98 0.52 -0.72 -0.40 118.95 123.73 1tkr s ARG 317 Ca -0.05 1.71 0.14 0.00 -0.52 0.00 0.00 55.73 57.01 1tkr s ARG 317 Cb -0.14 -1.79 1.01 0.00 0.52 0.00 0.00 34.95 34.56 1tkr s ARG 317 CO -0.02 -2.16 1.95 -0.09 0.02 0.00 0.00 175.30 175.00 1tkr h ARG 318 N -0.90 0.43 -5.08 3.54 2.43 -1.59 -2.58 114.38 110.63 1tkr h ARG 318 Ca -0.46 -0.03 -0.69 0.00 -0.81 0.00 0.00 59.98 57.99 1tkr h ARG 318 Cb 1.29 -0.10 -0.17 0.00 -0.42 0.00 0.00 29.97 30.57 1tkr h ARG 318 CO 0.47 0.28 0.99 0.42 -1.51 0.00 0.00 179.97 180.61 1tkr s ILE 319 N -5.42 4.70 0.00 1.20 -1.09 -1.26 -4.84 121.20 114.49 1tkr s ILE 319 Ca -0.08 -1.68 0.00 0.00 -2.23 0.00 0.00 60.65 56.66 1tkr s ILE 319 Cb 0.20 -4.83 0.00 0.00 -1.58 0.00 0.00 42.46 36.25 1tkr s ILE 319 CO 0.76 -1.57 0.39 0.00 -1.23 0.00 0.00 174.94 173.30 1tkr n GLN 320 N 6.63 0.00 -0.06 2.79 6.02 -0.97 -3.30 117.38 128.48 1tkr n GLN 320 Ca 0.27 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.21 1tkr n GLN 320 Cb 0.48 -1.32 -0.10 0.00 1.02 0.00 0.00 30.24 30.32 1tkr n GLN 320 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1tkr n ASN 321 N 2.70 1.81 -4.22 1.08 2.85 -1.26 -1.49 115.26 116.71 1tkr n ASN 321 Ca 0.00 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.18 1tkr n ASN 321 Cb 0.00 0.90 -0.16 0.00 1.24 0.00 0.00 39.78 41.76 1tkr n ASN 321 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1tkr s TYR 322 N -2.38 2.08 0.01 1.20 6.14 -1.21 -2.14 117.35 121.05 1tkr s TYR 322 Ca -0.06 -0.55 0.00 0.00 0.64 0.00 0.00 57.07 57.11 1tkr s TYR 322 Cb 0.04 -1.37 -0.01 0.00 0.42 0.00 0.00 41.96 41.05 1tkr s TYR 322 CO 0.54 -0.14 -0.02 0.45 0.64 0.00 0.00 175.55 177.01 1tkr s SER 323 N -0.22 0.21 -0.04 4.32 0.15 -0.21 -1.75 113.70 116.16 1tkr s SER 323 Ca 0.00 -0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.53 1tkr s SER 323 Cb -0.11 0.01 0.01 0.00 -1.71 0.00 0.00 66.02 64.22 1tkr s SER 323 CO 0.02 -0.05 -0.07 -0.69 1.20 0.00 0.00 173.24 173.64 1tkr s VAL 324 N -0.37 0.72 -0.20 4.45 1.01 0.82 -0.77 120.40 126.06 1tkr s VAL 324 Ca -0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 1tkr s VAL 324 Cb -0.03 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 1tkr s VAL 324 CO -0.00 0.25 -0.03 -0.32 0.00 0.00 0.00 175.10 174.99 1tkr s MET 325 N 0.53 3.52 0.08 2.72 1.75 -0.03 0.56 119.30 128.43 1tkr s MET 325 Ca -0.08 -0.57 -0.01 0.00 -1.25 0.00 0.00 55.69 53.77 1tkr s MET 325 Cb -0.12 -3.00 -0.04 0.00 2.84 0.00 0.00 34.83 34.51 1tkr s MET 325 CO 0.01 -0.01 0.25 -0.51 -0.65 0.00 0.00 175.02 174.11 1tkr s ASP 326 N 1.02 6.40 -0.46 1.11 1.01 0.27 -1.63 116.67 124.39 1tkr s ASP 326 Ca 0.01 0.36 0.03 0.00 0.71 0.00 0.00 52.55 53.65 1tkr s ASP 326 Cb -0.15 -2.00 0.14 0.00 1.01 0.00 0.00 42.92 41.92 1tkr s ASP 326 CO 0.01 0.15 0.25 -0.63 0.21 0.00 0.00 175.17 175.16 1tkr s ILE 327 N -1.54 1.62 0.03 0.77 1.01 -1.26 -1.18 121.20 120.65 1tkr s ILE 327 Ca 0.36 -2.74 -0.20 0.00 0.00 0.00 0.00 60.65 58.08 1tkr s ILE 327 Cb -0.13 -2.13 -0.06 0.00 0.01 0.00 0.00 42.46 40.15 1tkr s ILE 327 CO 0.27 -0.89 0.57 0.00 0.00 0.00 0.00 174.94 174.88 1tkr s ASP 329 N -0.61 3.87 0.30 0.00 -0.00 0.06 -1.17 116.67 119.12 1tkr s ASP 329 Ca 0.29 -0.45 -0.28 0.00 -0.00 0.00 0.00 52.55 52.12 1tkr s ASP 329 Cb -0.19 -0.61 -0.09 0.00 -0.00 0.00 0.00 42.92 42.03 1tkr s ASP 329 CO 0.17 0.23 0.99 -0.47 -0.00 0.00 0.00 175.17 176.10 1tkr s TYR 330 N -0.99 3.70 -0.37 4.23 5.04 -0.09 -1.11 117.35 127.75 1tkr s TYR 330 Ca 0.16 1.79 -0.04 0.00 -2.44 0.00 0.00 57.07 56.54 1tkr s TYR 330 Cb -0.11 -3.04 0.08 0.00 0.35 0.00 0.00 41.96 39.24 1tkr s TYR 330 CO 0.07 0.01 0.14 0.34 -1.34 0.00 0.00 175.55 174.78 1tkr s ASP 331 N -1.33 5.22 0.00 4.32 -1.08 -0.36 -4.94 116.67 118.50 1tkr s ASP 331 Ca 0.47 -1.64 0.00 0.00 -0.52 0.00 0.00 52.55 50.87 1tkr s ASP 331 Cb -0.24 -1.83 0.00 0.00 -1.46 0.00 0.00 42.92 39.39 1tkr s ASP 331 CO 0.30 -0.44 0.69 1.21 0.52 0.00 0.00 175.17 177.46 1tkr n GLU 332 N 4.68 0.00 -0.33 4.34 4.07 -1.26 0.14 120.64 132.28 1tkr n GLU 332 Ca -0.08 0.62 -0.00 0.00 -0.06 0.00 0.00 57.16 57.64 1tkr n GLU 332 Cb 0.42 -1.19 -0.00 0.00 -0.06 0.00 0.00 31.44 30.61 1tkr n GLU 332 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1tkr n SER 333 N -1.67 3.45 0.00 4.31 3.41 -1.26 -2.90 113.62 118.96 1tkr n SER 333 Ca 0.00 -1.91 0.00 0.00 -0.26 0.00 0.00 58.87 56.70 1tkr n SER 333 Cb 0.00 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.22 1tkr n SER 333 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1tkr n SER 334 N 1.69 0.00 -0.13 4.04 2.88 -0.96 -5.03 113.62 116.11 1tkr n SER 334 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.53 1tkr n SER 334 Cb 0.33 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.78 1tkr n SER 334 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1tkr n GLY 335 N -0.57 0.53 3.79 0.46 0.00 0.12 -5.04 105.19 104.48 1tkr n GLY 335 Ca 0.00 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 1tkr n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tkr s ARG 336 N -1.57 2.28 -0.19 1.61 0.52 -1.25 -4.90 118.95 115.47 1tkr s ARG 336 Ca 0.00 -1.84 -0.00 0.00 -0.52 0.00 0.00 55.73 53.37 1tkr s ARG 336 Cb 0.00 -2.05 0.01 0.00 0.52 0.00 0.00 34.95 33.43 1tkr s ARG 336 CO 0.00 -0.21 -0.15 -1.58 0.02 0.00 0.00 175.30 173.38 1tkr s TRP 337 N -2.61 2.83 -0.23 -0.53 0.52 -1.26 -1.22 118.94 116.43 1tkr s TRP 337 Ca 0.40 -1.35 -0.08 0.00 0.02 0.00 0.00 56.10 55.08 1tkr s TRP 337 Cb 0.02 -1.97 -0.04 0.00 -1.15 0.00 0.00 33.47 30.33 1tkr s TRP 337 CO 0.22 -0.68 0.10 -0.80 0.02 0.00 0.00 176.95 175.81 1tkr s ASN 338 N 1.27 5.57 -0.88 2.95 -0.87 -0.27 -4.86 114.94 117.86 1tkr s ASN 338 Ca 0.03 -0.03 -0.06 0.00 -1.57 0.00 0.00 52.86 51.23 1tkr s ASN 338 Cb -0.14 -1.99 0.22 0.00 -0.02 0.00 0.00 41.25 39.32 1tkr s ASN 338 CO -0.08 0.05 0.79 0.00 -2.57 0.00 0.00 177.10 175.29 1tkr n LEU 340 N 2.98 3.17 -4.69 0.00 4.77 -1.26 -4.90 117.00 117.07 1tkr n LEU 340 Ca 0.18 1.13 -0.30 0.00 -0.03 0.00 0.00 56.01 56.99 1tkr n LEU 340 Cb 0.40 -1.44 0.22 0.00 -2.33 0.00 0.00 43.42 40.27 1tkr n LEU 340 CO 0.38 -0.43 0.70 0.54 -1.33 0.00 0.00 177.39 177.25 1tkr s VAL 341 N 0.07 1.72 0.00 4.08 0.11 -1.26 -2.76 120.40 122.37 1tkr s VAL 341 Ca 0.69 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.74 1tkr s VAL 341 Cb -0.65 -2.64 0.00 0.00 -1.53 0.00 0.00 36.38 31.56 1tkr s VAL 341 CO 0.48 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 172.25 1tkr n ALA 342 N -4.46 0.00 1.03 1.54 0.00 -1.26 -4.36 120.51 113.01 1tkr n ALA 342 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.69 1tkr n ALA 342 Cb 0.59 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.13 1tkr n ALA 342 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1tkr n ARG 343 N -0.53 0.30 -3.31 0.00 0.63 -1.11 -4.73 116.66 107.91 1tkr n ARG 343 Ca 0.00 -0.22 -0.33 0.00 -0.92 0.00 0.00 57.85 56.37 1tkr n ARG 343 Cb 0.00 -1.50 -0.06 0.00 0.45 0.00 0.00 32.46 31.36 1tkr n ARG 343 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 1tkr s GLN 344 N -2.85 3.93 -0.05 -0.14 -2.07 -1.22 -4.49 119.66 112.76 1tkr s GLN 344 Ca 0.13 0.47 0.06 0.00 -1.82 0.00 0.00 55.36 54.20 1tkr s GLN 344 Cb 0.17 -2.70 -0.01 0.00 -1.09 0.00 0.00 33.01 29.38 1tkr s GLN 344 CO 0.72 0.33 -0.23 -1.01 -1.32 0.00 0.00 175.29 173.78 1tkr s HIS 345 N -1.73 2.47 -0.13 9.60 3.76 -0.65 -4.93 115.29 123.69 1tkr s HIS 345 Ca 0.46 -0.61 -0.07 0.00 -0.15 0.00 0.00 55.06 54.69 1tkr s HIS 345 Cb -0.12 -1.60 -0.04 0.00 1.11 0.00 0.00 32.58 31.93 1tkr s HIS 345 CO 0.20 -0.14 0.12 0.42 -0.85 0.00 0.00 174.74 174.49 1tkr s ILE 346 N -0.28 5.37 -0.19 0.60 1.01 -1.26 -0.85 121.20 125.59 1tkr s ILE 346 Ca 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.81 1tkr s ILE 346 Cb -0.13 -3.34 0.05 0.00 0.01 0.00 0.00 42.46 39.05 1tkr s ILE 346 CO 0.03 0.60 -0.05 -0.70 0.00 0.00 0.00 174.94 174.81 1tkr s GLU 347 N -0.86 1.51 0.21 2.79 2.12 0.05 -5.00 118.70 119.51 1tkr s GLU 347 Ca 0.14 -0.66 0.03 0.00 0.36 0.00 0.00 54.97 54.84 1tkr s GLU 347 Cb -0.12 -2.20 -0.05 0.00 0.26 0.00 0.00 34.13 32.02 1tkr s GLU 347 CO 0.03 -0.48 0.00 0.00 -0.54 0.00 0.00 175.26 174.27 1tkr s MET 348 N 1.56 1.24 0.02 4.30 0.23 -1.26 -1.04 119.30 124.35 1tkr s MET 348 Ca -0.01 -1.61 0.01 0.00 -1.03 0.00 0.00 55.69 53.05 1tkr s MET 348 Cb -0.16 -0.45 -0.02 0.00 -1.53 0.00 0.00 34.83 32.67 1tkr s MET 348 CO -0.07 -0.12 -0.05 0.45 -2.03 0.00 0.00 175.02 173.20 1tkr s SER 349 N -3.25 0.57 -0.00 -1.18 0.15 -0.91 -5.01 113.70 104.07 1tkr s SER 349 Ca 0.27 -0.39 0.10 0.00 0.70 0.00 0.00 55.95 56.63 1tkr s SER 349 Cb 0.06 0.03 -0.11 0.00 -1.71 0.00 0.00 66.02 64.28 1tkr s SER 349 CO 0.07 -0.15 0.42 0.35 1.20 0.00 0.00 173.24 175.13 1tkr n THR 350 N 1.97 0.00 0.18 6.45 -2.24 -1.26 -4.52 114.28 114.87 1tkr n THR 350 Ca -0.20 -0.26 0.07 0.00 -2.27 0.00 0.00 64.05 61.39 1tkr n THR 350 Cb 0.56 0.96 -0.11 0.00 -2.10 0.00 0.00 70.33 69.65 1tkr n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tkr n THR 351 N -1.27 0.00 -1.51 4.28 -2.24 -1.26 -5.08 114.28 107.20 1tkr n THR 351 Ca 0.02 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1tkr n THR 351 Cb 0.16 0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1tkr n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tkr n GLY 352 N 1.57 2.22 3.93 3.38 0.00 -1.26 -4.82 105.19 110.21 1tkr n GLY 352 Ca -0.01 -0.37 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 1tkr n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1tkr s TRP 353 N -1.05 2.54 -0.06 1.61 -2.14 -1.26 -4.53 118.94 114.05 1tkr s TRP 353 Ca 0.00 0.38 -0.17 0.00 2.66 0.00 0.00 56.10 58.97 1tkr s TRP 353 Cb 0.00 -3.38 -0.05 0.00 -3.10 0.00 0.00 33.47 26.94 1tkr s TRP 353 CO 0.00 -1.71 0.47 0.08 -2.66 0.00 0.00 176.95 173.13 1tkr s VAL 354 N -3.40 5.09 0.13 -0.66 1.01 -0.56 -4.80 120.40 117.20 1tkr s VAL 354 Ca 0.63 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.57 1tkr s VAL 354 Cb -0.09 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1tkr s VAL 354 CO 0.47 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.60 1tkr n GLY 355 N 2.68 -2.02 0.23 4.51 0.00 -1.26 -3.82 105.19 105.52 1tkr n GLY 355 Ca -0.09 -1.40 -0.13 0.00 0.00 0.00 0.00 46.02 44.40 1tkr n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1tkr h ARG 356 N -0.38 0.79 0.00 1.61 3.08 -1.97 -3.40 114.38 114.12 1tkr h ARG 356 Ca -0.02 -0.42 0.00 0.00 0.07 0.00 0.00 59.98 59.61 1tkr h ARG 356 Cb 0.37 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1tkr h ARG 356 CO 0.01 1.05 -0.29 1.19 -1.07 0.00 0.00 179.97 180.86 1tkr n PHE 357 N -4.19 0.00 -3.54 3.04 3.72 -1.26 -4.84 117.46 110.38 1tkr n PHE 357 Ca -0.03 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.30 1tkr n PHE 357 Cb 0.50 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.02 1tkr n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1tkr s ARG 358 N -0.90 0.77 0.28 -1.08 1.70 -1.25 -5.03 118.95 113.44 1tkr s ARG 358 Ca 0.00 -0.31 -0.30 0.00 -0.47 0.00 0.00 55.73 54.65 1tkr s ARG 358 Cb 0.00 0.34 -0.13 0.00 -0.57 0.00 0.00 34.95 34.59 1tkr s ARG 358 CO 0.00 -0.34 1.42 -0.35 -1.08 0.00 0.00 175.30 174.95 1tkr n PRO 359 N -0.25 2.22 -0.96 3.89 -0.04 -1.25 -4.36 135.00 134.24 1tkr n PRO 359 Ca -0.07 0.79 -0.34 0.00 -0.04 0.00 0.00 63.50 63.84 1tkr n PRO 359 Cb 0.61 -2.45 0.11 0.00 -0.04 0.00 0.00 33.50 31.73 1tkr n PRO 359 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1tkr n SER 360 N 1.80 -1.02 -4.72 3.54 3.41 -1.26 -4.95 113.62 110.42 1tkr n SER 360 Ca 0.09 0.45 -0.40 0.00 -0.26 0.00 0.00 58.87 58.75 1tkr n SER 360 Cb 0.34 -1.29 -0.04 0.00 -0.26 0.00 0.00 64.21 62.95 1tkr n SER 360 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1tkr s GLU 361 N -3.60 4.48 0.43 4.33 2.12 -1.26 -4.95 118.70 120.26 1tkr s GLU 361 Ca 0.63 1.07 -0.22 0.00 0.36 0.00 0.00 54.97 56.81 1tkr s GLU 361 Cb -0.26 -3.44 -0.10 0.00 0.26 0.00 0.00 34.13 30.59 1tkr s GLU 361 CO 0.61 0.06 0.99 -1.25 -0.54 0.00 0.00 175.26 175.12 1tkr s PRO 362 N 0.76 4.13 -0.41 4.30 0.04 -1.26 -4.62 135.00 137.93 1tkr s PRO 362 Ca 0.42 1.26 0.03 0.00 0.04 0.00 0.00 61.00 62.75 1tkr s PRO 362 Cb -0.19 -2.25 0.12 0.00 0.04 0.00 0.00 34.50 32.21 1tkr s PRO 362 CO 0.22 -0.13 0.16 -1.01 0.04 0.00 0.00 177.00 176.27 1tkr s HIS 363 N -2.01 2.99 0.41 0.56 3.76 0.12 -4.96 115.29 116.16 1tkr s HIS 363 Ca 0.62 -2.80 -0.24 0.00 -0.15 0.00 0.00 55.06 52.49 1tkr s HIS 363 Cb -0.14 -2.55 -0.09 0.00 1.11 0.00 0.00 32.58 30.91 1tkr s HIS 363 CO 0.18 -0.84 1.08 -0.06 -0.85 0.00 0.00 174.74 174.25 1tkr s PHE 364 N 0.49 3.17 1.09 1.40 0.40 -1.26 -0.22 117.98 123.05 1tkr s PHE 364 Ca 0.14 1.61 -0.17 0.00 -0.60 0.00 0.00 56.93 57.92 1tkr s PHE 364 Cb -0.22 -3.20 0.24 0.00 0.51 0.00 0.00 43.02 40.35 1tkr s PHE 364 CO -0.06 -0.86 1.17 0.95 0.70 0.00 0.00 175.22 177.12 1tkr s THR 365 N -1.61 1.79 0.14 0.64 -4.23 0.29 -4.85 115.64 107.80 1tkr s THR 365 Ca 0.59 0.00 -0.27 0.00 -1.18 0.00 0.00 61.69 60.83 1tkr s THR 365 Cb -0.24 -2.66 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 1tkr s THR 365 CO 0.30 0.00 1.59 0.25 -0.54 0.00 0.00 174.62 176.22 1tkr h LEU 366 N -2.14 -1.17 -0.01 4.79 5.85 -1.93 -0.36 115.31 120.34 1tkr h LEU 366 Ca -0.46 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1tkr h LEU 366 Cb 1.29 0.49 0.00 0.00 0.37 0.00 0.00 40.66 42.81 1tkr h LEU 366 CO 0.41 -0.38 0.00 -0.90 -0.34 0.00 0.00 178.44 177.23 1tkr n ASP 367 N -5.42 0.02 -3.84 1.25 5.75 -1.26 -4.90 116.55 108.14 1tkr n ASP 367 Ca -0.03 -1.39 -0.30 0.00 -0.01 0.00 0.00 54.79 53.07 1tkr n ASP 367 Cb 0.34 -0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.45 1tkr n ASP 367 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tkr n GLY 368 N 0.81 -0.49 0.00 6.12 0.00 -0.15 -4.85 105.19 106.63 1tkr n GLY 368 Ca 0.15 0.18 0.06 0.00 0.00 0.00 0.00 46.02 46.41 1tkr n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tkr n ASN 369 N -2.74 1.00 -3.91 1.61 5.03 -1.26 -4.92 115.26 110.07 1tkr n ASN 369 Ca 0.04 -0.57 -0.09 0.00 0.87 0.00 0.00 54.58 54.82 1tkr n ASN 369 Cb 0.53 1.19 -0.07 0.00 -1.02 0.00 0.00 39.78 40.41 1tkr n ASN 369 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1tkr s SER 370 N -2.65 0.01 0.16 6.41 1.04 -1.26 -1.48 113.70 115.93 1tkr s SER 370 Ca 0.02 -0.78 -0.16 0.00 0.48 0.00 0.00 55.95 55.51 1tkr s SER 370 Cb 0.10 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.68 1tkr s SER 370 CO 0.55 -0.89 0.44 0.72 0.98 0.00 0.00 173.24 175.04 1tkr s PHE 371 N -3.94 -0.09 -0.03 5.02 -0.12 -1.02 -0.55 117.98 117.24 1tkr s PHE 371 Ca 0.14 -0.25 0.05 0.00 -0.05 0.00 0.00 56.93 56.82 1tkr s PHE 371 Cb 0.03 0.27 -0.03 0.00 -0.63 0.00 0.00 43.02 42.67 1tkr s PHE 371 CO -0.02 -0.79 -0.17 0.71 -0.05 0.00 0.00 175.22 174.89 1tkr s TYR 372 N -3.85 2.60 -0.19 3.49 1.51 0.69 -0.20 117.35 121.40 1tkr s TYR 372 Ca 0.07 -0.23 -0.26 0.00 -1.01 0.00 0.00 57.07 55.64 1tkr s TYR 372 Cb 0.01 -1.58 0.07 0.00 -0.11 0.00 0.00 41.96 40.34 1tkr s TYR 372 CO -0.07 0.14 0.69 -1.59 -1.11 0.00 0.00 175.55 173.61 1tkr s LYS 373 N -0.78 0.89 -0.11 -0.62 0.00 -0.79 0.15 119.74 118.49 1tkr s LYS 373 Ca 0.11 0.73 -0.30 0.00 0.00 0.00 0.00 55.97 56.51 1tkr s LYS 373 Cb -0.10 0.43 -0.02 0.00 0.00 0.00 0.00 37.83 38.13 1tkr s LYS 373 CO 0.01 -0.17 1.17 0.42 0.00 0.00 0.00 175.35 176.78 1tkr s ILE 374 N -0.15 4.38 0.15 3.79 1.01 -1.26 -1.70 121.20 127.42 1tkr s ILE 374 Ca -0.04 1.69 0.01 0.00 0.00 0.00 0.00 60.65 62.31 1tkr s ILE 374 Cb -0.03 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.31 1tkr s ILE 374 CO 0.04 -0.06 0.00 0.27 0.00 0.00 0.00 174.94 175.19 1tkr s ILE 375 N 2.65 0.57 0.38 2.92 -4.36 -0.82 -4.49 121.20 118.03 1tkr s ILE 375 Ca 0.53 -1.96 -0.25 0.00 -0.26 0.00 0.00 60.65 58.72 1tkr s ILE 375 Cb -0.22 -2.03 -0.09 0.00 1.25 0.00 0.00 42.46 41.37 1tkr s ILE 375 CO 0.18 -0.54 1.03 -0.55 0.24 0.00 0.00 174.94 175.29 1tkr s SER 376 N -3.13 6.91 1.17 4.36 0.15 -1.26 -1.57 113.70 120.33 1tkr s SER 376 Ca 0.22 2.01 -0.19 0.00 0.70 0.00 0.00 55.95 58.69 1tkr s SER 376 Cb 0.06 -2.59 0.28 0.00 -1.71 0.00 0.00 66.02 62.07 1tkr s SER 376 CO 0.02 -0.39 1.15 0.20 1.20 0.00 0.00 173.24 175.43 1tkr s ASN 377 N -1.53 1.18 0.18 5.45 0.01 0.69 -4.85 114.94 116.08 1tkr s ASN 377 Ca 0.55 0.51 -0.02 0.00 -0.71 0.00 0.00 52.86 53.19 1tkr s ASN 377 Cb -0.22 -0.68 0.07 0.00 0.41 0.00 0.00 41.25 40.84 1tkr s ASN 377 CO 0.28 -3.95 1.45 -0.08 -1.51 0.00 0.00 177.10 173.29 1tkr h GLU 378 N -2.47 0.47 -0.12 -0.60 4.57 -1.97 -2.55 114.58 111.91 1tkr h GLU 378 Ca -0.44 -0.35 0.00 0.00 -1.18 0.00 0.00 59.36 57.39 1tkr h GLU 378 Cb 1.28 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.93 1tkr h GLU 378 CO 0.32 0.97 0.00 -1.91 -1.18 0.00 0.00 179.01 177.22 1tkr n GLU 379 N -3.88 1.67 -0.48 1.92 2.13 -1.26 -4.94 120.64 115.80 1tkr n GLU 379 Ca -0.04 -1.00 0.00 0.00 0.66 0.00 0.00 57.16 56.78 1tkr n GLU 379 Cb 0.68 -1.41 0.00 0.00 0.27 0.00 0.00 31.44 30.97 1tkr n GLU 379 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1tkr n GLY 380 N 1.13 0.75 3.81 8.31 0.00 -0.96 -4.60 105.19 113.61 1tkr n GLY 380 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1tkr n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tkr s TYR 381 N -2.64 3.56 -0.12 1.61 1.51 -1.26 0.38 117.35 120.38 1tkr s TYR 381 Ca 0.00 0.60 -0.30 0.00 -1.01 0.00 0.00 57.07 56.37 1tkr s TYR 381 Cb 0.00 -2.14 -0.02 0.00 -0.11 0.00 0.00 41.96 39.69 1tkr s TYR 381 CO 0.00 0.52 1.21 1.03 -1.11 0.00 0.00 175.55 177.20 1tkr s ARG 382 N -0.44 4.29 0.10 -0.62 0.52 -1.26 -0.22 118.95 121.32 1tkr s ARG 382 Ca 0.16 1.64 -0.03 0.00 -0.52 0.00 0.00 55.73 56.97 1tkr s ARG 382 Cb -0.13 -3.66 -0.03 0.00 0.52 0.00 0.00 34.95 31.65 1tkr s ARG 382 CO 0.05 -0.58 0.08 -1.01 0.02 0.00 0.00 175.30 173.86 1tkr s HIS 383 N 2.88 0.59 -0.07 -0.53 3.76 -0.61 -1.89 115.29 119.43 1tkr s HIS 383 Ca 0.54 -1.03 -0.30 0.00 -0.15 0.00 0.00 55.06 54.13 1tkr s HIS 383 Cb -0.22 -0.34 -0.03 0.00 1.11 0.00 0.00 32.58 33.10 1tkr s HIS 383 CO 0.17 -0.51 1.25 0.42 -0.85 0.00 0.00 174.74 175.23 1tkr s ILE 384 N -3.97 4.16 -0.08 0.60 1.01 -1.26 -1.94 121.20 119.73 1tkr s ILE 384 Ca 0.15 1.49 0.02 0.00 0.00 0.00 0.00 60.65 62.30 1tkr s ILE 384 Cb 0.07 -3.96 -0.02 0.00 0.01 0.00 0.00 42.46 38.56 1tkr s ILE 384 CO -0.04 -0.03 -0.12 0.00 0.00 0.00 0.00 174.94 174.75 1tkr s TYR 386 N -0.46 3.30 0.45 0.00 5.04 0.14 -1.88 117.35 123.94 1tkr s TYR 386 Ca 0.06 0.44 0.06 0.00 -2.44 0.00 0.00 57.07 55.19 1tkr s TYR 386 Cb -0.12 -2.49 -0.03 0.00 0.35 0.00 0.00 41.96 39.67 1tkr s TYR 386 CO 0.02 -0.09 0.21 -0.06 -1.34 0.00 0.00 175.55 174.29 1tkr s PHE 387 N 1.58 2.36 -0.05 4.97 0.40 0.72 -0.76 117.98 127.20 1tkr s PHE 387 Ca 0.15 -0.67 -0.01 0.00 -0.60 0.00 0.00 56.93 55.80 1tkr s PHE 387 Cb -0.15 -1.93 0.03 0.00 0.51 0.00 0.00 43.02 41.48 1tkr s PHE 387 CO 0.08 0.06 0.01 -0.65 0.70 0.00 0.00 175.22 175.42 1tkr s GLN 388 N -3.98 0.35 0.00 0.44 1.11 -1.26 -2.45 119.66 113.87 1tkr s GLN 388 Ca 0.37 0.15 0.00 0.00 0.01 0.00 0.00 55.36 55.88 1tkr s GLN 388 Cb 0.02 -0.68 0.00 0.00 -1.01 0.00 0.00 33.01 31.34 1tkr s GLN 388 CO 0.21 -0.24 0.41 0.44 0.01 0.00 0.00 175.29 176.12 1tkr n ILE 389 N 4.77 0.32 0.00 1.08 -5.35 -0.55 -1.25 119.36 118.38 1tkr n ILE 389 Ca -0.14 0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.50 1tkr n ILE 389 Cb 0.50 -1.16 0.00 0.00 -1.74 0.00 0.00 39.64 37.25 1tkr n ILE 389 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1tkr n ASP 390 N -0.91 4.16 -4.67 7.28 5.68 -1.26 -4.42 116.55 122.41 1tkr n ASP 390 Ca 0.00 0.00 -0.41 0.00 -0.50 0.00 0.00 54.79 53.88 1tkr n ASP 390 Cb 0.08 0.54 -0.05 0.00 -1.14 0.00 0.00 41.12 40.55 1tkr n ASP 390 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1tkr s LYS 391 N -1.78 4.27 0.15 0.11 1.02 -0.38 -4.81 119.74 118.31 1tkr s LYS 391 Ca 0.00 0.87 -0.17 0.00 0.02 0.00 0.00 55.97 56.69 1tkr s LYS 391 Cb 0.00 -3.57 0.02 0.00 -0.52 0.00 0.00 37.83 33.76 1tkr s LYS 391 CO 0.00 -0.29 1.78 1.57 -0.92 0.00 0.00 175.35 177.48 1tkr h LYS 392 N 7.38 0.34 -6.10 1.68 2.10 -1.86 -3.39 116.57 116.73 1tkr h LYS 392 Ca -0.30 -0.02 -0.59 0.00 -2.00 0.00 0.00 60.65 57.73 1tkr h LYS 392 Cb 1.14 -0.08 -0.05 0.00 -0.90 0.00 0.00 32.23 32.34 1tkr h LYS 392 CO 0.81 0.23 -0.21 -0.51 -2.00 0.00 0.00 179.45 177.77 1tkr s ASP 393 N -5.42 6.73 0.54 7.07 1.01 -1.26 -4.94 116.67 120.41 1tkr s ASP 393 Ca -0.13 0.90 0.08 0.00 0.71 0.00 0.00 52.55 54.11 1tkr s ASP 393 Cb 0.11 -2.22 0.06 0.00 1.01 0.00 0.00 42.92 41.87 1tkr s ASP 393 CO 0.71 0.22 0.60 0.00 0.21 0.00 0.00 175.17 176.91 1tkr s THR 395 N -2.68 1.36 0.12 0.00 2.01 0.06 -4.87 115.64 111.64 1tkr s THR 395 Ca 0.49 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.61 1tkr s THR 395 Cb -0.04 -1.25 -0.07 0.00 0.01 0.00 0.00 72.50 71.15 1tkr s THR 395 CO 0.31 0.41 1.24 -0.36 -0.69 0.00 0.00 174.62 175.53 1tkr s PHE 396 N 0.87 3.39 -1.07 4.92 0.08 -1.26 0.25 117.98 125.15 1tkr s PHE 396 Ca -0.10 1.26 0.17 0.00 0.12 0.00 0.00 56.93 58.38 1tkr s PHE 396 Cb -0.15 -3.49 -0.12 0.00 -0.57 0.00 0.00 43.02 38.69 1tkr s PHE 396 CO 0.01 -1.51 0.78 0.44 -0.10 0.00 0.00 175.22 174.84 1tkr n ILE 397 N 3.45 0.00 -4.10 0.64 -5.35 0.07 -4.92 119.36 109.14 1tkr n ILE 397 Ca 0.08 -0.17 -0.14 0.00 -0.27 0.00 0.00 62.75 62.24 1tkr n ILE 397 Cb 0.45 1.07 -0.13 0.00 -1.74 0.00 0.00 39.64 39.29 1tkr n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1tkr s THR 398 N -2.40 0.47 0.24 7.28 -4.23 -1.25 -4.95 115.64 110.79 1tkr s THR 398 Ca 0.09 -0.71 -0.12 0.00 -1.18 0.00 0.00 61.69 59.77 1tkr s THR 398 Cb 0.13 -0.49 -0.01 0.00 1.34 0.00 0.00 72.50 73.48 1tkr s THR 398 CO 0.61 -0.18 0.46 -1.59 -0.54 0.00 0.00 174.62 173.38 1tkr s LYS 399 N -0.96 1.52 0.00 3.99 -2.85 -1.26 -4.53 119.74 115.66 1tkr s LYS 399 Ca -0.05 -1.26 0.00 0.00 -1.00 0.00 0.00 55.97 53.66 1tkr s LYS 399 Cb -0.07 0.46 0.00 0.00 -2.06 0.00 0.00 37.83 36.16 1tkr s LYS 399 CO 0.00 -0.63 0.00 0.41 0.10 0.00 0.00 175.35 175.23 1tkr n GLY 400 N -0.37 1.90 3.05 0.59 0.00 -1.26 -4.90 105.19 104.20 1tkr n GLY 400 Ca -0.02 -2.13 -0.43 0.00 0.00 0.00 0.00 46.02 43.44 1tkr n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tkr n THR 401 N -1.25 4.73 -3.64 2.61 -2.24 -1.26 -4.84 114.28 108.38 1tkr n THR 401 Ca 0.00 -5.12 -0.03 0.00 -2.27 0.00 0.00 64.05 56.63 1tkr n THR 401 Cb 0.00 -2.30 -0.01 0.00 -2.10 0.00 0.00 70.33 65.92 1tkr n THR 401 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1tkr s TRP 402 N -0.82 -0.14 0.09 4.78 1.48 -1.26 -5.04 118.94 118.04 1tkr s TRP 402 Ca 0.36 -0.04 0.08 0.00 -1.06 0.00 0.00 56.10 55.44 1tkr s TRP 402 Cb 0.04 0.57 -0.03 0.00 -1.16 0.00 0.00 33.47 32.89 1tkr s TRP 402 CO 0.03 -0.50 -0.21 -1.21 -4.06 0.00 0.00 176.95 171.00 1tkr s GLU 403 N -2.84 1.16 -0.24 3.25 2.02 -1.26 -4.59 118.70 116.21 1tkr s GLU 403 Ca 0.11 -1.13 -0.27 0.00 0.02 0.00 0.00 54.97 53.70 1tkr s GLU 403 Cb 0.01 -1.41 0.00 0.00 0.10 0.00 0.00 34.13 32.83 1tkr s GLU 403 CO -0.03 0.33 0.95 0.08 0.02 0.00 0.00 175.26 176.62 1tkr s VAL 404 N -1.11 4.74 0.07 2.63 1.01 -0.79 -2.27 120.40 124.68 1tkr s VAL 404 Ca 0.07 1.83 -0.17 0.00 0.00 0.00 0.00 61.98 63.71 1tkr s VAL 404 Cb -0.10 -4.23 -0.12 0.00 0.00 0.00 0.00 36.38 31.92 1tkr s VAL 404 CO 0.04 -0.14 1.35 0.40 0.00 0.00 0.00 175.10 176.75 1tkr h ILE 405 N 5.45 1.33 -1.15 2.22 1.08 0.25 -3.45 117.51 123.23 1tkr h ILE 405 Ca -0.21 -1.54 0.20 0.00 -0.39 0.00 0.00 64.86 62.93 1tkr h ILE 405 Cb 1.07 1.81 -0.28 0.00 -3.07 0.00 0.00 36.82 36.36 1tkr h ILE 405 CO 0.94 0.48 0.87 -0.83 -0.69 0.00 0.00 178.15 178.91 1tkr s GLY 406 N -3.70 0.09 -0.15 5.37 0.00 -1.02 -5.00 107.32 102.90 1tkr s GLY 406 Ca -0.13 2.87 -0.29 0.00 0.00 0.00 0.00 44.72 47.17 1tkr s GLY 406 CO 0.81 1.30 1.10 -0.42 0.00 0.00 0.00 173.10 175.89 1tkr s ILE 407 N -0.76 4.57 -0.17 0.90 1.01 -1.26 -1.88 121.20 123.60 1tkr s ILE 407 Ca 0.07 1.88 0.08 0.00 0.00 0.00 0.00 60.65 62.67 1tkr s ILE 407 Cb -0.02 -4.21 -0.22 0.00 0.01 0.00 0.00 42.46 38.02 1tkr s ILE 407 CO -0.08 -0.09 0.15 -0.62 0.00 0.00 0.00 174.94 174.31 1tkr n GLU 408 N 5.78 0.68 -3.52 2.79 -0.58 0.12 -4.98 120.64 120.93 1tkr n GLU 408 Ca 0.11 0.15 -0.17 0.00 -0.42 0.00 0.00 57.16 56.83 1tkr n GLU 408 Cb 0.47 -1.61 -0.06 0.00 -0.57 0.00 0.00 31.44 29.67 1tkr n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1tkr s ALA 409 N -2.53 -1.78 -0.02 0.62 0.00 -0.88 -4.84 121.76 112.33 1tkr s ALA 409 Ca -0.18 1.30 0.01 0.00 0.00 0.00 0.00 51.96 53.09 1tkr s ALA 409 Cb 0.07 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.17 1tkr s ALA 409 CO 0.75 -0.39 -0.04 -1.17 0.00 0.00 0.00 175.76 174.91 1tkr s LEU 410 N -1.28 1.66 0.00 0.00 2.96 -1.26 0.20 118.68 120.96 1tkr s LEU 410 Ca -0.09 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 53.75 1tkr s LEU 410 Cb -0.00 -0.33 -0.01 0.00 0.50 0.00 0.00 46.19 46.35 1tkr s LEU 410 CO 0.08 0.00 0.11 0.35 -1.32 0.00 0.00 176.35 175.57 1tkr n THR 411 N 3.48 0.00 0.10 3.68 -2.24 -0.30 -4.98 114.28 114.02 1tkr n THR 411 Ca -0.19 -1.18 -0.05 0.00 -2.27 0.00 0.00 64.05 60.36 1tkr n THR 411 Cb 0.54 0.53 0.06 0.00 -2.10 0.00 0.00 70.33 69.36 1tkr n THR 411 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1tkr h SER 412 N 0.92 0.13 0.20 3.42 4.64 -2.01 -3.34 113.55 117.51 1tkr h SER 412 Ca -0.13 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.09 1tkr h SER 412 Cb 0.59 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1tkr h SER 412 CO 0.19 0.84 -0.10 0.44 -0.87 0.00 0.00 176.83 177.34 1tkr h ASP 413 N 0.06 -0.23 -3.82 4.97 3.32 -1.98 -3.44 116.42 115.30 1tkr h ASP 413 Ca -0.02 -0.23 -0.52 0.00 0.02 0.00 0.00 57.03 56.28 1tkr h ASP 413 Cb 1.34 0.06 -0.13 0.00 0.22 0.00 0.00 39.33 40.82 1tkr h ASP 413 CO 0.11 0.31 -0.52 -0.31 -1.72 0.00 0.00 179.24 177.11 1tkr s TYR 414 N -3.05 1.76 -0.19 4.55 1.51 -1.26 -1.88 117.35 118.78 1tkr s TYR 414 Ca -0.10 -1.35 -0.01 0.00 -1.01 0.00 0.00 57.07 54.60 1tkr s TYR 414 Cb 0.00 -1.04 0.05 0.00 -0.11 0.00 0.00 41.96 40.86 1tkr s TYR 414 CO 0.35 -0.42 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.17 1tkr s LEU 415 N -3.53 1.76 -0.20 -1.29 1.98 -0.80 -1.15 118.68 115.46 1tkr s LEU 415 Ca 0.28 -0.85 -0.14 0.00 -2.89 0.00 0.00 54.13 50.53 1tkr s LEU 415 Cb 0.03 -0.90 -0.04 0.00 0.66 0.00 0.00 46.19 45.94 1tkr s LEU 415 CO 0.17 -0.23 0.32 -0.31 -1.89 0.00 0.00 176.35 174.41 1tkr s TYR 416 N 1.63 3.39 0.34 5.38 1.51 0.13 -1.51 117.35 128.22 1tkr s TYR 416 Ca -0.02 0.54 0.07 0.00 -1.01 0.00 0.00 57.07 56.65 1tkr s TYR 416 Cb -0.17 -2.43 -0.03 0.00 -0.11 0.00 0.00 41.96 39.23 1tkr s TYR 416 CO -0.07 0.08 0.27 1.52 -1.11 0.00 0.00 175.55 176.24 1tkr s TYR 417 N 1.02 1.78 -0.06 2.71 -0.85 0.03 0.15 117.35 122.13 1tkr s TYR 417 Ca 0.16 -1.66 0.01 0.00 -0.52 0.00 0.00 57.07 55.06 1tkr s TYR 417 Cb -0.14 -0.75 0.02 0.00 0.38 0.00 0.00 41.96 41.47 1tkr s TYR 417 CO 0.06 -0.85 -0.06 0.42 -1.52 0.00 0.00 175.55 173.61 1tkr s ILE 418 N -3.41 0.67 0.27 -3.49 1.01 -0.79 0.06 121.20 115.52 1tkr s ILE 418 Ca 0.40 -0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.89 1tkr s ILE 418 Cb 0.02 -0.69 -0.03 0.00 0.01 0.00 0.00 42.46 41.77 1tkr s ILE 418 CO 0.27 0.26 0.23 -0.94 0.00 0.00 0.00 174.94 174.76 1tkr s SER 419 N 1.04 0.88 -0.52 3.58 1.04 -1.05 0.23 113.70 118.89 1tkr s SER 419 Ca -0.09 -1.55 0.03 0.00 0.48 0.00 0.00 55.95 54.82 1tkr s SER 419 Cb -0.14 0.48 0.43 0.00 0.10 0.00 0.00 66.02 66.88 1tkr s SER 419 CO -0.00 -0.97 1.50 -0.46 0.98 0.00 0.00 173.24 174.28 1tkr n ASN 420 N -0.91 5.92 -0.03 7.02 0.23 -0.96 -2.06 115.26 124.47 1tkr n ASN 420 Ca 0.04 -3.77 -0.12 0.00 -0.53 0.00 0.00 54.58 50.21 1tkr n ASN 420 Cb 0.64 -0.64 -0.10 0.00 -2.08 0.00 0.00 39.78 37.60 1tkr n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1tkr h GLU 421 N 2.41 -0.04 -6.00 -3.83 4.81 -1.85 -3.37 114.58 106.71 1tkr h GLU 421 Ca 0.44 0.00 -0.78 0.00 -0.13 0.00 0.00 59.36 58.88 1tkr h GLU 421 Cb 0.93 0.01 0.05 0.00 0.63 0.00 0.00 28.75 30.37 1tkr h GLU 421 CO 1.08 0.65 0.04 0.98 -0.73 0.00 0.00 179.01 181.03 1tkr n TYR 422 N -4.75 0.60 -0.43 0.92 9.36 -1.26 0.14 117.16 121.74 1tkr n TYR 422 Ca -0.08 1.05 0.00 0.00 3.32 0.00 0.00 57.90 62.19 1tkr n TYR 422 Cb 0.35 -2.09 0.00 0.00 -0.63 0.00 0.00 39.34 36.97 1tkr n TYR 422 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1tkr n LYS 423 N 1.49 -0.15 -1.78 2.98 4.01 -1.26 -2.68 118.16 120.76 1tkr n LYS 423 Ca 0.20 0.03 -0.14 0.00 -0.51 0.00 0.00 58.31 57.89 1tkr n LYS 423 Cb 0.09 -3.85 -0.03 0.00 -0.51 0.00 0.00 35.03 30.72 1tkr n LYS 423 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1tkr n GLY 424 N -1.24 0.70 3.41 0.72 0.00 0.12 -5.00 105.19 103.90 1tkr n GLY 424 Ca 0.00 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 1tkr n GLY 424 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1tkr s MET 425 N -3.83 3.55 0.45 1.61 0.23 -1.09 -4.98 119.30 115.23 1tkr s MET 425 Ca 0.00 -0.54 0.31 0.00 -1.03 0.00 0.00 55.69 54.43 1tkr s MET 425 Cb 0.00 -3.25 1.54 0.00 -1.53 0.00 0.00 34.83 31.59 1tkr s MET 425 CO 0.00 -0.21 1.94 -1.00 -2.03 0.00 0.00 175.02 173.72 1tkr h PRO 426 N 8.21 0.00 -0.47 3.16 0.13 -1.88 -2.67 132.00 138.48 1tkr h PRO 426 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1tkr h PRO 426 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1tkr h PRO 426 CO 0.59 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.77 1tkr n GLY 427 N -0.74 1.00 3.66 1.56 0.00 -1.26 -4.86 105.19 104.54 1tkr n GLY 427 Ca -0.01 -0.37 -0.24 0.00 0.00 0.00 0.00 46.02 45.40 1tkr n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tkr s GLY 428 N -0.81 2.05 -0.12 -0.02 0.00 -1.01 -1.79 107.32 105.62 1tkr s GLY 428 Ca 0.22 -1.93 -0.08 0.00 0.00 0.00 0.00 44.72 42.93 1tkr s GLY 428 CO 0.12 -1.87 0.29 0.50 0.00 0.00 0.00 173.10 172.15 1tkr s ARG 429 N -3.75 0.29 0.04 2.90 1.81 0.20 -4.29 118.95 116.15 1tkr s ARG 429 Ca 0.36 0.52 0.00 0.00 -1.72 0.00 0.00 55.73 54.89 1tkr s ARG 429 Cb -0.01 0.01 -0.03 0.00 -0.45 0.00 0.00 34.95 34.48 1tkr s ARG 429 CO 0.20 -0.11 -0.04 -0.80 -0.68 0.00 0.00 175.30 173.87 1tkr s ASN 430 N 0.83 0.53 -0.30 0.23 0.01 -0.87 -0.98 114.94 114.39 1tkr s ASN 430 Ca -0.05 -0.73 -0.20 0.00 -0.71 0.00 0.00 52.86 51.16 1tkr s ASN 430 Cb -0.07 0.12 -0.01 0.00 0.41 0.00 0.00 41.25 41.70 1tkr s ASN 430 CO -0.06 -0.40 0.62 -0.22 -1.51 0.00 0.00 177.10 175.53 1tkr s LEU 431 N -2.14 4.13 0.28 0.60 2.96 -1.26 -2.53 118.68 120.72 1tkr s LEU 431 Ca -0.04 0.46 0.10 0.00 -0.22 0.00 0.00 54.13 54.43 1tkr s LEU 431 Cb -0.02 -2.80 -0.05 0.00 0.50 0.00 0.00 46.19 43.82 1tkr s LEU 431 CO -0.04 -0.45 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.16 1tkr s TYR 432 N 2.57 2.53 -0.03 5.38 1.51 0.11 0.07 117.35 129.49 1tkr s TYR 432 Ca 0.25 -0.30 -0.01 0.00 -1.01 0.00 0.00 57.07 56.00 1tkr s TYR 432 Cb -0.15 -1.18 0.02 0.00 -0.11 0.00 0.00 41.96 40.54 1tkr s TYR 432 CO 0.11 0.63 0.06 -1.59 -1.11 0.00 0.00 175.55 173.65 1tkr s LYS 433 N -3.63 0.04 -0.07 -0.62 -2.85 -0.29 -0.79 119.74 111.53 1tkr s LYS 433 Ca 0.32 0.15 0.04 0.00 -1.00 0.00 0.00 55.97 55.47 1tkr s LYS 433 Cb -0.05 -0.08 -0.01 0.00 -2.06 0.00 0.00 37.83 35.63 1tkr s LYS 433 CO 0.18 -0.07 -0.20 -1.50 0.10 0.00 0.00 175.35 173.85 1tkr s ILE 434 N 0.47 2.47 -0.03 3.79 2.07 -0.57 -0.51 121.20 128.89 1tkr s ILE 434 Ca -0.04 -0.92 -0.30 0.00 -1.41 0.00 0.00 60.65 57.99 1tkr s ILE 434 Cb -0.05 -1.94 -0.04 0.00 0.13 0.00 0.00 42.46 40.55 1tkr s ILE 434 CO -0.02 0.57 1.32 -1.58 -1.91 0.00 0.00 174.94 173.32 1tkr s GLN 435 N -0.20 4.30 0.20 3.50 0.74 -0.57 -1.90 119.66 125.74 1tkr s GLN 435 Ca -0.02 1.84 0.20 0.00 0.05 0.00 0.00 55.36 57.44 1tkr s GLN 435 Cb -0.13 -3.58 0.88 0.00 1.10 0.00 0.00 33.01 31.27 1tkr s GLN 435 CO 0.03 -0.54 1.62 1.28 -0.55 0.00 0.00 175.29 177.14 1tkr n LEU 436 N 5.40 0.48 -0.28 3.68 4.32 -0.79 -2.53 117.00 127.29 1tkr n LEU 436 Ca 0.12 0.63 0.09 0.00 -0.02 0.00 0.00 56.01 56.84 1tkr n LEU 436 Cb 0.45 -0.59 -0.04 0.00 -1.62 0.00 0.00 43.42 41.62 1tkr n LEU 436 CO 0.57 -0.54 0.17 -1.54 -1.22 0.00 0.00 177.39 174.83 1tkr n SER 437 N -2.05 1.48 -3.25 -1.43 3.41 -1.26 -4.79 113.62 105.73 1tkr n SER 437 Ca 0.02 -1.24 -0.04 0.00 -0.26 0.00 0.00 58.87 57.35 1tkr n SER 437 Cb 0.18 0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 64.76 1tkr n SER 437 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1tkr s ASP 438 N -2.35 -0.80 0.00 4.04 -1.08 -1.05 -5.01 116.67 110.42 1tkr s ASP 438 Ca 0.13 -0.98 0.00 0.00 -0.52 0.00 0.00 52.55 51.18 1tkr s ASP 438 Cb 0.15 1.58 0.00 0.00 -1.46 0.00 0.00 42.92 43.19 1tkr s ASP 438 CO 0.57 -0.20 0.70 -1.22 0.52 0.00 0.00 175.17 175.54 1tkr n TYR 439 N 4.40 0.00 0.19 -5.34 4.01 -1.22 -0.34 117.16 118.86 1tkr n TYR 439 Ca 0.11 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.97 1tkr n TYR 439 Cb 0.54 -0.22 0.07 0.00 -0.31 0.00 0.00 39.34 39.42 1tkr n TYR 439 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1tkr h THR 440 N 0.00 0.00 -3.23 -0.72 1.03 -1.93 -3.41 112.91 104.65 1tkr h THR 440 Ca 0.00 -0.94 -0.78 0.00 -0.01 0.00 0.00 66.41 64.68 1tkr h THR 440 Cb 0.04 1.60 -0.25 0.00 -1.07 0.00 0.00 68.15 68.47 1tkr h THR 440 CO 0.00 0.00 0.66 -0.54 -0.01 0.00 0.00 175.52 175.63 1tkr s LYS 441 N -3.30 4.16 -0.07 0.00 1.02 0.54 -4.99 119.74 117.11 1tkr s LYS 441 Ca 0.03 -3.04 0.02 0.00 0.02 0.00 0.00 55.97 52.99 1tkr s LYS 441 Cb 0.09 -4.68 -0.03 0.00 -0.52 0.00 0.00 37.83 32.69 1tkr s LYS 441 CO 0.74 -1.37 -0.11 0.54 -0.92 0.00 0.00 175.35 174.24 1tkr s VAL 442 N -0.53 3.38 -0.05 3.17 0.11 -1.26 -1.51 120.40 123.71 1tkr s VAL 442 Ca 0.33 -0.60 0.02 0.00 -2.93 0.00 0.00 61.98 58.80 1tkr s VAL 442 Cb -0.08 -2.36 0.01 0.00 -1.53 0.00 0.00 36.38 32.42 1tkr s VAL 442 CO -0.06 0.59 -0.08 -0.89 -3.33 0.00 0.00 175.10 171.32 1tkr s THR 443 N -0.68 0.81 0.01 5.04 2.01 0.33 -4.97 115.64 118.20 1tkr s THR 443 Ca 0.10 -0.31 -0.27 0.00 0.31 0.00 0.00 61.69 61.52 1tkr s THR 443 Cb -0.11 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.59 1tkr s THR 443 CO 0.01 0.27 0.83 0.00 -0.69 0.00 0.00 174.62 175.05 1tkr n LEU 445 N 3.36 1.21 0.00 0.00 4.77 0.11 -4.65 117.00 121.80 1tkr n LEU 445 Ca 0.01 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 1tkr n LEU 445 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1tkr n LEU 445 CO 0.49 0.26 -0.49 -1.54 -1.33 0.00 0.00 177.39 174.78 1tkr n SER 446 N -0.98 4.94 -0.33 -1.43 3.41 -1.22 -4.79 113.62 113.23 1tkr n SER 446 Ca 0.05 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.68 1tkr n SER 446 Cb 0.33 0.52 0.08 0.00 -0.26 0.00 0.00 64.21 64.89 1tkr n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tkr n GLU 448 N -5.39 1.25 -0.22 0.00 4.71 -1.26 -4.10 120.64 115.63 1tkr n GLU 448 Ca 0.12 -0.82 -0.01 0.00 -0.01 0.00 0.00 57.16 56.44 1tkr n GLU 448 Cb 0.40 -1.48 0.10 0.00 -1.01 0.00 0.00 31.44 29.45 1tkr n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1tkr h LEU 449 N 1.99 0.48 -5.00 -4.62 3.38 -1.73 -3.38 115.31 106.42 1tkr h LEU 449 Ca 0.00 0.04 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 1tkr h LEU 449 Cb 0.58 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.14 1tkr h LEU 449 CO 0.00 0.30 -0.37 -3.20 0.09 0.00 0.00 178.44 175.26 1tkr n ASN 450 N -4.84 -2.56 -0.20 -0.43 2.85 -1.26 -5.04 115.26 103.78 1tkr n ASN 450 Ca 0.08 -2.75 0.22 0.00 -0.11 0.00 0.00 54.58 52.03 1tkr n ASN 450 Cb 0.19 1.51 0.60 0.00 1.24 0.00 0.00 39.78 43.32 1tkr n ASN 450 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1tkr h PRO 451 N 4.01 0.23 0.03 1.20 0.13 -1.76 0.90 132.00 136.75 1tkr h PRO 451 Ca -0.12 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1tkr h PRO 451 Cb 1.09 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1tkr h PRO 451 CO 0.13 0.15 -0.01 0.93 -0.23 0.00 0.00 178.00 178.97 1tkr h GLU 452 N 0.24 -0.04 0.11 0.86 4.39 -1.96 -3.35 114.58 114.83 1tkr h GLU 452 Ca 0.44 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.84 1tkr h GLU 452 Cb 1.34 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.99 1tkr h GLU 452 CO -0.11 0.38 -1.54 -0.09 -1.16 0.00 0.00 179.01 176.48 1tkr h ARG 453 N -0.47 0.24 -4.85 2.33 2.43 -1.79 -3.42 114.38 108.85 1tkr h ARG 453 Ca -0.00 -0.41 -0.68 0.00 -0.81 0.00 0.00 59.98 58.08 1tkr h ARG 453 Cb 0.44 0.15 -0.34 0.00 -0.42 0.00 0.00 29.97 29.80 1tkr h ARG 453 CO 0.01 1.10 -0.75 0.00 -1.51 0.00 0.00 179.97 178.81 1tkr n GLN 455 N 4.59 -0.41 -3.73 0.00 6.02 0.57 -4.35 117.38 120.06 1tkr n GLN 455 Ca -0.15 -0.21 -0.28 0.00 -0.01 0.00 0.00 57.00 56.35 1tkr n GLN 455 Cb 0.45 -0.71 -0.16 0.00 1.02 0.00 0.00 30.24 30.83 1tkr n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1tkr s TYR 456 N -0.00 1.10 0.24 1.08 6.14 -1.11 -0.63 117.35 124.17 1tkr s TYR 456 Ca 0.00 -0.98 0.09 0.00 0.64 0.00 0.00 57.07 56.82 1tkr s TYR 456 Cb 0.00 -1.11 -0.04 0.00 0.42 0.00 0.00 41.96 41.23 1tkr s TYR 456 CO 0.00 -0.65 -0.01 0.71 0.64 0.00 0.00 175.55 176.23 1tkr s TYR 457 N 1.83 2.72 0.20 4.97 1.51 -0.15 -1.07 117.35 127.35 1tkr s TYR 457 Ca 0.01 -0.21 0.02 0.00 -1.01 0.00 0.00 57.07 55.88 1tkr s TYR 457 Cb -0.17 -1.23 -0.05 0.00 -0.11 0.00 0.00 41.96 40.40 1tkr s TYR 457 CO -0.11 0.59 0.01 0.45 -1.11 0.00 0.00 175.55 175.38 1tkr s SER 458 N -3.47 1.38 0.03 2.29 0.15 0.73 -4.70 113.70 110.11 1tkr s SER 458 Ca 0.30 -1.21 -0.15 0.00 0.70 0.00 0.00 55.95 55.59 1tkr s SER 458 Cb -0.07 0.09 0.02 0.00 -1.71 0.00 0.00 66.02 64.36 1tkr s SER 458 CO 0.19 -0.57 0.33 0.54 1.20 0.00 0.00 173.24 174.93 1tkr s VAL 459 N -3.60 0.07 -0.25 4.45 0.11 -1.26 -1.41 120.40 118.50 1tkr s VAL 459 Ca 0.27 -0.58 -0.03 0.00 -2.93 0.00 0.00 61.98 58.71 1tkr s VAL 459 Cb 0.06 -0.86 0.11 0.00 -1.53 0.00 0.00 36.38 34.16 1tkr s VAL 459 CO 0.06 -0.32 0.23 -0.55 -3.33 0.00 0.00 175.10 171.19 1tkr s SER 460 N -1.86 1.97 0.49 3.54 0.15 -0.37 -4.96 113.70 112.66 1tkr s SER 460 Ca -0.07 -0.66 -0.07 0.00 0.70 0.00 0.00 55.95 55.85 1tkr s SER 460 Cb -0.02 0.26 -0.04 0.00 -1.71 0.00 0.00 66.02 64.51 1tkr s SER 460 CO -0.01 -0.37 0.82 -0.36 1.20 0.00 0.00 173.24 174.52 1tkr s PHE 461 N 2.29 3.56 0.83 3.44 0.40 -1.26 -0.98 117.98 126.26 1tkr s PHE 461 Ca 0.08 0.92 -0.11 0.00 -0.60 0.00 0.00 56.93 57.22 1tkr s PHE 461 Cb -0.15 -2.39 0.12 0.00 0.51 0.00 0.00 43.02 41.11 1tkr s PHE 461 CO -0.25 -0.32 1.18 -1.54 0.70 0.00 0.00 175.22 174.99 1tkr s SER 462 N -4.00 4.13 0.14 1.36 1.04 -0.77 -4.87 113.70 110.73 1tkr s SER 462 Ca 0.49 0.49 -0.28 0.00 0.48 0.00 0.00 55.95 57.13 1tkr s SER 462 Cb -0.10 -0.87 -0.06 0.00 0.10 0.00 0.00 66.02 65.09 1tkr s SER 462 CO 0.45 -2.10 1.41 0.29 0.98 0.00 0.00 173.24 174.27 1tkr n LYS 463 N -3.35 -0.39 -0.87 4.02 4.76 -0.90 -0.62 118.16 120.81 1tkr n LYS 463 Ca 0.11 1.38 0.01 0.00 -2.87 0.00 0.00 58.31 56.94 1tkr n LYS 463 Cb 0.60 -2.04 0.33 0.00 -1.84 0.00 0.00 35.03 32.09 1tkr n LYS 463 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1tkr n GLU 464 N -5.08 4.12 -3.57 1.97 -0.58 -1.26 -4.92 120.64 111.33 1tkr n GLU 464 Ca 0.02 -2.83 -0.26 0.00 -0.42 0.00 0.00 57.16 53.67 1tkr n GLU 464 Cb 0.23 -2.18 0.03 0.00 -0.57 0.00 0.00 31.44 28.96 1tkr n GLU 464 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1tkr n ALA 465 N 0.29 -1.17 0.01 0.62 0.00 0.21 -4.87 120.51 115.60 1tkr n ALA 465 Ca 0.30 0.23 -0.18 0.00 0.00 0.00 0.00 53.44 53.79 1tkr n ALA 465 Cb 1.19 -4.21 -0.11 0.00 0.00 0.00 0.00 19.45 16.32 1tkr n ALA 465 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1tkr h LYS 466 N -1.82 0.41 -5.54 0.00 3.64 -1.80 -3.43 116.57 108.04 1tkr h LYS 466 Ca -0.54 -0.46 -0.50 0.00 -1.27 0.00 0.00 60.65 57.88 1tkr h LYS 466 Cb 1.36 0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 33.17 1tkr h LYS 466 CO 0.61 1.12 -0.67 0.71 -2.27 0.00 0.00 179.45 178.95 1tkr s TYR 467 N -3.13 1.99 -0.07 1.91 2.02 -1.26 -0.41 117.35 118.40 1tkr s TYR 467 Ca -0.13 -0.69 -0.15 0.00 -0.37 0.00 0.00 57.07 55.73 1tkr s TYR 467 Cb 0.03 -1.14 0.03 0.00 -0.40 0.00 0.00 41.96 40.49 1tkr s TYR 467 CO 0.83 0.30 0.35 1.52 -1.57 0.00 0.00 175.55 176.98 1tkr s TYR 468 N -2.99 -0.30 -0.25 2.71 1.13 -0.39 -1.84 117.35 115.43 1tkr s TYR 468 Ca 0.30 0.61 -0.07 0.00 -1.41 0.00 0.00 57.07 56.49 1tkr s TYR 468 Cb 0.04 0.13 -0.03 0.00 -1.10 0.00 0.00 41.96 41.00 1tkr s TYR 468 CO 0.12 -0.32 0.07 -1.14 -2.51 0.00 0.00 175.55 171.77 1tkr s GLN 469 N -0.71 3.66 -0.03 -3.49 0.74 -0.15 -0.97 119.66 118.72 1tkr s GLN 469 Ca -0.08 -0.48 -0.18 0.00 0.05 0.00 0.00 55.36 54.67 1tkr s GLN 469 Cb -0.04 -3.31 -0.05 0.00 1.10 0.00 0.00 33.01 30.70 1tkr s GLN 469 CO 0.03 -0.17 0.50 -0.51 -0.55 0.00 0.00 175.29 174.59 1tkr s LEU 470 N 1.56 4.41 -0.27 3.68 1.43 -0.49 -1.23 118.68 127.78 1tkr s LEU 470 Ca 0.06 1.02 0.02 0.00 -1.03 0.00 0.00 54.13 54.20 1tkr s LEU 470 Cb -0.15 -2.75 0.07 0.00 0.03 0.00 0.00 46.19 43.38 1tkr s LEU 470 CO 0.04 0.16 -0.06 -0.13 0.23 0.00 0.00 176.35 176.58 1tkr s ARG 471 N -0.33 1.89 -0.15 1.70 0.52 -0.50 -2.04 118.95 120.04 1tkr s ARG 471 Ca 0.27 -1.31 -0.15 0.00 -0.52 0.00 0.00 55.73 54.02 1tkr s ARG 471 Cb -0.17 -2.82 -0.04 0.00 0.52 0.00 0.00 34.95 32.44 1tkr s ARG 471 CO 0.14 -0.65 0.36 0.00 0.02 0.00 0.00 175.30 175.17 1tkr n SER 473 N 3.61 2.42 0.00 0.00 3.41 -0.24 -1.60 113.62 121.23 1tkr n SER 473 Ca -0.10 -2.37 0.00 0.00 -0.26 0.00 0.00 58.87 56.13 1tkr n SER 473 Cb 0.52 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 1tkr n SER 473 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tkr n GLY 474 N -0.57 0.98 0.19 5.00 0.00 -1.26 -0.25 105.19 109.28 1tkr n GLY 474 Ca 0.08 -1.26 0.14 0.00 0.00 0.00 0.00 46.02 44.99 1tkr n GLY 474 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tkr h PRO 475 N 0.00 0.00 0.00 1.61 0.13 -0.94 0.17 132.00 132.97 1tkr h PRO 475 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.01 1tkr h PRO 475 Cb 0.00 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.15 1tkr h PRO 475 CO 0.00 0.00 0.03 0.41 -0.23 0.00 0.00 178.00 178.21 1tkr n GLY 476 N -0.28 0.64 3.73 1.56 0.00 -0.08 -4.53 105.19 106.23 1tkr n GLY 476 Ca 0.01 -1.96 -0.39 0.00 0.00 0.00 0.00 46.02 43.68 1tkr n GLY 476 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tkr n LEU 477 N 0.00 5.10 -4.57 0.99 4.77 -1.26 -4.64 117.00 117.38 1tkr n LEU 477 Ca 0.04 1.01 -0.41 0.00 -0.03 0.00 0.00 56.01 56.63 1tkr n LEU 477 Cb 0.15 -1.56 0.01 0.00 -2.33 0.00 0.00 43.42 39.70 1tkr n LEU 477 CO 0.10 -0.60 0.46 -2.65 -1.33 0.00 0.00 177.39 173.38 1tkr n PRO 478 N -0.69 1.12 -3.86 3.23 -0.02 -1.26 -4.71 135.00 128.81 1tkr n PRO 478 Ca 0.09 0.41 -0.20 0.00 -2.02 0.00 0.00 63.50 61.77 1tkr n PRO 478 Cb 0.43 -1.93 -0.17 0.00 -0.02 0.00 0.00 33.50 31.81 1tkr n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1tkr s LEU 479 N -0.15 0.80 -0.22 2.45 2.96 -0.63 -4.25 118.68 119.64 1tkr s LEU 479 Ca 0.64 -0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 54.47 1tkr s LEU 479 Cb -0.55 -0.33 -0.01 0.00 0.50 0.00 0.00 46.19 45.80 1tkr s LEU 479 CO 0.56 -0.15 -0.03 -0.31 -1.32 0.00 0.00 176.35 175.09 1tkr s TYR 480 N 1.57 2.97 0.13 5.38 1.51 -0.04 -1.25 117.35 127.61 1tkr s TYR 480 Ca -0.02 -0.88 0.04 0.00 -1.01 0.00 0.00 57.07 55.20 1tkr s TYR 480 Cb -0.13 -2.11 -0.04 0.00 -0.11 0.00 0.00 41.96 39.57 1tkr s TYR 480 CO -0.03 -0.52 -0.10 0.95 -1.11 0.00 0.00 175.55 174.74 1tkr s THR 481 N 1.47 1.05 0.07 -0.71 -4.23 -0.86 0.69 115.64 113.12 1tkr s THR 481 Ca 0.06 -1.94 0.06 0.00 -1.18 0.00 0.00 61.69 58.69 1tkr s THR 481 Cb -0.14 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 71.96 1tkr s THR 481 CO -0.03 -0.71 -0.11 -0.76 -0.54 0.00 0.00 174.62 172.47 1tkr s LEU 482 N -2.97 2.99 0.04 4.79 1.43 -0.77 -1.39 118.68 122.80 1tkr s LEU 482 Ca 0.13 -0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 52.84 1tkr s LEU 482 Cb 0.02 -1.77 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 1tkr s LEU 482 CO -0.00 0.22 0.09 -1.00 0.23 0.00 0.00 176.35 175.89 1tkr s HIS 483 N -1.11 0.23 -0.15 0.29 3.76 -0.14 -1.15 115.29 117.02 1tkr s HIS 483 Ca 0.19 -0.57 -0.03 0.00 -0.15 0.00 0.00 55.06 54.51 1tkr s HIS 483 Cb -0.11 -0.16 -0.02 0.00 1.11 0.00 0.00 32.58 33.40 1tkr s HIS 483 CO 0.11 -0.38 -0.07 -1.54 -0.85 0.00 0.00 174.74 172.01 1tkr s SER 484 N -2.28 4.54 0.41 1.40 1.04 -0.98 -1.26 113.70 116.58 1tkr s SER 484 Ca -0.03 -0.20 0.17 0.00 0.48 0.00 0.00 55.95 56.38 1tkr s SER 484 Cb 0.00 -1.73 0.90 0.00 0.10 0.00 0.00 66.02 65.29 1tkr s SER 484 CO -0.06 0.16 1.88 0.28 0.98 0.00 0.00 173.24 176.48 1tkr h SER 485 N 6.74 0.00 -0.68 7.02 0.02 -1.00 0.20 113.55 125.86 1tkr h SER 485 Ca -0.30 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 60.80 1tkr h SER 485 Cb 1.20 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.62 1tkr h SER 485 CO 0.60 0.30 0.02 1.62 -1.14 0.00 0.00 176.83 178.24 1tkr h VAL 486 N 0.00 0.44 0.00 2.27 3.04 -1.92 -3.25 116.25 116.83 1tkr h VAL 486 Ca -0.00 -0.04 -0.05 0.00 -1.01 0.00 0.00 66.70 65.59 1tkr h VAL 486 Cb 0.61 0.30 -0.12 0.00 -2.01 0.00 0.00 31.29 30.07 1tkr h VAL 486 CO 0.04 0.02 -0.63 0.59 -1.01 0.00 0.00 177.57 176.58 1tkr n ASN 487 N -5.29 0.51 -4.21 3.17 4.13 -1.21 -5.01 115.26 107.34 1tkr n ASN 487 Ca 0.11 -2.13 -0.35 0.00 1.68 0.00 0.00 54.58 53.89 1tkr n ASN 487 Cb 0.41 -0.26 -0.03 0.00 -1.54 0.00 0.00 39.78 38.36 1tkr n ASN 487 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1tkr n ASP 488 N 0.02 -2.60 -4.78 6.41 10.43 0.68 -4.91 116.55 121.80 1tkr n ASP 488 Ca 0.03 -1.04 -0.38 0.00 2.57 0.00 0.00 54.79 55.98 1tkr n ASP 488 Cb 0.83 -2.68 -0.06 0.00 1.84 0.00 0.00 41.12 41.05 1tkr n ASP 488 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1tkr s LYS 489 N -6.92 4.59 -0.89 -1.24 1.02 -1.13 -4.85 119.74 110.32 1tkr s LYS 489 Ca 0.61 1.28 -0.20 0.00 0.02 0.00 0.00 55.97 57.68 1tkr s LYS 489 Cb -0.33 -2.94 0.11 0.00 -0.52 0.00 0.00 37.83 34.15 1tkr s LYS 489 CO 0.93 0.37 1.12 0.20 -0.92 0.00 0.00 175.35 177.05 1tkr s GLY 490 N -1.50 1.79 0.00 -3.33 0.00 -1.26 -2.32 107.32 100.70 1tkr s GLY 490 Ca 0.46 -2.57 0.00 0.00 0.00 0.00 0.00 44.72 42.61 1tkr s GLY 490 CO 0.25 2.06 0.85 1.04 0.00 0.00 0.00 173.10 177.30 1tkr n LEU 491 N 6.90 0.00 -3.51 0.66 4.77 -0.30 -4.92 117.00 120.60 1tkr n LEU 491 Ca 0.20 0.85 -0.12 0.00 -0.03 0.00 0.00 56.01 56.90 1tkr n LEU 491 Cb 0.49 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 1tkr n LEU 491 CO 0.54 -0.35 0.32 0.00 -1.33 0.00 0.00 177.39 176.57 1tkr s ARG 492 N -2.39 1.17 0.08 3.23 1.70 -1.24 -5.01 118.95 116.49 1tkr s ARG 492 Ca 0.00 -0.45 -0.30 0.00 -0.47 0.00 0.00 55.73 54.50 1tkr s ARG 492 Cb 0.00 0.53 -0.05 0.00 -0.57 0.00 0.00 34.95 34.86 1tkr s ARG 492 CO 0.00 -0.48 1.08 0.08 -1.08 0.00 0.00 175.30 174.90 1tkr s VAL 493 N -3.41 4.31 -0.22 4.99 1.01 -1.26 -1.85 120.40 123.97 1tkr s VAL 493 Ca -0.00 1.76 -0.19 0.00 0.00 0.00 0.00 61.98 63.55 1tkr s VAL 493 Cb -0.00 -4.12 -0.18 0.00 0.00 0.00 0.00 36.38 32.08 1tkr s VAL 493 CO -0.10 0.19 0.08 0.18 0.00 0.00 0.00 175.10 175.45 1tkr n LEU 494 N 3.42 1.94 -3.60 3.92 4.77 0.22 -4.94 117.00 122.73 1tkr n LEU 494 Ca 0.06 0.38 -0.08 0.00 -0.03 0.00 0.00 56.01 56.34 1tkr n LEU 494 Cb 0.48 -0.94 -0.09 0.00 -2.33 0.00 0.00 43.42 40.55 1tkr n LEU 494 CO 0.53 0.39 0.03 -0.70 -1.33 0.00 0.00 177.39 176.31 1tkr s GLU 495 N -2.41 0.35 0.00 3.23 2.56 -1.05 -4.99 118.70 116.40 1tkr s GLU 495 Ca -0.31 0.99 0.18 0.00 0.00 0.00 0.00 54.97 55.83 1tkr s GLU 495 Cb 0.08 0.26 0.14 0.00 2.00 0.00 0.00 34.13 36.61 1tkr s GLU 495 CO 0.58 -0.32 1.07 -0.40 -0.56 0.00 0.00 175.26 175.63 1tkr n ASP 496 N 5.39 2.50 -3.37 -1.70 5.68 -1.26 -0.86 116.55 122.93 1tkr n ASP 496 Ca -0.08 -1.75 -0.23 0.00 -0.50 0.00 0.00 54.79 52.23 1tkr n ASP 496 Cb 0.50 -0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.54 1tkr n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1tkr n ASN 497 N 1.00 -6.30 -0.03 -1.12 3.02 -1.26 -4.81 115.26 105.77 1tkr n ASN 497 Ca 0.10 -0.45 -0.01 0.00 -0.03 0.00 0.00 54.58 54.19 1tkr n ASN 497 Cb 0.45 -4.99 0.25 0.00 -0.61 0.00 0.00 39.78 34.88 1tkr n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1tkr h SER 498 N -2.23 0.56 0.67 6.41 4.64 -1.94 -2.03 113.55 119.62 1tkr h SER 498 Ca -0.55 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 60.62 1tkr h SER 498 Cb 1.37 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1tkr h SER 498 CO 0.56 0.64 -0.42 0.00 -0.87 0.00 0.00 176.83 176.74 1tkr h ALA 499 N 1.43 -1.06 -0.83 5.18 0.00 -2.00 -2.86 119.26 119.12 1tkr h ALA 499 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1tkr h ALA 499 Cb 0.38 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 1tkr h ALA 499 CO 0.01 -1.11 0.52 1.25 0.00 0.00 0.00 179.25 179.93 1tkr h LEU 500 N -1.03 0.98 -0.12 0.00 5.85 -1.85 -3.00 115.31 116.13 1tkr h LEU 500 Ca -0.08 -0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.64 1tkr h LEU 500 Cb 0.83 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 1tkr h LEU 500 CO 0.08 0.73 -0.17 -0.78 -0.34 0.00 0.00 178.44 177.96 1tkr h ASP 501 N 1.14 -0.53 -0.98 1.25 3.58 -1.23 -1.80 116.42 117.84 1tkr h ASP 501 Ca 0.30 0.09 0.08 0.00 0.42 0.00 0.00 57.03 57.93 1tkr h ASP 501 Cb -0.09 0.25 -0.07 0.00 1.72 0.00 0.00 39.33 41.14 1tkr h ASP 501 CO -0.06 -0.22 0.63 0.11 -2.88 0.00 0.00 179.24 176.82 1tkr h LYS 502 N -0.22 1.06 0.22 0.28 1.79 -1.37 -2.53 116.57 115.81 1tkr h LYS 502 Ca 0.09 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.49 1tkr h LYS 502 Cb 0.36 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 1tkr h LYS 502 CO -0.25 0.70 -0.11 0.52 -1.08 0.00 0.00 179.45 179.23 1tkr h MET 503 N 1.09 -0.29 -0.94 3.15 2.86 -1.39 -3.22 114.93 116.19 1tkr h MET 503 Ca 0.44 0.02 0.10 0.00 -2.06 0.00 0.00 59.70 58.20 1tkr h MET 503 Cb 0.27 0.07 -0.08 0.00 0.06 0.00 0.00 31.60 31.92 1tkr h MET 503 CO -0.19 -0.07 0.58 -0.07 1.06 0.00 0.00 176.91 178.22 1tkr h LEU 504 N -0.46 0.87 0.00 1.22 3.38 -0.95 -0.03 115.31 119.35 1tkr h LEU 504 Ca -0.03 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1tkr h LEU 504 Cb 0.35 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1tkr h LEU 504 CO 0.05 0.50 0.00 0.00 0.09 0.00 0.00 178.44 179.08 1tkr n GLN 505 N -4.63 0.04 -0.03 1.13 10.64 -0.99 0.07 117.38 123.61 1tkr n GLN 505 Ca 0.16 0.32 0.13 0.00 -1.83 0.00 0.00 57.00 55.78 1tkr n GLN 505 Cb 0.29 -1.50 0.35 0.00 -0.86 0.00 0.00 30.24 28.53 1tkr n GLN 505 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1tkr n ASN 506 N -1.38 2.12 -4.14 2.61 3.02 -0.02 -4.90 115.26 112.57 1tkr n ASN 506 Ca 0.02 -1.72 -0.16 0.00 -0.03 0.00 0.00 54.58 52.69 1tkr n ASN 506 Cb 0.05 -0.04 -0.12 0.00 -0.61 0.00 0.00 39.78 39.06 1tkr n ASN 506 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1tkr s VAL 507 N -1.92 0.92 -0.91 2.41 0.11 0.11 -3.93 120.40 117.19 1tkr s VAL 507 Ca 0.34 -1.30 -0.24 0.00 -2.93 0.00 0.00 61.98 57.85 1tkr s VAL 507 Cb 0.20 -0.99 0.04 0.00 -1.53 0.00 0.00 36.38 34.10 1tkr s VAL 507 CO 0.31 -0.33 1.43 -1.10 -3.33 0.00 0.00 175.10 172.09 1tkr s GLN 508 N -1.88 3.38 0.19 1.54 -0.21 0.26 -4.95 119.66 117.99 1tkr s GLN 508 Ca -0.03 -0.75 -0.15 0.00 0.02 0.00 0.00 55.36 54.45 1tkr s GLN 508 Cb -0.09 -4.94 -0.07 0.00 1.00 0.00 0.00 33.01 28.91 1tkr s GLN 508 CO 0.01 -2.27 0.61 -1.64 -2.12 0.00 0.00 175.29 169.89 1tkr s MET 509 N 5.39 4.03 1.07 2.91 -1.94 -1.26 -4.25 119.30 125.25 1tkr s MET 509 Ca 0.44 0.58 -0.17 0.00 -1.71 0.00 0.00 55.69 54.83 1tkr s MET 509 Cb -0.03 -2.84 0.23 0.00 2.01 0.00 0.00 34.83 34.20 1tkr s MET 509 CO -0.01 0.41 1.20 -1.25 -0.01 0.00 0.00 175.02 175.36 1tkr s PRO 510 N -2.15 -0.17 0.48 2.03 0.04 -1.26 -4.50 135.00 129.48 1tkr s PRO 510 Ca 0.42 -0.15 0.04 0.00 0.04 0.00 0.00 61.00 61.34 1tkr s PRO 510 Cb -0.15 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.64 1tkr s PRO 510 CO 0.20 -3.00 0.07 -1.54 0.04 0.00 0.00 177.00 172.76 1tkr s SER 511 N -4.30 4.16 -0.07 6.66 1.04 0.66 -4.95 113.70 116.89 1tkr s SER 511 Ca 0.71 -1.49 -0.02 0.00 0.48 0.00 0.00 55.95 55.63 1tkr s SER 511 Cb -0.08 0.21 0.03 0.00 0.10 0.00 0.00 66.02 66.28 1tkr s SER 511 CO 0.54 -0.76 0.02 -0.75 0.98 0.00 0.00 173.24 173.27 1tkr s LYS 512 N -3.89 0.46 -0.30 4.02 2.20 -1.26 -0.86 119.74 120.11 1tkr s LYS 512 Ca 0.19 0.13 -0.09 0.00 -0.36 0.00 0.00 55.97 55.83 1tkr s LYS 512 Cb 0.03 -0.97 -0.01 0.00 -1.51 0.00 0.00 37.83 35.38 1tkr s LYS 512 CO 0.10 -0.34 0.14 0.21 -0.36 0.00 0.00 175.35 175.11 1tkr s LYS 513 N 2.01 3.37 -0.47 4.03 2.20 -0.62 -4.91 119.74 125.35 1tkr s LYS 513 Ca 0.05 -0.70 -0.13 0.00 -0.36 0.00 0.00 55.97 54.83 1tkr s LYS 513 Cb -0.13 -3.54 0.09 0.00 -1.51 0.00 0.00 37.83 32.74 1tkr s LYS 513 CO -0.05 -0.39 0.38 -1.17 -0.36 0.00 0.00 175.35 173.75 1tkr s LEU 514 N 1.61 5.62 0.00 5.43 0.20 -1.26 -0.98 118.68 129.29 1tkr s LEU 514 Ca 0.05 -1.52 0.00 0.00 0.69 0.00 0.00 54.13 53.35 1tkr s LEU 514 Cb -0.17 -2.12 0.00 0.00 -0.43 0.00 0.00 46.19 43.47 1tkr s LEU 514 CO 0.06 -0.66 0.00 -0.67 -0.29 0.00 0.00 176.35 174.79 1tkr n ASP 515 N 5.11 0.49 -4.01 3.68 4.64 -0.79 -5.00 116.55 120.67 1tkr n ASP 515 Ca -0.12 -0.69 -0.10 0.00 -1.38 0.00 0.00 54.79 52.50 1tkr n ASP 515 Cb 0.42 0.00 -0.07 0.00 -1.04 0.00 0.00 41.12 40.43 1tkr n ASP 515 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 1tkr s PHE 516 N -1.37 0.51 0.09 -0.67 -0.71 -1.26 -0.70 117.98 113.87 1tkr s PHE 516 Ca 0.00 -0.87 0.02 0.00 -1.04 0.00 0.00 56.93 55.04 1tkr s PHE 516 Cb 0.00 -0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.64 1tkr s PHE 516 CO 0.00 -0.70 -0.07 0.96 -1.34 0.00 0.00 175.22 174.06 1tkr s ILE 517 N -4.00 0.72 -0.28 -4.49 -4.36 -0.91 -4.95 121.20 102.94 1tkr s ILE 517 Ca 0.20 -1.82 -0.04 0.00 -0.26 0.00 0.00 60.65 58.73 1tkr s ILE 517 Cb 0.04 -1.54 0.02 0.00 1.25 0.00 0.00 42.46 42.23 1tkr s ILE 517 CO 0.02 -0.78 0.01 -0.63 0.24 0.00 0.00 174.94 173.79 1tkr s ILE 518 N -3.24 3.36 -0.43 8.37 1.01 -1.26 -1.59 121.20 127.41 1tkr s ILE 518 Ca 0.09 -0.93 -0.15 0.00 0.00 0.00 0.00 60.65 59.66 1tkr s ILE 518 Cb 0.03 -2.75 0.04 0.00 0.01 0.00 0.00 42.46 39.79 1tkr s ILE 518 CO -0.03 0.10 0.33 -0.76 0.00 0.00 0.00 174.94 174.58 1tkr s LEU 519 N 1.39 5.28 0.00 2.97 1.43 0.35 -4.77 118.68 125.34 1tkr s LEU 519 Ca 0.00 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.04 1tkr s LEU 519 Cb -0.17 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 43.88 1tkr s LEU 519 CO -0.01 -0.52 0.00 -0.46 0.23 0.00 0.00 176.35 175.59 1tkr n ASN 520 N 5.17 -4.69 0.00 2.29 6.94 -1.26 -2.60 115.26 121.11 1tkr n ASN 520 Ca -0.12 0.32 0.00 0.00 -0.02 0.00 0.00 54.58 54.77 1tkr n ASN 520 Cb 0.46 -1.10 0.00 0.00 -2.36 0.00 0.00 39.78 36.78 1tkr n ASN 520 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1tkr n GLU 521 N 1.17 0.00 -2.94 -3.83 -0.58 -1.26 -4.92 120.64 108.27 1tkr n GLU 521 Ca 0.00 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.38 1tkr n GLU 521 Cb 0.31 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.12 1tkr n GLU 521 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1tkr s THR 522 N 0.00 4.42 -0.15 2.62 2.01 -1.07 -5.04 115.64 118.42 1tkr s THR 522 Ca 0.00 1.49 -0.05 0.00 0.31 0.00 0.00 61.69 63.44 1tkr s THR 522 Cb 0.00 -3.85 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 1tkr s THR 522 CO 0.00 0.06 0.00 -1.59 -0.69 0.00 0.00 174.62 172.40 1tkr s LYS 523 N -2.30 3.65 -0.08 4.92 -2.85 -1.26 -0.49 119.74 121.32 1tkr s LYS 523 Ca 0.50 -0.44 0.04 0.00 -1.00 0.00 0.00 55.97 55.07 1tkr s LYS 523 Cb -0.16 -2.99 -0.00 0.00 -2.06 0.00 0.00 37.83 32.63 1tkr s LYS 523 CO 0.20 0.34 -0.22 -0.06 0.10 0.00 0.00 175.35 175.71 1tkr s PHE 524 N 0.13 2.27 0.28 1.78 0.40 -0.62 -4.97 117.98 117.26 1tkr s PHE 524 Ca 0.01 -0.84 -0.21 0.00 -0.60 0.00 0.00 56.93 55.29 1tkr s PHE 524 Cb -0.13 -1.53 -0.09 0.00 0.51 0.00 0.00 43.02 41.78 1tkr s PHE 524 CO 0.02 -0.33 0.82 -1.58 0.70 0.00 0.00 175.22 174.85 1tkr s TRP 525 N 0.25 3.60 0.22 0.36 0.52 -1.26 -2.13 118.94 120.50 1tkr s TRP 525 Ca -0.13 1.52 0.00 0.00 0.02 0.00 0.00 56.10 57.50 1tkr s TRP 525 Cb -0.16 -2.73 -0.04 0.00 -1.15 0.00 0.00 33.47 29.39 1tkr s TRP 525 CO 0.06 0.23 0.10 1.52 0.02 0.00 0.00 176.95 178.89 1tkr s TYR 526 N -1.66 1.29 0.05 -1.98 -0.85 0.12 -1.73 117.35 112.60 1tkr s TYR 526 Ca 0.48 -1.27 0.00 0.00 -0.52 0.00 0.00 57.07 55.77 1tkr s TYR 526 Cb -0.16 -0.70 -0.03 0.00 0.38 0.00 0.00 41.96 41.45 1tkr s TYR 526 CO 0.21 -0.48 -0.04 1.14 -1.52 0.00 0.00 175.55 174.85 1tkr s GLN 527 N -4.09 0.58 -0.10 -3.49 -2.07 -0.58 -1.89 119.66 108.02 1tkr s GLN 527 Ca 0.37 -1.05 -0.03 0.00 -1.82 0.00 0.00 55.36 52.83 1tkr s GLN 527 Cb 0.07 0.02 0.04 0.00 -1.09 0.00 0.00 33.01 32.06 1tkr s GLN 527 CO 0.11 -0.05 0.07 1.41 -1.32 0.00 0.00 175.29 175.51 1tkr s MET 528 N -3.03 0.01 -0.70 9.60 1.75 -0.16 -1.84 119.30 124.93 1tkr s MET 528 Ca 0.01 0.16 -0.27 0.00 -1.25 0.00 0.00 55.69 54.34 1tkr s MET 528 Cb 0.01 -1.13 0.03 0.00 2.84 0.00 0.00 34.83 36.58 1tkr s MET 528 CO -0.05 -0.49 1.22 0.42 -0.65 0.00 0.00 175.02 175.47 1tkr s ILE 529 N 2.15 3.86 -0.00 10.11 -1.09 0.04 -1.59 121.20 134.67 1tkr s ILE 529 Ca 0.04 0.40 -0.15 0.00 -2.23 0.00 0.00 60.65 58.70 1tkr s ILE 529 Cb -0.14 -4.85 -0.06 0.00 -1.58 0.00 0.00 42.46 35.83 1tkr s ILE 529 CO -0.06 -1.71 0.42 -0.76 -1.23 0.00 0.00 174.94 171.60 1tkr s LEU 530 N 5.37 4.46 1.13 2.97 1.43 -0.04 -2.34 118.68 131.67 1tkr s LEU 530 Ca 0.35 0.97 -0.13 0.00 -1.03 0.00 0.00 54.13 54.28 1tkr s LEU 530 Cb -0.09 -2.61 0.24 0.00 0.03 0.00 0.00 46.19 43.76 1tkr s LEU 530 CO 0.16 0.30 0.88 -2.65 0.23 0.00 0.00 176.35 175.28 1tkr n PRO 531 N 1.95 -2.05 -2.11 1.29 -0.02 -1.26 -0.25 135.00 132.55 1tkr n PRO 531 Ca -0.13 -0.56 -0.40 0.00 -2.02 0.00 0.00 63.50 60.39 1tkr n PRO 531 Cb 0.52 -2.12 -0.01 0.00 -0.02 0.00 0.00 33.50 31.86 1tkr n PRO 531 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1tkr s PRO 532 N -4.28 4.10 -1.45 0.52 0.02 -1.26 -3.05 135.00 129.59 1tkr s PRO 532 Ca 0.66 2.13 -0.10 0.00 0.02 0.00 0.00 61.00 63.71 1tkr s PRO 532 Cb -0.23 -2.84 0.06 0.00 0.02 0.00 0.00 34.50 31.50 1tkr s PRO 532 CO 0.64 -0.37 0.98 0.72 -0.33 0.00 0.00 177.00 178.65 1tkr n HIS 533 N 0.33 -2.36 -1.66 6.54 8.25 -1.26 -4.88 115.22 120.18 1tkr n HIS 533 Ca 0.03 0.92 -0.47 0.00 -0.26 0.00 0.00 57.72 57.93 1tkr n HIS 533 Cb 0.43 -4.29 -0.05 0.00 1.12 0.00 0.00 29.99 27.21 1tkr n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1tkr n PHE 534 N -4.67 2.17 -3.98 4.41 7.35 -1.17 -4.98 117.46 116.59 1tkr n PHE 534 Ca -0.03 0.29 -0.31 0.00 -0.76 0.00 0.00 57.45 56.65 1tkr n PHE 534 Cb 0.56 -2.53 -0.15 0.00 0.35 0.00 0.00 39.48 37.71 1tkr n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1tkr s ASP 535 N 1.22 4.21 0.19 -2.13 2.15 -1.26 -4.97 116.67 116.07 1tkr s ASP 535 Ca 0.81 -1.46 0.10 0.00 0.43 0.00 0.00 52.55 52.43 1tkr s ASP 535 Cb -0.72 -1.35 0.52 0.00 -0.30 0.00 0.00 42.92 41.07 1tkr s ASP 535 CO 0.41 -0.26 1.21 2.29 -0.17 0.00 0.00 175.17 178.65 1tkr n LYS 536 N 4.53 0.06 0.00 4.34 2.85 -1.26 0.24 118.16 128.93 1tkr n LYS 536 Ca -0.09 0.51 0.15 0.00 -1.05 0.00 0.00 58.31 57.82 1tkr n LYS 536 Cb 0.43 -1.87 0.68 0.00 -0.65 0.00 0.00 35.03 33.62 1tkr n LYS 536 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1tkr n SER 537 N -1.82 0.64 -4.57 -5.58 2.88 -1.26 -4.25 113.62 99.66 1tkr n SER 537 Ca -0.01 -0.97 -0.25 0.00 -1.33 0.00 0.00 58.87 56.32 1tkr n SER 537 Cb 0.17 -0.03 -0.09 0.00 -0.75 0.00 0.00 64.21 63.51 1tkr n SER 537 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1tkr s LYS 538 N -2.20 1.93 -0.13 -1.46 2.20 0.14 -5.07 119.74 115.14 1tkr s LYS 538 Ca 0.37 -1.78 -0.02 0.00 -0.36 0.00 0.00 55.97 54.18 1tkr s LYS 538 Cb 0.21 -1.85 -0.02 0.00 -1.51 0.00 0.00 37.83 34.66 1tkr s LYS 538 CO 0.41 0.20 -0.07 0.15 -0.36 0.00 0.00 175.35 175.68 1tkr s LYS 539 N -3.63 3.38 0.12 4.03 1.02 -1.26 -4.33 119.74 119.07 1tkr s LYS 539 Ca 0.33 -0.57 0.10 0.00 0.02 0.00 0.00 55.97 55.85 1tkr s LYS 539 Cb -0.01 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 1tkr s LYS 539 CO 0.18 0.34 -0.24 0.71 -0.92 0.00 0.00 175.35 175.41 1tkr s TYR 540 N 0.08 2.07 0.37 3.18 1.51 0.93 -4.77 117.35 120.71 1tkr s TYR 540 Ca -0.02 -0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 55.39 1tkr s TYR 540 Cb -0.14 -1.12 -0.09 0.00 -0.11 0.00 0.00 41.96 40.50 1tkr s TYR 540 CO 0.03 0.28 1.04 -1.25 -1.11 0.00 0.00 175.55 174.54 1tkr s PRO 541 N -2.00 4.29 -0.04 -1.71 0.04 -1.26 -0.75 135.00 133.57 1tkr s PRO 541 Ca 0.11 1.53 0.06 0.00 0.04 0.00 0.00 61.00 62.74 1tkr s PRO 541 Cb -0.10 -2.67 -0.01 0.00 0.04 0.00 0.00 34.50 31.76 1tkr s PRO 541 CO 0.05 -0.04 -0.23 -1.17 0.04 0.00 0.00 177.00 175.66 1tkr s LEU 542 N -2.39 2.03 -0.17 -3.56 0.20 0.00 -1.94 118.68 112.85 1tkr s LEU 542 Ca 0.55 -0.45 -0.02 0.00 0.69 0.00 0.00 54.13 54.89 1tkr s LEU 542 Cb -0.23 -1.24 -0.02 0.00 -0.43 0.00 0.00 46.19 44.27 1tkr s LEU 542 CO 0.29 0.24 -0.08 -0.22 -0.29 0.00 0.00 176.35 176.30 1tkr s LEU 543 N -0.27 2.90 -0.59 -0.68 0.20 0.68 0.36 118.68 121.28 1tkr s LEU 543 Ca 0.01 -0.31 -0.19 0.00 0.69 0.00 0.00 54.13 54.33 1tkr s LEU 543 Cb -0.12 -1.70 0.10 0.00 -0.43 0.00 0.00 46.19 44.05 1tkr s LEU 543 CO 0.02 0.10 0.72 -0.22 -0.29 0.00 0.00 176.35 176.67 1tkr s LEU 544 N 0.78 5.34 -0.24 -0.68 2.96 0.18 -0.98 118.68 126.03 1tkr s LEU 544 Ca -0.03 -1.40 -0.29 0.00 -0.22 0.00 0.00 54.13 52.18 1tkr s LEU 544 Cb -0.15 -2.31 -0.01 0.00 0.50 0.00 0.00 46.19 44.22 1tkr s LEU 544 CO 0.02 -1.13 1.30 -0.62 -1.32 0.00 0.00 176.35 174.60 1tkr s ASP 545 N 3.62 6.77 0.10 3.68 -1.08 0.97 -2.46 116.67 128.26 1tkr s ASP 545 Ca 0.12 1.43 0.05 0.00 -0.52 0.00 0.00 52.55 53.63 1tkr s ASP 545 Cb -0.24 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 38.65 1tkr s ASP 545 CO 0.06 -0.96 -0.12 0.54 0.52 0.00 0.00 175.17 175.21 1tkr s VAL 546 N 4.06 1.14 0.12 1.11 0.11 -0.67 -4.26 120.40 122.00 1tkr s VAL 546 Ca 0.56 -1.62 0.00 0.00 -2.93 0.00 0.00 61.98 57.99 1tkr s VAL 546 Cb -0.19 -1.39 0.00 0.00 -1.53 0.00 0.00 36.38 33.27 1tkr s VAL 546 CO 0.20 -0.45 0.00 0.00 -3.33 0.00 0.00 175.10 171.52 1tkr n TYR 547 N 0.65 -1.17 -3.09 1.54 9.36 -1.26 -4.18 117.16 119.02 1tkr n TYR 547 Ca -0.17 0.21 -0.20 0.00 3.32 0.00 0.00 57.90 61.06 1tkr n TYR 547 Cb 0.57 0.63 -0.00 0.00 -0.63 0.00 0.00 39.34 39.91 1tkr n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1tkr n ALA 548 N -2.88 -0.98 -2.09 2.98 0.00 -1.26 -3.67 120.51 112.61 1tkr n ALA 548 Ca 0.00 0.11 -0.25 0.00 0.00 0.00 0.00 53.44 53.29 1tkr n ALA 548 Cb 0.00 -2.56 0.03 0.00 0.00 0.00 0.00 19.45 16.93 1tkr n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1tkr s GLY 549 N -2.54 1.63 0.14 0.00 0.00 -1.26 -4.91 107.32 100.39 1tkr s GLY 549 Ca 0.29 -0.84 -0.34 0.00 0.00 0.00 0.00 44.72 43.83 1tkr s GLY 549 CO 0.35 -0.56 1.11 -1.05 0.00 0.00 0.00 173.10 172.95 1tkr n PRO 550 N -2.53 0.89 -2.72 2.90 -0.02 -1.26 -1.80 135.00 130.45 1tkr n PRO 550 Ca 0.05 0.32 -0.20 0.00 -2.02 0.00 0.00 63.50 61.65 1tkr n PRO 550 Cb 0.58 -1.79 0.01 0.00 -0.02 0.00 0.00 33.50 32.28 1tkr n PRO 550 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tkr s SER 552 N -2.34 5.02 -0.29 0.00 1.04 -0.74 -4.36 113.70 112.03 1tkr s SER 552 Ca 0.15 -0.35 0.05 0.00 0.48 0.00 0.00 55.95 56.28 1tkr s SER 552 Cb -0.07 -0.35 0.19 0.00 0.10 0.00 0.00 66.02 65.89 1tkr s SER 552 CO 0.18 -1.34 0.56 -1.58 0.98 0.00 0.00 173.24 172.05 1tkr s GLN 553 N -4.79 0.54 0.00 4.02 0.74 -1.26 -1.95 119.66 116.95 1tkr s GLN 553 Ca 0.60 0.49 0.24 0.00 0.05 0.00 0.00 55.36 56.75 1tkr s GLN 553 Cb -0.08 0.17 0.24 0.00 1.10 0.00 0.00 33.01 34.44 1tkr s GLN 553 CO 0.39 -1.04 1.23 1.63 -0.55 0.00 0.00 175.29 176.95 1tkr n LYS 554 N 5.41 0.41 -3.86 1.67 4.76 -1.26 -4.73 118.16 120.56 1tkr n LYS 554 Ca 0.04 -0.30 -0.36 0.00 -2.87 0.00 0.00 58.31 54.83 1tkr n LYS 554 Cb 0.53 -1.49 -0.13 0.00 -1.84 0.00 0.00 35.03 32.10 1tkr n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1tkr s ALA 555 N -2.79 2.92 0.06 7.82 0.00 -1.26 -4.81 121.76 123.69 1tkr s ALA 555 Ca 0.14 -1.94 -0.01 0.00 0.00 0.00 0.00 51.96 50.16 1tkr s ALA 555 Cb 0.18 -2.09 0.00 0.00 0.00 0.00 0.00 23.12 21.21 1tkr s ALA 555 CO 0.69 -1.40 0.08 -0.40 0.00 0.00 0.00 175.76 174.73 1tkr n ASP 556 N 4.64 -0.23 -0.97 0.00 5.68 -1.26 -4.47 116.55 119.93 1tkr n ASP 556 Ca -0.10 -1.30 0.10 0.00 -0.50 0.00 0.00 54.79 52.99 1tkr n ASP 556 Cb 0.43 0.43 0.17 0.00 -1.14 0.00 0.00 41.12 41.01 1tkr n ASP 556 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1tkr n THR 557 N -0.09 0.45 -1.94 2.12 -2.24 -0.74 -4.95 114.28 106.89 1tkr n THR 557 Ca -0.00 -0.73 -0.40 0.00 -2.27 0.00 0.00 64.05 60.65 1tkr n THR 557 Cb 0.09 1.01 -0.00 0.00 -2.10 0.00 0.00 70.33 69.32 1tkr n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1tkr s VAL 558 N -1.38 2.36 -0.28 2.28 1.01 -1.26 -2.53 120.40 120.60 1tkr s VAL 558 Ca 0.32 0.34 -0.20 0.00 0.00 0.00 0.00 61.98 62.44 1tkr s VAL 558 Cb 0.19 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 1tkr s VAL 558 CO 0.27 0.07 0.61 0.12 0.00 0.00 0.00 175.10 176.17 1tkr s PHE 559 N -1.17 3.25 0.13 5.22 5.36 0.65 -4.92 117.98 126.50 1tkr s PHE 559 Ca 0.54 0.67 0.11 0.00 -0.96 0.00 0.00 56.93 57.29 1tkr s PHE 559 Cb -0.42 -2.89 -0.04 0.00 -0.34 0.00 0.00 43.02 39.33 1tkr s PHE 559 CO 0.56 -0.39 -0.27 1.03 -1.46 0.00 0.00 175.22 174.70 1tkr s ARG 560 N 2.51 1.40 -0.58 10.12 0.52 -1.26 -4.92 118.95 126.74 1tkr s ARG 560 Ca 0.25 -1.35 0.06 0.00 -0.52 0.00 0.00 55.73 54.17 1tkr s ARG 560 Cb -0.15 -1.89 0.24 0.00 0.52 0.00 0.00 34.95 33.66 1tkr s ARG 560 CO 0.10 0.45 0.64 -0.11 0.02 0.00 0.00 175.30 176.40 1tkr n LEU 561 N 0.92 2.60 0.00 2.53 7.94 -1.26 -4.89 117.00 124.84 1tkr n LEU 561 Ca -0.18 -5.18 0.00 0.00 -1.11 0.00 0.00 56.01 49.54 1tkr n LEU 561 Cb 0.53 -0.30 0.00 0.00 0.53 0.00 0.00 43.42 44.18 1tkr n LEU 561 CO 0.23 2.01 0.00 -0.46 -1.11 0.00 0.00 177.39 178.06 1tkr n ASN 562 N 1.22 0.63 -0.06 1.96 0.23 -1.26 -5.00 115.26 112.98 1tkr n ASN 562 Ca 0.27 0.00 -0.13 0.00 -0.53 0.00 0.00 54.58 54.19 1tkr n ASN 562 Cb 0.43 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.07 1tkr n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 1tkr h TRP 563 N 0.00 0.41 -0.77 -2.53 7.01 -1.97 -3.12 115.95 114.97 1tkr h TRP 563 Ca 0.00 -0.10 0.17 0.00 2.11 0.00 0.00 58.89 61.07 1tkr h TRP 563 Cb 0.00 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 26.92 1tkr h TRP 563 CO 0.00 0.68 0.52 0.00 -2.79 0.00 0.00 178.44 176.85 1tkr h ALA 564 N 0.67 2.25 -0.03 2.65 0.00 -1.98 0.05 119.26 122.87 1tkr h ALA 564 Ca 0.04 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1tkr h ALA 564 Cb 0.57 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1tkr h ALA 564 CO 0.03 -0.47 -0.16 1.15 0.00 0.00 0.00 179.25 179.79 1tkr h THR 565 N 0.32 0.61 -0.21 0.00 2.02 -1.89 -0.90 112.91 112.86 1tkr h THR 565 Ca 0.38 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.56 1tkr h THR 565 Cb 1.02 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1tkr h THR 565 CO -0.11 0.00 0.11 0.22 0.37 0.00 0.00 175.52 176.11 1tkr h TYR 566 N -0.25 0.31 -0.49 3.16 3.20 -1.13 0.27 116.97 122.04 1tkr h TYR 566 Ca 0.06 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.01 1tkr h TYR 566 Cb 0.33 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1tkr h TYR 566 CO -0.23 0.31 0.33 -0.07 -1.64 0.00 0.00 178.16 176.86 1tkr h LEU 567 N 0.22 0.24 0.06 2.82 3.38 -0.83 0.35 115.31 121.55 1tkr h LEU 567 Ca 0.07 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.74 1tkr h LEU 567 Cb 0.11 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1tkr h LEU 567 CO -0.01 0.14 -1.66 0.00 0.09 0.00 0.00 178.44 177.00 1tkr n ALA 568 N -2.55 0.84 -0.12 1.53 0.00 -0.37 -0.45 120.51 119.40 1tkr n ALA 568 Ca 0.08 -0.55 -0.11 0.00 0.00 0.00 0.00 53.44 52.85 1tkr n ALA 568 Cb 0.37 -0.61 -0.03 0.00 0.00 0.00 0.00 19.45 19.19 1tkr n ALA 568 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1tkr h SER 569 N -0.47 0.67 0.03 0.00 0.87 -0.22 -1.65 113.55 112.77 1tkr h SER 569 Ca -0.40 -0.36 -0.37 0.00 -1.23 0.00 0.00 61.79 59.43 1tkr h SER 569 Cb 1.68 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 63.40 1tkr h SER 569 CO -0.07 0.88 -2.09 0.41 -0.53 0.00 0.00 176.83 175.43 1tkr n THR 570 N -4.42 1.57 1.32 2.23 -1.04 0.12 -4.47 114.28 109.60 1tkr n THR 570 Ca -0.02 -0.39 0.13 0.00 -2.04 0.00 0.00 64.05 61.73 1tkr n THR 570 Cb 0.34 -1.79 0.42 0.00 -1.82 0.00 0.00 70.33 67.48 1tkr n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1tkr n GLU 571 N -3.91 1.81 -3.92 -2.82 -0.58 -1.14 -4.96 120.64 105.12 1tkr n GLU 571 Ca -0.42 -1.19 -0.25 0.00 -0.42 0.00 0.00 57.16 54.88 1tkr n GLU 571 Cb 0.89 -1.46 -0.01 0.00 -0.57 0.00 0.00 31.44 30.28 1tkr n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1tkr n ASN 572 N 0.44 -0.46 -4.38 1.62 4.13 -0.62 -4.89 115.26 111.09 1tkr n ASN 572 Ca 0.18 -0.98 -0.33 0.00 1.68 0.00 0.00 54.58 55.13 1tkr n ASN 572 Cb 0.40 -3.19 -0.14 0.00 -1.54 0.00 0.00 39.78 35.30 1tkr n ASN 572 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1tkr s ILE 573 N -3.91 3.08 -0.12 2.41 1.01 0.41 -4.56 121.20 119.51 1tkr s ILE 573 Ca 0.01 -0.66 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 1tkr s ILE 573 Cb -0.01 -2.28 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 1tkr s ILE 573 CO 0.88 0.53 1.01 -0.63 0.00 0.00 0.00 174.94 176.73 1tkr s ILE 574 N 0.24 4.77 -0.40 2.92 1.01 -0.82 -3.38 121.20 125.54 1tkr s ILE 574 Ca -0.09 2.03 -0.09 0.00 0.00 0.00 0.00 60.65 62.51 1tkr s ILE 574 Cb -0.15 -4.31 0.07 0.00 0.01 0.00 0.00 42.46 38.07 1tkr s ILE 574 CO 0.05 -0.02 0.23 -0.69 0.00 0.00 0.00 174.94 174.51 1tkr s VAL 575 N 2.17 4.17 0.07 2.92 1.01 -0.99 -0.23 120.40 129.52 1tkr s VAL 575 Ca 0.47 -1.32 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1tkr s VAL 575 Cb -0.18 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1tkr s VAL 575 CO 0.16 -0.43 0.11 0.00 0.00 0.00 0.00 175.10 174.94 1tkr s ALA 576 N 1.43 3.67 0.04 5.51 0.00 -0.15 -0.78 121.76 131.48 1tkr s ALA 576 Ca 0.02 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.04 1tkr s ALA 576 Cb -0.22 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 1tkr s ALA 576 CO 0.03 0.77 -0.08 -1.12 0.00 0.00 0.00 175.76 175.35 1tkr s SER 577 N -2.40 0.92 -0.09 0.00 0.01 -0.77 -0.02 113.70 111.36 1tkr s SER 577 Ca 0.30 -0.53 -0.06 0.00 1.31 0.00 0.00 55.95 56.97 1tkr s SER 577 Cb -0.12 0.02 0.04 0.00 0.21 0.00 0.00 66.02 66.17 1tkr s SER 577 CO 0.23 -0.18 0.22 0.12 0.41 0.00 0.00 173.24 174.04 1tkr s PHE 578 N -1.31 -0.27 -0.49 2.43 5.36 -1.26 -1.53 117.98 120.91 1tkr s PHE 578 Ca -0.09 0.67 -0.14 0.00 -0.96 0.00 0.00 56.93 56.42 1tkr s PHE 578 Cb -0.10 0.04 0.11 0.00 -0.34 0.00 0.00 43.02 42.73 1tkr s PHE 578 CO 0.01 -0.18 0.41 -0.51 -1.46 0.00 0.00 175.22 173.48 1tkr s ASP 579 N 0.85 6.00 0.00 6.13 1.01 -0.71 -4.83 116.67 125.13 1tkr s ASP 579 Ca -0.06 -1.66 0.00 0.00 0.71 0.00 0.00 52.55 51.54 1tkr s ASP 579 Cb -0.07 -2.13 0.00 0.00 1.01 0.00 0.00 42.92 41.72 1tkr s ASP 579 CO -0.05 -0.73 0.00 0.61 0.21 0.00 0.00 175.17 175.21 1tkr n GLY 580 N 5.12 3.03 3.59 0.21 0.00 -1.26 -4.16 105.19 111.71 1tkr n GLY 580 Ca -0.12 -2.01 -0.50 0.00 0.00 0.00 0.00 46.02 43.39 1tkr n GLY 580 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tkr n ARG 581 N 0.00 1.18 0.00 1.61 3.00 -1.26 -0.51 116.66 120.68 1tkr n ARG 581 Ca 0.00 0.43 0.00 0.00 -0.01 0.00 0.00 57.85 58.27 1tkr n ARG 581 Cb 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 32.46 30.45 1tkr n ARG 581 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1tkr n GLY 582 N 2.32 2.48 3.47 -0.13 0.00 0.24 -3.86 105.19 109.69 1tkr n GLY 582 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1tkr n GLY 582 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1tkr n SER 583 N 0.00 -1.44 -4.72 1.61 7.64 0.33 -1.04 113.62 116.01 1tkr n SER 583 Ca 0.00 0.21 -0.31 0.00 1.01 0.00 0.00 58.87 59.78 1tkr n SER 583 Cb 0.00 -1.24 -0.08 0.00 -1.01 0.00 0.00 64.21 61.87 1tkr n SER 583 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1tkr s GLY 584 N -2.21 2.80 -1.50 0.23 0.00 -0.82 -3.11 107.32 102.70 1tkr s GLY 584 Ca 0.61 -1.14 0.00 0.00 0.00 0.00 0.00 44.72 44.19 1tkr s GLY 584 CO 0.64 -2.14 0.00 -1.72 0.00 0.00 0.00 173.10 169.88 1tkr n TYR 585 N -1.18 -0.26 -2.51 1.90 4.01 -1.26 -4.85 117.16 113.00 1tkr n TYR 585 Ca -0.13 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.65 1tkr n TYR 585 Cb 0.67 -2.85 0.03 0.00 -0.31 0.00 0.00 39.34 36.88 1tkr n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1tkr n GLN 586 N -2.52 0.29 0.00 -0.72 6.02 -1.26 -4.50 117.38 114.69 1tkr n GLN 586 Ca -0.16 -2.25 0.00 0.00 -0.01 0.00 0.00 57.00 54.58 1tkr n GLN 586 Cb 0.55 -0.27 0.00 0.00 1.02 0.00 0.00 30.24 31.54 1tkr n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1tkr n GLY 587 N 0.30 -1.69 0.21 1.08 0.00 -1.26 -4.52 105.19 99.31 1tkr n GLY 587 Ca 0.07 -1.51 0.08 0.00 0.00 0.00 0.00 46.02 44.65 1tkr n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1tkr h ASP 588 N 0.00 0.00 -0.56 1.61 3.32 -0.33 -2.81 116.42 117.65 1tkr h ASP 588 Ca 0.00 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.11 1tkr h ASP 588 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1tkr h ASP 588 CO 0.00 0.29 0.37 0.50 -1.72 0.00 0.00 179.24 178.68 1tkr h LYS 589 N 0.00 0.53 0.00 3.56 3.64 -1.83 0.63 116.57 123.09 1tkr h LYS 589 Ca -0.00 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1tkr h LYS 589 Cb 0.76 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 1tkr h LYS 589 CO 0.04 0.35 -0.23 0.82 -2.27 0.00 0.00 179.45 178.15 1tkr h ILE 590 N 0.54 1.22 -0.06 2.00 1.08 -1.77 -3.33 117.51 117.20 1tkr h ILE 590 Ca 0.24 -1.99 -0.00 0.00 -0.39 0.00 0.00 64.86 62.71 1tkr h ILE 590 Cb 0.26 2.38 -0.00 0.00 -3.07 0.00 0.00 36.82 36.39 1tkr h ILE 590 CO -0.07 0.41 0.02 -0.03 -0.69 0.00 0.00 178.15 177.80 1tkr h MET 591 N -1.00 0.09 0.00 2.37 4.05 -1.27 0.76 114.93 119.93 1tkr h MET 591 Ca -0.06 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1tkr h MET 591 Cb 0.83 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.62 1tkr h MET 591 CO -0.03 0.22 0.00 0.72 0.23 0.00 0.00 176.91 178.04 1tkr n HIS 592 N -4.96 0.00 0.10 1.39 8.25 0.19 -3.87 115.22 116.32 1tkr n HIS 592 Ca -0.06 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.45 1tkr n HIS 592 Cb 0.11 0.00 0.50 0.00 1.12 0.00 0.00 29.99 31.72 1tkr n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1tkr h ALA 593 N 3.10 1.80 -0.76 -1.41 0.00 -1.60 -1.52 119.26 118.86 1tkr h ALA 593 Ca 0.00 -0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.55 1tkr h ALA 593 Cb 0.00 -0.10 -0.20 0.00 0.00 0.00 0.00 17.79 17.49 1tkr h ALA 593 CO 0.00 0.18 0.37 0.44 0.00 0.00 0.00 179.25 180.24 1tkr n ILE 594 N -4.49 2.96 -2.03 0.00 -5.35 -1.25 -4.93 119.36 104.27 1tkr n ILE 594 Ca 0.01 -1.96 -0.41 0.00 -0.27 0.00 0.00 62.75 60.12 1tkr n ILE 594 Cb 0.08 -0.39 -0.02 0.00 -1.74 0.00 0.00 39.64 37.57 1tkr n ILE 594 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1tkr s ASN 595 N -1.44 6.67 -0.03 7.28 3.84 -0.58 -1.71 114.94 128.98 1tkr s ASN 595 Ca 0.54 2.73 0.00 0.00 0.21 0.00 0.00 52.86 56.33 1tkr s ASN 595 Cb 0.45 -2.64 0.00 0.00 -0.55 0.00 0.00 41.25 38.51 1tkr s ASN 595 CO 0.10 -0.64 0.00 0.54 -2.79 0.00 0.00 177.10 174.31 1tkr n ARG 596 N 1.37 -1.99 -2.67 0.43 1.74 0.31 -4.77 116.66 111.08 1tkr n ARG 596 Ca 0.03 0.39 -0.08 0.00 -0.77 0.00 0.00 57.85 57.41 1tkr n ARG 596 Cb 0.41 -4.41 0.04 0.00 -1.02 0.00 0.00 32.46 27.47 1tkr n ARG 596 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1tkr n ARG 597 N 0.71 1.17 -1.93 5.56 3.00 -0.69 -4.89 116.66 119.59 1tkr n ARG 597 Ca -0.00 -3.19 -0.37 0.00 -0.00 0.00 0.00 57.85 54.29 1tkr n ARG 597 Cb 0.38 -1.19 0.03 0.00 0.00 0.00 0.00 32.46 31.68 1tkr n ARG 597 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1tkr s LEU 598 N -3.16 3.80 0.00 6.15 1.43 -1.22 -3.51 118.68 122.17 1tkr s LEU 598 Ca 0.27 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 55.93 1tkr s LEU 598 Cb 0.45 -4.39 0.00 0.00 0.03 0.00 0.00 46.19 42.28 1tkr s LEU 598 CO 0.03 -1.50 0.00 0.61 0.23 0.00 0.00 176.35 175.71 1tkr n GLY 599 N 0.64 0.60 0.00 -3.19 0.00 -1.26 -4.81 105.19 97.16 1tkr n GLY 599 Ca 0.11 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1tkr n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tkr n THR 600 N -3.43 0.00 -0.30 2.61 -2.24 -1.23 -4.86 114.28 104.83 1tkr n THR 600 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1tkr n THR 600 Cb 0.48 0.00 0.20 0.00 -2.10 0.00 0.00 70.33 68.92 1tkr n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1tkr h PHE 601 N 0.00 0.86 0.00 4.78 0.04 -1.92 0.17 116.94 120.87 1tkr h PHE 601 Ca 0.00 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.77 1tkr h PHE 601 Cb 0.00 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 37.89 1tkr h PHE 601 CO 0.00 0.29 -0.16 1.05 -0.60 0.00 0.00 178.31 178.89 1tkr h GLU 602 N 0.74 0.00 0.01 1.51 9.09 -1.91 0.52 114.58 124.54 1tkr h GLU 602 Ca 0.44 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.75 1tkr h GLU 602 Cb 0.52 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.60 1tkr h GLU 602 CO -0.30 0.16 -0.54 -0.24 0.05 0.00 0.00 179.01 178.13 1tkr h VAL 603 N 0.00 1.44 -0.95 -1.06 3.04 -1.57 -3.23 116.25 113.92 1tkr h VAL 603 Ca -0.00 -2.30 0.04 0.00 -1.01 0.00 0.00 66.70 63.43 1tkr h VAL 603 Cb 0.30 2.94 -0.06 0.00 -2.01 0.00 0.00 31.29 32.46 1tkr h VAL 603 CO 0.02 0.51 0.62 -0.33 -1.01 0.00 0.00 177.57 177.38 1tkr h GLU 604 N -0.95 1.16 0.00 4.17 5.08 -0.49 -0.10 114.58 123.44 1tkr h GLU 604 Ca -0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1tkr h GLU 604 Cb 1.16 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1tkr h GLU 604 CO -0.07 0.77 0.00 -0.44 -1.00 0.00 0.00 179.01 178.27 1tkr h ASP 605 N 1.19 0.00 0.60 1.42 3.32 -0.10 -1.51 116.42 121.34 1tkr h ASP 605 Ca 0.38 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 57.15 1tkr h ASP 605 Cb 0.01 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.57 1tkr h ASP 605 CO -0.12 0.00 -1.24 -0.61 -1.72 0.00 0.00 179.24 175.55 1tkr h GLN 606 N 0.00 0.29 -0.24 3.56 5.75 -1.03 -1.34 115.11 122.11 1tkr h GLN 606 Ca 0.00 -0.49 -0.16 0.00 -0.15 0.00 0.00 58.65 57.85 1tkr h GLN 606 Cb 0.30 0.18 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1tkr h GLN 606 CO 0.00 1.23 -0.47 0.82 -2.65 0.00 0.00 178.83 177.75 1tkr h ILE 607 N 0.08 1.30 -0.41 2.39 2.04 -1.10 -1.63 117.51 120.19 1tkr h ILE 607 Ca -0.14 -1.68 -0.05 0.00 1.00 0.00 0.00 64.86 63.99 1tkr h ILE 607 Cb 1.96 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 39.79 1tkr h ILE 607 CO 0.21 0.53 0.05 -0.08 0.00 0.00 0.00 178.15 178.86 1tkr h GLU 608 N 0.47 0.69 -0.40 2.37 4.57 -1.34 0.59 114.58 121.53 1tkr h GLU 608 Ca 0.01 -0.19 -0.01 0.00 -1.18 0.00 0.00 59.36 57.99 1tkr h GLU 608 Cb 1.08 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.57 1tkr h GLU 608 CO 0.11 0.74 0.23 0.00 -1.18 0.00 0.00 179.01 178.90 1tkr h ALA 609 N 0.92 0.52 -0.27 2.92 0.00 -1.24 -0.86 119.26 121.25 1tkr h ALA 609 Ca 0.12 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1tkr h ALA 609 Cb 0.40 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1tkr h ALA 609 CO 0.01 0.03 -0.31 0.00 0.00 0.00 0.00 179.25 178.99 1tkr h ALA 610 N 1.08 0.97 -0.38 0.00 0.00 -1.04 -1.12 119.26 118.78 1tkr h ALA 610 Ca 0.14 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1tkr h ALA 610 Cb 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1tkr h ALA 610 CO -0.02 0.60 -0.01 -0.09 0.00 0.00 0.00 179.25 179.73 1tkr h ARG 611 N 0.48 0.60 0.00 0.00 2.43 0.68 -2.10 114.38 116.47 1tkr h ARG 611 Ca 0.06 -0.14 -0.15 0.00 -0.81 0.00 0.00 59.98 58.94 1tkr h ARG 611 Cb 0.77 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 1tkr h ARG 611 CO 0.06 0.64 -0.79 1.96 -1.51 0.00 0.00 179.97 180.33 1tkr h GLN 612 N 0.57 0.00 -0.62 0.20 4.20 -0.93 -3.23 115.11 115.29 1tkr h GLN 612 Ca 0.12 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 1tkr h GLN 612 Cb 0.39 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 1tkr h GLN 612 CO 0.01 0.62 0.23 0.74 -0.67 0.00 0.00 178.83 179.77 1tkr h PHE 613 N 0.00 0.96 -0.88 2.96 0.04 -0.66 -2.57 116.94 116.79 1tkr h PHE 613 Ca -0.03 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 1tkr h PHE 613 Cb 1.54 -0.29 -0.04 0.00 2.20 0.00 0.00 35.95 39.36 1tkr h PHE 613 CO 0.00 0.77 0.50 0.66 -0.60 0.00 0.00 178.31 179.64 1tkr h SER 614 N 0.88 1.08 0.00 2.17 4.64 -1.44 -1.65 113.55 119.22 1tkr h SER 614 Ca 0.21 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1tkr h SER 614 Cb 0.23 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1tkr h SER 614 CO -0.01 0.85 0.00 0.29 -0.87 0.00 0.00 176.83 177.09 1tkr n LYS 615 N -4.34 0.82 0.05 4.77 4.76 -0.97 -3.38 118.16 119.87 1tkr n LYS 615 Ca 0.09 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.65 1tkr n LYS 615 Cb 0.08 -1.38 0.05 0.00 -1.84 0.00 0.00 35.03 31.94 1tkr n LYS 615 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1tkr n MET 616 N 0.04 0.37 0.00 1.97 2.81 -0.62 -5.00 117.12 116.69 1tkr n MET 616 Ca 0.00 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.92 1tkr n MET 616 Cb 0.19 -1.66 0.00 0.00 -0.71 0.00 0.00 33.22 31.04 1tkr n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1tkr n GLY 617 N 1.32 2.83 1.38 3.03 0.00 -1.22 -4.83 105.19 107.69 1tkr n GLY 617 Ca 0.02 -0.48 0.11 0.00 0.00 0.00 0.00 46.02 45.66 1tkr n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1tkr n PHE 618 N 0.00 1.08 -4.03 1.61 1.16 -1.26 -4.71 117.46 111.31 1tkr n PHE 618 Ca 0.00 -0.53 -0.35 0.00 -1.87 0.00 0.00 57.45 54.70 1tkr n PHE 618 Cb 0.00 -0.06 -0.14 0.00 -1.61 0.00 0.00 39.48 37.67 1tkr n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1tkr s VAL 619 N -1.22 3.56 -0.76 1.97 1.01 -1.26 -0.05 120.40 123.65 1tkr s VAL 619 Ca 0.48 -0.44 -0.26 0.00 0.00 0.00 0.00 61.98 61.77 1tkr s VAL 619 Cb 0.27 -2.61 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1tkr s VAL 619 CO 0.30 0.43 1.63 -0.62 0.00 0.00 0.00 175.10 176.84 1tkr s ASP 620 N 1.24 5.71 0.33 3.32 -1.08 0.07 -4.82 116.67 121.45 1tkr s ASP 620 Ca 0.03 -0.35 0.16 0.00 -0.52 0.00 0.00 52.55 51.88 1tkr s ASP 620 Cb -0.14 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.65 1tkr s ASP 620 CO -0.01 -2.14 1.43 -0.46 0.52 0.00 0.00 175.17 174.52 1tkr n ASN 621 N 11.31 0.42 0.12 -0.34 6.94 -1.26 -0.59 115.26 131.86 1tkr n ASN 621 Ca 0.20 0.63 0.12 0.00 -0.02 0.00 0.00 54.58 55.51 1tkr n ASN 621 Cb 0.50 -0.62 0.10 0.00 -2.36 0.00 0.00 39.78 37.40 1tkr n ASN 621 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 1tkr h LYS 622 N 0.00 0.00 -2.42 -3.83 1.57 -1.93 -3.40 116.57 106.57 1tkr h LYS 622 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1tkr h LYS 622 Cb 0.40 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.30 1tkr h LYS 622 CO 0.00 0.00 -0.70 0.54 -0.57 0.00 0.00 179.45 178.72 1tkr n ARG 623 N -2.62 1.88 -4.05 3.15 1.74 0.24 -4.82 116.66 112.18 1tkr n ARG 623 Ca 0.02 -4.28 -0.31 0.00 -0.77 0.00 0.00 57.85 52.51 1tkr n ARG 623 Cb 0.51 -2.06 -0.16 0.00 -1.02 0.00 0.00 32.46 29.73 1tkr n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1tkr s ILE 624 N -1.81 1.72 0.44 0.55 1.01 -1.26 -0.82 121.20 121.04 1tkr s ILE 624 Ca 0.35 -0.74 0.06 0.00 0.00 0.00 0.00 60.65 60.32 1tkr s ILE 624 Cb 0.09 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1tkr s ILE 624 CO -0.08 0.47 0.14 0.00 0.00 0.00 0.00 174.94 175.47 1tkr s ALA 625 N 1.43 3.69 -0.15 9.38 0.00 0.16 -1.24 121.76 135.02 1tkr s ALA 625 Ca 0.05 -1.77 -0.11 0.00 0.00 0.00 0.00 51.96 50.13 1tkr s ALA 625 Cb -0.13 -0.24 0.04 0.00 0.00 0.00 0.00 23.12 22.80 1tkr s ALA 625 CO -0.11 -0.17 0.38 -1.50 0.00 0.00 0.00 175.76 174.36 1tkr s ILE 626 N -2.69 -0.01 0.08 0.00 2.07 -1.02 0.47 121.20 120.10 1tkr s ILE 626 Ca 0.33 0.04 -0.09 0.00 -1.41 0.00 0.00 60.65 59.52 1tkr s ILE 626 Cb 0.04 -0.54 0.00 0.00 0.13 0.00 0.00 42.46 42.09 1tkr s ILE 626 CO 0.18 0.02 0.20 -1.66 -1.91 0.00 0.00 174.94 171.77 1tkr s TRP 627 N 0.63 0.12 0.09 3.50 1.48 -1.03 -1.16 118.94 122.57 1tkr s TRP 627 Ca -0.04 -0.51 -0.26 0.00 -1.06 0.00 0.00 56.10 54.23 1tkr s TRP 627 Cb -0.05 -0.04 0.08 0.00 -1.16 0.00 0.00 33.47 32.30 1tkr s TRP 627 CO -0.04 -0.53 0.82 0.20 -4.06 0.00 0.00 176.95 173.34 1tkr s GLY 628 N -2.74 -0.42 -0.03 3.67 0.00 -0.97 -1.67 107.32 105.16 1tkr s GLY 628 Ca 0.03 0.59 0.06 0.00 0.00 0.00 0.00 44.72 45.41 1tkr s GLY 628 CO -0.10 0.19 -0.22 0.86 0.00 0.00 0.00 173.10 173.83 1tkr s TRP 629 N -3.37 2.06 0.00 1.90 -0.11 -1.26 -1.45 118.94 116.71 1tkr s TRP 629 Ca 0.06 -0.50 0.00 0.00 1.22 0.00 0.00 56.10 56.88 1tkr s TRP 629 Cb -0.01 -1.35 0.00 0.00 -1.50 0.00 0.00 33.47 30.61 1tkr s TRP 629 CO -0.06 -0.12 0.00 0.45 -4.62 0.00 0.00 176.95 172.60 1tkr n SER 630 N 2.79 0.00 0.14 5.86 2.88 0.82 -0.49 113.62 125.62 1tkr n SER 630 Ca -0.17 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.39 1tkr n SER 630 Cb 0.52 0.00 0.36 0.00 -0.75 0.00 0.00 64.21 64.34 1tkr n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1tkr h TYR 631 N 0.00 0.17 -0.55 0.66 5.03 -1.87 -1.07 116.97 119.34 1tkr h TYR 631 Ca 0.00 -0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.23 1tkr h TYR 631 Cb 0.00 -0.04 -0.03 0.00 1.55 0.00 0.00 36.73 38.21 1tkr h TYR 631 CO 0.00 0.40 0.14 0.78 -1.32 0.00 0.00 178.16 178.17 1tkr h GLY 632 N 0.92 0.89 0.98 1.82 0.00 -0.86 -1.89 103.07 104.92 1tkr h GLY 632 Ca 0.02 -0.50 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 1tkr h GLY 632 CO 0.04 0.47 0.11 -1.33 0.00 0.00 0.00 176.54 175.84 1tkr h GLY 633 N 0.97 0.86 0.98 4.60 0.00 -1.16 -0.71 103.07 108.60 1tkr h GLY 633 Ca 0.18 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 1tkr h GLY 633 CO -0.00 0.51 -0.03 -1.82 0.00 0.00 0.00 176.54 175.19 1tkr h TYR 634 N 0.68 -0.09 -0.58 5.60 3.20 -0.95 0.12 116.97 124.96 1tkr h TYR 634 Ca 0.16 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.00 1tkr h TYR 634 Cb 0.34 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 1tkr h TYR 634 CO 0.02 -0.06 0.24 0.28 -1.64 0.00 0.00 178.16 177.01 1tkr h VAL 635 N -0.09 1.20 -0.11 1.81 2.07 -1.31 0.20 116.25 120.04 1tkr h VAL 635 Ca -0.00 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1tkr h VAL 635 Cb 0.08 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1tkr h VAL 635 CO 0.00 0.25 0.06 0.74 0.02 0.00 0.00 177.57 178.65 1tkr h THR 636 N 0.83 1.07 -0.69 2.57 2.02 -0.64 0.18 112.91 118.24 1tkr h THR 636 Ca 0.20 -0.18 -0.06 0.00 0.77 0.00 0.00 66.41 67.14 1tkr h THR 636 Cb 0.14 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 1tkr h THR 636 CO -0.02 0.06 0.18 0.28 0.37 0.00 0.00 175.52 176.39 1tkr h SER 637 N 0.10 1.03 -0.49 4.18 0.02 -0.19 -0.03 113.55 118.18 1tkr h SER 637 Ca 0.04 -0.21 -0.10 0.00 -0.84 0.00 0.00 61.79 60.68 1tkr h SER 637 Cb 0.04 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 1tkr h SER 637 CO -0.01 0.98 -0.07 0.24 -1.14 0.00 0.00 176.83 176.83 1tkr h MET 638 N 1.04 0.92 -0.08 3.45 2.86 -0.40 -1.65 114.93 121.06 1tkr h MET 638 Ca 0.22 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1tkr h MET 638 Cb 0.35 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 1tkr h MET 638 CO -0.00 0.98 0.02 0.28 1.06 0.00 0.00 176.91 179.25 1tkr h VAL 639 N 0.77 1.19 0.00 -2.22 2.07 -0.71 -2.08 116.25 115.27 1tkr h VAL 639 Ca 0.13 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1tkr h VAL 639 Cb 0.62 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1tkr h VAL 639 CO 0.04 0.17 -0.04 -0.07 0.02 0.00 0.00 177.57 177.69 1tkr h LEU 640 N -0.08 0.00 -3.68 2.57 3.38 -0.96 -1.95 115.31 114.60 1tkr h LEU 640 Ca 0.03 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 1tkr h LEU 640 Cb 0.25 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.90 1tkr h LEU 640 CO 0.00 0.04 0.20 0.61 0.09 0.00 0.00 178.44 179.38 1tkr n GLY 641 N -1.41 3.60 0.02 0.83 0.00 -0.63 -4.27 105.19 103.34 1tkr n GLY 641 Ca -0.03 -1.00 0.11 0.00 0.00 0.00 0.00 46.02 45.10 1tkr n GLY 641 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tkr n SER 642 N -0.05 0.60 0.00 1.61 3.41 -0.73 -4.74 113.62 113.72 1tkr n SER 642 Ca 0.38 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1tkr n SER 642 Cb 1.33 0.97 0.00 0.00 -0.26 0.00 0.00 64.21 66.25 1tkr n SER 642 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tkr n GLY 643 N 1.38 0.52 0.37 5.00 0.00 -1.26 -4.93 105.19 106.27 1tkr n GLY 643 Ca 0.02 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.06 1tkr n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1tkr h SER 644 N 0.00 0.89 0.00 1.61 4.64 -1.89 -3.45 113.55 115.35 1tkr h SER 644 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1tkr h SER 644 Cb 0.00 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 1tkr h SER 644 CO 0.00 0.51 0.00 0.61 -0.87 0.00 0.00 176.83 177.08 1tkr n GLY 645 N -1.38 1.62 0.25 -0.77 0.00 -1.26 -4.87 105.19 98.77 1tkr n GLY 645 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1tkr n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1tkr h VAL 646 N 0.00 1.29 -2.71 1.61 2.07 -1.96 -3.44 116.25 113.11 1tkr h VAL 646 Ca 0.00 -1.51 -0.66 0.00 0.82 0.00 0.00 66.70 65.35 1tkr h VAL 646 Cb 0.00 1.42 -0.07 0.00 -1.52 0.00 0.00 31.29 31.13 1tkr h VAL 646 CO 0.00 0.49 -0.44 -0.36 0.02 0.00 0.00 177.57 177.28 1tkr s PHE 647 N -4.37 3.61 -0.16 1.57 0.40 -1.26 -4.67 117.98 113.10 1tkr s PHE 647 Ca -0.09 0.59 -0.22 0.00 -0.60 0.00 0.00 56.93 56.60 1tkr s PHE 647 Cb 0.12 -1.98 -0.23 0.00 0.51 0.00 0.00 43.02 41.44 1tkr s PHE 647 CO 0.84 0.72 0.47 -0.22 0.70 0.00 0.00 175.22 177.73 1tkr h LYS 648 N 4.85 0.06 -4.13 0.44 3.64 -1.47 -3.46 116.57 116.50 1tkr h LYS 648 Ca -0.54 -0.11 -0.14 0.00 -1.27 0.00 0.00 60.65 58.59 1tkr h LYS 648 Cb 1.23 0.04 -0.13 0.00 -0.41 0.00 0.00 32.23 32.95 1tkr h LYS 648 CO 0.59 1.05 -0.43 0.00 -2.27 0.00 0.00 179.45 178.40 1tkr s GLY 650 N -3.04 -0.50 -0.12 0.00 0.00 0.02 -2.43 107.32 101.26 1tkr s GLY 650 Ca 0.24 0.74 0.02 0.00 0.00 0.00 0.00 44.72 45.73 1tkr s GLY 650 CO 0.05 0.42 -0.18 -0.42 0.00 0.00 0.00 173.10 172.96 1tkr s ILE 651 N -2.39 1.75 -0.22 0.90 1.01 -0.31 -1.59 121.20 120.35 1tkr s ILE 651 Ca -0.05 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.77 1tkr s ILE 651 Cb -0.01 -1.57 0.00 0.00 0.01 0.00 0.00 42.46 40.90 1tkr s ILE 651 CO -0.01 0.49 -0.07 0.00 0.00 0.00 0.00 174.94 175.35 1tkr s ALA 652 N 0.86 2.72 -0.19 9.38 0.00 0.05 -2.28 121.76 132.30 1tkr s ALA 652 Ca -0.08 -1.26 -0.04 0.00 0.00 0.00 0.00 51.96 50.58 1tkr s ALA 652 Cb -0.15 -1.64 -0.02 0.00 0.00 0.00 0.00 23.12 21.30 1tkr s ALA 652 CO -0.01 -0.53 -0.03 0.08 0.00 0.00 0.00 175.76 175.27 1tkr s VAL 653 N 1.42 3.75 -1.19 0.00 1.01 -0.53 -0.76 120.40 124.11 1tkr s VAL 653 Ca 0.04 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.49 1tkr s VAL 653 Cb -0.15 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.58 1tkr s VAL 653 CO -0.05 0.45 0.28 0.00 0.00 0.00 0.00 175.10 175.78 1tkr n ALA 654 N 4.12 -2.11 -1.82 5.51 0.00 -0.05 -0.13 120.51 126.04 1tkr n ALA 654 Ca -0.17 -0.44 -0.29 0.00 0.00 0.00 0.00 53.44 52.54 1tkr n ALA 654 Cb 0.52 -1.39 0.15 0.00 0.00 0.00 0.00 19.45 18.72 1tkr n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tkr s PRO 655 N -6.94 1.05 -0.16 0.00 0.04 -1.26 -2.84 135.00 124.89 1tkr s PRO 655 Ca 0.20 -0.12 -0.07 0.00 0.04 0.00 0.00 61.00 61.06 1tkr s PRO 655 Cb -0.11 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 1tkr s PRO 655 CO 0.84 -2.18 0.07 0.08 0.04 0.00 0.00 177.00 175.85 1tkr s VAL 656 N -3.65 4.85 -0.21 -0.36 1.01 -1.23 -4.64 120.40 116.16 1tkr s VAL 656 Ca 0.68 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.67 1tkr s VAL 656 Cb -0.08 -3.16 -0.15 0.00 0.00 0.00 0.00 36.38 33.00 1tkr s VAL 656 CO 0.52 0.50 -0.18 -1.54 0.00 0.00 0.00 175.10 174.40 1tkr n SER 657 N 3.12 2.23 -3.74 3.32 3.41 -1.26 -4.29 113.62 116.41 1tkr n SER 657 Ca -0.17 -0.11 -0.12 0.00 -0.26 0.00 0.00 58.87 58.21 1tkr n SER 657 Cb 0.53 -0.27 -0.12 0.00 -0.26 0.00 0.00 64.21 64.09 1tkr n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tkr s ARG 658 N -2.43 0.30 0.63 4.33 1.70 -1.26 0.77 118.95 122.99 1tkr s ARG 658 Ca -0.28 0.54 0.35 0.00 -0.47 0.00 0.00 55.73 55.87 1tkr s ARG 658 Cb 0.07 0.01 1.94 0.00 -0.57 0.00 0.00 34.95 36.41 1tkr s ARG 658 CO 0.51 -0.12 2.18 -1.49 -1.08 0.00 0.00 175.30 175.30 1tkr h TRP 659 N 6.60 0.00 0.00 5.89 4.06 -1.84 -1.58 115.95 129.08 1tkr h TRP 659 Ca -0.34 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.61 1tkr h TRP 659 Cb 1.17 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.33 1tkr h TRP 659 CO 0.35 0.00 0.00 0.93 -3.56 0.00 0.00 178.44 176.16 1tkr h GLU 660 N 0.00 0.00 0.00 0.49 5.08 -1.92 -2.49 114.58 115.74 1tkr h GLU 660 Ca 0.03 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1tkr h GLU 660 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1tkr h GLU 660 CO -0.00 0.00 -0.43 1.88 -1.00 0.00 0.00 179.01 179.46 1tkr h TYR 661 N 0.00 0.00 -3.49 4.33 0.05 -1.66 -3.24 116.97 112.95 1tkr h TYR 661 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.32 1tkr h TYR 661 Cb 0.34 0.00 0.06 0.00 1.01 0.00 0.00 36.73 38.13 1tkr h TYR 661 CO 0.00 0.21 0.15 -0.47 -1.05 0.00 0.00 178.16 176.99 1tkr s TYR 662 N -3.13 3.11 0.71 4.88 5.04 -0.94 -4.83 117.35 122.19 1tkr s TYR 662 Ca 0.04 0.48 -0.14 0.00 -2.44 0.00 0.00 57.07 55.01 1tkr s TYR 662 Cb 0.07 -2.83 0.03 0.00 0.35 0.00 0.00 41.96 39.57 1tkr s TYR 662 CO 0.72 -0.96 1.15 0.16 -1.34 0.00 0.00 175.55 175.28 1tkr s ASP 663 N -4.37 4.61 0.04 4.32 1.47 -1.26 -0.70 116.67 120.78 1tkr s ASP 663 Ca 0.56 2.13 -0.20 0.00 1.18 0.00 0.00 52.55 56.22 1tkr s ASP 663 Cb -0.11 -2.56 -0.10 0.00 -0.34 0.00 0.00 42.92 39.81 1tkr s ASP 663 CO 0.44 -1.97 1.31 0.77 0.68 0.00 0.00 175.17 176.39 1tkr h SER 664 N -0.26 -0.70 -0.94 2.11 4.64 -0.43 -2.36 113.55 115.60 1tkr h SER 664 Ca -0.47 0.04 0.16 0.00 -0.47 0.00 0.00 61.79 61.06 1tkr h SER 664 Cb 1.27 0.21 -0.16 0.00 -0.31 0.00 0.00 62.40 63.40 1tkr h SER 664 CO 0.52 -0.41 -0.34 0.58 -0.87 0.00 0.00 176.83 176.31 1tkr h VAL 665 N -0.64 0.03 0.44 0.95 2.07 -1.94 -1.23 116.25 115.94 1tkr h VAL 665 Ca -0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1tkr h VAL 665 Cb 0.52 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1tkr h VAL 665 CO 0.04 0.00 -0.21 0.22 0.02 0.00 0.00 177.57 177.64 1tkr h TYR 666 N -0.02 -0.55 0.04 1.57 5.03 -1.92 -3.22 116.97 117.90 1tkr h TYR 666 Ca 0.37 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.67 1tkr h TYR 666 Cb 0.62 0.18 -0.01 0.00 1.55 0.00 0.00 36.73 39.08 1tkr h TYR 666 CO -0.81 -0.34 -0.11 1.15 -1.32 0.00 0.00 178.16 176.73 1tkr h THR 667 N -1.11 0.00 -0.65 1.81 2.02 -1.18 -2.18 112.91 111.62 1tkr h THR 667 Ca -0.06 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.31 1tkr h THR 667 Cb 0.46 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.84 1tkr h THR 667 CO 0.10 0.00 0.80 -0.33 0.37 0.00 0.00 175.52 176.46 1tkr h GLU 668 N -0.17 0.00 -0.33 6.66 5.08 -1.39 0.49 114.58 124.92 1tkr h GLU 668 Ca -0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1tkr h GLU 668 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1tkr h GLU 668 CO -0.05 0.00 0.22 -0.09 -1.00 0.00 0.00 179.01 178.09 1tkr h ARG 669 N 0.00 0.36 0.00 2.33 2.43 -1.40 0.12 114.38 118.22 1tkr h ARG 669 Ca 0.31 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 1tkr h ARG 669 Cb 1.89 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.36 1tkr h ARG 669 CO -0.00 0.24 -1.16 0.66 -1.51 0.00 0.00 179.97 178.19 1tkr n TYR 670 N -4.49 0.00 0.22 2.20 4.01 0.15 -4.52 117.16 114.74 1tkr n TYR 670 Ca 0.03 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.80 1tkr n TYR 670 Cb 0.13 -0.15 -0.04 0.00 -0.31 0.00 0.00 39.34 38.97 1tkr n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1tkr n MET 671 N -1.66 3.26 0.00 -0.72 2.81 -0.12 0.11 117.12 120.81 1tkr n MET 671 Ca -0.01 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1tkr n MET 671 Cb 0.19 -0.94 0.00 0.00 -0.71 0.00 0.00 33.22 31.76 1tkr n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1tkr n GLY 672 N 1.47 -0.63 3.85 3.03 0.00 0.41 -4.55 105.19 108.76 1tkr n GLY 672 Ca 0.00 -1.14 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 1tkr n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tkr s LEU 673 N 0.00 4.38 -0.01 0.99 1.02 -1.26 -4.20 118.68 119.60 1tkr s LEU 673 Ca 0.00 0.92 -0.05 0.00 0.02 0.00 0.00 54.13 55.02 1tkr s LEU 673 Cb 0.00 -2.97 -0.22 0.00 0.02 0.00 0.00 46.19 43.02 1tkr s LEU 673 CO 0.00 0.19 3.07 -0.81 0.02 0.00 0.00 176.35 178.82 1tkr n PRO 674 N 1.10 1.65 -4.69 1.29 -0.04 -1.26 -2.51 135.00 130.54 1tkr n PRO 674 Ca -0.09 -0.83 -0.31 0.00 -0.04 0.00 0.00 63.50 62.23 1tkr n PRO 674 Cb 0.52 -1.92 -0.13 0.00 -0.04 0.00 0.00 33.50 31.94 1tkr n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1tkr s THR 675 N 1.37 2.87 0.60 0.52 -4.23 -1.26 -4.57 115.64 110.93 1tkr s THR 675 Ca 0.55 -1.10 0.30 0.00 -1.18 0.00 0.00 61.69 60.27 1tkr s THR 675 Cb 0.26 -2.19 0.36 0.00 1.34 0.00 0.00 72.50 72.27 1tkr s THR 675 CO -0.00 0.38 2.09 1.55 -0.54 0.00 0.00 174.62 178.10 1tkr h PRO 676 N 4.66 0.00 0.00 3.99 0.13 -1.94 0.48 132.00 139.32 1tkr h PRO 676 Ca -0.47 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.58 1tkr h PRO 676 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1tkr h PRO 676 CO 0.48 0.00 -0.36 0.93 -0.23 0.00 0.00 178.00 178.82 1tkr h GLU 677 N 0.00 0.00 0.00 0.86 3.07 -1.95 -3.45 114.58 113.12 1tkr h GLU 677 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 1tkr h GLU 677 Cb 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1tkr h GLU 677 CO -0.00 0.36 0.00 -3.47 -1.40 0.00 0.00 179.01 174.50 1tkr n ASP 678 N -3.49 0.00 -0.55 1.42 -0.08 0.16 -5.00 116.55 109.01 1tkr n ASP 678 Ca -0.00 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.34 1tkr n ASP 678 Cb 0.51 0.00 0.19 0.00 2.34 0.00 0.00 41.12 44.16 1tkr n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1tkr n ASN 679 N 0.00 2.50 -0.20 1.67 4.05 -1.04 -4.76 115.26 117.47 1tkr n ASN 679 Ca 0.00 -3.40 0.14 0.00 0.45 0.00 0.00 54.58 51.77 1tkr n ASN 679 Cb 0.00 -0.51 0.46 0.00 1.23 0.00 0.00 39.78 40.96 1tkr n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1tkr h LEU 680 N 0.76 0.48 0.12 1.20 5.85 -1.46 -2.60 115.31 119.67 1tkr h LEU 680 Ca 0.04 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1tkr h LEU 680 Cb 1.20 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 1tkr h LEU 680 CO 0.11 0.25 -0.12 0.44 -0.34 0.00 0.00 178.44 178.77 1tkr h ASP 681 N 0.51 -0.32 -0.80 1.25 3.32 -1.86 -2.26 116.42 116.26 1tkr h ASP 681 Ca 0.40 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.46 1tkr h ASP 681 Cb 0.81 0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.44 1tkr h ASP 681 CO -0.15 -0.19 0.41 -0.74 -1.72 0.00 0.00 179.24 176.85 1tkr h HIS 682 N -0.27 1.15 -0.89 4.55 2.76 -1.84 -0.95 115.15 119.65 1tkr h HIS 682 Ca 0.00 -0.04 0.19 0.00 -2.20 0.00 0.00 60.37 58.32 1tkr h HIS 682 Cb 0.26 -0.36 -0.11 0.00 1.55 0.00 0.00 27.41 28.75 1tkr h HIS 682 CO -0.12 0.82 0.45 1.88 -1.30 0.00 0.00 177.93 179.65 1tkr h TYR 683 N 1.15 0.77 0.00 5.26 0.05 -1.21 0.27 116.97 123.26 1tkr h TYR 683 Ca 0.28 0.04 -0.16 0.00 0.05 0.00 0.00 58.73 58.94 1tkr h TYR 683 Cb 0.09 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.60 1tkr h TYR 683 CO 0.01 0.09 -0.75 0.00 -1.05 0.00 0.00 178.16 176.46 1tkr h ARG 684 N 0.54 0.00 0.00 4.88 2.47 -0.74 -3.29 114.38 118.24 1tkr h ARG 684 Ca 0.52 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 59.16 1tkr h ARG 684 Cb 0.87 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.18 1tkr h ARG 684 CO -0.44 0.75 -0.49 -0.91 0.56 0.00 0.00 179.97 179.44 1tkr h ASN 685 N 0.00 0.00 -0.86 7.04 4.21 0.56 -3.36 115.58 123.18 1tkr h ASN 685 Ca -0.01 0.00 -0.40 0.00 1.21 0.00 0.00 56.30 57.10 1tkr h ASN 685 Cb 1.38 0.00 -0.24 0.00 -1.12 0.00 0.00 38.32 38.34 1tkr h ASN 685 CO 0.10 0.36 0.51 -1.54 -1.29 0.00 0.00 177.43 175.57 1tkr n SER 686 N -3.13 3.97 -4.90 5.81 3.41 0.66 -4.97 113.62 114.47 1tkr n SER 686 Ca 0.01 -3.38 -0.29 0.00 -0.26 0.00 0.00 58.87 54.95 1tkr n SER 686 Cb 0.69 -0.79 -0.04 0.00 -0.26 0.00 0.00 64.21 63.81 1tkr n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1tkr s THR 687 N -2.97 5.02 -0.01 6.66 -4.23 -1.26 -4.72 115.64 114.13 1tkr s THR 687 Ca 0.52 0.11 -0.24 0.00 -1.18 0.00 0.00 61.69 60.90 1tkr s THR 687 Cb 0.43 -3.71 -0.17 0.00 1.34 0.00 0.00 72.50 70.40 1tkr s THR 687 CO 0.11 -0.25 1.18 0.58 -0.54 0.00 0.00 174.62 175.70 1tkr h VAL 688 N 1.51 0.91 -1.06 2.29 2.07 0.03 -3.30 116.25 118.70 1tkr h VAL 688 Ca -0.47 -0.83 0.29 0.00 0.82 0.00 0.00 66.70 66.51 1tkr h VAL 688 Cb 1.18 1.38 -0.12 0.00 -1.52 0.00 0.00 31.29 32.21 1tkr h VAL 688 CO 0.67 0.18 0.66 0.00 0.02 0.00 0.00 177.57 179.10 1tkr h MET 689 N -0.69 0.38 -0.00 1.57 -0.00 -1.89 0.35 114.93 114.65 1tkr h MET 689 Ca -0.03 -0.02 0.00 0.00 -0.00 0.00 0.00 59.70 59.65 1tkr h MET 689 Cb 0.49 -0.08 -0.00 0.00 -0.00 0.00 0.00 31.60 32.00 1tkr h MET 689 CO 0.04 0.25 0.09 0.66 -0.00 0.00 0.00 176.91 177.95 1tkr h SER 690 N 0.39 0.00 -0.68 -0.10 4.64 -1.95 0.21 113.55 116.06 1tkr h SER 690 Ca 0.66 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.98 1tkr h SER 690 Cb 1.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.70 1tkr h SER 690 CO -0.41 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.09 1tkr n ARG 691 N -3.06 2.89 -0.13 4.77 1.74 0.12 -4.64 116.66 118.35 1tkr n ARG 691 Ca -0.03 -2.57 -0.09 0.00 -0.77 0.00 0.00 57.85 54.39 1tkr n ARG 691 Cb 0.16 -1.63 -0.04 0.00 -1.02 0.00 0.00 32.46 29.93 1tkr n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tkr h ALA 692 N 4.23 -0.35 -0.37 7.54 0.00 -0.64 -1.36 119.26 128.31 1tkr h ALA 692 Ca 0.00 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1tkr h ALA 692 Cb 1.06 0.85 -0.01 0.00 0.00 0.00 0.00 17.79 19.68 1tkr h ALA 692 CO 0.06 -0.82 0.55 1.49 0.00 0.00 0.00 179.25 180.52 1tkr h GLU 693 N -0.30 0.00 -0.00 0.00 4.57 -1.82 -0.34 114.58 116.69 1tkr h GLU 693 Ca 0.15 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1tkr h GLU 693 Cb 0.57 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 1tkr h GLU 693 CO -0.58 0.00 -0.09 0.09 -1.18 0.00 0.00 179.01 177.26 1tkr n ASN 694 N -3.39 0.28 -0.08 1.04 5.03 -0.51 -3.66 115.26 113.97 1tkr n ASN 694 Ca 0.07 -0.34 0.16 0.00 0.87 0.00 0.00 54.58 55.33 1tkr n ASN 694 Cb 0.70 -0.16 0.86 0.00 -1.02 0.00 0.00 39.78 40.16 1tkr n ASN 694 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1tkr n PHE 695 N -1.13 0.00 0.31 3.10 3.01 -0.14 -3.57 117.46 119.04 1tkr n PHE 695 Ca 0.13 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.76 1tkr n PHE 695 Cb 0.27 -0.02 0.73 0.00 -0.01 0.00 0.00 39.48 40.46 1tkr n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1tkr h LYS 696 N 0.40 0.00 -0.64 -1.08 1.57 -1.77 -2.78 116.57 112.27 1tkr h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1tkr h LYS 696 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1tkr h LYS 696 CO 0.00 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.92 1tkr n GLN 697 N -2.76 2.99 -3.98 3.15 1.13 -1.23 -4.99 117.38 111.69 1tkr n GLN 697 Ca 0.00 -2.62 -0.08 0.00 -1.94 0.00 0.00 57.00 52.35 1tkr n GLN 697 Cb 0.20 -1.60 -0.08 0.00 0.11 0.00 0.00 30.24 28.87 1tkr n GLN 697 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1tkr s VAL 698 N -1.23 0.16 -0.42 5.09 -7.23 -1.05 -4.93 120.40 110.79 1tkr s VAL 698 Ca 0.45 -1.50 -0.17 0.00 -1.81 0.00 0.00 61.98 58.95 1tkr s VAL 698 Cb 0.25 -1.52 0.03 0.00 0.56 0.00 0.00 36.38 35.70 1tkr s VAL 698 CO 0.28 -0.73 0.41 -1.61 -0.31 0.00 0.00 175.10 173.13 1tkr s GLU 699 N -3.91 3.05 -0.06 4.82 2.02 -0.93 -4.98 118.70 118.72 1tkr s GLU 699 Ca 0.09 -0.87 -0.01 0.00 0.02 0.00 0.00 54.97 54.19 1tkr s GLU 699 Cb 0.06 -3.99 -0.04 0.00 0.10 0.00 0.00 34.13 30.27 1tkr s GLU 699 CO -0.08 -0.85 0.03 -0.47 0.02 0.00 0.00 175.26 173.90 1tkr s TYR 700 N 2.01 3.21 -0.21 1.61 5.04 -1.26 -0.80 117.35 126.94 1tkr s TYR 700 Ca 0.10 0.21 0.00 0.00 -2.44 0.00 0.00 57.07 54.94 1tkr s TYR 700 Cb -0.18 -1.77 0.05 0.00 0.35 0.00 0.00 41.96 40.41 1tkr s TYR 700 CO 0.12 0.51 -0.05 -1.17 -1.34 0.00 0.00 175.55 173.62 1tkr s LEU 701 N -1.17 2.21 -0.26 6.97 0.20 -0.62 -1.08 118.68 124.92 1tkr s LEU 701 Ca 0.16 -0.99 -0.11 0.00 0.69 0.00 0.00 54.13 53.88 1tkr s LEU 701 Cb -0.12 -1.08 -0.05 0.00 -0.43 0.00 0.00 46.19 44.51 1tkr s LEU 701 CO 0.06 -0.22 0.18 -0.22 -0.29 0.00 0.00 176.35 175.86 1tkr s LEU 702 N 1.48 4.06 0.01 -0.68 0.20 0.04 -0.77 118.68 123.03 1tkr s LEU 702 Ca -0.03 0.05 0.06 0.00 0.69 0.00 0.00 54.13 54.90 1tkr s LEU 702 Cb -0.18 -2.12 -0.02 0.00 -0.43 0.00 0.00 46.19 43.44 1tkr s LEU 702 CO -0.07 -0.00 -0.19 -0.63 -0.29 0.00 0.00 176.35 175.17 1tkr s ILE 703 N 1.46 1.49 -0.25 6.68 1.01 0.06 -1.18 121.20 130.47 1tkr s ILE 703 Ca 0.07 -0.96 -0.26 0.00 0.00 0.00 0.00 60.65 59.50 1tkr s ILE 703 Cb -0.15 -1.27 0.12 0.00 0.01 0.00 0.00 42.46 41.17 1tkr s ILE 703 CO 0.08 0.29 1.00 -2.28 0.00 0.00 0.00 174.94 174.03 1tkr s HIS 704 N -0.61 -0.48 -0.07 3.97 2.46 -1.01 -0.87 115.29 118.69 1tkr s HIS 704 Ca 0.07 1.09 -0.23 0.00 0.47 0.00 0.00 55.06 56.46 1tkr s HIS 704 Cb -0.08 0.38 -0.04 0.00 -0.13 0.00 0.00 32.58 32.71 1tkr s HIS 704 CO 0.00 -0.27 0.67 0.20 -2.47 0.00 0.00 174.74 172.88 1tkr s GLY 705 N -0.08 2.60 0.53 1.59 0.00 -1.26 -1.79 107.32 108.91 1tkr s GLY 705 Ca 0.02 0.10 0.22 0.00 0.00 0.00 0.00 44.72 45.06 1tkr s GLY 705 CO -0.04 1.12 2.14 -0.91 0.00 0.00 0.00 173.10 175.41 1tkr h THR 706 N 4.71 0.79 -0.75 0.90 1.35 -1.21 -2.29 112.91 116.43 1tkr h THR 706 Ca -0.41 -0.21 -0.38 0.00 -0.55 0.00 0.00 66.41 64.86 1tkr h THR 706 Cb 1.20 1.12 -0.22 0.00 -1.73 0.00 0.00 68.15 68.51 1tkr h THR 706 CO 0.75 0.06 0.36 0.00 -0.25 0.00 0.00 175.52 176.44 1tkr n ALA 707 N -2.42 5.07 -2.22 6.62 0.00 -0.54 -4.67 120.51 122.36 1tkr n ALA 707 Ca -0.03 -2.96 -0.43 0.00 0.00 0.00 0.00 53.44 50.03 1tkr n ALA 707 Cb 0.14 -1.18 -0.02 0.00 0.00 0.00 0.00 19.45 18.39 1tkr n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1tkr s ASP 708 N -1.74 6.46 0.21 0.00 -1.08 -0.86 -4.24 116.67 115.41 1tkr s ASP 708 Ca 0.52 1.44 0.23 0.00 -0.52 0.00 0.00 52.55 54.23 1tkr s ASP 708 Cb 0.45 -2.53 0.19 0.00 -1.46 0.00 0.00 42.92 39.57 1tkr s ASP 708 CO 0.07 -1.22 1.24 -2.24 0.52 0.00 0.00 175.17 173.54 1tkr h ASP 709 N 10.32 0.00 0.00 -0.34 2.03 -1.91 -3.34 116.42 123.18 1tkr h ASP 709 Ca -0.31 -0.07 0.00 0.00 -0.73 0.00 0.00 57.03 55.92 1tkr h ASP 709 Cb 1.13 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.63 1tkr h ASP 709 CO 1.02 0.04 0.00 -3.20 -1.03 0.00 0.00 179.24 176.06 1tkr n ASN 710 N -2.53 0.00 -4.31 4.15 2.85 -1.26 -4.65 115.26 109.50 1tkr n ASN 710 Ca 0.02 0.19 -0.46 0.00 -0.11 0.00 0.00 54.58 54.22 1tkr n ASN 710 Cb 0.51 -0.23 -0.04 0.00 1.24 0.00 0.00 39.78 41.25 1tkr n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1tkr s VAL 711 N -0.47 5.33 0.43 3.44 1.01 -1.26 -4.84 120.40 124.04 1tkr s VAL 711 Ca 0.00 -1.92 -0.24 0.00 0.00 0.00 0.00 61.98 59.82 1tkr s VAL 711 Cb 0.00 -4.36 -0.10 0.00 0.00 0.00 0.00 36.38 31.92 1tkr s VAL 711 CO 0.00 -0.93 1.05 1.41 0.00 0.00 0.00 175.10 176.63 1tkr n HIS 712 N 4.70 1.32 0.03 5.22 8.25 -1.25 -4.73 115.22 128.77 1tkr n HIS 712 Ca -0.02 0.54 0.21 0.00 -0.26 0.00 0.00 57.72 58.19 1tkr n HIS 712 Cb 0.43 -2.25 0.73 0.00 1.12 0.00 0.00 29.99 30.02 1tkr n HIS 712 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1tkr h PHE 713 N 1.57 0.00 -0.88 4.41 3.57 -1.79 0.14 116.94 123.96 1tkr h PHE 713 Ca -0.45 0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.22 1tkr h PHE 713 Cb 1.33 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 39.97 1tkr h PHE 713 CO 0.44 0.00 0.44 0.37 -2.23 0.00 0.00 178.31 177.33 1tkr h GLN 714 N 0.00 0.54 -0.36 1.11 4.15 -1.94 -0.27 115.11 118.35 1tkr h GLN 714 Ca 0.24 -0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.70 1tkr h GLN 714 Cb 1.09 -0.12 -0.09 0.00 0.21 0.00 0.00 27.48 28.57 1tkr h GLN 714 CO -0.00 0.36 -0.28 1.96 -1.93 0.00 0.00 178.83 178.93 1tkr h GLN 715 N 0.56 -0.23 0.00 1.69 1.08 -1.05 -1.02 115.11 116.14 1tkr h GLN 715 Ca 0.51 0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.67 1tkr h GLN 715 Cb 0.81 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.29 1tkr h GLN 715 CO -0.42 -0.15 -0.26 0.77 -0.95 0.00 0.00 178.83 177.82 1tkr h SER 716 N -0.23 0.00 0.71 1.46 0.02 -1.47 -2.85 113.55 111.19 1tkr h SER 716 Ca 0.17 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 1tkr h SER 716 Cb 0.51 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1tkr h SER 716 CO -0.49 0.26 -0.22 0.00 -1.14 0.00 0.00 176.83 175.23 1tkr h ALA 717 N 1.74 1.11 0.00 3.77 0.00 0.03 -0.21 119.26 125.71 1tkr h ALA 717 Ca -0.00 -0.20 -0.24 0.00 0.00 0.00 0.00 54.91 54.47 1tkr h ALA 717 Cb 1.00 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 1tkr h ALA 717 CO 0.03 0.28 -1.36 1.96 0.00 0.00 0.00 179.25 180.16 1tkr h GLN 718 N 0.00 0.00 -0.22 0.00 1.08 -1.09 -2.61 115.11 112.27 1tkr h GLN 718 Ca -0.00 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.09 1tkr h GLN 718 Cb 0.64 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.07 1tkr h GLN 718 CO 0.03 0.64 -0.27 0.82 -0.95 0.00 0.00 178.83 179.09 1tkr h ILE 719 N 0.00 1.32 -0.46 2.54 2.04 -1.23 -2.18 117.51 119.54 1tkr h ILE 719 Ca -0.16 -1.46 -0.08 0.00 1.00 0.00 0.00 64.86 64.16 1tkr h ILE 719 Cb 1.84 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 39.65 1tkr h ILE 719 CO 0.09 0.45 -0.03 0.77 0.00 0.00 0.00 178.15 179.43 1tkr h SER 720 N 0.27 0.76 -0.37 1.72 4.64 -1.13 -2.50 113.55 116.93 1tkr h SER 720 Ca 0.03 -0.20 -0.09 0.00 -0.47 0.00 0.00 61.79 61.06 1tkr h SER 720 Cb 0.84 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 1tkr h SER 720 CO 0.07 0.85 -0.12 0.50 -0.87 0.00 0.00 176.83 177.25 1tkr h LYS 721 N 0.73 0.73 -0.74 4.77 3.64 -1.41 -2.35 116.57 121.94 1tkr h LYS 721 Ca 0.14 -0.30 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 1tkr h LYS 721 Cb 0.49 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 1tkr h LYS 721 CO 0.02 0.90 0.40 0.00 -2.27 0.00 0.00 179.45 178.51 1tkr h ALA 722 N 0.82 0.95 0.00 5.00 0.00 -1.28 -0.63 119.26 124.12 1tkr h ALA 722 Ca 0.09 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1tkr h ALA 722 Cb 0.65 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1tkr h ALA 722 CO 0.04 0.46 -0.18 -0.07 0.00 0.00 0.00 179.25 179.50 1tkr h LEU 723 N 1.02 0.00 0.00 0.00 3.38 -1.40 -1.92 115.31 116.39 1tkr h LEU 723 Ca 0.26 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.02 1tkr h LEU 723 Cb 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1tkr h LEU 723 CO -0.04 0.18 -1.08 0.58 0.09 0.00 0.00 178.44 178.17 1tkr h VAL 724 N 0.00 1.37 0.00 1.22 2.07 -0.74 0.25 116.25 120.42 1tkr h VAL 724 Ca -0.00 -3.04 -0.12 0.00 0.82 0.00 0.00 66.70 64.36 1tkr h VAL 724 Cb 0.55 2.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.97 1tkr h VAL 724 CO 0.02 0.78 -0.58 0.44 0.02 0.00 0.00 177.57 178.25 1tkr h ASP 725 N 0.00 0.00 0.60 0.57 3.32 -0.50 -3.12 116.42 117.28 1tkr h ASP 725 Ca -0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1tkr h ASP 725 Cb 1.75 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.30 1tkr h ASP 725 CO 0.11 0.58 -0.92 0.52 -1.72 0.00 0.00 179.24 177.81 1tkr n VAL 726 N -3.48 0.26 -1.39 -1.35 0.31 -0.78 -4.98 118.33 106.91 1tkr n VAL 726 Ca 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1tkr n VAL 726 Cb 0.67 0.06 0.00 0.00 -0.91 0.00 0.00 33.84 33.66 1tkr n VAL 726 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tkr n GLY 727 N 1.34 0.99 3.50 2.92 0.00 -1.01 -4.97 105.19 107.97 1tkr n GLY 727 Ca 0.02 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 1tkr n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tkr s VAL 728 N -2.47 4.25 0.27 1.61 1.01 0.86 -5.03 120.40 120.90 1tkr s VAL 728 Ca 0.00 -0.21 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 1tkr s VAL 728 Cb 0.00 -2.93 -0.09 0.00 0.00 0.00 0.00 36.38 33.37 1tkr s VAL 728 CO 0.00 0.42 0.74 -0.62 0.00 0.00 0.00 175.10 175.64 1tkr s ASP 729 N 0.88 6.94 0.36 3.32 2.15 -1.26 -4.50 116.67 124.57 1tkr s ASP 729 Ca 0.02 1.38 -0.16 0.00 0.43 0.00 0.00 52.55 54.22 1tkr s ASP 729 Cb -0.14 -2.41 0.04 0.00 -0.30 0.00 0.00 42.92 40.12 1tkr s ASP 729 CO 0.02 -0.08 0.75 0.72 -0.17 0.00 0.00 175.17 176.42 1tkr s PHE 730 N -1.73 0.12 -0.11 -5.34 -0.71 -1.26 -4.80 117.98 104.15 1tkr s PHE 730 Ca 0.48 -0.73 -0.05 0.00 -1.04 0.00 0.00 56.93 55.59 1tkr s PHE 730 Cb -0.14 0.75 -0.04 0.00 -1.21 0.00 0.00 43.02 42.38 1tkr s PHE 730 CO 0.19 -1.47 0.09 -0.65 -1.34 0.00 0.00 175.22 172.04 1tkr s GLN 731 N -2.69 3.27 0.08 1.99 -1.52 -0.24 -5.04 119.66 115.51 1tkr s GLN 731 Ca 0.16 -0.23 0.03 0.00 -1.95 0.00 0.00 55.36 53.36 1tkr s GLN 731 Cb -0.05 -3.04 -0.03 0.00 -0.22 0.00 0.00 33.01 29.67 1tkr s GLN 731 CO 0.11 0.75 -0.09 0.00 -0.25 0.00 0.00 175.29 175.81 1tkr s ALA 732 N -0.97 0.96 -0.30 6.09 0.00 -1.26 -0.78 121.76 125.51 1tkr s ALA 732 Ca 0.14 -1.10 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 1tkr s ALA 732 Cb -0.12 0.04 0.19 0.00 0.00 0.00 0.00 23.12 23.23 1tkr s ALA 732 CO 0.03 -0.05 0.61 1.41 0.00 0.00 0.00 175.76 177.77 1tkr s MET 733 N -2.58 0.56 0.25 0.00 1.75 -0.33 -4.94 119.30 114.01 1tkr s MET 733 Ca 0.02 1.02 0.05 0.00 -1.25 0.00 0.00 55.69 55.54 1tkr s MET 733 Cb -0.04 0.57 -0.03 0.00 2.84 0.00 0.00 34.83 38.18 1tkr s MET 733 CO -0.00 -0.58 0.35 1.67 -0.65 0.00 0.00 175.02 175.80 1tkr s TRP 734 N 2.86 3.39 -0.28 4.11 -2.14 -1.26 -2.42 118.94 123.21 1tkr s TRP 734 Ca 0.19 -0.04 -0.01 0.00 2.66 0.00 0.00 56.10 58.89 1tkr s TRP 734 Cb -0.15 -1.59 0.09 0.00 -3.10 0.00 0.00 33.47 28.73 1tkr s TRP 734 CO -0.21 0.41 0.07 0.71 -2.66 0.00 0.00 176.95 175.28 1tkr s TYR 735 N -2.01 1.70 0.25 1.66 2.02 -0.74 -4.93 117.35 115.30 1tkr s TYR 735 Ca 0.35 -1.60 -0.31 0.00 -0.37 0.00 0.00 57.07 55.14 1tkr s TYR 735 Cb -0.09 -1.60 -0.12 0.00 -0.40 0.00 0.00 41.96 39.76 1tkr s TYR 735 CO 0.29 -0.82 1.67 0.95 -1.57 0.00 0.00 175.55 176.07 1tkr s THR 736 N 1.62 2.03 0.00 -0.71 -4.23 -1.26 -1.14 115.64 111.95 1tkr s THR 736 Ca 0.06 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 1tkr s THR 736 Cb -0.17 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1tkr s THR 736 CO -0.20 0.00 0.00 0.47 -0.54 0.00 0.00 174.62 174.36 1tkr n ASP 737 N 3.21 -4.33 -4.81 3.99 8.00 -1.26 -4.86 116.55 116.50 1tkr n ASP 737 Ca 0.13 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.27 1tkr n ASP 737 Cb 0.36 -2.61 -0.06 0.00 -0.02 0.00 0.00 41.12 38.79 1tkr n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1tkr s GLU 738 N -1.37 4.27 0.18 -1.24 0.41 -1.00 -4.64 118.70 115.30 1tkr s GLU 738 Ca 0.00 0.89 0.00 0.00 -0.41 0.00 0.00 54.97 55.46 1tkr s GLU 738 Cb 0.00 -2.86 0.03 0.00 -1.78 0.00 0.00 34.13 29.52 1tkr s GLU 738 CO 0.00 0.38 0.24 -0.40 -0.49 0.00 0.00 175.26 174.99 1tkr n ASP 739 N 0.68 0.36 -0.25 -0.19 5.75 -1.26 -1.46 116.55 120.18 1tkr n ASP 739 Ca -0.02 -1.30 0.20 0.00 -0.01 0.00 0.00 54.79 53.67 1tkr n ASP 739 Cb 0.51 -0.15 0.52 0.00 -1.03 0.00 0.00 41.12 40.97 1tkr n ASP 739 CO 0.00 0.00 0.00 -0.74 -0.11 0.00 0.00 177.20 176.35 1tkr h HIS 740 N -0.37 0.52 0.00 2.11 -0.00 -1.90 -1.79 115.15 113.72 1tkr h HIS 740 Ca -0.08 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.25 1tkr h HIS 740 Cb 0.31 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 27.55 1tkr h HIS 740 CO 0.00 0.12 -0.29 0.78 -0.00 0.00 0.00 177.93 178.54 1tkr h GLY 741 N 0.38 0.00 -6.82 5.26 0.00 -1.98 -3.47 103.07 96.44 1tkr h GLY 741 Ca 0.49 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.25 1tkr h GLY 741 CO -0.18 0.00 -0.85 1.39 0.00 0.00 0.00 176.54 176.90 1tkr n ILE 742 N -3.41 -0.94 -0.04 2.60 5.41 -0.68 -4.83 119.36 117.47 1tkr n ILE 742 Ca 0.00 -0.03 0.10 0.00 1.00 0.00 0.00 62.75 63.83 1tkr n ILE 742 Cb 0.48 -1.53 0.24 0.00 -0.71 0.00 0.00 39.64 38.12 1tkr n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1tkr n ALA 743 N -4.34 2.36 -1.37 -1.39 0.00 -1.26 -3.72 120.51 110.80 1tkr n ALA 743 Ca 0.07 -1.12 -0.35 0.00 0.00 0.00 0.00 53.44 52.03 1tkr n ALA 743 Cb 0.49 -0.79 0.10 0.00 0.00 0.00 0.00 19.45 19.25 1tkr n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1tkr s SER 744 N -1.18 4.00 0.17 0.00 1.04 -1.26 -4.75 113.70 111.72 1tkr s SER 744 Ca 0.39 2.48 -0.23 0.00 0.48 0.00 0.00 55.95 59.07 1tkr s SER 744 Cb 0.21 -2.60 0.06 0.00 0.10 0.00 0.00 66.02 63.80 1tkr s SER 744 CO 0.29 -2.40 1.59 -1.28 0.98 0.00 0.00 173.24 172.42 1tkr h SER 745 N -0.30 -1.18 0.01 7.02 0.87 -2.00 -1.57 113.55 116.40 1tkr h SER 745 Ca -0.48 0.21 -0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1tkr h SER 745 Cb 1.31 0.55 0.00 0.00 -0.44 0.00 0.00 62.40 63.83 1tkr h SER 745 CO 0.49 -0.33 -0.00 0.71 -0.53 0.00 0.00 176.83 177.17 1tkr h THR 746 N -0.24 1.49 -0.73 2.23 1.35 -1.98 -3.03 112.91 112.00 1tkr h THR 746 Ca 0.18 -1.51 0.13 0.00 -0.55 0.00 0.00 66.41 64.67 1tkr h THR 746 Cb 0.55 2.51 -0.05 0.00 -1.73 0.00 0.00 68.15 69.43 1tkr h THR 746 CO -0.59 0.39 0.49 0.00 -0.25 0.00 0.00 175.52 175.56 1tkr h ALA 747 N 0.32 2.03 0.25 6.62 0.00 -1.88 0.06 119.26 126.67 1tkr h ALA 747 Ca -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1tkr h ALA 747 Cb 0.64 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1tkr h ALA 747 CO 0.00 -0.22 -0.12 1.25 0.00 0.00 0.00 179.25 180.16 1tkr h HIS 748 N 0.47 -0.32 0.00 0.00 2.76 -1.31 0.13 115.15 116.88 1tkr h HIS 748 Ca 0.35 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.48 1tkr h HIS 748 Cb 0.73 0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.78 1tkr h HIS 748 CO -0.00 -0.04 -0.18 1.96 -1.30 0.00 0.00 177.93 178.37 1tkr h GLN 749 N -0.57 0.00 -0.02 5.26 4.20 -1.26 -2.87 115.11 119.85 1tkr h GLN 749 Ca -0.03 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 1tkr h GLN 749 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1tkr h GLN 749 CO 0.06 0.18 -0.21 1.25 -0.67 0.00 0.00 178.83 179.44 1tkr h HIS 750 N 0.00 0.25 -0.80 2.96 2.76 -0.74 -2.92 115.15 116.67 1tkr h HIS 750 Ca -0.00 -0.12 -0.02 0.00 -2.20 0.00 0.00 60.37 58.03 1tkr h HIS 750 Cb 0.34 -0.04 -0.04 0.00 1.55 0.00 0.00 27.41 29.23 1tkr h HIS 750 CO 0.00 0.87 0.43 0.97 -1.30 0.00 0.00 177.93 178.90 1tkr h ILE 751 N -0.43 1.24 0.00 6.26 2.10 -0.63 -1.02 117.51 125.03 1tkr h ILE 751 Ca -0.02 -0.60 0.00 0.00 1.08 0.00 0.00 64.86 65.32 1tkr h ILE 751 Cb 0.91 0.18 0.00 0.00 -1.09 0.00 0.00 36.82 36.82 1tkr h ILE 751 CO 0.04 0.27 0.00 1.88 -1.08 0.00 0.00 178.15 179.26 1tkr h TYR 752 N 1.11 0.00 0.16 2.19 0.05 -1.62 -1.36 116.97 117.50 1tkr h TYR 752 Ca 0.28 0.00 -0.31 0.00 0.05 0.00 0.00 58.73 58.75 1tkr h TYR 752 Cb 0.04 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.79 1tkr h TYR 752 CO 0.00 0.00 -1.47 1.15 -1.05 0.00 0.00 178.16 176.79 1tkr h THR 753 N 0.00 1.24 -0.43 -2.88 2.02 -1.15 -2.58 112.91 109.13 1tkr h THR 753 Ca 0.00 -2.81 -0.15 0.00 0.77 0.00 0.00 66.41 64.22 1tkr h THR 753 Cb 0.56 2.87 -0.01 0.00 -1.74 0.00 0.00 68.15 69.83 1tkr h THR 753 CO 0.00 0.84 -0.30 -0.74 0.37 0.00 0.00 175.52 175.69 1tkr h HIS 754 N 0.09 1.13 -0.53 3.16 -0.00 -0.94 -2.84 115.15 115.22 1tkr h HIS 754 Ca -0.23 -0.30 -0.08 0.00 -0.00 0.00 0.00 60.37 59.75 1tkr h HIS 754 Cb 2.05 -0.25 -0.02 0.00 -0.00 0.00 0.00 27.41 29.19 1tkr h HIS 754 CO 0.08 1.13 0.00 0.52 -0.00 0.00 0.00 177.93 179.66 1tkr h MET 755 N 0.81 0.94 -0.56 5.26 2.07 -1.33 -2.63 114.93 119.48 1tkr h MET 755 Ca 0.09 -0.30 -0.02 0.00 -2.07 0.00 0.00 59.70 57.40 1tkr h MET 755 Cb 0.88 -0.08 -0.03 0.00 -1.87 0.00 0.00 31.60 30.50 1tkr h MET 755 CO 0.08 0.95 0.29 0.77 1.07 0.00 0.00 176.91 180.07 1tkr h SER 756 N 0.81 0.72 -0.53 1.22 0.02 -1.43 0.13 113.55 114.49 1tkr h SER 756 Ca 0.15 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1tkr h SER 756 Cb 0.53 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.85 1tkr h SER 756 CO 0.03 0.63 0.33 0.45 -1.14 0.00 0.00 176.83 177.13 1tkr h HIS 757 N 0.76 0.63 0.03 3.45 3.86 -1.45 -0.66 115.15 121.77 1tkr h HIS 757 Ca 0.20 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.42 1tkr h HIS 757 Cb 0.08 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.35 1tkr h HIS 757 CO -0.01 0.38 -0.01 0.35 0.86 0.00 0.00 177.93 179.50 1tkr h PHE 758 N 0.67 -0.03 0.07 2.45 3.57 -1.07 -0.40 116.94 122.19 1tkr h PHE 758 Ca 0.20 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 1tkr h PHE 758 Cb -0.03 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1tkr h PHE 758 CO -0.05 0.07 -0.03 0.82 -2.23 0.00 0.00 178.31 176.89 1tkr h ILE 759 N -0.13 0.97 0.00 1.41 1.08 -0.47 -0.67 117.51 119.70 1tkr h ILE 759 Ca -0.00 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.35 1tkr h ILE 759 Cb 0.12 1.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.92 1tkr h ILE 759 CO 0.01 0.03 0.00 0.07 -0.69 0.00 0.00 178.15 177.56 1tkr h LYS 760 N -0.14 0.00 0.14 2.37 2.10 -1.13 -1.77 116.57 118.14 1tkr h LYS 760 Ca -0.01 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 58.35 1tkr h LYS 760 Cb 0.12 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.46 1tkr h LYS 760 CO 0.01 0.00 -1.26 0.37 -2.00 0.00 0.00 179.45 176.57 1tkr h GLN 761 N 0.00 0.45 -0.06 0.07 -0.00 -0.69 -0.67 115.11 114.20 1tkr h GLN 761 Ca 0.00 -0.67 -0.13 0.00 -0.00 0.00 0.00 58.65 57.85 1tkr h GLN 761 Cb 0.49 0.24 -0.01 0.00 0.00 0.00 0.00 27.48 28.19 1tkr h GLN 761 CO 0.00 1.30 -0.56 0.00 0.00 0.00 0.00 178.83 179.57 1tkr h PHE 763 N 0.15 0.44 0.00 0.00 0.04 -1.37 -3.49 116.94 112.71 1tkr h PHE 763 Ca -0.00 -0.32 0.00 0.00 2.80 0.00 0.00 57.97 60.45 1tkr h PHE 763 Cb 1.03 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.16 1tkr h PHE 763 CO 0.02 1.55 0.00 0.43 -0.60 0.00 0.00 178.31 179.71