#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 -1.14 -0.23 -1.46 0.63 -1.26 -5.02 116.66 108.18 1tkr n ARG 40 Ca 0.00 1.33 -0.31 0.00 -0.92 0.00 0.00 57.85 57.95 1tkr n ARG 40 Cb 0.00 -4.56 0.30 0.00 0.45 0.00 0.00 32.46 28.65 1tkr n ARG 40 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 1tkr s LYS 41 N -2.79 -3.51 0.56 -0.14 -2.85 -1.22 -4.18 119.74 105.62 1tkr s LYS 41 Ca 0.05 0.09 0.05 0.00 -1.00 0.00 0.00 55.97 55.15 1tkr s LYS 41 Cb -0.01 -1.31 0.04 0.00 -2.06 0.00 0.00 37.83 34.49 1tkr s LYS 41 CO 0.54 -5.24 0.39 0.95 0.10 0.00 0.00 175.35 172.09 1tkr s THR 42 N -2.12 1.50 -0.76 3.79 -4.23 -1.26 0.24 115.64 112.80 1tkr s THR 42 Ca 0.68 -1.53 -0.23 0.00 -1.18 0.00 0.00 61.69 59.43 1tkr s THR 42 Cb -0.12 -2.03 0.07 0.00 1.34 0.00 0.00 72.50 71.76 1tkr s THR 42 CO 0.57 0.00 1.11 -0.47 -0.54 0.00 0.00 174.62 175.29 1tkr s TYR 43 N -2.81 2.66 0.56 3.99 5.04 -1.26 -4.81 117.35 120.72 1tkr s TYR 43 Ca 0.30 -0.64 -0.13 0.00 -2.44 0.00 0.00 57.07 54.16 1tkr s TYR 43 Cb -0.02 -4.40 -0.06 0.00 0.35 0.00 0.00 41.96 37.83 1tkr s TYR 43 CO 0.19 -1.74 0.98 0.95 -1.34 0.00 0.00 175.55 174.60 1tkr s THR 44 N 4.24 4.66 0.23 4.34 -4.23 -1.26 -4.13 115.64 119.48 1tkr s THR 44 Ca 0.29 0.96 -0.07 0.00 -1.18 0.00 0.00 61.69 61.69 1tkr s THR 44 Cb -0.11 -3.80 0.18 0.00 1.34 0.00 0.00 72.50 70.11 1tkr s THR 44 CO 0.05 -0.91 1.74 0.25 -0.54 0.00 0.00 174.62 175.21 1tkr h LEU 45 N 0.31 0.24 -1.02 4.79 5.85 -1.95 0.28 115.31 123.82 1tkr h LEU 45 Ca -0.45 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 1tkr h LEU 45 Cb 1.19 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.26 1tkr h LEU 45 CO 0.62 0.12 0.38 0.74 -0.34 0.00 0.00 178.44 179.96 1tkr h THR 46 N 0.43 1.23 -0.79 1.05 2.02 -1.97 0.11 112.91 114.99 1tkr h THR 46 Ca 0.36 -0.63 0.12 0.00 0.77 0.00 0.00 66.41 67.02 1tkr h THR 46 Cb 0.50 0.24 -0.08 0.00 -1.74 0.00 0.00 68.15 67.07 1tkr h THR 46 CO -0.36 0.27 0.40 0.44 0.37 0.00 0.00 175.52 176.65 1tkr h ASP 47 N 1.07 0.51 0.52 4.18 3.45 -0.85 0.93 116.42 126.23 1tkr h ASP 47 Ca 0.26 0.07 -0.03 0.00 0.43 0.00 0.00 57.03 57.77 1tkr h ASP 47 Cb 0.08 -0.01 0.01 0.00 -0.56 0.00 0.00 39.33 38.84 1tkr h ASP 47 CO -0.04 0.26 -0.25 0.22 -1.57 0.00 0.00 179.24 177.86 1tkr h TYR 48 N 0.63 -0.64 -0.66 4.55 3.20 -0.12 -1.62 116.97 122.31 1tkr h TYR 48 Ca 0.40 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.26 1tkr h TYR 48 Cb 0.49 0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.94 1tkr h TYR 48 CO -0.10 -0.35 0.41 -0.07 -1.64 0.00 0.00 178.16 176.41 1tkr h LEU 49 N -1.12 0.78 -0.15 2.82 3.38 -0.58 -2.00 115.31 118.44 1tkr h LEU 49 Ca -0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1tkr h LEU 49 Cb 0.58 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1tkr h LEU 49 CO 0.12 0.59 -0.15 0.29 0.09 0.00 0.00 178.44 179.38 1tkr n LYS 50 N -4.41 0.44 -3.59 1.13 4.76 0.32 -4.94 118.16 111.87 1tkr n LYS 50 Ca 0.07 -0.15 -0.21 0.00 -2.87 0.00 0.00 58.31 55.15 1tkr n LYS 50 Cb 0.06 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 31.80 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 -1.15 -2.76 0.11 4.39 5.15 -0.75 -4.92 115.26 115.33 1tkr n ASN 51 Ca 0.12 -0.80 -0.12 0.00 -0.60 0.00 0.00 54.58 53.17 1tkr n ASN 51 Cb 0.30 -4.30 -0.08 0.00 -0.53 0.00 0.00 39.78 35.17 1tkr n ASN 51 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 1tkr h THR 52 N -1.75 0.74 -2.50 -0.44 2.02 -1.58 -3.37 112.91 106.02 1tkr h THR 52 Ca -0.62 -0.82 -0.72 0.00 0.77 0.00 0.00 66.41 65.02 1tkr h THR 52 Cb 1.35 1.15 -0.19 0.00 -1.74 0.00 0.00 68.15 68.72 1tkr h THR 52 CO 0.52 0.16 0.94 -0.31 0.37 0.00 0.00 175.52 177.20 1tkr s TYR 53 N -4.10 3.38 0.33 3.16 2.02 -1.26 -5.02 117.35 115.85 1tkr s TYR 53 Ca -0.13 -1.79 -0.16 0.00 -0.37 0.00 0.00 57.07 54.62 1tkr s TYR 53 Cb 0.01 -4.23 -0.09 0.00 -0.40 0.00 0.00 41.96 37.25 1tkr s TYR 53 CO 0.51 -1.38 0.76 0.50 -1.57 0.00 0.00 175.55 174.37 1tkr s ARG 54 N 1.84 4.05 -0.16 -0.62 3.52 -1.26 -5.05 118.95 121.27 1tkr s ARG 54 Ca 0.35 0.74 -0.13 0.00 -0.13 0.00 0.00 55.73 56.56 1tkr s ARG 54 Cb -0.05 -2.44 -0.05 0.00 -1.56 0.00 0.00 34.95 30.86 1tkr s ARG 54 CO -0.06 0.15 0.26 -0.51 -0.81 0.00 0.00 175.30 174.34 1tkr s LEU 55 N -2.93 4.26 0.15 -0.88 1.43 -1.26 -4.85 118.68 114.59 1tkr s LEU 55 Ca 0.54 0.49 -0.26 0.00 -1.03 0.00 0.00 54.13 53.87 1tkr s LEU 55 Cb -0.11 -2.32 -0.08 0.00 0.03 0.00 0.00 46.19 43.72 1tkr s LEU 55 CO 0.17 0.14 0.79 -0.54 0.23 0.00 0.00 176.35 177.14 1tkr s LYS 56 N 0.29 4.57 0.22 1.70 1.02 -1.26 -5.06 119.74 121.22 1tkr s LYS 56 Ca 0.15 1.16 0.01 0.00 0.02 0.00 0.00 55.97 57.32 1tkr s LYS 56 Cb -0.13 -3.28 0.01 0.00 -0.52 0.00 0.00 37.83 33.92 1tkr s LYS 56 CO 0.03 0.52 0.11 1.28 -0.92 0.00 0.00 175.35 176.37 1tkr n LEU 57 N 1.79 0.00 -2.80 3.17 4.77 -1.26 -4.93 117.00 117.74 1tkr n LEU 57 Ca -0.05 -1.26 -0.07 0.00 -0.03 0.00 0.00 56.01 54.60 1tkr n LEU 57 Cb 0.49 0.05 0.01 0.00 -2.33 0.00 0.00 43.42 41.64 1tkr n LEU 57 CO 0.47 -0.32 0.11 0.00 -1.33 0.00 0.00 177.39 176.31 1tkr n TYR 58 N -0.85 -3.47 -2.26 -1.77 4.19 -1.26 -5.00 117.16 106.74 1tkr n TYR 58 Ca -0.04 -1.63 -0.43 0.00 3.31 0.00 0.00 57.90 59.12 1tkr n TYR 58 Cb 0.27 1.40 -0.02 0.00 0.49 0.00 0.00 39.34 41.47 1tkr n TYR 58 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 1tkr s SER 59 N 0.09 6.37 0.66 2.98 0.15 -1.26 -5.01 113.70 117.68 1tkr s SER 59 Ca 0.31 1.20 0.02 0.00 0.70 0.00 0.00 55.95 58.17 1tkr s SER 59 Cb 0.07 -2.54 0.12 0.00 -1.71 0.00 0.00 66.02 61.96 1tkr s SER 59 CO -0.11 -1.34 0.87 -0.11 1.20 0.00 0.00 173.24 173.75 1tkr n LEU 60 N 8.62 0.00 -2.81 3.45 7.94 -1.26 -4.42 117.00 128.52 1tkr n LEU 60 Ca 0.18 -2.01 0.02 0.00 -1.11 0.00 0.00 56.01 53.08 1tkr n LEU 60 Cb 0.47 -0.54 0.00 0.00 0.53 0.00 0.00 43.42 43.88 1tkr n LEU 60 CO 0.67 -0.88 0.43 -0.60 -1.11 0.00 0.00 177.39 175.90 1tkr s ARG 61 N -4.75 0.24 -0.22 1.96 3.00 -1.20 -4.95 118.95 113.02 1tkr s ARG 61 Ca 0.59 -0.08 -0.29 0.00 -1.00 0.00 0.00 55.73 54.96 1tkr s ARG 61 Cb -0.04 0.03 -0.03 0.00 0.00 0.00 0.00 34.95 34.91 1tkr s ARG 61 CO 0.39 -0.34 1.79 -1.58 0.00 0.00 0.00 175.30 175.55 1tkr s TRP 62 N 1.96 1.81 -0.15 5.12 0.52 -1.26 -0.88 118.94 126.05 1tkr s TRP 62 Ca 0.15 0.45 0.19 0.00 0.02 0.00 0.00 56.10 56.91 1tkr s TRP 62 Cb 0.02 -4.04 -0.12 0.00 -1.15 0.00 0.00 33.47 28.19 1tkr s TRP 62 CO -0.14 -3.39 0.83 0.44 0.02 0.00 0.00 176.95 174.70 1tkr n ILE 63 N 6.76 0.94 -2.25 2.03 -5.35 -1.17 -4.81 119.36 115.51 1tkr n ILE 63 Ca 0.21 -0.64 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 1tkr n ILE 63 Cb 0.45 -0.55 0.00 0.00 -1.74 0.00 0.00 39.64 37.80 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 -2.77 0.02 -0.35 7.28 3.41 -1.20 -5.01 113.62 115.01 1tkr n SER 64 Ca -0.07 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.60 1tkr n SER 64 Cb 0.75 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.71 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 0.00 1.56 0.00 4.04 2.03 -1.26 -1.67 116.55 121.25 1tkr n ASP 65 Ca 0.00 -1.28 0.00 0.00 0.52 0.00 0.00 54.79 54.03 1tkr n ASP 65 Cb 0.00 0.37 0.00 0.00 -0.72 0.00 0.00 41.12 40.77 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 0.01 0.00 -4.40 -0.67 -0.00 -1.26 -4.49 115.22 104.40 1tkr n HIS 66 Ca 0.06 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 57.58 1tkr n HIS 66 Cb 0.29 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.17 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 -1.22 1.55 0.11 -0.41 2.02 -1.26 -1.27 118.70 118.22 1tkr s GLU 67 Ca 0.00 -1.84 -0.20 0.00 0.02 0.00 0.00 54.97 52.95 1tkr s GLU 67 Cb 0.00 -0.66 0.05 0.00 0.10 0.00 0.00 34.13 33.62 1tkr s GLU 67 CO 0.00 -0.21 0.50 1.52 0.02 0.00 0.00 175.26 177.09 1tkr s TYR 68 N -3.44 -0.37 -0.15 1.61 -0.85 -1.03 -3.02 117.35 110.08 1tkr s TYR 68 Ca 0.36 0.20 -0.08 0.00 -0.52 0.00 0.00 57.07 57.03 1tkr s TYR 68 Cb 0.08 0.38 -0.04 0.00 0.38 0.00 0.00 41.96 42.75 1tkr s TYR 68 CO 0.14 -0.73 0.14 -0.51 -1.52 0.00 0.00 175.55 173.08 1tkr s LEU 69 N -2.53 4.31 -0.23 -3.49 1.43 -0.06 -0.50 118.68 117.61 1tkr s LEU 69 Ca -0.00 0.38 0.00 0.00 -1.03 0.00 0.00 54.13 53.48 1tkr s LEU 69 Cb 0.00 -2.09 0.03 0.00 0.03 0.00 0.00 46.19 44.16 1tkr s LEU 69 CO -0.09 0.31 -0.12 -0.47 0.23 0.00 0.00 176.35 176.21 1tkr s TYR 70 N -0.42 3.03 -0.43 0.29 5.04 -0.26 -3.25 117.35 121.36 1tkr s TYR 70 Ca 0.12 -1.78 -0.27 0.00 -2.44 0.00 0.00 57.07 52.70 1tkr s TYR 70 Cb -0.12 -1.98 0.02 0.00 0.35 0.00 0.00 41.96 40.23 1tkr s TYR 70 CO 0.02 -0.79 1.00 0.21 -1.34 0.00 0.00 175.55 174.65 1tkr s LYS 71 N 1.26 3.72 -0.63 4.97 2.20 -1.26 -2.80 119.74 127.19 1tkr s LYS 71 Ca -0.01 0.47 0.01 0.00 -0.36 0.00 0.00 55.97 56.09 1tkr s LYS 71 Cb -0.16 -3.87 0.40 0.00 -1.51 0.00 0.00 37.83 32.68 1tkr s LYS 71 CO -0.07 -1.17 1.62 1.04 -0.36 0.00 0.00 175.35 176.40 1tkr n GLN 72 N 7.25 3.07 0.00 4.03 6.02 -0.56 -4.99 117.38 132.20 1tkr n GLN 72 Ca 0.09 -3.92 0.00 0.00 -0.01 0.00 0.00 57.00 53.16 1tkr n GLN 72 Cb 0.48 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.48 1tkr n GLN 72 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1tkr n GLU 73 N -0.57 0.00 0.00 -1.09 4.71 -1.26 -3.41 120.64 119.01 1tkr n GLU 73 Ca 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.64 1tkr n GLU 73 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.93 1tkr n GLU 73 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1tkr n ASN 74 N 4.66 0.00 -4.56 1.62 4.13 -1.26 -4.70 115.26 115.15 1tkr n ASN 74 Ca 0.00 0.91 -0.28 0.00 1.68 0.00 0.00 54.58 56.89 1tkr n ASN 74 Cb 0.00 -0.41 -0.10 0.00 -1.54 0.00 0.00 39.78 37.73 1tkr n ASN 74 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1tkr s ASN 75 N -2.84 4.26 -0.34 6.41 2.20 -1.22 -3.18 114.94 120.23 1tkr s ASN 75 Ca 0.00 -0.53 0.04 0.00 -0.94 0.00 0.00 52.86 51.43 1tkr s ASN 75 Cb 0.00 -0.73 0.10 0.00 -2.00 0.00 0.00 41.25 38.62 1tkr s ASN 75 CO 0.00 0.13 0.05 -0.51 -2.94 0.00 0.00 177.10 173.83 1tkr s ILE 76 N -1.53 2.22 0.51 0.54 2.07 0.21 -1.50 121.20 123.72 1tkr s ILE 76 Ca 0.23 -2.30 0.04 0.00 -1.41 0.00 0.00 60.65 57.21 1tkr s ILE 76 Cb -0.09 -2.64 0.03 0.00 0.13 0.00 0.00 42.46 39.89 1tkr s ILE 76 CO 0.14 -0.60 0.71 -1.48 -1.91 0.00 0.00 174.94 171.81 1tkr s LEU 77 N 0.93 3.39 0.10 8.50 2.34 -1.12 -1.67 118.68 131.15 1tkr s LEU 77 Ca 0.11 -0.23 0.06 0.00 0.06 0.00 0.00 54.13 54.13 1tkr s LEU 77 Cb -0.19 -2.67 -0.04 0.00 -0.56 0.00 0.00 46.19 42.73 1tkr s LEU 77 CO -0.09 -1.06 -0.07 0.54 -1.06 0.00 0.00 176.35 174.62 1tkr s VAL 78 N -2.63 3.58 0.17 1.48 0.11 -0.79 -1.10 120.40 121.22 1tkr s VAL 78 Ca 0.57 -1.19 0.11 0.00 -2.93 0.00 0.00 61.98 58.54 1tkr s VAL 78 Cb -0.10 -2.69 -0.04 0.00 -1.53 0.00 0.00 36.38 32.02 1tkr s VAL 78 CO 0.37 0.11 -0.23 -0.36 -3.33 0.00 0.00 175.10 171.65 1tkr s PHE 79 N -1.26 2.19 -0.48 1.54 0.40 0.35 -4.16 117.98 116.56 1tkr s PHE 79 Ca 0.23 -0.38 -0.11 0.00 -0.60 0.00 0.00 56.93 56.07 1tkr s PHE 79 Cb -0.11 -1.11 0.11 0.00 0.51 0.00 0.00 43.02 42.43 1tkr s PHE 79 CO 0.15 0.43 0.37 1.21 0.70 0.00 0.00 175.22 178.08 1tkr s ASN 80 N -2.54 5.80 0.33 1.36 3.84 -1.14 -2.47 114.94 120.13 1tkr s ASN 80 Ca 0.18 -1.82 0.11 0.00 0.21 0.00 0.00 52.86 51.54 1tkr s ASN 80 Cb -0.08 -2.05 1.00 0.00 -0.55 0.00 0.00 41.25 39.56 1tkr s ASN 80 CO 0.08 -0.70 1.62 0.00 -2.79 0.00 0.00 177.10 175.31 1tkr h ALA 81 N 8.54 1.68 0.08 1.71 0.00 -1.55 0.73 119.26 130.45 1tkr h ALA 81 Ca -0.23 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1tkr h ALA 81 Cb 1.08 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1tkr h ALA 81 CO 0.88 -0.65 -0.17 1.49 0.00 0.00 0.00 179.25 180.80 1tkr h GLU 82 N 0.15 -0.27 0.00 0.00 4.57 -1.93 -3.37 114.58 113.73 1tkr h GLU 82 Ca 0.69 0.02 -0.28 0.00 -1.18 0.00 0.00 59.36 58.61 1tkr h GLU 82 Cb 1.60 0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 30.19 1tkr h GLU 82 CO -0.72 -0.18 -2.22 0.66 -1.18 0.00 0.00 179.01 175.36 1tkr n TYR 83 N -3.41 0.00 0.00 0.92 4.02 -1.01 -5.00 117.16 112.67 1tkr n TYR 83 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 1tkr n TYR 83 Cb 0.14 -0.84 0.00 0.00 -0.02 0.00 0.00 39.34 38.62 1tkr n TYR 83 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1tkr n GLY 84 N 1.75 1.19 3.59 2.72 0.00 0.25 -5.04 105.19 109.65 1tkr n GLY 84 Ca -0.26 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.33 1tkr n GLY 84 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tkr n ASN 85 N 0.00 1.22 0.00 1.61 4.13 -1.24 -4.68 115.26 116.29 1tkr n ASN 85 Ca 0.00 1.13 0.00 0.00 1.68 0.00 0.00 54.58 57.39 1tkr n ASN 85 Cb 0.00 -1.30 0.00 0.00 -1.54 0.00 0.00 39.78 36.94 1tkr n ASN 85 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1tkr n SER 86 N 1.06 0.00 -1.55 6.41 7.64 -1.26 -2.87 113.62 123.04 1tkr n SER 86 Ca 0.09 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.97 1tkr n SER 86 Cb 0.34 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.54 1tkr n SER 86 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1tkr n SER 87 N 0.00 -2.25 -4.74 6.43 2.88 -1.26 -4.27 113.62 110.41 1tkr n SER 87 Ca 0.00 0.28 -0.41 0.00 -1.33 0.00 0.00 58.87 57.41 1tkr n SER 87 Cb 0.00 -1.78 -0.03 0.00 -0.75 0.00 0.00 64.21 61.65 1tkr n SER 87 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1tkr s VAL 88 N -0.12 3.26 -0.20 2.46 0.11 -1.26 -1.88 120.40 122.77 1tkr s VAL 88 Ca -0.04 1.09 0.14 0.00 -2.93 0.00 0.00 61.98 60.24 1tkr s VAL 88 Cb 0.00 -3.69 -0.23 0.00 -1.53 0.00 0.00 36.38 30.92 1tkr s VAL 88 CO 0.10 0.19 0.07 0.33 -3.33 0.00 0.00 175.10 172.46 1tkr n PHE 89 N 2.21 0.11 -3.64 1.54 -0.00 -1.23 -4.75 117.46 111.70 1tkr n PHE 89 Ca 0.04 0.04 -0.07 0.00 -0.00 0.00 0.00 57.45 57.46 1tkr n PHE 89 Cb 0.43 -1.02 -0.07 0.00 -0.00 0.00 0.00 39.48 38.82 1tkr n PHE 89 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1tkr s LEU 90 N -5.75 -0.81 0.43 -2.13 2.96 -0.67 -5.01 118.68 107.69 1tkr s LEU 90 Ca -0.14 1.34 0.07 0.00 -0.22 0.00 0.00 54.13 55.17 1tkr s LEU 90 Cb 0.07 2.25 -0.05 0.00 0.50 0.00 0.00 46.19 48.95 1tkr s LEU 90 CO 0.79 -0.21 0.15 -1.83 -1.32 0.00 0.00 176.35 173.93 1tkr s GLU 91 N 1.36 2.18 0.12 1.98 -1.05 -1.26 -0.62 118.70 121.41 1tkr s GLU 91 Ca -0.08 -1.93 -0.28 0.00 -0.15 0.00 0.00 54.97 52.52 1tkr s GLU 91 Cb -0.05 -1.90 -0.09 0.00 -0.44 0.00 0.00 34.13 31.65 1tkr s GLU 91 CO -0.16 -0.15 1.48 -2.95 0.95 0.00 0.00 175.26 174.43 1tkr h ASN 92 N 1.44 -1.68 0.05 0.83 7.08 -1.89 -1.73 115.58 119.67 1tkr h ASN 92 Ca -0.43 0.23 -0.01 0.00 -3.08 0.00 0.00 56.30 53.01 1tkr h ASN 92 Cb 1.26 0.70 -0.00 0.00 -2.08 0.00 0.00 38.32 38.20 1tkr h ASN 92 CO 0.71 -0.32 -0.05 0.77 -2.08 0.00 0.00 177.43 176.47 1tkr h SER 93 N -0.27 0.00 0.00 6.14 4.64 -1.97 -2.94 113.55 119.15 1tkr h SER 93 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1tkr h SER 93 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1tkr h SER 93 CO -0.58 0.05 0.40 0.41 -0.87 0.00 0.00 176.83 176.23 1tkr n THR 94 N -4.48 0.54 -2.73 2.95 -1.04 -0.65 -0.93 114.28 107.94 1tkr n THR 94 Ca -0.03 0.64 -0.05 0.00 -2.04 0.00 0.00 64.05 62.57 1tkr n THR 94 Cb 0.13 -1.64 0.05 0.00 -1.82 0.00 0.00 70.33 67.05 1tkr n THR 94 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1tkr n PHE 95 N -1.62 0.58 -2.61 -1.42 3.72 -1.11 -5.01 117.46 109.99 1tkr n PHE 95 Ca -0.00 -2.38 -0.06 0.00 -0.05 0.00 0.00 57.45 54.95 1tkr n PHE 95 Cb 0.41 0.02 0.03 0.00 -0.94 0.00 0.00 39.48 39.00 1tkr n PHE 95 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1tkr n ASP 96 N -0.43 0.47 -2.24 4.37 10.43 -0.11 -4.41 116.55 124.64 1tkr n ASP 96 Ca 0.05 -1.37 -0.08 0.00 2.57 0.00 0.00 54.79 55.96 1tkr n ASP 96 Cb 0.82 -0.16 -0.01 0.00 1.84 0.00 0.00 41.12 43.61 1tkr n ASP 96 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1tkr n GLU 97 N -1.46 -2.28 -0.10 -1.24 4.71 -1.26 -4.76 120.64 114.25 1tkr n GLU 97 Ca 0.05 0.38 -0.11 0.00 -0.01 0.00 0.00 57.16 57.48 1tkr n GLU 97 Cb 0.17 -4.87 -0.16 0.00 -1.01 0.00 0.00 31.44 25.57 1tkr n GLU 97 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1tkr n PHE 98 N -2.77 0.00 0.00 -0.32 -0.00 -1.26 -5.03 117.46 108.07 1tkr n PHE 98 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.36 1tkr n PHE 98 Cb 0.51 -1.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.00 1tkr n PHE 98 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1tkr n GLY 99 N 1.79 2.01 3.68 7.13 0.00 -1.26 -4.96 105.19 113.59 1tkr n GLY 99 Ca -0.34 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 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 0.00 2.75 -0.08 1.61 3.76 -1.26 -4.96 115.29 117.12 1tkr s HIS 100 Ca 0.00 0.79 -0.30 0.00 -0.15 0.00 0.00 55.06 55.40 1tkr s HIS 100 Cb 0.00 -3.66 -0.05 0.00 1.11 0.00 0.00 32.58 29.99 1tkr s HIS 100 CO 0.00 -2.45 1.55 0.45 -0.85 0.00 0.00 174.74 173.43 1tkr s SER 101 N 2.07 6.74 -0.58 1.40 0.15 -1.26 -4.92 113.70 117.30 1tkr s SER 101 Ca 0.63 2.10 -0.26 0.00 0.70 0.00 0.00 55.95 59.12 1tkr s SER 101 Cb -0.30 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.45 1tkr s SER 101 CO 0.25 -0.87 1.95 -0.63 1.20 0.00 0.00 173.24 175.14 1tkr s ILE 102 N 3.80 3.30 0.40 6.45 -1.09 -1.26 -4.57 121.20 128.23 1tkr s ILE 102 Ca 0.68 0.18 0.07 0.00 -2.23 0.00 0.00 60.65 59.35 1tkr s ILE 102 Cb -0.30 -3.77 0.24 0.00 -1.58 0.00 0.00 42.46 37.05 1tkr s ILE 102 CO 0.26 -0.74 2.03 -1.13 -1.23 0.00 0.00 174.94 174.13 1tkr h ASN 103 N 15.68 0.44 -5.26 3.58 -0.73 -1.04 -3.46 115.58 124.80 1tkr h ASN 103 Ca -0.26 -0.03 0.13 0.00 1.87 0.00 0.00 56.30 58.02 1tkr h ASN 103 Cb 1.18 -0.11 -0.06 0.00 0.27 0.00 0.00 38.32 39.60 1tkr h ASN 103 CO 1.20 0.36 0.44 -0.62 -0.37 0.00 0.00 177.43 178.44 1tkr s ASP 104 N -6.72 -0.13 0.37 1.15 -1.08 -0.68 -5.02 116.67 104.56 1tkr s ASP 104 Ca -0.08 -0.59 0.04 0.00 -0.52 0.00 0.00 52.55 51.40 1tkr s ASP 104 Cb 0.17 0.57 -0.02 0.00 -1.46 0.00 0.00 42.92 42.19 1tkr s ASP 104 CO 0.73 -1.09 0.15 0.00 0.52 0.00 0.00 175.17 175.48 1tkr n TYR 105 N -0.53 0.05 -3.15 -5.34 4.11 -1.26 -1.16 117.16 109.87 1tkr n TYR 105 Ca -0.05 -2.43 0.05 0.00 -0.00 0.00 0.00 57.90 55.47 1tkr n TYR 105 Cb 0.60 0.02 -0.02 0.00 -0.00 0.00 0.00 39.34 39.94 1tkr n TYR 105 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1tkr s SER 106 N -3.29 -0.05 -0.03 9.48 0.15 -1.06 -4.91 113.70 113.99 1tkr s SER 106 Ca 0.21 0.04 -0.12 0.00 0.70 0.00 0.00 55.95 56.78 1tkr s SER 106 Cb 0.01 1.05 -0.05 0.00 -1.71 0.00 0.00 66.02 65.31 1tkr s SER 106 CO 0.15 -0.01 0.33 -0.63 1.20 0.00 0.00 173.24 174.28 1tkr s ILE 107 N 2.76 5.17 0.76 6.45 1.01 -1.26 -0.38 121.20 135.70 1tkr s ILE 107 Ca -0.08 0.63 -0.14 0.00 0.00 0.00 0.00 60.65 61.06 1tkr s ILE 107 Cb -0.06 -3.62 0.06 0.00 0.01 0.00 0.00 42.46 38.84 1tkr s ILE 107 CO -0.09 0.57 1.19 -0.94 0.00 0.00 0.00 174.94 175.66 1tkr s SER 108 N -1.13 4.04 0.09 3.58 1.04 -0.76 -4.91 113.70 115.65 1tkr s SER 108 Ca 0.22 2.28 -0.26 0.00 0.48 0.00 0.00 55.95 58.67 1tkr s SER 108 Cb -0.15 -2.58 -0.13 0.00 0.10 0.00 0.00 66.02 63.25 1tkr s SER 108 CO 0.11 -2.36 1.68 -0.65 0.98 0.00 0.00 173.24 173.00 1tkr h PRO 109 N -0.60 -0.34 0.00 4.02 0.11 -1.81 -1.51 132.00 131.87 1tkr h PRO 109 Ca -0.47 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1tkr h PRO 109 Cb 1.28 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1tkr h PRO 109 CO 0.49 -0.23 0.00 -0.40 -0.21 0.00 0.00 178.00 177.65 1tkr n ASP 110 N -5.27 0.00 -1.64 -2.05 5.75 -0.94 -4.83 116.55 107.57 1tkr n ASP 110 Ca -0.08 0.27 -0.17 0.00 -0.01 0.00 0.00 54.79 54.80 1tkr n ASP 110 Cb 0.19 -0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 39.95 1tkr n ASP 110 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tkr n GLY 111 N -1.13 0.52 0.08 6.12 0.00 -0.57 -4.90 105.19 105.32 1tkr n GLY 111 Ca 0.01 -0.20 -0.06 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.57 0.68 -4.54 1.61 6.02 -1.26 -4.91 117.38 112.42 1tkr n GLN 112 Ca -0.19 -0.04 -0.25 0.00 -0.01 0.00 0.00 57.00 56.51 1tkr n GLN 112 Cb 0.61 -1.53 -0.11 0.00 1.02 0.00 0.00 30.24 30.23 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 -2.70 2.28 -0.12 1.08 0.08 -1.26 -0.14 117.98 117.20 1tkr s PHE 113 Ca -0.09 -0.73 -0.05 0.00 0.12 0.00 0.00 56.93 56.18 1tkr s PHE 113 Cb 0.08 -1.51 0.06 0.00 -0.57 0.00 0.00 43.02 41.07 1tkr s PHE 113 CO 0.85 0.32 0.25 -1.50 -0.10 0.00 0.00 175.22 175.04 1tkr s ILE 114 N -2.90 -0.30 0.01 0.64 2.07 -0.46 -1.84 121.20 118.44 1tkr s ILE 114 Ca 0.34 0.25 -0.27 0.00 -1.41 0.00 0.00 60.65 59.57 1tkr s ILE 114 Cb 0.08 -0.42 -0.04 0.00 0.13 0.00 0.00 42.46 42.21 1tkr s ILE 114 CO 0.16 0.10 0.83 -0.22 -1.91 0.00 0.00 174.94 173.91 1tkr s LEU 115 N 2.08 4.40 -0.32 8.50 2.96 0.49 -0.58 118.68 136.22 1tkr s LEU 115 Ca -0.02 1.49 -0.06 0.00 -0.22 0.00 0.00 54.13 55.32 1tkr s LEU 115 Cb -0.12 -3.33 0.03 0.00 0.50 0.00 0.00 46.19 43.27 1tkr s LEU 115 CO -0.08 -0.10 0.08 -0.76 -1.32 0.00 0.00 176.35 174.17 1tkr s LEU 116 N 0.44 4.07 -0.47 -0.68 1.43 0.18 -2.56 118.68 121.10 1tkr s LEU 116 Ca 0.43 -0.97 -0.20 0.00 -1.03 0.00 0.00 54.13 52.36 1tkr s LEU 116 Cb -0.20 -1.86 0.04 0.00 0.03 0.00 0.00 46.19 44.20 1tkr s LEU 116 CO 0.24 -0.26 0.62 -0.70 0.23 0.00 0.00 176.35 176.48 1tkr s GLU 117 N 1.43 3.20 0.37 1.70 2.12 -0.31 -2.05 118.70 125.16 1tkr s GLU 117 Ca -0.00 -0.60 0.03 0.00 0.36 0.00 0.00 54.97 54.76 1tkr s GLU 117 Cb -0.18 -4.01 -0.04 0.00 0.26 0.00 0.00 34.13 30.15 1tkr s GLU 117 CO 0.02 -1.09 0.09 1.52 -0.54 0.00 0.00 175.26 175.27 1tkr s TYR 118 N 2.72 1.86 -1.25 5.30 1.13 -0.35 -0.34 117.35 126.42 1tkr s TYR 118 Ca 0.19 -1.12 -0.05 0.00 -1.41 0.00 0.00 57.07 54.69 1tkr s TYR 118 Cb -0.16 -1.23 -0.01 0.00 -1.10 0.00 0.00 41.96 39.46 1tkr s TYR 118 CO 0.16 -0.13 0.73 0.09 -2.51 0.00 0.00 175.55 173.88 1tkr n ASN 119 N -0.99 -2.53 -4.73 -0.18 3.02 -1.26 0.09 115.26 108.67 1tkr n ASN 119 Ca -0.05 -0.86 -0.41 0.00 -0.03 0.00 0.00 54.58 53.24 1tkr n ASN 119 Cb 0.66 -4.01 -0.04 0.00 -0.61 0.00 0.00 39.78 35.78 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 -3.61 3.78 -0.34 3.10 5.04 -1.26 -3.26 117.35 120.80 1tkr s TYR 120 Ca 0.14 1.77 -0.01 0.00 -2.44 0.00 0.00 57.07 56.53 1tkr s TYR 120 Cb -0.04 -3.10 0.13 0.00 0.35 0.00 0.00 41.96 39.30 1tkr s TYR 120 CO 0.82 0.05 0.19 0.08 -1.34 0.00 0.00 175.55 175.34 1tkr s VAL 121 N -0.19 0.20 0.67 3.14 1.01 0.19 -4.98 120.40 120.44 1tkr s VAL 121 Ca 0.47 -1.53 -0.17 0.00 0.00 0.00 0.00 61.98 60.75 1tkr s VAL 121 Cb -0.25 -1.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.91 1tkr s VAL 121 CO 0.31 -0.91 0.49 1.17 0.00 0.00 0.00 175.10 176.16 1tkr n LYS 122 N 4.32 0.37 0.00 2.72 4.81 -1.26 -0.77 118.16 128.35 1tkr n LYS 122 Ca 0.07 0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 1tkr n LYS 122 Cb 0.38 -1.76 0.00 0.00 0.02 0.00 0.00 35.03 33.68 1tkr n LYS 122 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1tkr n GLN 123 N -0.39 0.00 0.00 1.64 7.27 -0.71 -4.74 117.38 120.45 1tkr n GLN 123 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.17 1tkr n GLN 123 Cb 0.49 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.14 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 0.02 3.69 5.03 -1.19 -4.97 117.44 120.02 1tkr n TRP 124 Ca 0.00 0.00 -0.11 0.00 3.03 0.00 0.00 57.50 60.42 1tkr n TRP 124 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 31.31 30.23 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 -0.43 0.00 -0.99 9.65 -1.99 -3.33 114.38 117.29 1tkr h ARG 125 Ca 0.00 0.03 -0.11 0.00 -1.10 0.00 0.00 59.98 58.79 1tkr h ARG 125 Cb 0.00 0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.66 1tkr h ARG 125 CO 0.00 -0.29 -1.76 0.72 2.80 0.00 0.00 179.97 181.44 1tkr n HIS 126 N -5.42 0.00 -2.24 2.20 8.25 -1.26 -5.02 115.22 111.73 1tkr n HIS 126 Ca -0.04 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.08 1tkr n HIS 126 Cb 0.34 -0.47 -0.00 0.00 1.12 0.00 0.00 29.99 30.98 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 -4.08 5.80 -0.27 0.41 1.04 -1.25 -4.80 113.70 110.53 1tkr s SER 127 Ca -0.06 2.06 -0.26 0.00 0.48 0.00 0.00 55.95 58.17 1tkr s SER 127 Cb 0.06 -2.57 0.16 0.00 0.10 0.00 0.00 66.02 63.78 1tkr s SER 127 CO 0.55 -1.16 1.25 -0.72 0.98 0.00 0.00 173.24 174.15 1tkr s TYR 128 N -1.96 -0.22 0.20 5.02 -0.85 -1.26 -1.75 117.35 116.54 1tkr s TYR 128 Ca 0.70 0.49 -0.03 0.00 -0.52 0.00 0.00 57.07 57.71 1tkr s TYR 128 Cb -0.21 0.45 -0.05 0.00 0.38 0.00 0.00 41.96 42.53 1tkr s TYR 128 CO 0.28 -0.13 0.42 -0.08 -1.52 0.00 0.00 175.55 174.52 1tkr s THR 129 N -0.21 5.15 0.05 -3.49 -1.32 0.05 -4.72 115.64 111.15 1tkr s THR 129 Ca 0.05 -0.12 -0.28 0.00 -1.21 0.00 0.00 61.69 60.13 1tkr s THR 129 Cb -0.04 -3.69 0.09 0.00 -1.51 0.00 0.00 72.50 67.35 1tkr s THR 129 CO -0.10 -0.13 1.07 0.00 -2.21 0.00 0.00 174.62 173.26 1tkr s ALA 130 N -1.84 -1.89 0.08 11.08 0.00 -0.86 0.54 121.76 128.87 1tkr s ALA 130 Ca 0.41 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.90 1tkr s ALA 130 Cb -0.11 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 1tkr s ALA 130 CO 0.27 -0.96 0.23 -1.12 0.00 0.00 0.00 175.76 174.18 1tkr s SER 131 N -2.83 6.36 0.01 0.00 0.01 0.11 -1.98 113.70 115.38 1tkr s SER 131 Ca 0.12 0.27 -0.00 0.00 1.31 0.00 0.00 55.95 57.65 1tkr s SER 131 Cb 0.01 -1.96 -0.01 0.00 0.21 0.00 0.00 66.02 64.27 1tkr s SER 131 CO -0.02 0.15 -0.01 -0.31 0.41 0.00 0.00 173.24 173.47 1tkr s TYR 132 N -1.55 0.08 -0.01 2.43 1.51 -1.26 -1.21 117.35 117.34 1tkr s TYR 132 Ca 0.35 -0.16 0.02 0.00 -1.01 0.00 0.00 57.07 56.27 1tkr s TYR 132 Cb -0.13 -0.06 -0.00 0.00 -0.11 0.00 0.00 41.96 41.66 1tkr s TYR 132 CO 0.28 -0.06 -0.06 -0.51 -1.11 0.00 0.00 175.55 174.09 1tkr s ASP 133 N -0.46 0.74 -0.12 2.29 1.01 -0.87 -4.26 116.67 115.00 1tkr s ASP 133 Ca -0.05 -0.11 -0.05 0.00 0.71 0.00 0.00 52.55 53.05 1tkr s ASP 133 Cb -0.03 -0.13 -0.04 0.00 1.01 0.00 0.00 42.92 43.73 1tkr s ASP 133 CO -0.00 0.05 0.06 -0.63 0.21 0.00 0.00 175.17 174.86 1tkr s ILE 134 N 0.03 4.79 -0.11 0.77 1.01 -1.26 0.49 121.20 126.92 1tkr s ILE 134 Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.60 1tkr s ILE 134 Cb -0.04 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.33 1tkr s ILE 134 CO -0.00 0.57 -0.13 -0.47 0.00 0.00 0.00 174.94 174.91 1tkr s TYR 135 N -0.59 2.79 -0.19 3.97 5.04 0.25 -1.90 117.35 126.72 1tkr s TYR 135 Ca 0.11 -0.53 -0.23 0.00 -2.44 0.00 0.00 57.07 53.98 1tkr s TYR 135 Cb -0.12 -1.80 -0.02 0.00 0.35 0.00 0.00 41.96 40.38 1tkr s TYR 135 CO 0.02 -0.12 0.74 0.34 -1.34 0.00 0.00 175.55 175.19 1tkr s ASP 136 N 0.10 6.82 0.07 4.32 -1.08 0.66 -1.35 116.67 126.21 1tkr s ASP 136 Ca -0.06 1.01 0.24 0.00 -0.52 0.00 0.00 52.55 53.22 1tkr s ASP 136 Cb -0.15 -2.40 0.36 0.00 -1.46 0.00 0.00 42.92 39.27 1tkr s ASP 136 CO 0.05 -0.35 1.31 0.18 0.52 0.00 0.00 175.17 176.88 1tkr n LEU 137 N 5.19 0.61 -0.05 -1.34 4.77 0.80 -1.81 117.00 125.17 1tkr n LEU 137 Ca 0.02 0.12 0.13 0.00 -0.03 0.00 0.00 56.01 56.25 1tkr n LEU 137 Cb 0.49 -0.19 0.49 0.00 -2.33 0.00 0.00 43.42 41.88 1tkr n LEU 137 CO 0.46 0.02 0.76 0.59 -1.33 0.00 0.00 177.39 177.89 1tkr n ASN 138 N -1.88 0.36 -0.13 -1.43 3.02 -1.25 -3.94 115.26 110.00 1tkr n ASN 138 Ca 0.04 -0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 1tkr n ASN 138 Cb 0.40 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 1tkr n ASN 138 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1tkr n LYS 139 N -1.28 0.00 -2.48 3.52 2.85 -1.25 -5.00 118.16 114.52 1tkr n LYS 139 Ca 0.09 -0.49 -0.08 0.00 -1.05 0.00 0.00 58.31 56.79 1tkr n LYS 139 Cb 0.32 -0.39 -0.00 0.00 -0.65 0.00 0.00 35.03 34.31 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 0.00 -2.55 -4.78 -1.58 5.12 -0.75 -4.92 116.66 107.21 1tkr n ARG 140 Ca 0.00 0.36 -0.32 0.00 -1.93 0.00 0.00 57.85 55.96 1tkr n ARG 140 Cb 0.54 -4.92 -0.13 0.00 -1.16 0.00 0.00 32.46 26.80 1tkr n ARG 140 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1tkr s GLN 141 N -5.04 2.35 -0.45 5.56 -0.21 -0.95 -4.95 119.66 115.97 1tkr s GLN 141 Ca 0.01 -0.81 -0.26 0.00 0.02 0.00 0.00 55.36 54.33 1tkr s GLN 141 Cb -0.00 -2.32 0.03 0.00 1.00 0.00 0.00 33.01 31.72 1tkr s GLN 141 CO 0.01 0.59 0.93 -1.17 -2.12 0.00 0.00 175.29 173.53 1tkr s LEU 142 N -1.06 4.00 0.06 2.90 2.96 -1.26 -0.24 118.68 126.03 1tkr s LEU 142 Ca 0.13 0.16 -0.34 0.00 -0.22 0.00 0.00 54.13 53.87 1tkr s LEU 142 Cb -0.11 -3.21 -0.13 0.00 0.50 0.00 0.00 46.19 43.25 1tkr s LEU 142 CO 0.03 -1.04 1.73 -0.38 -1.32 0.00 0.00 176.35 175.37 1tkr n ILE 143 N 6.39 0.27 0.35 6.68 5.41 -0.80 -4.89 119.36 132.78 1tkr n ILE 143 Ca 0.06 -0.05 0.04 0.00 1.00 0.00 0.00 62.75 63.80 1tkr n ILE 143 Cb 0.48 -1.73 -0.03 0.00 -0.71 0.00 0.00 39.64 37.65 1tkr n ILE 143 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1tkr n THR 144 N 4.24 0.00 -3.31 1.39 -2.24 -1.26 -4.58 114.28 108.52 1tkr n THR 144 Ca 0.19 -0.35 -0.34 0.00 -2.27 0.00 0.00 64.05 61.28 1tkr n THR 144 Cb 0.30 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 1tkr n THR 144 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1tkr s GLU 145 N -1.56 3.97 -1.67 -0.78 2.02 -1.26 -4.36 118.70 115.05 1tkr s GLU 145 Ca 0.04 0.51 -0.12 0.00 0.02 0.00 0.00 54.97 55.42 1tkr s GLU 145 Cb 0.06 -2.78 0.12 0.00 0.10 0.00 0.00 34.13 31.63 1tkr s GLU 145 CO 0.28 0.38 0.46 0.39 0.02 0.00 0.00 175.26 176.79 1tkr n GLU 146 N 0.38 -1.85 -0.90 1.61 -0.58 -1.26 -4.72 120.64 113.33 1tkr n GLU 146 Ca -0.02 0.23 -0.34 0.00 -0.42 0.00 0.00 57.16 56.61 1tkr n GLU 146 Cb 0.52 -4.49 0.11 0.00 -0.57 0.00 0.00 31.44 27.01 1tkr n GLU 146 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1tkr n ARG 147 N -4.34 -0.16 -2.49 3.49 1.74 -1.26 -4.87 116.66 108.76 1tkr n ARG 147 Ca -0.08 -0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.59 1tkr n ARG 147 Cb 0.56 -1.83 -0.04 0.00 -1.02 0.00 0.00 32.46 30.14 1tkr n ARG 147 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1tkr s ILE 148 N -2.28 3.60 0.49 0.55 1.01 -1.26 -4.97 121.20 118.34 1tkr s ILE 148 Ca 0.58 1.55 -0.22 0.00 0.00 0.00 0.00 60.65 62.55 1tkr s ILE 148 Cb -0.24 -3.98 -0.08 0.00 0.01 0.00 0.00 42.46 38.17 1tkr s ILE 148 CO 0.66 0.34 1.06 -2.65 0.00 0.00 0.00 174.94 174.35 1tkr n PRO 149 N 1.53 1.32 -1.39 2.79 -0.02 -1.26 -4.63 135.00 133.33 1tkr n PRO 149 Ca -0.00 0.48 -0.30 0.00 -2.02 0.00 0.00 63.50 61.66 1tkr n PRO 149 Cb 0.45 -2.18 0.10 0.00 -0.02 0.00 0.00 33.50 31.85 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 -0.89 4.22 -1.39 2.55 0.01 -1.26 -3.54 114.94 114.65 1tkr s ASN 150 Ca 0.68 1.48 -0.09 0.00 -0.71 0.00 0.00 52.86 54.21 1tkr s ASN 150 Cb -0.49 -2.20 0.03 0.00 0.41 0.00 0.00 41.25 39.00 1tkr s ASN 150 CO 0.53 -2.16 1.09 0.59 -1.51 0.00 0.00 177.10 175.64 1tkr n ASN 151 N -3.57 -5.20 -4.78 -1.22 3.02 -1.22 -4.96 115.26 97.32 1tkr n ASN 151 Ca 0.07 -0.63 -0.39 0.00 -0.03 0.00 0.00 54.58 53.60 1tkr n ASN 151 Cb 0.55 -4.69 -0.06 0.00 -0.61 0.00 0.00 39.78 34.98 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 -3.34 4.64 0.07 3.41 2.01 -0.84 -4.72 115.64 116.88 1tkr s THR 152 Ca 0.51 1.43 0.01 0.00 0.31 0.00 0.00 61.69 63.95 1tkr s THR 152 Cb -0.24 -4.01 -0.25 0.00 0.01 0.00 0.00 72.50 68.02 1tkr s THR 152 CO 0.76 0.50 1.12 1.56 -0.69 0.00 0.00 174.62 177.87 1tkr h GLN 153 N 4.77 0.15 -1.88 4.92 4.20 -1.06 -2.29 115.11 123.91 1tkr h GLN 153 Ca -0.47 -0.25 0.01 0.00 0.06 0.00 0.00 58.65 57.99 1tkr h GLN 153 Cb 1.21 0.09 -0.23 0.00 0.30 0.00 0.00 27.48 28.86 1tkr h GLN 153 CO 0.66 1.07 0.19 -0.46 -0.67 0.00 0.00 178.83 179.62 1tkr s TRP 154 N -2.67 -0.78 -0.02 2.96 -0.11 -1.21 -4.63 118.94 112.49 1tkr s TRP 154 Ca -0.03 1.76 0.06 0.00 1.22 0.00 0.00 56.10 59.11 1tkr s TRP 154 Cb 0.08 0.38 -0.01 0.00 -1.50 0.00 0.00 33.47 32.42 1tkr s TRP 154 CO 0.85 -0.38 -0.21 0.08 -4.62 0.00 0.00 176.95 172.67 1tkr s VAL 155 N 0.74 1.67 -0.04 5.86 1.01 -1.26 -0.10 120.40 128.29 1tkr s VAL 155 Ca -0.03 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.07 1tkr s VAL 155 Cb -0.05 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.96 1tkr s VAL 155 CO -0.07 0.47 -0.02 -0.89 0.00 0.00 0.00 175.10 174.60 1tkr s THR 156 N -0.38 0.31 0.52 3.92 2.01 0.19 -4.98 115.64 117.22 1tkr s THR 156 Ca 0.05 0.01 -0.15 0.00 0.31 0.00 0.00 61.69 61.92 1tkr s THR 156 Cb -0.09 -0.38 -0.07 0.00 0.01 0.00 0.00 72.50 71.96 1tkr s THR 156 CO 0.00 0.18 0.96 0.26 -0.69 0.00 0.00 174.62 175.33 1tkr s TRP 157 N 1.02 3.48 0.62 4.92 0.23 -1.26 -1.13 118.94 126.82 1tkr s TRP 157 Ca -0.10 1.38 -0.14 0.00 -2.03 0.00 0.00 56.10 55.22 1tkr s TRP 157 Cb -0.14 -2.73 -0.02 0.00 0.03 0.00 0.00 33.47 30.61 1tkr s TRP 157 CO -0.01 -0.38 1.05 -1.54 0.96 0.00 0.00 176.95 177.03 1tkr s SER 158 N -3.26 5.68 0.30 2.95 1.04 -0.07 -4.90 113.70 115.45 1tkr s SER 158 Ca 0.57 1.74 0.24 0.00 0.48 0.00 0.00 55.95 58.98 1tkr s SER 158 Cb -0.10 -2.52 1.08 0.00 0.10 0.00 0.00 66.02 64.58 1tkr s SER 158 CO 0.35 -1.23 1.74 1.55 0.98 0.00 0.00 173.24 176.62 1tkr h PRO 159 N 0.06 0.00 -3.33 4.02 0.13 -1.83 -3.43 132.00 127.63 1tkr h PRO 159 Ca -0.46 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.44 1tkr h PRO 159 Cb 1.21 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.04 1tkr h PRO 159 CO 0.57 0.00 -0.60 0.08 -0.23 0.00 0.00 178.00 177.82 1tkr s VAL 160 N -3.41 -0.04 0.00 1.56 1.01 -1.26 -4.85 120.40 113.42 1tkr s VAL 160 Ca 0.03 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1tkr s VAL 160 Cb 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.26 1tkr s VAL 160 CO 0.37 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1tkr n GLY 161 N 3.85 0.80 1.32 4.51 0.00 -1.26 -4.55 105.19 109.86 1tkr n GLY 161 Ca -0.22 -1.35 0.02 0.00 0.00 0.00 0.00 46.02 44.47 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 4.77 0.00 -2.08 1.61 1.44 -1.26 -2.22 115.22 117.48 1tkr n HIS 162 Ca 0.00 -0.46 -0.33 0.00 -2.01 0.00 0.00 57.72 54.92 1tkr n HIS 162 Cb 0.00 -0.02 0.01 0.00 0.12 0.00 0.00 29.99 30.10 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 0.00 3.31 0.07 -1.40 1.02 -1.26 -4.57 119.74 116.91 1tkr s LYS 163 Ca 0.25 1.27 0.07 0.00 0.02 0.00 0.00 55.97 57.58 1tkr s LYS 163 Cb 0.29 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.54 1tkr s LYS 163 CO -0.13 -0.83 -0.20 -0.51 -0.92 0.00 0.00 175.35 172.77 1tkr s LEU 164 N -4.39 2.23 -0.03 3.17 1.43 0.03 -0.89 118.68 120.22 1tkr s LEU 164 Ca 0.65 -0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 53.16 1tkr s LEU 164 Cb -0.17 -0.87 0.03 0.00 0.03 0.00 0.00 46.19 45.21 1tkr s LEU 164 CO 0.35 0.09 0.03 0.00 0.23 0.00 0.00 176.35 177.05 1tkr s ALA 165 N -0.98 0.21 0.09 4.21 0.00 -0.29 -0.66 121.76 124.35 1tkr s ALA 165 Ca 0.06 0.22 -0.04 0.00 0.00 0.00 0.00 51.96 52.20 1tkr s ALA 165 Cb -0.09 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 1tkr s ALA 165 CO 0.03 -0.19 0.09 1.52 0.00 0.00 0.00 175.76 177.21 1tkr s TYR 166 N 1.32 0.47 -0.16 0.00 1.13 -0.65 0.53 117.35 119.98 1tkr s TYR 166 Ca -0.06 -0.93 -0.00 0.00 -1.41 0.00 0.00 57.07 54.67 1tkr s TYR 166 Cb -0.13 -0.28 -0.00 0.00 -1.10 0.00 0.00 41.96 40.45 1tkr s TYR 166 CO -0.03 -0.50 -0.14 0.08 -2.51 0.00 0.00 175.55 172.46 1tkr s VAL 167 N -3.94 2.79 -0.07 -3.49 1.01 0.86 -0.49 120.40 117.08 1tkr s VAL 167 Ca 0.11 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1tkr s VAL 167 Cb 0.06 -2.19 0.03 0.00 0.00 0.00 0.00 36.38 34.28 1tkr s VAL 167 CO -0.07 0.50 -0.01 0.86 0.00 0.00 0.00 175.10 176.39 1tkr s TRP 168 N 0.87 0.73 -1.38 5.22 -0.00 0.07 -0.48 118.94 123.97 1tkr s TRP 168 Ca -0.04 -0.21 -0.03 0.00 -0.00 0.00 0.00 56.10 55.82 1tkr s TRP 168 Cb -0.15 -0.80 0.00 0.00 -0.00 0.00 0.00 33.47 32.52 1tkr s TRP 168 CO -0.01 -0.32 0.45 0.09 -0.00 0.00 0.00 176.95 177.17 1tkr n ASN 169 N 4.96 -5.50 -1.01 5.86 5.03 -1.26 -1.83 115.26 121.50 1tkr n ASN 169 Ca -0.10 -0.21 -0.12 0.00 0.87 0.00 0.00 54.58 55.02 1tkr n ASN 169 Cb 0.50 -4.37 -0.04 0.00 -1.02 0.00 0.00 39.78 34.85 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 -1.87 -4.23 -4.16 6.41 5.03 -1.26 -4.25 115.26 110.92 1tkr n ASN 170 Ca -0.12 0.21 -0.25 0.00 0.87 0.00 0.00 54.58 55.29 1tkr n ASN 170 Cb 0.61 -2.95 -0.15 0.00 -1.02 0.00 0.00 39.78 36.27 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 -2.77 2.05 0.10 6.41 -0.00 -0.76 -3.05 116.67 118.65 1tkr s ASP 171 Ca 0.00 -0.32 -0.24 0.00 -0.00 0.00 0.00 52.55 51.99 1tkr s ASP 171 Cb 0.00 -0.25 -0.07 0.00 -0.00 0.00 0.00 42.92 42.61 1tkr s ASP 171 CO 0.00 0.21 0.73 -0.63 -0.00 0.00 0.00 175.17 175.48 1tkr s ILE 172 N -0.38 4.59 0.11 0.77 1.01 -1.26 -0.75 121.20 125.28 1tkr s ILE 172 Ca 0.06 1.58 0.06 0.00 0.00 0.00 0.00 60.65 62.35 1tkr s ILE 172 Cb -0.07 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 1tkr s ILE 172 CO -0.01 0.46 -0.15 -0.31 0.00 0.00 0.00 174.94 174.94 1tkr s TYR 173 N -0.69 1.42 -0.05 3.97 1.51 0.35 -0.42 117.35 123.46 1tkr s TYR 173 Ca 0.35 -0.50 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1tkr s TYR 173 Cb -0.21 -0.76 0.02 0.00 -0.11 0.00 0.00 41.96 40.89 1tkr s TYR 173 CO 0.23 0.14 -0.07 0.08 -1.11 0.00 0.00 175.55 174.82 1tkr s VAL 174 N -1.76 0.74 -0.30 0.71 1.01 0.25 -1.64 120.40 119.41 1tkr s VAL 174 Ca 0.06 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 1tkr s VAL 174 Cb -0.07 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.61 1tkr s VAL 174 CO 0.03 0.26 0.08 -0.54 0.00 0.00 0.00 175.10 174.93 1tkr s LYS 175 N 0.75 2.96 0.11 2.72 -0.14 0.17 0.25 119.74 126.56 1tkr s LYS 175 Ca -0.12 -0.94 -0.06 0.00 -1.36 0.00 0.00 55.97 53.49 1tkr s LYS 175 Cb -0.14 -3.37 -0.16 0.00 -1.68 0.00 0.00 37.83 32.48 1tkr s LYS 175 CO 0.01 -0.49 1.24 0.82 -0.76 0.00 0.00 175.35 176.17 1tkr h ILE 176 N 5.96 1.41 -3.41 2.17 1.08 -1.85 0.13 117.51 122.99 1tkr h ILE 176 Ca -0.30 -2.61 -0.52 0.00 -0.39 0.00 0.00 64.86 61.05 1tkr h ILE 176 Cb 1.11 2.59 -0.33 0.00 -3.07 0.00 0.00 36.82 37.12 1tkr h ILE 176 CO 0.60 0.78 -0.82 -1.61 -0.69 0.00 0.00 178.15 176.41 1tkr s GLU 177 N -3.07 1.72 0.61 2.37 0.41 -1.26 -4.45 118.70 115.02 1tkr s GLU 177 Ca -0.06 -0.42 0.27 0.00 -0.41 0.00 0.00 54.97 54.35 1tkr s GLU 177 Cb 0.08 -1.42 1.16 0.00 -1.78 0.00 0.00 34.13 32.16 1tkr s GLU 177 CO 0.88 0.03 1.57 -1.35 -0.49 0.00 0.00 175.26 175.89 1tkr h PRO 178 N 6.98 0.00 0.00 0.39 0.11 -1.85 -1.59 132.00 136.04 1tkr h PRO 178 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1tkr h PRO 178 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1tkr h PRO 178 CO 0.47 0.00 -1.78 0.27 -0.21 0.00 0.00 178.00 176.75 1tkr n ASN 179 N -3.38 1.04 -4.85 -2.05 6.94 -1.26 -4.91 115.26 106.79 1tkr n ASN 179 Ca 0.15 -0.01 -0.32 0.00 -0.02 0.00 0.00 54.58 54.39 1tkr n ASN 179 Cb 1.11 1.78 -0.01 0.00 -2.36 0.00 0.00 39.78 40.30 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 -4.19 3.44 0.61 -4.53 1.43 -0.60 -4.19 118.68 110.65 1tkr s LEU 180 Ca -0.06 1.53 -0.19 0.00 -1.03 0.00 0.00 54.13 54.37 1tkr s LEU 180 Cb 0.11 -4.49 -0.03 0.00 0.03 0.00 0.00 46.19 41.81 1tkr s LEU 180 CO 0.72 -0.77 1.32 -0.81 0.23 0.00 0.00 176.35 177.04 1tkr n PRO 181 N -2.13 1.34 -2.60 1.29 -0.04 -1.26 -4.80 135.00 126.80 1tkr n PRO 181 Ca 0.06 0.51 -0.25 0.00 -0.04 0.00 0.00 63.50 63.79 1tkr n PRO 181 Cb 0.54 -2.55 0.03 0.00 -0.04 0.00 0.00 33.50 31.48 1tkr n PRO 181 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1tkr s SER 182 N -1.19 5.54 -0.17 3.54 1.04 -1.26 -4.74 113.70 116.45 1tkr s SER 182 Ca 0.78 0.45 -0.06 0.00 0.48 0.00 0.00 55.95 57.60 1tkr s SER 182 Cb -0.39 -1.47 -0.04 0.00 0.10 0.00 0.00 66.02 64.22 1tkr s SER 182 CO 0.44 -1.02 0.03 -0.31 0.98 0.00 0.00 173.24 173.36 1tkr s TYR 183 N -2.85 3.17 0.15 5.02 1.51 0.14 -4.86 117.35 119.64 1tkr s TYR 183 Ca 0.53 -0.06 -0.30 0.00 -1.01 0.00 0.00 57.07 56.23 1tkr s TYR 183 Cb -0.10 -2.03 -0.07 0.00 -0.11 0.00 0.00 41.96 39.64 1tkr s TYR 183 CO 0.42 0.09 1.09 0.50 -1.11 0.00 0.00 175.55 176.53 1tkr s ARG 184 N 0.37 4.59 -0.16 -0.62 3.52 -1.26 -0.59 118.95 124.80 1tkr s ARG 184 Ca 0.00 1.68 0.10 0.00 -0.13 0.00 0.00 55.73 57.38 1tkr s ARG 184 Cb -0.13 -3.30 -0.16 0.00 -1.56 0.00 0.00 34.95 29.80 1tkr s ARG 184 CO 0.01 0.06 -0.01 -0.89 -0.81 0.00 0.00 175.30 173.66 1tkr n ILE 185 N 2.59 1.02 -4.26 4.11 2.08 0.44 -4.91 119.36 120.44 1tkr n ILE 185 Ca 0.03 -0.56 -0.18 0.00 0.56 0.00 0.00 62.75 62.60 1tkr n ILE 185 Cb 0.47 -0.77 -0.13 0.00 -0.75 0.00 0.00 39.64 38.46 1tkr n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1tkr s THR 186 N -2.36 0.87 -0.02 1.39 -4.23 -1.24 -4.94 115.64 105.11 1tkr s THR 186 Ca -0.12 -0.89 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 1tkr s THR 186 Cb 0.05 -0.81 0.00 0.00 1.34 0.00 0.00 72.50 73.08 1tkr s THR 186 CO 0.55 -0.06 0.38 0.79 -0.54 0.00 0.00 174.62 175.74 1tkr n TRP 187 N 1.98 0.00 0.96 3.99 8.01 -1.26 -4.53 117.44 126.59 1tkr n TRP 187 Ca -0.18 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.14 1tkr n TRP 187 Cb 0.55 0.00 0.46 0.00 -2.01 0.00 0.00 31.31 30.31 1tkr n TRP 187 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 1tkr n THR 188 N -0.24 0.05 -1.59 -0.99 -2.24 -1.26 -4.92 114.28 103.07 1tkr n THR 188 Ca 0.00 -0.03 -0.51 0.00 -2.27 0.00 0.00 64.05 61.25 1tkr n THR 188 Cb 0.01 -0.22 -0.05 0.00 -2.10 0.00 0.00 70.33 67.97 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 1.48 0.42 3.32 3.38 0.00 -1.26 -4.68 105.19 107.85 1tkr n GLY 189 Ca 0.06 0.65 -0.09 0.00 0.00 0.00 0.00 46.02 46.64 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 0.28 0.41 0.09 1.61 2.20 -0.86 -4.92 119.74 118.55 1tkr s LYS 190 Ca 0.81 0.94 -0.36 0.00 -0.36 0.00 0.00 55.97 56.99 1tkr s LYS 190 Cb -0.90 0.14 -0.17 0.00 -1.51 0.00 0.00 37.83 35.39 1tkr s LYS 190 CO 0.48 -0.19 1.33 -1.91 -0.36 0.00 0.00 175.35 174.70 1tkr n GLU 191 N 4.67 1.16 -0.81 4.03 2.13 -1.26 0.01 120.64 130.57 1tkr n GLU 191 Ca -0.18 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.06 1tkr n GLU 191 Cb 0.54 -2.05 0.00 0.00 0.27 0.00 0.00 31.44 30.19 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 2.49 -4.72 0.05 4.31 8.00 -1.26 -4.65 116.55 120.77 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 0.20 -2.93 0.00 0.00 -0.02 0.00 0.00 41.12 38.36 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 -1.64 0.45 -4.61 0.53 2.08 0.00 -4.71 119.36 111.45 1tkr n ILE 193 Ca 0.00 0.15 -0.31 0.00 0.56 0.00 0.00 62.75 63.15 1tkr n ILE 193 Cb 0.39 -1.19 -0.17 0.00 -0.75 0.00 0.00 39.64 37.93 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 -2.00 1.87 -0.16 1.39 -1.09 0.10 0.50 121.20 121.81 1tkr s ILE 194 Ca 0.00 -0.87 -0.00 0.00 -2.23 0.00 0.00 60.65 57.55 1tkr s ILE 194 Cb 0.00 -1.67 -0.00 0.00 -1.58 0.00 0.00 42.46 39.21 1tkr s ILE 194 CO 0.00 0.51 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.77 1tkr s TYR 195 N 0.86 2.80 -0.13 3.97 1.51 0.49 -2.03 117.35 124.81 1tkr s TYR 195 Ca -0.07 -1.08 0.02 0.00 -1.01 0.00 0.00 57.07 54.93 1tkr s TYR 195 Cb -0.15 -1.91 0.01 0.00 -0.11 0.00 0.00 41.96 39.80 1tkr s TYR 195 CO -0.02 -0.50 -0.20 -0.80 -1.11 0.00 0.00 175.55 172.92 1tkr s ASN 196 N 0.90 2.92 0.00 2.29 0.01 -1.17 0.10 114.94 119.99 1tkr s ASN 196 Ca -0.04 -0.55 0.00 0.00 -0.71 0.00 0.00 52.86 51.56 1tkr s ASN 196 Cb -0.15 -1.34 0.00 0.00 0.41 0.00 0.00 41.25 40.17 1tkr s ASN 196 CO -0.01 0.06 0.00 0.61 -1.51 0.00 0.00 177.10 176.25 1tkr n GLY 197 N 4.10 2.91 3.06 0.66 0.00 -1.03 -4.38 105.19 110.51 1tkr n GLY 197 Ca -0.20 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.63 0.77 0.70 -0.61 -4.36 -1.26 0.47 121.20 114.28 1tkr s ILE 198 Ca 0.00 -0.68 -0.11 0.00 -0.26 0.00 0.00 60.65 59.60 1tkr s ILE 198 Cb 0.00 -0.70 0.01 0.00 1.25 0.00 0.00 42.46 43.02 1tkr s ILE 198 CO 0.00 0.03 1.09 0.42 0.24 0.00 0.00 174.94 176.72 1tkr s THR 199 N -0.60 3.65 0.05 8.37 -4.23 -0.66 -4.74 115.64 117.48 1tkr s THR 199 Ca 0.00 0.54 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 1tkr s THR 199 Cb -0.06 -3.50 0.01 0.00 1.34 0.00 0.00 72.50 70.29 1tkr s THR 199 CO 0.00 -0.70 0.07 -0.90 -0.54 0.00 0.00 174.62 172.55 1tkr n ASP 200 N -3.01 0.10 0.19 3.99 5.75 -1.26 -4.81 116.55 117.49 1tkr n ASP 200 Ca 0.07 -1.08 -0.14 0.00 -0.01 0.00 0.00 54.79 53.62 1tkr n ASP 200 Cb 0.57 -0.04 -0.07 0.00 -1.03 0.00 0.00 41.12 40.54 1tkr n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 1tkr h TRP 201 N -0.37 -0.60 -0.25 2.11 7.01 -1.99 -1.79 115.95 120.07 1tkr h TRP 201 Ca -0.02 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.97 1tkr h TRP 201 Cb 0.09 0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.36 1tkr h TRP 201 CO 0.00 -0.34 0.12 -0.24 -2.79 0.00 0.00 178.44 175.19 1tkr h VAL 202 N -0.52 1.15 0.00 2.65 3.04 -1.95 -2.33 116.25 118.28 1tkr h VAL 202 Ca -0.02 -0.42 -0.02 0.00 -1.01 0.00 0.00 66.70 65.23 1tkr h VAL 202 Cb 0.46 0.96 -0.00 0.00 -2.01 0.00 0.00 31.29 30.70 1tkr h VAL 202 CO -0.01 0.15 -0.10 1.88 -1.01 0.00 0.00 177.57 178.48 1tkr h TYR 203 N 0.28 0.00 -0.01 3.17 -1.99 -1.92 -0.12 116.97 116.37 1tkr h TYR 203 Ca 0.09 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.75 1tkr h TYR 203 Cb 0.12 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.86 1tkr h TYR 203 CO -0.02 0.10 -0.25 1.49 -0.00 0.00 0.00 178.16 179.48 1tkr h GLU 204 N 0.00 0.19 0.13 4.88 4.81 -0.96 0.30 114.58 123.94 1tkr h GLU 204 Ca -0.00 -0.19 -0.19 0.00 -0.13 0.00 0.00 59.36 58.85 1tkr h GLU 204 Cb 0.20 0.05 0.02 0.00 0.63 0.00 0.00 28.75 29.65 1tkr h GLU 204 CO 0.01 0.90 -0.84 1.49 -0.73 0.00 0.00 179.01 179.83 1tkr h GLU 205 N -0.44 0.29 0.00 1.92 4.57 -1.31 -0.00 114.58 119.60 1tkr h GLU 205 Ca -0.03 -0.49 -0.38 0.00 -1.18 0.00 0.00 59.36 57.28 1tkr h GLU 205 Cb 0.97 0.18 -0.07 0.00 -0.16 0.00 0.00 28.75 29.67 1tkr h GLU 205 CO 0.05 1.23 -2.45 0.39 -1.18 0.00 0.00 179.01 177.05 1tkr n GLU 206 N -4.12 0.66 0.00 1.92 -0.58 -0.07 -4.35 120.64 114.10 1tkr n GLU 206 Ca -0.15 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 1tkr n GLU 206 Cb 0.82 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 30.17 1tkr n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1tkr n VAL 207 N -3.14 0.00 1.63 2.62 0.31 -1.17 -4.57 118.33 114.01 1tkr n VAL 207 Ca -0.43 0.34 0.15 0.00 -0.01 0.00 0.00 64.34 64.39 1tkr n VAL 207 Cb 1.03 -1.13 0.70 0.00 -0.91 0.00 0.00 33.84 33.53 1tkr n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1tkr n PHE 208 N -1.76 0.00 -3.81 3.52 3.72 0.11 -4.90 117.46 114.35 1tkr n PHE 208 Ca 0.00 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 1tkr n PHE 208 Cb 0.00 -0.08 -0.05 0.00 -0.94 0.00 0.00 39.48 38.41 1tkr n PHE 208 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1tkr n SER 209 N -0.68 -1.49 -3.57 4.37 2.88 -0.85 -4.80 113.62 109.48 1tkr n SER 209 Ca 0.19 -0.74 -0.08 0.00 -1.33 0.00 0.00 58.87 56.90 1tkr n SER 209 Cb 0.24 -1.33 -0.02 0.00 -0.75 0.00 0.00 64.21 62.35 1tkr n SER 209 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tkr s ALA 210 N -2.76 -1.65 -0.17 -1.46 0.00 -0.07 -4.96 121.76 110.69 1tkr s ALA 210 Ca 0.58 0.53 -0.12 0.00 0.00 0.00 0.00 51.96 52.95 1tkr s ALA 210 Cb -0.34 0.65 -0.22 0.00 0.00 0.00 0.00 23.12 23.21 1tkr s ALA 210 CO 0.71 -0.83 0.22 0.98 0.00 0.00 0.00 175.76 176.84 1tkr n TYR 211 N -0.35 0.99 -1.68 0.00 9.36 -1.26 -4.10 117.16 120.11 1tkr n TYR 211 Ca -0.10 0.29 -0.45 0.00 3.32 0.00 0.00 57.90 60.96 1tkr n TYR 211 Cb 0.62 -1.12 -0.04 0.00 -0.63 0.00 0.00 39.34 38.17 1tkr n TYR 211 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1tkr n SER 212 N -3.84 3.48 -1.46 2.98 2.88 -1.26 -1.65 113.62 114.75 1tkr n SER 212 Ca -0.35 1.05 -0.12 0.00 -1.33 0.00 0.00 58.87 58.12 1tkr n SER 212 Cb 0.91 -1.47 0.10 0.00 -0.75 0.00 0.00 64.21 63.00 1tkr n SER 212 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tkr n ALA 213 N 4.36 4.51 -2.88 -1.46 0.00 0.18 -4.77 120.51 120.44 1tkr n ALA 213 Ca 0.18 -3.59 -0.12 0.00 0.00 0.00 0.00 53.44 49.91 1tkr n ALA 213 Cb 0.32 -0.36 -0.13 0.00 0.00 0.00 0.00 19.45 19.27 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 -3.46 2.09 -0.23 0.00 0.05 -1.24 -2.24 118.68 113.65 1tkr s LEU 214 Ca 0.46 -0.19 -0.02 0.00 0.05 0.00 0.00 54.13 54.43 1tkr s LEU 214 Cb 0.40 -0.03 0.07 0.00 -2.05 0.00 0.00 46.19 44.58 1tkr s LEU 214 CO -0.00 -0.09 0.03 0.26 -0.55 0.00 0.00 176.35 176.00 1tkr s TRP 215 N -0.53 1.42 0.33 3.48 0.51 0.57 -5.00 118.94 119.73 1tkr s TRP 215 Ca -0.05 -1.21 -0.28 0.00 -2.12 0.00 0.00 56.10 52.44 1tkr s TRP 215 Cb -0.04 -1.28 -0.09 0.00 -0.81 0.00 0.00 33.47 31.25 1tkr s TRP 215 CO -0.00 -0.70 1.18 -1.58 -0.51 0.00 0.00 176.95 175.33 1tkr s TRP 216 N 1.72 3.29 0.61 -1.98 0.52 -1.26 -1.90 118.94 119.93 1tkr s TRP 216 Ca 0.00 1.58 -0.18 0.00 0.02 0.00 0.00 56.10 57.53 1tkr s TRP 216 Cb -0.17 -3.42 -0.03 0.00 -1.15 0.00 0.00 33.47 28.70 1tkr s TRP 216 CO -0.12 -1.12 1.16 -1.54 0.02 0.00 0.00 176.95 175.35 1tkr s SER 217 N -0.85 5.25 0.35 2.95 1.04 -0.65 -4.87 113.70 116.91 1tkr s SER 217 Ca 0.49 2.22 0.16 0.00 0.48 0.00 0.00 55.95 59.31 1tkr s SER 217 Cb -0.34 -2.58 1.15 0.00 0.10 0.00 0.00 66.02 64.36 1tkr s SER 217 CO 0.43 -1.54 1.64 1.55 0.98 0.00 0.00 173.24 176.29 1tkr h PRO 218 N 0.67 0.21 0.02 4.02 0.13 -1.92 -0.68 132.00 134.46 1tkr h PRO 218 Ca -0.49 -0.01 -0.18 0.00 -0.87 0.00 0.00 66.00 64.45 1tkr h PRO 218 Cb 1.27 -0.05 0.02 0.00 0.13 0.00 0.00 31.00 32.37 1tkr h PRO 218 CO 0.55 0.14 -0.70 -0.97 -0.23 0.00 0.00 178.00 176.78 1tkr h ASN 219 N 0.22 0.59 0.00 1.44 -0.73 -1.92 -3.39 115.58 111.78 1tkr h ASN 219 Ca 0.76 -0.78 0.00 0.00 1.87 0.00 0.00 56.30 58.15 1tkr h ASN 219 Cb 1.83 -0.18 0.00 0.00 0.27 0.00 0.00 38.32 40.24 1tkr h ASN 219 CO -0.66 1.29 0.00 0.61 -0.37 0.00 0.00 177.43 178.30 1tkr n GLY 220 N 1.15 0.98 0.22 1.57 0.00 -0.26 -4.36 105.19 104.49 1tkr n GLY 220 Ca -0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 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 0.41 -3.01 2.61 2.02 -1.93 -3.45 112.91 109.56 1tkr h THR 221 Ca 0.00 -0.71 -0.51 0.00 0.77 0.00 0.00 66.41 65.95 1tkr h THR 221 Cb 0.00 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1tkr h THR 221 CO 0.00 0.09 -0.21 -0.36 0.37 0.00 0.00 175.52 175.41 1tkr s PHE 222 N -3.85 3.48 -0.19 3.16 0.08 -1.26 -0.49 117.98 118.92 1tkr s PHE 222 Ca -0.12 0.49 -0.02 0.00 0.12 0.00 0.00 56.93 57.40 1tkr s PHE 222 Cb 0.01 -1.98 0.06 0.00 -0.57 0.00 0.00 43.02 40.54 1tkr s PHE 222 CO 0.41 0.22 0.02 -1.17 -0.10 0.00 0.00 175.22 174.60 1tkr s LEU 223 N -3.65 1.30 -0.10 -0.37 1.98 0.39 -1.64 118.68 116.58 1tkr s LEU 223 Ca 0.41 -0.79 -0.08 0.00 -2.89 0.00 0.00 54.13 50.79 1tkr s LEU 223 Cb -0.11 -0.66 -0.04 0.00 0.66 0.00 0.00 46.19 46.04 1tkr s LEU 223 CO 0.31 -0.28 0.18 0.00 -1.89 0.00 0.00 176.35 174.67 1tkr s ALA 224 N 1.81 3.86 0.01 5.97 0.00 -0.80 -1.22 121.76 131.39 1tkr s ALA 224 Ca -0.01 -0.58 -0.18 0.00 0.00 0.00 0.00 51.96 51.19 1tkr s ALA 224 Cb -0.17 -2.03 0.04 0.00 0.00 0.00 0.00 23.12 20.96 1tkr s ALA 224 CO -0.08 0.60 0.41 1.52 0.00 0.00 0.00 175.76 178.22 1tkr s TYR 225 N -1.05 -0.28 0.12 0.00 1.13 0.93 -0.31 117.35 117.88 1tkr s TYR 225 Ca 0.17 0.35 0.04 0.00 -1.41 0.00 0.00 57.07 56.21 1tkr s TYR 225 Cb -0.13 0.20 -0.04 0.00 -1.10 0.00 0.00 41.96 40.89 1tkr s TYR 225 CO 0.06 -0.51 0.14 0.00 -2.51 0.00 0.00 175.55 172.73 1tkr s ALA 226 N -1.92 3.65 -0.06 9.51 0.00 -0.95 -0.40 121.76 131.60 1tkr s ALA 226 Ca -0.09 -1.08 0.04 0.00 0.00 0.00 0.00 51.96 50.83 1tkr s ALA 226 Cb -0.02 -1.48 -0.00 0.00 0.00 0.00 0.00 23.12 21.62 1tkr s ALA 226 CO 0.02 0.63 -0.18 -1.14 0.00 0.00 0.00 175.76 175.08 1tkr s GLN 227 N -2.79 2.06 -0.12 0.00 0.74 0.35 -2.46 119.66 117.43 1tkr s GLN 227 Ca 0.31 -0.66 0.02 0.00 0.05 0.00 0.00 55.36 55.08 1tkr s GLN 227 Cb -0.11 -1.72 -0.00 0.00 1.10 0.00 0.00 33.01 32.27 1tkr s GLN 227 CO 0.24 0.22 -0.20 -0.06 -0.55 0.00 0.00 175.29 174.94 1tkr s PHE 228 N 0.15 2.67 -0.35 1.67 0.08 0.12 -1.52 117.98 120.80 1tkr s PHE 228 Ca -0.08 -1.03 -0.09 0.00 0.12 0.00 0.00 56.93 55.85 1tkr s PHE 228 Cb -0.13 -1.79 0.03 0.00 -0.57 0.00 0.00 43.02 40.55 1tkr s PHE 228 CO 0.04 -0.43 0.17 1.21 -0.10 0.00 0.00 175.22 176.10 1tkr s ASN 229 N 0.53 5.56 -0.25 1.36 3.84 -0.92 -0.38 114.94 124.69 1tkr s ASN 229 Ca -0.12 -0.96 0.13 0.00 0.21 0.00 0.00 52.86 52.12 1tkr s ASN 229 Cb -0.17 -1.97 0.57 0.00 -0.55 0.00 0.00 41.25 39.13 1tkr s ASN 229 CO 0.04 -0.34 1.52 0.47 -2.79 0.00 0.00 177.10 176.01 1tkr n ASP 230 N 4.94 3.64 -0.15 -4.21 9.92 0.18 -2.13 116.55 128.74 1tkr n ASP 230 Ca -0.12 -3.31 -0.04 0.00 -0.53 0.00 0.00 54.79 50.79 1tkr n ASP 230 Cb 0.46 -0.62 0.03 0.00 -0.64 0.00 0.00 41.12 40.35 1tkr n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1tkr h THR 231 N 1.69 0.40 -0.01 -3.53 2.02 -1.85 -2.19 112.91 109.45 1tkr h THR 231 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1tkr h THR 231 Cb 1.72 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 1tkr h THR 231 CO 0.40 0.00 -0.03 1.21 0.37 0.00 0.00 175.52 177.47 1tkr n GLU 232 N -5.39 1.43 -2.79 6.66 4.07 -1.26 -4.92 120.64 118.45 1tkr n GLU 232 Ca 0.04 -0.74 -0.42 0.00 -0.06 0.00 0.00 57.16 55.99 1tkr n GLU 232 Cb 0.30 -1.48 -0.03 0.00 -0.06 0.00 0.00 31.44 30.16 1tkr n GLU 232 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1tkr s VAL 233 N -2.08 4.86 0.69 6.31 1.01 -0.83 -4.72 120.40 125.66 1tkr s VAL 233 Ca 0.38 1.88 -0.17 0.00 0.00 0.00 0.00 61.98 64.07 1tkr s VAL 233 Cb 0.21 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 32.36 1tkr s VAL 233 CO 0.37 0.08 1.28 -2.84 0.00 0.00 0.00 175.10 173.99 1tkr s PRO 234 N 1.62 2.29 -0.22 2.72 0.02 -1.26 -4.73 135.00 135.43 1tkr s PRO 234 Ca 0.46 2.00 -0.09 0.00 0.02 0.00 0.00 61.00 63.39 1tkr s PRO 234 Cb -0.19 -1.82 -0.04 0.00 0.02 0.00 0.00 34.50 32.47 1tkr s PRO 234 CO 0.19 -1.78 0.11 -0.51 -0.33 0.00 0.00 177.00 174.67 1tkr s LEU 235 N -4.73 3.85 0.09 -5.54 1.43 -1.26 -1.43 118.68 111.09 1tkr s LEU 235 Ca 0.80 0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 53.64 1tkr s LEU 235 Cb -0.36 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 43.80 1tkr s LEU 235 CO 0.43 0.08 0.95 -0.51 0.23 0.00 0.00 176.35 177.52 1tkr s ILE 236 N 0.95 4.58 -0.03 -0.59 1.10 0.49 -4.80 121.20 122.91 1tkr s ILE 236 Ca 0.05 2.03 0.04 0.00 -0.51 0.00 0.00 60.65 62.26 1tkr s ILE 236 Cb -0.14 -4.30 -0.00 0.00 0.15 0.00 0.00 42.46 38.17 1tkr s ILE 236 CO 0.03 0.30 -0.14 -1.61 -2.11 0.00 0.00 174.94 171.41 1tkr s GLU 237 N 0.16 1.35 0.06 3.50 2.02 -1.26 -0.99 118.70 123.53 1tkr s GLU 237 Ca 0.47 -0.50 -0.16 0.00 0.02 0.00 0.00 54.97 54.80 1tkr s GLU 237 Cb -0.23 -1.23 0.03 0.00 0.10 0.00 0.00 34.13 32.80 1tkr s GLU 237 CO 0.29 0.24 0.37 1.52 0.02 0.00 0.00 175.26 177.69 1tkr s TYR 238 N -0.06 -0.19 0.44 1.61 -0.85 -0.68 -4.99 117.35 112.63 1tkr s TYR 238 Ca -0.00 0.05 -0.19 0.00 -0.52 0.00 0.00 57.07 56.41 1tkr s TYR 238 Cb -0.09 0.18 -0.10 0.00 0.38 0.00 0.00 41.96 42.34 1tkr s TYR 238 CO 0.01 -0.58 0.93 -1.12 -1.52 0.00 0.00 175.55 173.27 1tkr s SER 239 N -2.23 6.82 -0.12 -0.18 0.01 -1.26 -0.81 113.70 115.93 1tkr s SER 239 Ca -0.03 1.59 -0.02 0.00 1.31 0.00 0.00 55.95 58.80 1tkr s SER 239 Cb 0.00 -2.50 0.04 0.00 0.21 0.00 0.00 66.02 63.77 1tkr s SER 239 CO -0.05 -0.41 0.02 0.12 0.41 0.00 0.00 173.24 173.33 1tkr s PHE 240 N -2.29 0.73 -0.08 2.43 5.36 0.14 -4.72 117.98 119.55 1tkr s PHE 240 Ca 0.60 -0.41 0.13 0.00 -0.96 0.00 0.00 56.93 56.29 1tkr s PHE 240 Cb -0.09 -0.86 -0.03 0.00 -0.34 0.00 0.00 43.02 41.69 1tkr s PHE 240 CO 0.19 -0.44 1.33 1.88 -1.46 0.00 0.00 175.22 176.73 1tkr h TYR 241 N 8.31 0.00 -0.69 10.12 -1.99 -1.95 0.08 116.97 130.85 1tkr h TYR 241 Ca -0.18 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.55 1tkr h TYR 241 Cb 1.13 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.86 1tkr h TYR 241 CO 0.38 0.65 0.00 0.45 -0.00 0.00 0.00 178.16 179.64 1tkr n SER 242 N -3.22 -2.07 -4.84 3.88 2.88 -1.26 -4.71 113.62 104.28 1tkr n SER 242 Ca 0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 1tkr n SER 242 Cb 0.80 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.28 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 5.96 0.44 -3.46 1.01 -1.26 -4.92 116.67 110.44 1tkr s ASP 243 Ca 0.00 1.57 0.24 0.00 0.71 0.00 0.00 52.55 55.08 1tkr s ASP 243 Cb 0.00 -2.49 1.26 0.00 1.01 0.00 0.00 42.92 42.69 1tkr s ASP 243 CO 0.00 -1.05 1.76 -0.33 0.21 0.00 0.00 175.17 175.76 1tkr h GLU 244 N -0.11 0.25 -0.52 8.23 5.08 -2.05 0.74 114.58 126.21 1tkr h GLU 244 Ca -0.45 -0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.05 1tkr h GLU 244 Cb 1.20 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1tkr h GLU 244 CO 0.59 0.17 0.42 0.66 -1.00 0.00 0.00 179.01 179.85 1tkr h SER 245 N 0.26 0.00 -2.95 1.42 4.64 -1.93 -3.39 113.55 111.59 1tkr h SER 245 Ca 0.62 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.37 1tkr h SER 245 Cb 1.85 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.90 1tkr h SER 245 CO -0.25 0.00 1.16 -0.22 -0.87 0.00 0.00 176.83 176.65 1tkr s LEU 246 N -8.30 3.62 0.19 5.97 0.20 0.25 -4.88 118.68 115.73 1tkr s LEU 246 Ca -0.05 1.17 -0.08 0.00 0.69 0.00 0.00 54.13 55.86 1tkr s LEU 246 Cb 0.19 -3.53 0.10 0.00 -0.43 0.00 0.00 46.19 42.52 1tkr s LEU 246 CO 0.68 -1.49 1.62 -0.61 -0.29 0.00 0.00 176.35 176.26 1tkr h GLN 247 N 11.49 0.97 -5.20 1.98 4.15 -1.88 -3.42 115.11 123.20 1tkr h GLN 247 Ca -0.31 -0.35 -0.67 0.00 0.77 0.00 0.00 58.65 58.10 1tkr h GLN 247 Cb 1.14 -0.07 -0.31 0.00 0.21 0.00 0.00 27.48 28.45 1tkr h GLN 247 CO 1.05 1.02 -0.81 0.71 -1.93 0.00 0.00 178.83 178.86 1tkr s TYR 248 N -4.83 2.76 0.73 3.99 2.02 -1.26 -5.10 117.35 115.66 1tkr s TYR 248 Ca -0.11 -1.07 -0.16 0.00 -0.37 0.00 0.00 57.07 55.36 1tkr s TYR 248 Cb 0.13 -1.88 -0.01 0.00 -0.40 0.00 0.00 41.96 39.81 1tkr s TYR 248 CO 0.85 -0.49 0.75 -2.30 -1.57 0.00 0.00 175.55 172.80 1tkr n PRO 249 N 4.04 0.36 -4.03 -1.71 -0.02 -1.26 -4.98 135.00 127.40 1tkr n PRO 249 Ca -0.19 0.17 -0.27 0.00 -2.02 0.00 0.00 63.50 61.19 1tkr n PRO 249 Cb 0.52 -2.03 -0.05 0.00 -0.02 0.00 0.00 33.50 31.91 1tkr n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1tkr s LYS 250 N -3.11 3.07 -0.28 -0.52 2.20 0.01 -4.92 119.74 116.19 1tkr s LYS 250 Ca 0.69 -0.75 -0.04 0.00 -0.36 0.00 0.00 55.97 55.51 1tkr s LYS 250 Cb -0.34 -2.76 0.02 0.00 -1.51 0.00 0.00 37.83 33.24 1tkr s LYS 250 CO 0.55 0.51 0.02 0.99 -0.36 0.00 0.00 175.35 177.06 1tkr s THR 251 N -1.67 3.45 -0.15 3.43 2.01 -1.26 0.25 115.64 121.69 1tkr s THR 251 Ca 0.32 -0.93 -0.23 0.00 0.31 0.00 0.00 61.69 61.16 1tkr s THR 251 Cb -0.11 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.57 1tkr s THR 251 CO 0.25 0.08 0.70 -0.69 -0.69 0.00 0.00 174.62 174.26 1tkr s VAL 252 N 1.40 4.99 -0.12 3.82 1.01 0.01 -4.92 120.40 126.60 1tkr s VAL 252 Ca 0.00 1.36 0.01 0.00 0.00 0.00 0.00 61.98 63.35 1tkr s VAL 252 Cb -0.17 -4.02 0.02 0.00 0.00 0.00 0.00 36.38 32.21 1tkr s VAL 252 CO -0.00 0.13 -0.12 0.00 0.00 0.00 0.00 175.10 175.11 1tkr s ARG 253 N 1.66 1.94 -0.03 2.72 3.03 -1.26 -1.69 118.95 125.32 1tkr s ARG 253 Ca 0.33 -0.43 0.05 0.00 2.03 0.00 0.00 55.73 57.71 1tkr s ARG 253 Cb -0.16 -1.80 -0.01 0.00 -1.03 0.00 0.00 34.95 31.95 1tkr s ARG 253 CO 0.13 -0.18 -0.18 0.08 -1.13 0.00 0.00 175.30 174.01 1tkr s VAL 254 N 1.38 1.47 -0.19 4.99 1.01 -0.16 -4.91 120.40 123.98 1tkr s VAL 254 Ca 0.01 -0.76 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 1tkr s VAL 254 Cb -0.13 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1tkr s VAL 254 CO -0.06 0.42 1.86 -2.84 0.00 0.00 0.00 175.10 174.47 1tkr s PRO 255 N -0.12 3.63 -0.21 2.72 0.02 -1.26 -0.38 135.00 139.40 1tkr s PRO 255 Ca -0.00 1.90 -0.04 0.00 0.02 0.00 0.00 61.00 62.87 1tkr s PRO 255 Cb -0.10 -4.16 0.08 0.00 0.02 0.00 0.00 34.50 30.34 1tkr s PRO 255 CO 0.01 -1.51 0.16 -0.47 -0.33 0.00 0.00 177.00 174.86 1tkr s TYR 256 N 6.07 -0.02 -0.25 6.54 6.14 -0.51 -4.43 117.35 130.89 1tkr s TYR 256 Ca 0.83 -0.16 -0.28 0.00 0.64 0.00 0.00 57.07 58.10 1tkr s TYR 256 Cb -0.30 -0.57 0.01 0.00 0.42 0.00 0.00 41.96 41.52 1tkr s TYR 256 CO 0.33 -0.61 1.00 -1.25 0.64 0.00 0.00 175.55 175.66 1tkr s PRO 257 N 2.22 4.21 0.74 4.97 0.04 -1.26 -4.60 135.00 141.32 1tkr s PRO 257 Ca 0.05 1.21 -0.05 0.00 0.04 0.00 0.00 61.00 62.26 1tkr s PRO 257 Cb -0.16 -3.66 0.11 0.00 0.04 0.00 0.00 34.50 30.83 1tkr s PRO 257 CO -0.15 -0.65 1.03 0.15 0.04 0.00 0.00 177.00 177.42 1tkr s LYS 258 N 3.19 1.74 -0.38 4.56 1.02 -1.26 -1.12 119.74 127.49 1tkr s LYS 258 Ca 0.42 -0.71 -0.43 0.00 0.02 0.00 0.00 55.97 55.28 1tkr s LYS 258 Cb -0.15 -2.22 -0.17 0.00 -0.52 0.00 0.00 37.83 34.77 1tkr s LYS 258 CO 0.08 -1.47 1.74 0.00 -0.92 0.00 0.00 175.35 174.78 1tkr n ALA 259 N -2.96 -0.55 -0.75 5.17 0.00 -0.52 -0.71 120.51 120.20 1tkr n ALA 259 Ca 0.12 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.96 1tkr n ALA 259 Cb 0.60 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.94 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 4.45 0.75 1.95 0.00 0.00 -1.26 -4.83 105.19 106.25 1tkr n GLY 260 Ca 0.31 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.17 1tkr n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkr n ALA 261 N 0.95 -1.56 -2.54 4.61 0.00 0.12 -4.96 120.51 117.12 1tkr n ALA 261 Ca 0.00 -0.90 -0.43 0.00 0.00 0.00 0.00 53.44 52.11 1tkr n ALA 261 Cb 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 19.45 19.37 1tkr n ALA 261 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1tkr s VAL 262 N -2.22 4.45 0.33 0.00 1.01 -1.26 -4.91 120.40 117.80 1tkr s VAL 262 Ca 0.39 1.73 -0.11 0.00 0.00 0.00 0.00 61.98 64.00 1tkr s VAL 262 Cb -0.03 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 32.08 1tkr s VAL 262 CO 0.29 -0.24 0.69 0.20 0.00 0.00 0.00 175.10 176.04 1tkr s ASN 263 N 1.72 6.60 0.92 3.32 0.01 -1.26 -4.39 114.94 121.86 1tkr s ASN 263 Ca 0.49 1.08 -0.11 0.00 -0.71 0.00 0.00 52.86 53.61 1tkr s ASN 263 Cb -0.17 -2.29 0.14 0.00 0.41 0.00 0.00 41.25 39.34 1tkr s ASN 263 CO 0.12 -0.25 1.10 -2.16 -1.51 0.00 0.00 177.10 174.40 1tkr s PRO 264 N -3.36 1.06 0.33 -0.60 0.04 -1.26 -4.83 135.00 126.38 1tkr s PRO 264 Ca 0.50 1.14 0.08 0.00 0.04 0.00 0.00 61.00 62.76 1tkr s PRO 264 Cb -0.10 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1tkr s PRO 264 CO 0.25 -2.47 0.20 0.95 0.04 0.00 0.00 177.00 175.97 1tkr s THR 265 N -2.76 3.26 0.03 1.26 -4.23 -0.90 -4.95 115.64 107.35 1tkr s THR 265 Ca 0.65 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 59.60 1tkr s THR 265 Cb -0.20 -3.07 -0.02 0.00 1.34 0.00 0.00 72.50 70.55 1tkr s THR 265 CO 0.58 -0.19 -0.04 0.54 -0.54 0.00 0.00 174.62 174.98 1tkr s VAL 266 N -2.37 0.20 0.04 2.29 0.11 -1.26 -2.16 120.40 117.26 1tkr s VAL 266 Ca 0.39 -1.03 0.01 0.00 -2.93 0.00 0.00 61.98 58.42 1tkr s VAL 266 Cb -0.04 -0.45 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 1tkr s VAL 266 CO 0.24 -0.53 -0.05 -0.54 -3.33 0.00 0.00 175.10 170.89 1tkr s LYS 267 N -1.72 0.49 -0.06 1.54 1.02 -0.57 -4.97 119.74 115.47 1tkr s LYS 267 Ca -0.13 -0.82 0.05 0.00 0.02 0.00 0.00 55.97 55.09 1tkr s LYS 267 Cb -0.08 -0.08 -0.00 0.00 -0.52 0.00 0.00 37.83 37.15 1tkr s LYS 267 CO -0.02 -0.01 -0.20 0.12 -0.92 0.00 0.00 175.35 174.32 1tkr s PHE 268 N -1.95 2.00 0.09 3.18 5.36 -1.26 -0.50 117.98 124.90 1tkr s PHE 268 Ca -0.08 -0.62 0.04 0.00 -0.96 0.00 0.00 56.93 55.31 1tkr s PHE 268 Cb -0.06 -1.34 -0.03 0.00 -0.34 0.00 0.00 43.02 41.25 1tkr s PHE 268 CO -0.02 -0.22 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.35 1tkr s PHE 269 N 0.06 1.10 -0.13 10.12 0.40 0.47 -1.16 117.98 128.83 1tkr s PHE 269 Ca -0.06 -0.56 -0.04 0.00 -0.60 0.00 0.00 56.93 55.67 1tkr s PHE 269 Cb -0.13 -0.61 0.05 0.00 0.51 0.00 0.00 43.02 42.84 1tkr s PHE 269 CO 0.03 0.02 0.06 0.08 0.70 0.00 0.00 175.22 176.12 1tkr s VAL 270 N -1.92 0.06 0.07 -0.44 1.01 0.10 -0.05 120.40 119.23 1tkr s VAL 270 Ca 0.02 -0.07 0.06 0.00 0.00 0.00 0.00 61.98 61.99 1tkr s VAL 270 Cb -0.06 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 1tkr s VAL 270 CO 0.01 -0.11 -0.09 0.54 0.00 0.00 0.00 175.10 175.46 1tkr s VAL 271 N 2.08 3.47 -0.42 2.92 0.11 -0.36 -1.74 120.40 126.47 1tkr s VAL 271 Ca 0.02 -1.08 -0.19 0.00 -2.93 0.00 0.00 61.98 57.81 1tkr s VAL 271 Cb -0.15 -2.58 0.02 0.00 -1.53 0.00 0.00 36.38 32.14 1tkr s VAL 271 CO -0.07 0.22 0.57 0.21 -3.33 0.00 0.00 175.10 172.70 1tkr s ASN 272 N -1.90 6.29 0.55 3.54 3.04 -1.26 -0.46 114.94 124.74 1tkr s ASN 272 Ca 0.20 -0.36 0.33 0.00 0.04 0.00 0.00 52.86 53.07 1tkr s ASN 272 Cb -0.11 -2.29 1.35 0.00 -1.54 0.00 0.00 41.25 38.66 1tkr s ASN 272 CO 0.11 -0.67 1.98 0.71 -3.04 0.00 0.00 177.10 176.19 1tkr h THR 273 N 5.79 0.01 0.00 -5.21 1.35 -1.09 -2.79 112.91 110.97 1tkr h THR 273 Ca -0.26 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 1tkr h THR 273 Cb 1.11 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 1tkr h THR 273 CO 0.84 0.00 0.00 0.44 -0.25 0.00 0.00 175.52 176.56 1tkr h ASP 274 N 0.00 0.00 0.66 5.36 3.32 -1.89 -2.80 116.42 121.08 1tkr h ASP 274 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1tkr h ASP 274 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1tkr h ASP 274 CO 0.00 0.00 -0.31 -1.54 -1.72 0.00 0.00 179.24 175.67 1tkr n SER 275 N -2.89 0.34 -0.29 6.45 3.41 -1.05 -4.15 113.62 115.43 1tkr n SER 275 Ca 0.01 -0.01 0.04 0.00 -0.26 0.00 0.00 58.87 58.65 1tkr n SER 275 Cb 0.31 -0.02 0.18 0.00 -0.26 0.00 0.00 64.21 64.42 1tkr n SER 275 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1tkr h LEU 276 N 0.04 0.65 -2.60 1.04 3.38 -1.62 -1.45 115.31 114.74 1tkr h LEU 276 Ca 0.00 0.06 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 1tkr h LEU 276 Cb 0.50 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 1tkr h LEU 276 CO 0.00 0.35 0.19 -1.54 0.09 0.00 0.00 178.44 177.53 1tkr n SER 277 N -4.77 3.42 0.00 -0.43 3.41 -1.26 -3.78 113.62 110.21 1tkr n SER 277 Ca 0.15 -2.47 0.00 0.00 -0.26 0.00 0.00 58.87 56.29 1tkr n SER 277 Cb 0.32 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 1tkr n SER 277 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1tkr n SER 278 N 0.11 0.00 -0.01 4.04 7.64 -0.57 -5.00 113.62 119.83 1tkr n SER 278 Ca 0.16 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 60.03 1tkr n SER 278 Cb 0.80 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.99 1tkr n SER 278 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1tkr n VAL 279 N -0.01 0.11 0.00 0.44 0.24 -1.06 -5.04 118.33 113.01 1tkr n VAL 279 Ca 0.00 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 1tkr n VAL 279 Cb 0.00 -0.87 0.00 0.00 -1.47 0.00 0.00 33.84 31.50 1tkr n VAL 279 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1tkr n THR 280 N -2.73 0.00 -3.09 3.34 5.66 -1.25 -4.92 114.28 111.29 1tkr n THR 280 Ca -0.04 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.84 1tkr n THR 280 Cb 0.53 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.28 1tkr n THR 280 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1tkr s ASN 281 N -0.13 -0.17 0.43 1.09 2.47 -1.26 -4.96 114.94 112.41 1tkr s ASN 281 Ca 0.00 -2.01 -0.26 0.00 0.42 0.00 0.00 52.86 51.01 1tkr s ASN 281 Cb 0.00 0.99 -0.09 0.00 -1.45 0.00 0.00 41.25 40.70 1tkr s ASN 281 CO 0.00 -0.13 1.40 0.00 -3.72 0.00 0.00 177.10 174.65 1tkr n ALA 282 N 3.28 1.91 -2.70 1.71 0.00 -1.26 -4.95 120.51 118.50 1tkr n ALA 282 Ca 0.20 0.26 -0.38 0.00 0.00 0.00 0.00 53.44 53.52 1tkr n ALA 282 Cb 0.52 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.54 1tkr n ALA 282 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1tkr s THR 283 N -1.18 5.18 -0.29 0.00 -4.23 -1.26 -5.03 115.64 108.83 1tkr s THR 283 Ca 0.60 0.89 -0.25 0.00 -1.18 0.00 0.00 61.69 61.75 1tkr s THR 283 Cb -0.47 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.59 1tkr s THR 283 CO 0.58 0.36 0.88 -0.44 -0.54 0.00 0.00 174.62 175.46 1tkr s SER 284 N 0.43 6.79 0.17 3.99 0.01 -1.26 -4.61 113.70 119.23 1tkr s SER 284 Ca 0.25 0.88 -0.30 0.00 1.31 0.00 0.00 55.95 58.09 1tkr s SER 284 Cb -0.15 -2.45 -0.07 0.00 0.21 0.00 0.00 66.02 63.56 1tkr s SER 284 CO 0.10 -0.65 0.97 -0.63 0.41 0.00 0.00 173.24 173.43 1tkr s ILE 285 N 3.09 4.25 -0.02 1.44 -1.09 -0.71 -4.79 121.20 123.37 1tkr s ILE 285 Ca 0.36 2.04 -0.07 0.00 -2.23 0.00 0.00 60.65 60.75 1tkr s ILE 285 Cb -0.14 -4.30 -0.05 0.00 -1.58 0.00 0.00 42.46 36.40 1tkr s ILE 285 CO 0.11 0.39 0.24 -1.58 -1.23 0.00 0.00 174.94 172.88 1tkr s GLN 286 N -0.56 3.56 -0.29 2.79 0.74 -1.26 0.02 119.66 124.67 1tkr s GLN 286 Ca 0.45 -0.07 0.01 0.00 0.05 0.00 0.00 55.36 55.80 1tkr s GLN 286 Cb -0.25 -3.11 0.06 0.00 1.10 0.00 0.00 33.01 30.81 1tkr s GLN 286 CO 0.31 0.68 -0.05 0.42 -0.55 0.00 0.00 175.29 176.11 1tkr s ILE 287 N -1.23 2.47 0.00 -2.34 1.01 -0.31 -4.88 121.20 115.92 1tkr s ILE 287 Ca 0.25 -1.66 0.00 0.00 0.00 0.00 0.00 60.65 59.24 1tkr s ILE 287 Cb -0.13 -2.50 0.00 0.00 0.01 0.00 0.00 42.46 39.84 1tkr s ILE 287 CO 0.14 -0.14 0.00 0.35 0.00 0.00 0.00 174.94 175.28 1tkr n THR 288 N 4.47 0.00 -0.52 2.92 -2.24 -1.26 -4.20 114.28 113.45 1tkr n THR 288 Ca -0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1tkr n THR 288 Cb 0.42 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 1tkr n THR 288 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tkr n ALA 289 N -3.00 0.00 -1.29 6.98 0.00 -1.26 -5.01 120.51 116.93 1tkr n ALA 289 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1tkr n ALA 289 Cb 0.00 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.57 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 1.62 0.23 0.00 0.02 -1.26 -4.78 135.00 130.83 1tkr s PRO 290 Ca 0.00 0.84 -0.08 0.00 0.02 0.00 0.00 61.00 61.79 1tkr s PRO 290 Cb 0.00 -1.85 0.21 0.00 0.02 0.00 0.00 34.50 32.88 1tkr s PRO 290 CO 0.00 -2.00 1.89 0.00 -0.33 0.00 0.00 177.00 176.56 1tkr h ALA 291 N -1.37 1.13 0.00 -1.55 0.00 -1.97 0.21 119.26 115.70 1tkr h ALA 291 Ca -0.48 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1tkr h ALA 291 Cb 1.27 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1tkr h ALA 291 CO 0.55 0.58 0.00 -1.13 0.00 0.00 0.00 179.25 179.25 1tkr n SER 292 N -4.42 0.00 -0.07 0.00 3.41 -1.26 -1.49 113.62 109.79 1tkr n SER 292 Ca 0.10 0.28 -0.14 0.00 -0.26 0.00 0.00 58.87 58.84 1tkr n SER 292 Cb 0.04 -0.35 -0.05 0.00 -0.26 0.00 0.00 64.21 63.59 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 -1.35 0.30 0.27 4.33 0.00 -0.43 -4.53 117.12 115.72 1tkr n MET 293 Ca 0.03 0.12 0.18 0.00 0.00 0.00 0.00 57.70 58.04 1tkr n MET 293 Cb 0.06 -1.04 0.97 0.00 0.00 0.00 0.00 33.22 33.22 1tkr n MET 293 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 1tkr h LEU 294 N -0.42 0.00 -2.19 -0.89 3.38 -0.34 -1.74 115.31 113.11 1tkr h LEU 294 Ca -0.35 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 1tkr h LEU 294 Cb 1.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 1tkr h LEU 294 CO -0.19 0.00 -0.06 -0.29 0.09 0.00 0.00 178.44 177.99 1tkr h ILE 295 N 0.00 0.58 -2.10 1.22 6.09 -1.50 -3.46 117.51 118.35 1tkr h ILE 295 Ca 0.00 -0.25 -0.00 0.00 -1.37 0.00 0.00 64.86 63.23 1tkr h ILE 295 Cb 0.03 1.16 0.00 0.00 0.47 0.00 0.00 36.82 38.48 1tkr h ILE 295 CO 0.00 0.06 0.02 0.61 -3.07 0.00 0.00 178.15 175.77 1tkr n GLY 296 N -1.05 2.03 3.69 8.18 0.00 -0.65 -5.13 105.19 112.25 1tkr n GLY 296 Ca -0.02 -1.07 -0.44 0.00 0.00 0.00 0.00 46.02 44.48 1tkr n GLY 296 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tkr n ASP 297 N -1.16 3.70 -3.55 1.61 9.92 -1.26 -4.91 116.55 120.90 1tkr n ASP 297 Ca -0.01 1.02 -0.15 0.00 -0.53 0.00 0.00 54.79 55.11 1tkr n ASP 297 Cb 0.05 -1.49 -0.07 0.00 -0.64 0.00 0.00 41.12 38.97 1tkr n ASP 297 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 1tkr s HIS 298 N 2.36 1.30 0.19 1.24 -3.43 -1.26 0.24 115.29 115.93 1tkr s HIS 298 Ca 0.82 -1.41 0.03 0.00 -0.80 0.00 0.00 55.06 53.70 1tkr s HIS 298 Cb -0.57 -0.41 -0.05 0.00 -1.43 0.00 0.00 32.58 30.12 1tkr s HIS 298 CO 0.39 -0.92 -0.01 0.71 -2.00 0.00 0.00 174.74 172.92 1tkr s TYR 299 N -3.52 1.35 -0.29 0.38 2.02 0.46 -4.83 117.35 112.92 1tkr s TYR 299 Ca 0.36 -0.95 -0.06 0.00 -0.37 0.00 0.00 57.07 56.05 1tkr s TYR 299 Cb 0.02 -0.77 0.01 0.00 -0.40 0.00 0.00 41.96 40.83 1tkr s TYR 299 CO 0.20 -0.11 0.06 -1.17 -1.57 0.00 0.00 175.55 172.96 1tkr s LEU 300 N -3.22 3.76 -0.02 -1.29 2.96 -1.26 -1.15 118.68 118.45 1tkr s LEU 300 Ca 0.25 -0.75 0.15 0.00 -0.22 0.00 0.00 54.13 53.56 1tkr s LEU 300 Cb 0.05 -1.85 -0.22 0.00 0.50 0.00 0.00 46.19 44.68 1tkr s LEU 300 CO 0.05 -0.18 0.35 0.00 -1.32 0.00 0.00 176.35 175.25 1tkr s ASP 302 N -3.56 -0.56 -0.18 0.00 -1.08 -1.17 -4.82 116.67 105.31 1tkr s ASP 302 Ca -0.04 0.93 -0.05 0.00 -0.52 0.00 0.00 52.55 52.88 1tkr s ASP 302 Cb 0.10 0.94 0.09 0.00 -1.46 0.00 0.00 42.92 42.59 1tkr s ASP 302 CO 0.61 -0.31 0.32 0.54 0.52 0.00 0.00 175.17 176.85 1tkr s VAL 303 N -0.19 -0.49 -0.02 1.11 0.11 -1.26 -0.26 120.40 119.39 1tkr s VAL 303 Ca -0.04 0.10 -0.01 0.00 -2.93 0.00 0.00 61.98 59.10 1tkr s VAL 303 Cb -0.03 -0.62 0.02 0.00 -1.53 0.00 0.00 36.38 34.22 1tkr s VAL 303 CO 0.03 -0.01 0.05 0.42 -3.33 0.00 0.00 175.10 172.27 1tkr s THR 304 N 2.48 -0.03 0.41 5.04 -4.23 -0.94 -5.01 115.64 113.35 1tkr s THR 304 Ca 0.04 0.12 -0.24 0.00 -1.18 0.00 0.00 61.69 60.43 1tkr s THR 304 Cb -0.13 -0.10 -0.09 0.00 1.34 0.00 0.00 72.50 73.52 1tkr s THR 304 CO -0.12 0.05 1.06 0.26 -0.54 0.00 0.00 174.62 175.33 1tkr s TRP 305 N 0.63 3.20 -0.17 3.99 0.52 -1.26 -1.08 118.94 124.76 1tkr s TRP 305 Ca -0.05 1.62 -0.02 0.00 0.02 0.00 0.00 56.10 57.67 1tkr s TRP 305 Cb -0.07 -3.16 -0.10 0.00 -1.15 0.00 0.00 33.47 28.99 1tkr s TRP 305 CO -0.02 -0.76 -0.18 0.00 0.02 0.00 0.00 176.95 176.01 1tkr n ALA 306 N -0.18 1.70 -3.84 0.98 0.00 0.15 -4.87 120.51 114.44 1tkr n ALA 306 Ca 0.06 -0.73 -0.12 0.00 0.00 0.00 0.00 53.44 52.65 1tkr n ALA 306 Cb 0.50 0.16 -0.03 0.00 0.00 0.00 0.00 19.45 20.08 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 -3.29 0.00 0.23 0.00 -2.24 -0.87 -4.46 114.28 103.65 1tkr n THR 307 Ca -0.32 -1.48 0.18 0.00 -2.27 0.00 0.00 64.05 60.16 1tkr n THR 307 Cb 0.80 0.88 0.86 0.00 -2.10 0.00 0.00 70.33 70.77 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 -1.98 -2.74 115.11 110.69 1tkr h GLN 308 Ca -0.21 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 56.93 1tkr h GLN 308 Cb 0.94 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 28.24 1tkr h GLN 308 CO 0.29 0.00 -0.61 0.39 -0.95 0.00 0.00 178.83 177.95 1tkr n GLU 309 N -3.50 0.33 -3.83 1.46 1.02 -1.26 -4.91 120.64 109.96 1tkr n GLU 309 Ca 0.01 -1.77 -0.23 0.00 -0.02 0.00 0.00 57.16 55.16 1tkr n GLU 309 Cb 0.35 -0.58 -0.17 0.00 -0.02 0.00 0.00 31.44 31.02 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 -0.71 0.67 -0.03 3.49 3.52 -1.03 -1.01 118.95 123.83 1tkr s ARG 310 Ca 0.19 0.07 0.06 0.00 -0.13 0.00 0.00 55.73 55.92 1tkr s ARG 310 Cb 0.20 -0.97 -0.01 0.00 -1.56 0.00 0.00 34.95 32.61 1tkr s ARG 310 CO -0.06 -0.27 -0.21 -1.50 -0.81 0.00 0.00 175.30 172.45 1tkr s ILE 311 N 1.81 1.67 -0.01 4.11 2.07 -0.34 0.31 121.20 130.82 1tkr s ILE 311 Ca 0.03 -0.88 -0.01 0.00 -1.41 0.00 0.00 60.65 58.38 1tkr s ILE 311 Cb -0.13 -1.41 -0.04 0.00 0.13 0.00 0.00 42.46 41.02 1tkr s ILE 311 CO -0.05 0.47 0.09 -0.94 -1.91 0.00 0.00 174.94 172.60 1tkr s SER 312 N -0.24 5.72 -0.01 4.50 1.04 -0.24 -1.10 113.70 123.36 1tkr s SER 312 Ca 0.02 0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.61 1tkr s SER 312 Cb -0.10 -1.65 0.01 0.00 0.10 0.00 0.00 66.02 64.37 1tkr s SER 312 CO 0.01 0.27 -0.02 -0.76 0.98 0.00 0.00 173.24 173.72 1tkr s LEU 313 N -1.74 1.67 -0.09 2.42 1.02 0.19 -2.23 118.68 119.92 1tkr s LEU 313 Ca 0.23 -0.05 0.02 0.00 0.02 0.00 0.00 54.13 54.36 1tkr s LEU 313 Cb -0.12 -0.19 -0.02 0.00 0.02 0.00 0.00 46.19 45.88 1tkr s LEU 313 CO 0.14 -0.02 -0.17 -1.10 0.02 0.00 0.00 176.35 175.23 1tkr s GLN 314 N 0.37 2.94 0.31 1.70 -0.21 0.65 0.30 119.66 125.72 1tkr s GLN 314 Ca -0.04 -0.74 0.10 0.00 0.02 0.00 0.00 55.36 54.70 1tkr s GLN 314 Cb -0.06 -2.44 -0.05 0.00 1.00 0.00 0.00 33.01 31.45 1tkr s GLN 314 CO -0.01 0.36 -0.11 -1.58 -2.12 0.00 0.00 175.29 171.84 1tkr s TRP 315 N -0.07 2.41 -0.15 0.91 0.52 0.48 -1.14 118.94 121.91 1tkr s TRP 315 Ca -0.04 -0.39 -0.10 0.00 0.02 0.00 0.00 56.10 55.60 1tkr s TRP 315 Cb -0.14 -1.22 0.05 0.00 -1.15 0.00 0.00 33.47 31.01 1tkr s TRP 315 CO 0.04 0.63 0.36 -1.17 0.02 0.00 0.00 176.95 176.83 1tkr s LEU 316 N -3.59 0.23 0.76 2.99 2.96 -0.30 -1.64 118.68 120.08 1tkr s LEU 316 Ca 0.32 0.77 -0.11 0.00 -0.22 0.00 0.00 54.13 54.89 1tkr s LEU 316 Cb -0.02 1.19 0.05 0.00 0.50 0.00 0.00 46.19 47.91 1tkr s LEU 316 CO 0.17 -0.17 1.08 -0.13 -1.32 0.00 0.00 176.35 175.98 1tkr s ARG 317 N 0.99 2.41 0.59 1.98 0.52 -1.22 0.17 118.95 124.39 1tkr s ARG 317 Ca -0.06 1.02 0.32 0.00 -0.52 0.00 0.00 55.73 56.49 1tkr s ARG 317 Cb -0.07 -1.92 1.84 0.00 0.52 0.00 0.00 34.95 35.32 1tkr s ARG 317 CO -0.08 -1.49 2.23 -0.09 0.02 0.00 0.00 175.30 175.89 1tkr h ARG 318 N -1.01 0.00 -4.66 3.54 2.43 -0.53 -2.97 114.38 111.17 1tkr h ARG 318 Ca -0.44 0.00 -0.73 0.00 -0.81 0.00 0.00 59.98 58.00 1tkr h ARG 318 Cb 1.23 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.59 1tkr h ARG 318 CO 0.54 0.03 1.01 0.42 -1.51 0.00 0.00 179.97 180.46 1tkr s ILE 319 N -4.42 5.07 0.00 1.20 -1.09 -1.26 -4.82 121.20 115.88 1tkr s ILE 319 Ca -0.04 -2.36 0.00 0.00 -2.23 0.00 0.00 60.65 56.02 1tkr s ILE 319 Cb 0.14 -4.81 0.00 0.00 -1.58 0.00 0.00 42.46 36.21 1tkr s ILE 319 CO 0.53 -1.50 0.00 0.00 -1.23 0.00 0.00 174.94 172.74 1tkr n GLN 320 N 5.54 0.00 0.00 2.79 6.02 -1.12 -3.19 117.38 127.42 1tkr n GLN 320 Ca 0.30 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.36 1tkr n GLN 320 Cb 0.45 -1.33 -0.06 0.00 1.02 0.00 0.00 30.24 30.32 1tkr n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1tkr n ASN 321 N 1.71 0.94 -4.12 1.08 6.94 -1.26 -2.60 115.26 117.95 1tkr n ASN 321 Ca 0.00 -0.97 -0.22 0.00 -0.02 0.00 0.00 54.58 53.37 1tkr n ASN 321 Cb 0.00 0.86 -0.15 0.00 -2.36 0.00 0.00 39.78 38.14 1tkr n ASN 321 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 1tkr s TYR 322 N -2.29 1.25 -0.12 -2.53 5.04 -1.19 -0.92 117.35 116.59 1tkr s TYR 322 Ca 0.08 -0.27 -0.09 0.00 -2.44 0.00 0.00 57.07 54.35 1tkr s TYR 322 Cb 0.12 -0.79 0.04 0.00 0.35 0.00 0.00 41.96 41.68 1tkr s TYR 322 CO 0.56 -0.00 0.29 0.45 -1.34 0.00 0.00 175.55 175.51 1tkr s SER 323 N -0.55 -0.32 -0.10 4.32 0.15 -0.63 -3.38 113.70 113.18 1tkr s SER 323 Ca 0.04 0.61 0.03 0.00 0.70 0.00 0.00 55.95 57.33 1tkr s SER 323 Cb -0.06 0.56 0.01 0.00 -1.71 0.00 0.00 66.02 64.82 1tkr s SER 323 CO -0.00 -0.13 -0.19 -0.69 1.20 0.00 0.00 173.24 173.43 1tkr s VAL 324 N 0.66 1.70 -0.24 4.45 1.01 -0.65 -1.16 120.40 126.17 1tkr s VAL 324 Ca -0.04 -0.79 -0.07 0.00 0.00 0.00 0.00 61.98 61.08 1tkr s VAL 324 Cb -0.05 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1tkr s VAL 324 CO -0.04 0.48 0.06 -0.32 0.00 0.00 0.00 175.10 175.28 1tkr s MET 325 N 0.68 3.65 -0.10 2.72 -2.45 -0.05 -0.38 119.30 123.35 1tkr s MET 325 Ca -0.12 -0.48 -0.04 0.00 -1.25 0.00 0.00 55.69 53.80 1tkr s MET 325 Cb -0.16 -3.28 -0.04 0.00 1.25 0.00 0.00 34.83 32.60 1tkr s MET 325 CO 0.03 -0.15 0.04 -0.51 1.05 0.00 0.00 175.02 175.47 1tkr s ASP 326 N 1.51 5.52 -0.31 1.11 1.01 0.15 -1.35 116.67 124.30 1tkr s ASP 326 Ca 0.06 0.21 0.01 0.00 0.71 0.00 0.00 52.55 53.53 1tkr s ASP 326 Cb -0.15 -1.66 0.07 0.00 1.01 0.00 0.00 42.92 42.19 1tkr s ASP 326 CO 0.03 0.36 0.01 -0.63 0.21 0.00 0.00 175.17 175.15 1tkr s ILE 327 N -0.78 2.63 -0.09 0.77 1.01 -1.24 -0.64 121.20 122.87 1tkr s ILE 327 Ca 0.12 -1.78 -0.02 0.00 0.00 0.00 0.00 60.65 58.97 1tkr s ILE 327 Cb -0.12 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 1tkr s ILE 327 CO 0.03 -0.29 0.02 0.00 0.00 0.00 0.00 174.94 174.70 1tkr s ASP 329 N -0.93 4.39 -0.20 0.00 1.11 0.90 -1.20 116.67 120.74 1tkr s ASP 329 Ca 0.14 -0.55 -0.25 0.00 0.18 0.00 0.00 52.55 52.07 1tkr s ASP 329 Cb -0.11 -0.80 -0.01 0.00 1.07 0.00 0.00 42.92 43.07 1tkr s ASP 329 CO 0.03 0.09 0.81 -0.47 1.18 0.00 0.00 175.17 176.81 1tkr s TYR 330 N -1.79 3.37 -0.83 4.23 5.04 -0.18 -0.79 117.35 126.40 1tkr s TYR 330 Ca 0.26 1.17 -0.20 0.00 -2.44 0.00 0.00 57.07 55.86 1tkr s TYR 330 Cb -0.09 -3.01 0.11 0.00 0.35 0.00 0.00 41.96 39.32 1tkr s TYR 330 CO 0.16 -0.31 1.06 0.34 -1.34 0.00 0.00 175.55 175.47 1tkr s ASP 331 N 1.24 6.45 0.61 4.32 -1.08 -0.05 -4.88 116.67 123.29 1tkr s ASP 331 Ca 0.36 -1.66 0.28 0.00 -0.52 0.00 0.00 52.55 51.01 1tkr s ASP 331 Cb -0.16 -2.40 1.43 0.00 -1.46 0.00 0.00 42.92 40.33 1tkr s ASP 331 CO 0.10 -1.20 1.83 -0.08 0.52 0.00 0.00 175.17 176.35 1tkr h GLU 332 N 9.11 0.00 0.09 4.34 4.81 -1.94 1.01 114.58 132.00 1tkr h GLU 332 Ca -0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1tkr h GLU 332 Cb 1.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1tkr h GLU 332 CO 1.14 0.00 -0.04 1.03 -0.73 0.00 0.00 179.01 180.40 1tkr h SER 333 N 0.00 -0.10 1.15 1.04 0.87 -1.94 -3.36 113.55 111.21 1tkr h SER 333 Ca 0.18 -0.45 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1tkr h SER 333 Cb 1.21 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 1tkr h SER 333 CO -0.00 0.55 -0.47 -1.28 -0.53 0.00 0.00 176.83 175.10 1tkr h SER 334 N -0.92 0.00 -0.34 6.23 0.87 -1.73 -3.47 113.55 114.19 1tkr h SER 334 Ca -0.01 -0.11 -0.15 0.00 -1.23 0.00 0.00 61.79 60.29 1tkr h SER 334 Cb 0.54 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.44 1tkr h SER 334 CO 0.02 0.05 -0.13 0.61 -0.53 0.00 0.00 176.83 176.85 1tkr n GLY 335 N 1.28 0.84 3.72 5.77 0.00 0.34 -4.98 105.19 112.17 1tkr n GLY 335 Ca 0.03 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.27 2.59 -0.22 1.61 1.81 -1.22 -4.91 118.95 116.34 1tkr s ARG 336 Ca 0.00 -1.17 -0.10 0.00 -1.72 0.00 0.00 55.73 52.74 1tkr s ARG 336 Cb 0.00 -2.39 -0.05 0.00 -0.45 0.00 0.00 34.95 32.06 1tkr s ARG 336 CO 0.00 0.41 0.13 -1.58 -0.68 0.00 0.00 175.30 173.58 1tkr s TRP 337 N -2.07 3.32 0.02 -0.53 0.52 -1.26 -0.87 118.94 118.07 1tkr s TRP 337 Ca 0.31 0.20 0.03 0.00 0.02 0.00 0.00 56.10 56.66 1tkr s TRP 337 Cb -0.08 -2.20 -0.04 0.00 -1.15 0.00 0.00 33.47 30.01 1tkr s TRP 337 CO 0.22 0.13 -0.04 -0.80 0.02 0.00 0.00 176.95 176.48 1tkr s ASN 338 N 0.74 4.83 -0.34 2.95 0.02 0.03 -4.90 114.94 118.26 1tkr s ASN 338 Ca 0.07 -0.13 0.02 0.00 -1.02 0.00 0.00 52.86 51.80 1tkr s ASN 338 Cb -0.13 -1.16 0.10 0.00 0.02 0.00 0.00 41.25 40.09 1tkr s ASN 338 CO 0.02 0.26 0.10 0.00 0.02 0.00 0.00 177.10 177.49 1tkr s LEU 340 N 1.09 4.39 0.57 0.00 1.43 -1.26 -4.88 118.68 120.03 1tkr s LEU 340 Ca 0.11 2.65 0.33 0.00 -1.03 0.00 0.00 54.13 56.20 1tkr s LEU 340 Cb -0.19 -3.63 1.69 0.00 0.03 0.00 0.00 46.19 44.10 1tkr s LEU 340 CO -0.14 -0.66 2.14 1.62 0.23 0.00 0.00 176.35 179.53 1tkr h VAL 341 N 3.48 0.30 0.00 -1.59 3.04 -1.96 -0.29 116.25 119.23 1tkr h VAL 341 Ca -0.46 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 64.85 1tkr h VAL 341 Cb 1.22 1.28 0.00 0.00 -2.01 0.00 0.00 31.29 31.78 1tkr h VAL 341 CO 0.76 0.06 0.00 0.00 -1.01 0.00 0.00 177.57 177.38 1tkr n ALA 342 N -2.19 1.92 -0.67 3.17 0.00 -1.26 -2.26 120.51 119.22 1tkr n ALA 342 Ca -0.02 -0.08 0.06 0.00 0.00 0.00 0.00 53.44 53.41 1tkr n ALA 342 Cb 0.21 -1.30 0.10 0.00 0.00 0.00 0.00 19.45 18.46 1tkr n ALA 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1tkr n ARG 343 N -1.38 2.04 -3.39 0.00 1.74 -0.12 -4.21 116.66 111.34 1tkr n ARG 343 Ca 0.07 -2.22 -0.38 0.00 -0.77 0.00 0.00 57.85 54.55 1tkr n ARG 343 Cb 0.18 -1.35 -0.08 0.00 -1.02 0.00 0.00 32.46 30.19 1tkr n ARG 343 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1tkr s GLN 344 N -2.17 4.12 -0.18 5.56 0.74 -0.96 -3.65 119.66 123.12 1tkr s GLN 344 Ca 0.22 0.15 -0.02 0.00 0.05 0.00 0.00 55.36 55.75 1tkr s GLN 344 Cb 0.18 -3.58 -0.01 0.00 1.10 0.00 0.00 33.01 30.71 1tkr s GLN 344 CO 0.03 -0.12 -0.08 -1.01 -0.55 0.00 0.00 175.29 173.55 1tkr s HIS 345 N 1.58 2.90 0.21 1.67 3.76 -0.46 -4.94 115.29 120.02 1tkr s HIS 345 Ca 0.18 -0.84 -0.03 0.00 -0.15 0.00 0.00 55.06 54.22 1tkr s HIS 345 Cb -0.15 -1.99 -0.05 0.00 1.11 0.00 0.00 32.58 31.50 1tkr s HIS 345 CO 0.08 -0.41 0.42 0.42 -0.85 0.00 0.00 174.74 174.41 1tkr s ILE 346 N 0.99 5.15 -0.27 0.60 1.09 -1.26 -0.87 121.20 126.63 1tkr s ILE 346 Ca -0.01 -0.16 0.00 0.00 -1.10 0.00 0.00 60.65 59.38 1tkr s ILE 346 Cb -0.15 -3.70 0.15 0.00 -1.06 0.00 0.00 42.46 37.70 1tkr s ILE 346 CO -0.01 -0.15 0.39 -0.70 -0.10 0.00 0.00 174.94 174.37 1tkr s GLU 347 N -3.20 0.38 0.28 2.79 2.12 -0.31 -4.99 118.70 115.77 1tkr s GLU 347 Ca 0.40 0.25 0.10 0.00 0.36 0.00 0.00 54.97 56.08 1tkr s GLU 347 Cb -0.11 -0.40 -0.05 0.00 0.26 0.00 0.00 34.13 33.84 1tkr s GLU 347 CO 0.28 -0.90 -0.07 0.00 -0.54 0.00 0.00 175.26 174.03 1tkr s MET 348 N 2.53 2.06 -0.01 4.30 0.23 -1.26 -1.61 119.30 125.54 1tkr s MET 348 Ca 0.11 -1.58 0.04 0.00 -1.03 0.00 0.00 55.69 53.23 1tkr s MET 348 Cb -0.14 -2.00 -0.01 0.00 -1.53 0.00 0.00 34.83 31.15 1tkr s MET 348 CO -0.26 0.32 -0.14 0.45 -2.03 0.00 0.00 175.02 173.37 1tkr s SER 349 N -3.63 1.63 -0.21 -1.18 0.15 -0.10 -4.99 113.70 105.37 1tkr s SER 349 Ca 0.31 -0.25 0.07 0.00 0.70 0.00 0.00 55.95 56.78 1tkr s SER 349 Cb -0.05 -0.21 -0.21 0.00 -1.71 0.00 0.00 66.02 63.84 1tkr s SER 349 CO 0.18 0.16 -0.00 0.35 1.20 0.00 0.00 173.24 175.13 1tkr n THR 350 N 2.79 1.50 0.50 6.45 -2.24 -1.26 -4.43 114.28 117.59 1tkr n THR 350 Ca -0.15 -0.69 0.10 0.00 -2.27 0.00 0.00 64.05 61.05 1tkr n THR 350 Cb 0.55 -1.13 0.27 0.00 -2.10 0.00 0.00 70.33 67.92 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 -3.11 0.53 0.00 4.28 -2.24 -1.26 -5.01 114.28 107.47 1tkr n THR 351 Ca -0.38 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 60.75 1tkr n THR 351 Cb 1.05 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.88 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 1.37 -1.00 3.99 3.38 0.00 -1.26 -4.84 105.19 106.84 1tkr n GLY 352 Ca 0.18 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 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 -4.00 2.24 -0.19 1.61 -2.14 -1.26 -4.62 118.94 110.58 1tkr s TRP 353 Ca 0.00 -0.55 -0.19 0.00 2.66 0.00 0.00 56.10 58.02 1tkr s TRP 353 Cb 0.00 -2.27 -0.03 0.00 -3.10 0.00 0.00 33.47 28.07 1tkr s TRP 353 CO 0.00 -0.64 0.53 0.08 -2.66 0.00 0.00 176.95 174.27 1tkr s VAL 354 N -2.50 5.10 0.05 -0.66 1.01 -1.07 -4.79 120.40 117.53 1tkr s VAL 354 Ca 0.55 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.52 1tkr s VAL 354 Cb -0.07 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1tkr s VAL 354 CO 0.34 0.18 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1tkr n GLY 355 N 3.82 -1.50 0.07 4.51 0.00 -1.26 -3.39 105.19 107.44 1tkr n GLY 355 Ca -0.04 -1.48 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.17 -0.03 0.00 1.61 3.08 -1.95 -3.41 114.38 113.51 1tkr h ARG 356 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1tkr h ARG 356 Cb 0.17 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1tkr h ARG 356 CO 0.00 0.50 -0.14 1.19 -1.07 0.00 0.00 179.97 180.45 1tkr n PHE 357 N -4.84 0.00 -3.67 3.04 3.72 -1.26 -4.89 117.46 109.55 1tkr n PHE 357 Ca -0.09 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.27 1tkr n PHE 357 Cb 0.28 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.80 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 -0.63 1.01 0.30 -1.08 1.70 -1.25 -5.01 118.95 113.97 1tkr s ARG 358 Ca 0.00 -0.51 -0.30 0.00 -0.47 0.00 0.00 55.73 54.45 1tkr s ARG 358 Cb 0.00 0.37 -0.12 0.00 -0.57 0.00 0.00 34.95 34.63 1tkr s ARG 358 CO 0.00 -0.46 1.43 -2.30 -1.08 0.00 0.00 175.30 172.89 1tkr n PRO 359 N -0.40 2.29 -0.91 3.89 -0.02 -1.22 -4.10 135.00 134.54 1tkr n PRO 359 Ca -0.07 0.81 -0.36 0.00 -2.02 0.00 0.00 63.50 61.86 1tkr n PRO 359 Cb 0.61 -2.49 0.07 0.00 -0.02 0.00 0.00 33.50 31.68 1tkr n PRO 359 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1tkr n SER 360 N 1.60 -3.67 -4.66 2.55 2.88 -1.26 -4.97 113.62 106.08 1tkr n SER 360 Ca 0.08 0.08 -0.35 0.00 -1.33 0.00 0.00 58.87 57.35 1tkr n SER 360 Cb 0.35 -0.76 -0.10 0.00 -0.75 0.00 0.00 64.21 62.95 1tkr n SER 360 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1tkr s GLU 361 N -2.50 3.45 0.12 -1.46 2.12 -1.26 -4.98 118.70 114.19 1tkr s GLU 361 Ca 0.44 -0.37 -0.30 0.00 0.36 0.00 0.00 54.97 55.10 1tkr s GLU 361 Cb -0.06 -2.99 -0.06 0.00 0.26 0.00 0.00 34.13 31.28 1tkr s GLU 361 CO 0.71 0.51 0.98 -1.25 -0.54 0.00 0.00 175.26 175.67 1tkr s PRO 362 N -0.33 4.69 -0.42 4.30 0.04 -1.26 -4.53 135.00 137.49 1tkr s PRO 362 Ca 0.08 1.48 0.04 0.00 0.04 0.00 0.00 61.00 62.63 1tkr s PRO 362 Cb -0.12 -3.36 0.11 0.00 0.04 0.00 0.00 34.50 31.17 1tkr s PRO 362 CO 0.02 0.21 0.15 -1.01 0.04 0.00 0.00 177.00 176.41 1tkr s HIS 363 N -0.06 3.27 0.52 0.56 3.76 -0.30 -4.94 115.29 118.11 1tkr s HIS 363 Ca 0.47 -2.95 -0.19 0.00 -0.15 0.00 0.00 55.06 52.24 1tkr s HIS 363 Cb -0.24 -2.73 -0.07 0.00 1.11 0.00 0.00 32.58 30.65 1tkr s HIS 363 CO 0.30 -0.85 1.06 -0.06 -0.85 0.00 0.00 174.74 174.34 1tkr s PHE 364 N 0.43 2.95 0.75 1.40 0.40 -1.26 -0.14 117.98 122.50 1tkr s PHE 364 Ca 0.14 1.56 -0.09 0.00 -0.60 0.00 0.00 56.93 57.94 1tkr s PHE 364 Cb -0.22 -3.08 0.07 0.00 0.51 0.00 0.00 43.02 40.30 1tkr s PHE 364 CO -0.05 -1.01 1.08 0.95 0.70 0.00 0.00 175.22 176.89 1tkr s THR 365 N -2.08 2.17 0.02 0.64 -4.23 0.04 -4.92 115.64 107.28 1tkr s THR 365 Ca 0.67 -0.16 -0.05 0.00 -1.18 0.00 0.00 61.69 60.97 1tkr s THR 365 Cb -0.17 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.65 1tkr s THR 365 CO 0.25 -0.00 1.08 0.25 -0.54 0.00 0.00 174.62 175.66 1tkr h LEU 366 N -0.78 -0.27 0.00 4.79 7.12 -1.93 -0.63 115.31 123.61 1tkr h LEU 366 Ca -0.45 0.03 0.00 0.00 0.13 0.00 0.00 57.88 57.59 1tkr h LEU 366 Cb 1.32 0.11 0.00 0.00 -0.53 0.00 0.00 40.66 41.56 1tkr h LEU 366 CO 0.63 -0.06 0.10 -0.90 -0.13 0.00 0.00 178.44 178.08 1tkr n ASP 367 N -3.08 0.00 -1.71 1.25 5.68 -1.26 -4.79 116.55 112.64 1tkr n ASP 367 Ca -0.01 0.31 -0.16 0.00 -0.50 0.00 0.00 54.79 54.43 1tkr n ASP 367 Cb 0.05 -0.31 -0.02 0.00 -1.14 0.00 0.00 41.12 39.70 1tkr n ASP 367 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tkr n GLY 368 N -1.28 0.15 0.73 6.12 0.00 -0.24 -4.88 105.19 105.78 1tkr n GLY 368 Ca 0.00 -0.22 0.07 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.99 2.86 -3.53 1.61 3.02 -1.26 -4.93 115.26 112.04 1tkr n ASN 369 Ca -0.19 -1.87 -0.09 0.00 -0.03 0.00 0.00 54.58 52.41 1tkr n ASN 369 Cb 0.62 -0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.56 1tkr n ASN 369 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1tkr s SER 370 N -1.05 -0.34 0.19 6.41 1.04 -1.26 -2.33 113.70 116.36 1tkr s SER 370 Ca 0.25 0.11 -0.14 0.00 0.48 0.00 0.00 55.95 56.65 1tkr s SER 370 Cb 0.14 0.33 0.01 0.00 0.10 0.00 0.00 66.02 66.61 1tkr s SER 370 CO 0.19 -0.50 0.42 0.72 0.98 0.00 0.00 173.24 175.06 1tkr s PHE 371 N -2.50 0.12 -0.06 5.02 -0.12 0.44 -0.78 117.98 120.10 1tkr s PHE 371 Ca 0.04 -0.48 0.01 0.00 -0.05 0.00 0.00 56.93 56.45 1tkr s PHE 371 Cb -0.01 0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 42.55 1tkr s PHE 371 CO -0.06 -0.84 -0.08 0.71 -0.05 0.00 0.00 175.22 174.90 1tkr s TYR 372 N -3.92 2.89 0.01 3.49 1.51 0.80 -0.05 117.35 122.07 1tkr s TYR 372 Ca 0.13 -0.01 -0.03 0.00 -1.01 0.00 0.00 57.07 56.15 1tkr s TYR 372 Cb 0.01 -1.69 -0.01 0.00 -0.11 0.00 0.00 41.96 40.16 1tkr s TYR 372 CO -0.01 0.31 0.06 0.21 -1.11 0.00 0.00 175.55 175.00 1tkr s LYS 373 N -0.80 0.36 -0.45 -0.62 2.20 -1.11 -1.15 119.74 118.17 1tkr s LYS 373 Ca 0.12 -0.43 -0.18 0.00 -0.36 0.00 0.00 55.97 55.12 1tkr s LYS 373 Cb -0.11 0.14 0.03 0.00 -1.51 0.00 0.00 37.83 36.39 1tkr s LYS 373 CO 0.01 -0.07 0.51 0.42 -0.36 0.00 0.00 175.35 175.86 1tkr s ILE 374 N -1.24 5.01 0.04 5.43 1.01 -1.26 -1.81 121.20 128.39 1tkr s ILE 374 Ca -0.13 -0.37 0.04 0.00 0.00 0.00 0.00 60.65 60.19 1tkr s ILE 374 Cb -0.08 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.24 1tkr s ILE 374 CO 0.00 -0.55 -0.12 0.27 0.00 0.00 0.00 174.94 174.55 1tkr s ILE 375 N 2.31 0.90 0.18 2.92 -4.36 -0.18 -4.58 121.20 118.40 1tkr s ILE 375 Ca 0.14 -1.03 -0.31 0.00 -0.26 0.00 0.00 60.65 59.19 1tkr s ILE 375 Cb -0.18 -0.86 -0.09 0.00 1.25 0.00 0.00 42.46 42.58 1tkr s ILE 375 CO 0.13 -0.14 1.39 -0.94 0.24 0.00 0.00 174.94 175.62 1tkr s SER 376 N -1.32 6.79 0.87 4.36 1.04 -1.26 -2.13 113.70 122.06 1tkr s SER 376 Ca -0.02 2.46 0.00 0.00 0.48 0.00 0.00 55.95 58.87 1tkr s SER 376 Cb -0.08 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.43 1tkr s SER 376 CO 0.01 -0.63 0.00 -0.46 0.98 0.00 0.00 173.24 173.14 1tkr n ASN 377 N 3.07 -0.50 0.18 7.02 2.04 0.11 -4.81 115.26 122.38 1tkr n ASN 377 Ca 0.09 -0.62 0.03 0.00 -0.44 0.00 0.00 54.58 53.64 1tkr n ASN 377 Cb 0.42 0.00 0.35 0.00 -2.53 0.00 0.00 39.78 38.01 1tkr n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 1tkr h GLU 378 N 0.00 0.00 -0.27 -3.83 4.39 -1.95 -2.25 114.58 110.68 1tkr h GLU 378 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1tkr h GLU 378 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1tkr h GLU 378 CO 0.00 0.40 0.00 -1.91 -1.16 0.00 0.00 179.01 176.34 1tkr n GLU 379 N -3.86 1.51 -1.42 2.33 0.00 -1.26 -4.88 120.64 113.06 1tkr n GLU 379 Ca -0.01 -0.71 -0.06 0.00 0.00 0.00 0.00 57.16 56.38 1tkr n GLU 379 Cb 0.46 -1.21 -0.02 0.00 0.00 0.00 0.00 31.44 30.67 1tkr n GLU 379 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1tkr n GLY 380 N 0.74 0.63 3.43 8.31 0.00 -0.85 -4.81 105.19 112.65 1tkr n GLY 380 Ca 0.07 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.23 2.84 -0.13 1.61 1.51 -1.26 0.59 117.35 120.28 1tkr s TYR 381 Ca 0.00 -0.44 -0.29 0.00 -1.01 0.00 0.00 57.07 55.33 1tkr s TYR 381 Cb 0.00 -1.81 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 1tkr s TYR 381 CO 0.00 -0.06 1.35 1.03 -1.11 0.00 0.00 175.55 176.76 1tkr s ARG 382 N 0.04 4.23 0.28 -0.62 0.52 -1.26 0.07 118.95 122.21 1tkr s ARG 382 Ca -0.04 1.79 0.04 0.00 -0.52 0.00 0.00 55.73 57.00 1tkr s ARG 382 Cb -0.14 -3.79 -0.03 0.00 0.52 0.00 0.00 34.95 31.50 1tkr s ARG 382 CO 0.04 -0.72 0.21 -1.01 0.02 0.00 0.00 175.30 173.85 1tkr s HIS 383 N 3.49 1.51 -0.09 -0.53 3.76 -0.90 -1.90 115.29 120.62 1tkr s HIS 383 Ca 0.59 -1.54 -0.14 0.00 -0.15 0.00 0.00 55.06 53.82 1tkr s HIS 383 Cb -0.25 -0.66 -0.05 0.00 1.11 0.00 0.00 32.58 32.74 1tkr s HIS 383 CO 0.19 -0.77 0.34 0.42 -0.85 0.00 0.00 174.74 174.07 1tkr s ILE 384 N -3.74 5.22 0.00 0.60 1.01 -1.26 -1.01 121.20 122.02 1tkr s ILE 384 Ca 0.40 0.66 0.00 0.00 0.00 0.00 0.00 60.65 61.71 1tkr s ILE 384 Cb 0.04 -3.65 -0.00 0.00 0.01 0.00 0.00 42.46 38.85 1tkr s ILE 384 CO 0.21 0.48 -0.01 0.00 0.00 0.00 0.00 174.94 175.62 1tkr s TYR 386 N -0.33 3.25 -0.10 0.00 5.04 0.30 -2.74 117.35 122.77 1tkr s TYR 386 Ca -0.04 1.37 -0.02 0.00 -2.44 0.00 0.00 57.07 55.95 1tkr s TYR 386 Cb -0.02 -3.32 -0.03 0.00 0.35 0.00 0.00 41.96 38.94 1tkr s TYR 386 CO -0.00 -0.78 -0.02 -0.06 -1.34 0.00 0.00 175.55 173.35 1tkr s PHE 387 N 2.95 3.08 -0.25 4.97 0.08 0.92 -1.27 117.98 128.46 1tkr s PHE 387 Ca 0.48 0.06 -0.08 0.00 0.12 0.00 0.00 56.93 57.52 1tkr s PHE 387 Cb -0.18 -1.80 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 1tkr s PHE 387 CO 0.12 0.34 0.09 -1.14 -0.10 0.00 0.00 175.22 174.53 1tkr s GLN 388 N -0.62 3.74 0.55 0.44 2.00 -1.26 -0.42 119.66 124.09 1tkr s GLN 388 Ca 0.10 -0.44 0.46 0.00 -2.00 0.00 0.00 55.36 53.48 1tkr s GLN 388 Cb -0.12 -3.37 1.67 0.00 0.80 0.00 0.00 33.01 31.99 1tkr s GLN 388 CO 0.02 -0.14 1.64 -0.84 -0.50 0.00 0.00 175.29 175.46 1tkr h ILE 389 N 5.45 0.12 -0.11 -2.34 3.07 -1.82 0.19 117.51 122.07 1tkr h ILE 389 Ca -0.37 -0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.03 1tkr h ILE 389 Cb 1.18 0.11 0.00 0.00 -0.27 0.00 0.00 36.82 37.84 1tkr h ILE 389 CO 0.58 0.00 0.00 -0.90 -1.05 0.00 0.00 178.15 176.78 1tkr n ASP 390 N -4.05 2.26 -4.42 2.16 5.75 -1.26 -4.09 116.55 112.91 1tkr n ASP 390 Ca 0.39 -1.63 -0.36 0.00 -0.01 0.00 0.00 54.79 53.19 1tkr n ASP 390 Cb 1.78 -0.06 -0.13 0.00 -1.03 0.00 0.00 41.12 41.68 1tkr n ASP 390 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1tkr s LYS 391 N -1.01 3.58 0.29 0.11 2.36 0.67 -4.82 119.74 120.93 1tkr s LYS 391 Ca 0.17 -0.53 0.05 0.00 -2.55 0.00 0.00 55.97 53.12 1tkr s LYS 391 Cb 0.11 -3.16 0.44 0.00 -1.05 0.00 0.00 37.83 34.17 1tkr s LYS 391 CO 0.16 -0.11 1.70 0.87 1.55 0.00 0.00 175.35 179.52 1tkr h LYS 392 N 7.91 0.29 -5.88 4.03 1.79 -1.88 -3.36 116.57 119.46 1tkr h LYS 392 Ca -0.38 -0.13 -0.57 0.00 -2.18 0.00 0.00 60.65 57.39 1tkr h LYS 392 Cb 1.17 -0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 31.75 1tkr h LYS 392 CO 0.60 0.64 -0.01 -0.51 -1.08 0.00 0.00 179.45 179.08 1tkr s ASP 393 N -6.87 6.84 0.60 0.86 1.01 -1.26 -4.98 116.67 112.87 1tkr s ASP 393 Ca -0.05 1.00 -0.00 0.00 0.71 0.00 0.00 52.55 54.21 1tkr s ASP 393 Cb 0.13 -2.35 0.05 0.00 1.01 0.00 0.00 42.92 41.77 1tkr s ASP 393 CO 0.78 -0.07 0.85 0.00 0.21 0.00 0.00 175.17 176.94 1tkr s THR 395 N -2.90 1.75 0.37 0.00 2.01 -0.40 -4.88 115.64 111.60 1tkr s THR 395 Ca 0.59 -1.27 -0.28 0.00 0.31 0.00 0.00 61.69 61.05 1tkr s THR 395 Cb -0.10 -1.91 -0.10 0.00 0.01 0.00 0.00 72.50 70.41 1tkr s THR 395 CO 0.40 0.01 1.37 -0.36 -0.69 0.00 0.00 174.62 175.35 1tkr s PHE 396 N 1.31 2.82 -0.11 4.92 0.08 -1.26 -0.54 117.98 125.21 1tkr s PHE 396 Ca -0.05 1.33 0.01 0.00 0.12 0.00 0.00 56.93 58.34 1tkr s PHE 396 Cb -0.18 -3.80 0.01 0.00 -0.57 0.00 0.00 43.02 38.47 1tkr s PHE 396 CO -0.07 -2.32 0.48 0.44 -0.10 0.00 0.00 175.22 173.65 1tkr n ILE 397 N 0.49 0.00 -4.32 0.64 -5.35 -0.07 -4.90 119.36 105.84 1tkr n ILE 397 Ca 0.01 -0.50 -0.23 0.00 -0.27 0.00 0.00 62.75 61.76 1tkr n ILE 397 Cb 0.41 1.02 -0.13 0.00 -1.74 0.00 0.00 39.64 39.20 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 -0.18 1.59 0.00 7.28 -4.23 -1.25 -4.94 115.64 113.91 1tkr s THR 398 Ca 0.01 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 1tkr s THR 398 Cb 0.01 -1.45 0.00 0.00 1.34 0.00 0.00 72.50 72.40 1tkr s THR 398 CO 0.01 -0.04 0.00 0.29 -0.54 0.00 0.00 174.62 174.34 1tkr n LYS 399 N 1.26 3.76 0.00 3.99 5.02 -1.26 -4.85 118.16 126.08 1tkr n LYS 399 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 1tkr n LYS 399 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.55 1tkr n LYS 399 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tkr n GLY 400 N 0.00 2.33 3.05 0.72 0.00 -1.26 -4.99 105.19 105.03 1tkr n GLY 400 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 46.02 45.87 1tkr n GLY 400 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1tkr n THR 401 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -4.48 114.28 110.11 1tkr n THR 401 Ca 0.00 -0.46 0.00 0.00 -2.04 0.00 0.00 64.05 61.55 1tkr n THR 401 Cb 0.00 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 68.34 1tkr n THR 401 CO 0.00 0.00 0.00 -2.67 -0.64 0.00 0.00 175.07 171.76 1tkr n TRP 402 N 5.37 0.00 -4.44 -1.42 4.27 -1.26 -4.97 117.44 114.98 1tkr n TRP 402 Ca 0.04 0.00 -0.22 0.00 -3.89 0.00 0.00 57.50 53.43 1tkr n TRP 402 Cb 0.44 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.28 1tkr n TRP 402 CO 0.00 0.00 0.00 -1.21 -2.29 0.00 0.00 177.69 174.19 1tkr s GLU 403 N -2.13 1.57 -0.08 -2.67 2.02 -1.26 -4.68 118.70 111.47 1tkr s GLU 403 Ca 0.00 -1.76 -0.18 0.00 0.02 0.00 0.00 54.97 53.05 1tkr s GLU 403 Cb 0.00 -1.38 -0.05 0.00 0.10 0.00 0.00 34.13 32.81 1tkr s GLU 403 CO 0.00 0.15 0.48 0.08 0.02 0.00 0.00 175.26 176.00 1tkr s VAL 404 N -2.82 5.12 0.00 2.63 1.01 -0.80 -2.82 120.40 122.72 1tkr s VAL 404 Ca 0.28 0.98 -0.08 0.00 0.00 0.00 0.00 61.98 63.16 1tkr s VAL 404 Cb 0.01 -3.82 -0.30 0.00 0.00 0.00 0.00 36.38 32.26 1tkr s VAL 404 CO 0.12 0.38 0.87 0.40 0.00 0.00 0.00 175.10 176.87 1tkr h ILE 405 N 4.49 1.16 -1.37 2.22 1.08 -0.39 -3.46 117.51 121.25 1tkr h ILE 405 Ca -0.43 -2.73 0.25 0.00 -0.39 0.00 0.00 64.86 61.56 1tkr h ILE 405 Cb 1.19 2.85 -0.21 0.00 -3.07 0.00 0.00 36.82 37.58 1tkr h ILE 405 CO 0.73 0.84 0.84 -0.83 -0.69 0.00 0.00 178.15 179.03 1tkr s GLY 406 N -4.89 -0.22 -0.23 5.37 0.00 -1.14 -5.01 107.32 101.20 1tkr s GLY 406 Ca -0.10 1.86 -0.16 0.00 0.00 0.00 0.00 44.72 46.32 1tkr s GLY 406 CO 0.88 0.67 0.40 -0.42 0.00 0.00 0.00 173.10 174.62 1tkr s ILE 407 N -2.07 5.18 -0.19 0.90 1.01 -1.26 -2.19 121.20 122.57 1tkr s ILE 407 Ca 0.09 0.68 0.10 0.00 0.00 0.00 0.00 60.65 61.51 1tkr s ILE 407 Cb -0.01 -3.73 -0.22 0.00 0.01 0.00 0.00 42.46 38.51 1tkr s ILE 407 CO -0.04 0.21 0.08 -0.62 0.00 0.00 0.00 174.94 174.56 1tkr n GLU 408 N 4.84 0.68 -3.55 2.79 -0.58 0.05 -5.00 120.64 119.87 1tkr n GLU 408 Ca -0.08 0.11 -0.17 0.00 -0.42 0.00 0.00 57.16 56.61 1tkr n GLU 408 Cb 0.51 -1.58 -0.06 0.00 -0.57 0.00 0.00 31.44 29.74 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 -2.52 -1.79 -0.14 0.62 0.00 -1.10 -4.89 121.76 111.93 1tkr s ALA 409 Ca -0.19 1.48 -0.02 0.00 0.00 0.00 0.00 51.96 53.23 1tkr s ALA 409 Cb 0.07 -0.30 0.04 0.00 0.00 0.00 0.00 23.12 22.94 1tkr s ALA 409 CO 0.75 -0.36 0.01 -1.17 0.00 0.00 0.00 175.76 174.99 1tkr s LEU 410 N -0.87 0.99 0.00 0.00 1.98 -1.26 -0.97 118.68 118.54 1tkr s LEU 410 Ca -0.08 -0.50 0.01 0.00 -2.89 0.00 0.00 54.13 50.67 1tkr s LEU 410 Cb -0.01 -0.57 0.01 0.00 0.66 0.00 0.00 46.19 46.28 1tkr s LEU 410 CO 0.07 -0.24 0.12 0.35 -1.89 0.00 0.00 176.35 174.76 1tkr n THR 411 N 5.07 0.00 0.19 3.68 -2.24 -0.74 -4.96 114.28 115.28 1tkr n THR 411 Ca -0.09 -2.30 0.04 0.00 -2.27 0.00 0.00 64.05 59.43 1tkr n THR 411 Cb 0.48 0.32 0.39 0.00 -2.10 0.00 0.00 70.33 69.43 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 1.04 0.00 0.00 3.42 4.64 -2.00 -3.36 113.55 117.29 1tkr h SER 412 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1tkr h SER 412 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1tkr h SER 412 CO 0.65 0.36 0.00 0.47 -0.87 0.00 0.00 176.83 177.43 1tkr n ASP 413 N -3.93 0.00 -4.77 4.97 8.00 -1.26 -4.86 116.55 114.70 1tkr n ASP 413 Ca -0.02 0.18 -0.29 0.00 0.71 0.00 0.00 54.79 55.38 1tkr n ASP 413 Cb 0.41 -0.19 -0.07 0.00 -0.02 0.00 0.00 41.12 41.26 1tkr n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1tkr s TYR 414 N -0.37 2.07 -0.11 1.24 1.51 -1.26 -2.59 117.35 117.84 1tkr s TYR 414 Ca 0.00 -0.81 0.01 0.00 -1.01 0.00 0.00 57.07 55.26 1tkr s TYR 414 Cb 0.00 -1.78 0.02 0.00 -0.11 0.00 0.00 41.96 40.09 1tkr s TYR 414 CO 0.00 0.10 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.23 1tkr s LEU 415 N -3.95 1.67 -0.18 -1.29 0.20 -0.73 -1.79 118.68 112.61 1tkr s LEU 415 Ca 0.24 -0.42 -0.10 0.00 0.69 0.00 0.00 54.13 54.54 1tkr s LEU 415 Cb 0.03 -1.06 -0.05 0.00 -0.43 0.00 0.00 46.19 44.67 1tkr s LEU 415 CO 0.13 -0.00 0.14 -0.31 -0.29 0.00 0.00 176.35 176.02 1tkr s TYR 416 N 1.09 3.45 0.11 5.38 1.51 -0.15 -1.64 117.35 127.11 1tkr s TYR 416 Ca -0.05 0.38 -0.06 0.00 -1.01 0.00 0.00 57.07 56.33 1tkr s TYR 416 Cb -0.14 -2.13 -0.02 0.00 -0.11 0.00 0.00 41.96 39.56 1tkr s TYR 416 CO -0.03 0.37 0.17 1.52 -1.11 0.00 0.00 175.55 176.47 1tkr s TYR 417 N 0.10 0.40 -0.06 2.71 -0.85 -0.74 -0.77 117.35 118.13 1tkr s TYR 417 Ca 0.10 -0.81 0.05 0.00 -0.52 0.00 0.00 57.07 55.88 1tkr s TYR 417 Cb -0.11 -0.17 -0.02 0.00 0.38 0.00 0.00 41.96 42.04 1tkr s TYR 417 CO -0.01 -0.58 -0.20 0.42 -1.52 0.00 0.00 175.55 173.67 1tkr s ILE 418 N -3.93 2.50 0.34 -3.49 1.01 -0.93 -0.27 121.20 116.41 1tkr s ILE 418 Ca 0.12 -0.91 -0.04 0.00 0.00 0.00 0.00 60.65 59.82 1tkr s ILE 418 Cb 0.05 -1.95 0.01 0.00 0.01 0.00 0.00 42.46 40.58 1tkr s ILE 418 CO -0.05 0.57 0.50 -0.94 0.00 0.00 0.00 174.94 175.02 1tkr s SER 419 N -0.31 0.74 -0.36 3.58 1.04 -0.59 0.41 113.70 118.21 1tkr s SER 419 Ca 0.02 -1.41 0.06 0.00 0.48 0.00 0.00 55.95 55.09 1tkr s SER 419 Cb -0.13 0.67 0.47 0.00 0.10 0.00 0.00 66.02 67.13 1tkr s SER 419 CO 0.02 -1.31 1.42 -0.46 0.98 0.00 0.00 173.24 173.89 1tkr n ASN 420 N -1.31 4.70 -0.04 7.02 0.23 -1.13 -1.38 115.26 123.36 1tkr n ASN 420 Ca -0.00 -3.78 -0.17 0.00 -0.53 0.00 0.00 54.58 50.10 1tkr n ASN 420 Cb 0.61 -0.54 -0.06 0.00 -2.08 0.00 0.00 39.78 37.71 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 1.81 0.81 -6.37 -3.83 4.81 -1.83 -3.37 114.58 106.60 1tkr h GLU 421 Ca 0.36 -0.62 -0.63 0.00 -0.13 0.00 0.00 59.36 58.35 1tkr h GLU 421 Cb 1.39 0.11 0.10 0.00 0.63 0.00 0.00 28.75 30.99 1tkr h GLU 421 CO 0.79 1.23 0.07 0.98 -0.73 0.00 0.00 179.01 181.35 1tkr n TYR 422 N -3.98 1.03 -0.91 0.92 9.36 -1.26 -1.55 117.16 120.76 1tkr n TYR 422 Ca -0.07 0.74 -0.04 0.00 3.32 0.00 0.00 57.90 61.85 1tkr n TYR 422 Cb 0.71 -2.22 -0.02 0.00 -0.63 0.00 0.00 39.34 37.18 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 1.02 -1.35 -0.67 2.98 4.01 -1.26 -1.54 118.16 121.34 1tkr n LYS 423 Ca 0.12 0.26 0.00 0.00 -0.51 0.00 0.00 58.31 58.18 1tkr n LYS 423 Cb 0.29 -4.06 0.00 0.00 -0.51 0.00 0.00 35.03 30.75 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 -0.01 0.23 3.59 0.72 0.00 -0.60 -4.94 105.19 104.19 1tkr n GLY 424 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.85 3.74 0.13 1.61 0.23 -0.59 -4.90 119.30 118.67 1tkr s MET 425 Ca 0.00 0.33 0.16 0.00 -1.03 0.00 0.00 55.69 55.15 1tkr s MET 425 Cb 0.00 -3.82 0.72 0.00 -1.53 0.00 0.00 34.83 30.20 1tkr s MET 425 CO 0.00 -0.89 1.50 -0.35 -2.03 0.00 0.00 175.02 173.25 1tkr n PRO 426 N 6.52 0.08 -0.15 3.16 -0.04 -1.26 -2.27 135.00 141.04 1tkr n PRO 426 Ca 0.04 0.40 0.10 0.00 -0.04 0.00 0.00 63.50 63.99 1tkr n PRO 426 Cb 0.48 -1.69 0.28 0.00 -0.04 0.00 0.00 33.50 32.54 1tkr n PRO 426 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tkr n GLY 427 N -0.39 0.95 3.83 0.55 0.00 -1.26 -4.88 105.19 103.99 1tkr n GLY 427 Ca 0.02 -0.54 -0.22 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.40 2.05 -0.14 -0.02 0.00 -0.96 -2.70 107.32 104.15 1tkr s GLY 428 Ca 0.34 -1.86 -0.07 0.00 0.00 0.00 0.00 44.72 43.14 1tkr s GLY 428 CO 0.27 -1.71 0.33 -1.60 0.00 0.00 0.00 173.10 170.38 1tkr s ARG 429 N -4.02 0.28 0.08 2.90 3.52 0.07 -4.18 118.95 117.59 1tkr s ARG 429 Ca 0.44 0.72 0.01 0.00 -0.13 0.00 0.00 55.73 56.76 1tkr s ARG 429 Cb -0.03 -0.02 -0.04 0.00 -1.56 0.00 0.00 34.95 33.30 1tkr s ARG 429 CO 0.26 -0.19 -0.05 -0.80 -0.81 0.00 0.00 175.30 173.71 1tkr s ASN 430 N 1.66 0.84 -0.25 -2.12 0.01 -0.48 0.31 114.94 114.91 1tkr s ASN 430 Ca -0.07 -0.99 -0.14 0.00 -0.71 0.00 0.00 52.86 50.95 1tkr s ASN 430 Cb -0.10 0.14 -0.04 0.00 0.41 0.00 0.00 41.25 41.66 1tkr s ASN 430 CO -0.11 -0.52 0.34 -0.22 -1.51 0.00 0.00 177.10 175.08 1tkr s LEU 431 N -2.96 4.07 0.27 0.60 2.96 -1.26 -1.54 118.68 120.83 1tkr s LEU 431 Ca 0.09 0.30 0.11 0.00 -0.22 0.00 0.00 54.13 54.41 1tkr s LEU 431 Cb 0.06 -2.38 -0.05 0.00 0.50 0.00 0.00 46.19 44.32 1tkr s LEU 431 CO -0.07 -0.12 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.39 1tkr s TYR 432 N 1.76 2.41 -0.09 5.38 1.51 0.62 0.11 117.35 129.05 1tkr s TYR 432 Ca 0.14 -0.30 0.00 0.00 -1.01 0.00 0.00 57.07 55.91 1tkr s TYR 432 Cb -0.15 -1.05 0.02 0.00 -0.11 0.00 0.00 41.96 40.67 1tkr s TYR 432 CO 0.09 0.69 -0.07 0.21 -1.11 0.00 0.00 175.55 175.35 1tkr s LYS 433 N -3.53 1.39 -0.10 -0.62 2.20 0.13 -1.80 119.74 117.42 1tkr s LYS 433 Ca 0.30 -0.24 0.01 0.00 -0.36 0.00 0.00 55.97 55.68 1tkr s LYS 433 Cb -0.06 -1.40 -0.02 0.00 -1.51 0.00 0.00 37.83 34.85 1tkr s LYS 433 CO 0.16 -0.18 -0.11 -1.50 -0.36 0.00 0.00 175.35 173.36 1tkr s ILE 434 N 1.40 3.26 -0.35 5.43 2.07 -0.65 -0.11 121.20 132.24 1tkr s ILE 434 Ca -0.01 -0.62 -0.28 0.00 -1.41 0.00 0.00 60.65 58.33 1tkr s ILE 434 Cb -0.13 -2.34 0.02 0.00 0.13 0.00 0.00 42.46 40.14 1tkr s ILE 434 CO -0.04 0.56 1.05 -1.58 -1.91 0.00 0.00 174.94 173.01 1tkr s GLN 435 N -0.20 3.96 0.57 3.50 0.74 -0.24 -1.77 119.66 126.21 1tkr s GLN 435 Ca 0.01 0.88 0.28 0.00 0.05 0.00 0.00 55.36 56.58 1tkr s GLN 435 Cb -0.13 -3.78 1.48 0.00 1.10 0.00 0.00 33.01 31.69 1tkr s GLN 435 CO 0.03 -0.98 1.96 -0.07 -0.55 0.00 0.00 175.29 175.67 1tkr h LEU 436 N 10.25 0.00 -0.37 3.68 4.07 -1.83 -0.32 115.31 130.79 1tkr h LEU 436 Ca -0.21 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.75 1tkr h LEU 436 Cb 1.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.80 1tkr h LEU 436 CO 1.03 0.00 -0.34 -1.54 -1.08 0.00 0.00 178.44 176.51 1tkr n SER 437 N -3.98 0.91 -2.94 -0.43 3.41 -1.26 -4.67 113.62 104.65 1tkr n SER 437 Ca 0.09 -0.74 -0.01 0.00 -0.26 0.00 0.00 58.87 57.95 1tkr n SER 437 Cb 0.63 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 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 -2.64 -1.25 0.00 4.04 2.15 -0.14 -5.01 116.67 113.81 1tkr s ASP 438 Ca 0.20 -1.03 0.00 0.00 0.43 0.00 0.00 52.55 52.16 1tkr s ASP 438 Cb 0.19 1.62 0.00 0.00 -0.30 0.00 0.00 42.92 44.43 1tkr s ASP 438 CO 0.57 -0.10 0.67 -1.22 -0.17 0.00 0.00 175.17 174.93 1tkr n TYR 439 N 3.62 0.00 0.65 -5.34 4.01 -1.13 0.52 117.16 119.49 1tkr n TYR 439 Ca 0.13 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 58.00 1tkr n TYR 439 Cb 0.58 -0.22 0.40 0.00 -0.31 0.00 0.00 39.34 39.79 1tkr n TYR 439 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1tkr n THR 440 N -1.17 0.54 -3.33 -0.72 -2.24 -1.26 -4.52 114.28 101.58 1tkr n THR 440 Ca 0.00 -0.27 -0.47 0.00 -2.27 0.00 0.00 64.05 61.05 1tkr n THR 440 Cb 0.13 -0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 67.79 1tkr n THR 440 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1tkr s LYS 441 N -3.10 3.40 -0.08 -0.78 -0.14 0.18 -5.02 119.74 114.20 1tkr s LYS 441 Ca 0.11 -2.23 0.05 0.00 -1.36 0.00 0.00 55.97 52.53 1tkr s LYS 441 Cb 0.13 -4.38 -0.01 0.00 -1.68 0.00 0.00 37.83 31.89 1tkr s LYS 441 CO 0.60 -1.30 -0.24 0.08 -0.76 0.00 0.00 175.35 173.73 1tkr s VAL 442 N 0.61 2.12 -0.06 3.17 1.01 -1.26 -1.08 120.40 124.91 1tkr s VAL 442 Ca 0.13 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.13 1tkr s VAL 442 Cb -0.16 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.42 1tkr s VAL 442 CO -0.05 0.56 -0.16 -0.89 0.00 0.00 0.00 175.10 174.56 1tkr s THR 443 N 0.14 1.42 -0.08 3.92 2.01 0.84 -4.95 115.64 118.94 1tkr s THR 443 Ca -0.12 -0.68 -0.24 0.00 0.31 0.00 0.00 61.69 60.96 1tkr s THR 443 Cb -0.16 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.07 1tkr s THR 443 CO 0.07 0.42 0.71 0.00 -0.69 0.00 0.00 174.62 175.13 1tkr n LEU 445 N 4.01 1.76 0.00 0.00 7.99 0.30 -4.58 117.00 126.48 1tkr n LEU 445 Ca -0.01 -0.67 0.00 0.00 -0.01 0.00 0.00 56.01 55.33 1tkr n LEU 445 Cb 0.51 -0.01 0.00 0.00 -0.11 0.00 0.00 43.42 43.81 1tkr n LEU 445 CO 0.47 0.34 -0.33 -1.54 -1.51 0.00 0.00 177.39 174.82 1tkr n SER 446 N -0.35 3.32 -0.33 -1.43 3.41 -1.19 -4.77 113.62 112.28 1tkr n SER 446 Ca 0.08 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.59 1tkr n SER 446 Cb 0.43 0.62 -0.08 0.00 -0.26 0.00 0.00 64.21 64.93 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 -5.32 1.78 -0.13 0.00 4.71 -1.26 -3.72 120.64 116.70 1tkr n GLU 448 Ca 0.01 -1.18 0.06 0.00 -0.01 0.00 0.00 57.16 56.05 1tkr n GLU 448 Cb 0.30 -1.40 0.38 0.00 -1.01 0.00 0.00 31.44 29.72 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 2.37 0.59 -5.00 -4.62 3.38 -1.74 -3.38 115.31 106.91 1tkr h LEU 449 Ca 0.00 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1tkr h LEU 449 Cb 0.52 -0.13 -0.13 0.00 0.09 0.00 0.00 40.66 41.02 1tkr h LEU 449 CO 0.00 0.39 -0.04 -3.20 0.09 0.00 0.00 178.44 175.68 1tkr n ASN 450 N -4.47 -1.35 0.30 -0.43 2.85 -1.26 -5.03 115.26 105.85 1tkr n ASN 450 Ca 0.09 -1.88 0.07 0.00 -0.11 0.00 0.00 54.58 52.75 1tkr n ASN 450 Cb 0.21 0.88 0.32 0.00 1.24 0.00 0.00 39.78 42.42 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 2.93 0.00 0.00 1.20 0.13 -1.73 0.16 132.00 134.69 1tkr h PRO 451 Ca -0.25 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.86 1tkr h PRO 451 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1tkr h PRO 451 CO -0.12 0.00 -0.14 0.93 -0.23 0.00 0.00 178.00 178.44 1tkr h GLU 452 N 0.00 0.00 0.00 0.86 4.39 -1.96 -3.40 114.58 114.47 1tkr h GLU 452 Ca 0.03 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.61 1tkr h GLU 452 Cb 1.59 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.22 1tkr h GLU 452 CO -0.00 0.41 -1.13 -0.09 -1.16 0.00 0.00 179.01 177.04 1tkr h ARG 453 N -1.00 0.00 -4.71 2.33 2.43 -1.78 -3.42 114.38 108.23 1tkr h ARG 453 Ca -0.02 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.50 1tkr h ARG 453 Cb 0.48 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 29.66 1tkr h ARG 453 CO -0.01 0.29 -0.81 0.00 -1.51 0.00 0.00 179.97 177.93 1tkr n GLN 455 N 4.56 0.52 -3.83 0.00 6.02 0.31 -4.22 117.38 120.75 1tkr n GLN 455 Ca -0.15 -0.12 -0.29 0.00 -0.01 0.00 0.00 57.00 56.44 1tkr n GLN 455 Cb 0.44 -0.51 -0.16 0.00 1.02 0.00 0.00 30.24 31.04 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 -0.11 1.79 0.21 1.08 6.14 -0.94 -0.75 117.35 124.76 1tkr s TYR 456 Ca 0.00 -1.44 0.09 0.00 0.64 0.00 0.00 57.07 56.36 1tkr s TYR 456 Cb 0.00 -1.43 -0.04 0.00 0.42 0.00 0.00 41.96 40.91 1tkr s TYR 456 CO 0.00 -0.73 -0.05 0.71 0.64 0.00 0.00 175.55 176.11 1tkr s TYR 457 N 1.60 2.68 0.22 4.97 2.02 0.15 -0.90 117.35 128.09 1tkr s TYR 457 Ca -0.01 -0.21 0.03 0.00 -0.37 0.00 0.00 57.07 56.51 1tkr s TYR 457 Cb -0.18 -1.27 -0.05 0.00 -0.40 0.00 0.00 41.96 40.06 1tkr s TYR 457 CO -0.10 0.55 0.02 0.45 -1.57 0.00 0.00 175.55 174.90 1tkr s SER 458 N -3.10 1.53 0.03 2.29 0.15 0.17 -4.65 113.70 110.12 1tkr s SER 458 Ca 0.27 -1.24 -0.22 0.00 0.70 0.00 0.00 55.95 55.46 1tkr s SER 458 Cb -0.08 0.07 0.05 0.00 -1.71 0.00 0.00 66.02 64.35 1tkr s SER 458 CO 0.17 -0.57 0.52 0.54 1.20 0.00 0.00 173.24 175.10 1tkr s VAL 459 N -3.55 0.03 -0.22 4.45 0.11 -1.26 -0.99 120.40 118.97 1tkr s VAL 459 Ca 0.29 -0.25 -0.03 0.00 -2.93 0.00 0.00 61.98 59.06 1tkr s VAL 459 Cb 0.06 -0.96 0.11 0.00 -1.53 0.00 0.00 36.38 34.06 1tkr s VAL 459 CO 0.08 -0.14 0.25 -0.55 -3.33 0.00 0.00 175.10 171.42 1tkr s SER 460 N -1.87 1.29 0.36 3.54 0.15 -0.05 -4.96 113.70 112.16 1tkr s SER 460 Ca -0.06 -0.25 -0.08 0.00 0.70 0.00 0.00 55.95 56.25 1tkr s SER 460 Cb -0.01 0.50 -0.06 0.00 -1.71 0.00 0.00 66.02 64.74 1tkr s SER 460 CO -0.00 -0.33 0.68 -0.36 1.20 0.00 0.00 173.24 174.42 1tkr s PHE 461 N 2.36 3.48 0.80 3.44 0.40 -1.26 -0.23 117.98 126.96 1tkr s PHE 461 Ca 0.08 0.87 -0.12 0.00 -0.60 0.00 0.00 56.93 57.16 1tkr s PHE 461 Cb -0.15 -2.30 0.07 0.00 0.51 0.00 0.00 43.02 41.15 1tkr s PHE 461 CO -0.16 0.00 1.10 -1.54 0.70 0.00 0.00 175.22 175.32 1tkr s SER 462 N -3.20 4.47 0.12 1.36 1.04 0.14 -4.84 113.70 112.80 1tkr s SER 462 Ca 0.48 1.25 -0.06 0.00 0.48 0.00 0.00 55.95 58.10 1tkr s SER 462 Cb -0.10 -1.97 0.17 0.00 0.10 0.00 0.00 66.02 64.21 1tkr s SER 462 CO 0.31 -1.98 0.77 0.29 0.98 0.00 0.00 173.24 173.61 1tkr n LYS 463 N -3.43 -0.08 -0.26 4.02 4.76 -0.67 0.29 118.16 122.79 1tkr n LYS 463 Ca 0.07 0.76 0.07 0.00 -2.87 0.00 0.00 58.31 56.35 1tkr n LYS 463 Cb 0.57 -1.14 0.21 0.00 -1.84 0.00 0.00 35.03 32.83 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 -4.76 2.89 -3.05 1.97 -0.58 -1.26 -4.97 120.64 110.89 1tkr n GLU 464 Ca 0.06 -2.29 -0.12 0.00 -0.42 0.00 0.00 57.16 54.40 1tkr n GLU 464 Cb 0.22 -1.41 0.04 0.00 -0.57 0.00 0.00 31.44 29.73 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 0.74 -0.70 0.00 0.62 0.00 0.15 -4.93 120.51 116.39 1tkr n ALA 465 Ca 0.16 0.20 -0.06 0.00 0.00 0.00 0.00 53.44 53.73 1tkr n ALA 465 Cb 0.52 -3.02 -0.12 0.00 0.00 0.00 0.00 19.45 16.83 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 -1.39 0.00 -4.34 0.00 3.64 -1.80 -3.42 116.57 109.25 1tkr h LYS 466 Ca -0.30 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 58.91 1tkr h LYS 466 Cb 1.19 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.84 1tkr h LYS 466 CO 0.29 0.50 -0.69 0.71 -2.27 0.00 0.00 179.45 177.99 1tkr s TYR 467 N -2.69 0.59 -0.05 1.91 2.02 -1.26 -0.64 117.35 117.23 1tkr s TYR 467 Ca -0.03 -0.87 -0.16 0.00 -0.37 0.00 0.00 57.07 55.63 1tkr s TYR 467 Cb 0.08 -0.39 0.03 0.00 -0.40 0.00 0.00 41.96 41.28 1tkr s TYR 467 CO 0.82 -0.25 0.38 1.52 -1.57 0.00 0.00 175.55 176.44 1tkr s TYR 468 N -3.13 -0.30 -0.18 2.71 1.13 -0.74 0.23 117.35 117.07 1tkr s TYR 468 Ca 0.02 0.58 -0.06 0.00 -1.41 0.00 0.00 57.07 56.20 1tkr s TYR 468 Cb 0.02 0.15 -0.03 0.00 -1.10 0.00 0.00 41.96 40.99 1tkr s TYR 468 CO -0.06 -0.37 0.03 -1.14 -2.51 0.00 0.00 175.55 171.51 1tkr s GLN 469 N -0.90 3.84 -0.07 -3.49 0.74 0.68 -0.81 119.66 119.64 1tkr s GLN 469 Ca -0.10 -0.42 -0.11 0.00 0.05 0.00 0.00 55.36 54.79 1tkr s GLN 469 Cb -0.04 -3.14 -0.05 0.00 1.10 0.00 0.00 33.01 30.88 1tkr s GLN 469 CO 0.04 0.19 0.27 -0.51 -0.55 0.00 0.00 175.29 174.73 1tkr s LEU 470 N 0.56 4.42 -0.39 3.68 1.43 -0.02 -0.87 118.68 127.49 1tkr s LEU 470 Ca 0.01 0.69 0.04 0.00 -1.03 0.00 0.00 54.13 53.85 1tkr s LEU 470 Cb -0.13 -2.33 0.11 0.00 0.03 0.00 0.00 46.19 43.87 1tkr s LEU 470 CO 0.02 0.35 0.12 -0.13 0.23 0.00 0.00 176.35 176.93 1tkr s ARG 471 N -0.92 1.61 -0.16 1.70 0.52 -0.16 -2.36 118.95 119.18 1tkr s ARG 471 Ca 0.19 -2.09 -0.26 0.00 -0.52 0.00 0.00 55.73 53.06 1tkr s ARG 471 Cb -0.14 -3.20 -0.01 0.00 0.52 0.00 0.00 34.95 32.11 1tkr s ARG 471 CO 0.08 -1.00 0.84 0.00 0.02 0.00 0.00 175.30 175.25 1tkr n SER 473 N 5.17 2.10 0.00 0.00 3.41 -0.08 -1.72 113.62 122.50 1tkr n SER 473 Ca 0.05 -2.12 0.00 0.00 -0.26 0.00 0.00 58.87 56.53 1tkr n SER 473 Cb 0.49 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 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 -0.55 1.41 0.01 5.00 0.00 -1.26 -0.37 105.19 109.43 1tkr n GLY 474 Ca 0.02 -1.05 0.11 0.00 0.00 0.00 0.00 46.02 45.10 1tkr n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1tkr n PRO 475 N -0.75 0.01 -0.44 1.61 -0.04 -0.84 0.12 135.00 134.67 1tkr n PRO 475 Ca 0.00 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1tkr n PRO 475 Cb 0.00 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.94 1tkr n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tkr n GLY 476 N 0.78 0.45 3.77 0.55 0.00 0.62 -4.55 105.19 106.81 1tkr n GLY 476 Ca 0.05 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.78 1tkr n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tkr s LEU 477 N 0.00 4.28 0.27 0.99 1.43 -1.26 -4.59 118.68 119.80 1tkr s LEU 477 Ca 0.00 2.51 -0.27 0.00 -1.03 0.00 0.00 54.13 55.34 1tkr s LEU 477 Cb 0.00 -3.87 -0.16 0.00 0.03 0.00 0.00 46.19 42.20 1tkr s LEU 477 CO 0.00 -0.65 0.60 -2.65 0.23 0.00 0.00 176.35 173.88 1tkr n PRO 478 N 0.35 0.41 -3.65 1.29 -0.02 -1.26 -4.79 135.00 127.33 1tkr n PRO 478 Ca 0.03 0.14 -0.25 0.00 -2.02 0.00 0.00 63.50 61.40 1tkr n PRO 478 Cb 0.44 -1.27 -0.17 0.00 -0.02 0.00 0.00 33.50 32.48 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 2.35 0.39 -0.23 2.45 2.96 -0.70 -4.26 118.68 121.65 1tkr s LEU 479 Ca 0.62 -0.43 -0.11 0.00 -0.22 0.00 0.00 54.13 53.99 1tkr s LEU 479 Cb -0.80 -0.26 -0.05 0.00 0.50 0.00 0.00 46.19 45.58 1tkr s LEU 479 CO 0.58 -0.31 0.18 -0.31 -1.32 0.00 0.00 176.35 175.17 1tkr s TYR 480 N 2.11 3.34 0.09 5.38 1.51 0.06 -2.18 117.35 127.66 1tkr s TYR 480 Ca 0.03 0.29 0.04 0.00 -1.01 0.00 0.00 57.07 56.41 1tkr s TYR 480 Cb -0.15 -2.28 -0.03 0.00 -0.11 0.00 0.00 41.96 39.39 1tkr s TYR 480 CO -0.07 0.10 -0.12 0.95 -1.11 0.00 0.00 175.55 175.30 1tkr s THR 481 N 0.96 1.03 0.01 -0.71 -4.23 -0.99 -0.37 115.64 111.34 1tkr s THR 481 Ca 0.09 -1.53 0.04 0.00 -1.18 0.00 0.00 61.69 59.11 1tkr s THR 481 Cb -0.13 -1.26 -0.03 0.00 1.34 0.00 0.00 72.50 72.41 1tkr s THR 481 CO 0.04 -0.43 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.37 1tkr s LEU 482 N -2.21 3.05 0.13 4.79 2.96 -0.63 -0.84 118.68 125.93 1tkr s LEU 482 Ca 0.03 -0.20 -0.00 0.00 -0.22 0.00 0.00 54.13 53.74 1tkr s LEU 482 Cb -0.06 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 1tkr s LEU 482 CO 0.01 0.28 0.03 -1.00 -1.32 0.00 0.00 176.35 174.35 1tkr s HIS 483 N -0.98 0.89 -0.10 5.38 3.76 0.01 -0.73 115.29 123.51 1tkr s HIS 483 Ca 0.17 -1.16 0.02 0.00 -0.15 0.00 0.00 55.06 53.93 1tkr s HIS 483 Cb -0.11 -0.51 -0.02 0.00 1.11 0.00 0.00 32.58 33.05 1tkr s HIS 483 CO 0.07 -0.43 -0.15 -1.54 -0.85 0.00 0.00 174.74 171.84 1tkr s SER 484 N -3.06 3.89 0.58 1.40 1.04 -1.19 -1.79 113.70 114.59 1tkr s SER 484 Ca 0.21 -0.32 0.35 0.00 0.48 0.00 0.00 55.95 56.67 1tkr s SER 484 Cb 0.07 -1.34 1.79 0.00 0.10 0.00 0.00 66.02 66.65 1tkr s SER 484 CO 0.00 0.22 2.17 0.28 0.98 0.00 0.00 173.24 176.89 1tkr h SER 485 N 6.28 0.00 0.09 7.02 0.02 -1.14 -0.50 113.55 125.32 1tkr h SER 485 Ca -0.31 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.65 1tkr h SER 485 Cb 1.20 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.69 1tkr h SER 485 CO 0.53 0.04 -0.47 0.58 -1.14 0.00 0.00 176.83 176.37 1tkr h VAL 486 N 0.00 0.00 -0.00 2.27 2.07 -1.92 -3.31 116.25 115.36 1tkr h VAL 486 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1tkr h VAL 486 Cb 0.24 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 1tkr h VAL 486 CO 0.01 0.00 -0.02 0.59 0.02 0.00 0.00 177.57 178.17 1tkr n ASN 487 N -5.14 0.83 -0.97 0.57 3.02 -1.25 -4.97 115.26 107.35 1tkr n ASN 487 Ca -0.07 -0.91 -0.10 0.00 -0.03 0.00 0.00 54.58 53.46 1tkr n ASN 487 Cb 0.36 0.28 -0.03 0.00 -0.61 0.00 0.00 39.78 39.79 1tkr n ASN 487 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1tkr n ASP 488 N -0.23 -3.84 -4.72 6.41 8.00 -0.20 -4.96 116.55 117.01 1tkr n ASP 488 Ca 0.01 0.13 -0.42 0.00 0.71 0.00 0.00 54.79 55.22 1tkr n ASP 488 Cb 0.03 -2.66 -0.03 0.00 -0.02 0.00 0.00 41.12 38.45 1tkr n ASP 488 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1tkr s LYS 489 N -3.66 4.37 -0.01 -1.24 2.47 -1.23 -4.78 119.74 115.66 1tkr s LYS 489 Ca 0.00 1.98 -0.30 0.00 -1.56 0.00 0.00 55.97 56.09 1tkr s LYS 489 Cb 0.00 -3.26 -0.06 0.00 -1.46 0.00 0.00 37.83 33.05 1tkr s LYS 489 CO 0.00 -0.34 1.59 0.20 0.16 0.00 0.00 175.35 176.96 1tkr s GLY 490 N 0.90 1.61 -0.12 5.54 0.00 -1.26 -3.15 107.32 110.84 1tkr s GLY 490 Ca 0.61 1.00 -0.27 0.00 0.00 0.00 0.00 44.72 46.06 1tkr s GLY 490 CO 0.32 2.87 0.80 1.41 0.00 0.00 0.00 173.10 178.49 1tkr h LEU 491 N 9.30 0.12 -7.02 0.66 3.38 -1.28 -3.49 115.31 116.97 1tkr h LEU 491 Ca -0.40 -0.99 0.35 0.00 0.09 0.00 0.00 57.88 56.94 1tkr h LEU 491 Cb 1.18 -0.04 -0.17 0.00 0.09 0.00 0.00 40.66 41.72 1tkr h LEU 491 CO 0.94 1.10 0.96 0.00 0.09 0.00 0.00 178.44 181.53 1tkr s ARG 492 N -2.27 0.07 -0.29 1.13 1.70 -1.22 -5.01 118.95 113.06 1tkr s ARG 492 Ca -0.18 -0.03 -0.20 0.00 -0.47 0.00 0.00 55.73 54.85 1tkr s ARG 492 Cb -0.02 0.03 -0.01 0.00 -0.57 0.00 0.00 34.95 34.38 1tkr s ARG 492 CO 0.73 -0.03 0.63 0.08 -1.08 0.00 0.00 175.30 175.63 1tkr s VAL 493 N -2.09 4.95 0.02 4.99 1.01 -1.26 -1.61 120.40 126.41 1tkr s VAL 493 Ca 0.13 0.96 0.10 0.00 0.00 0.00 0.00 61.98 63.17 1tkr s VAL 493 Cb 0.03 -3.98 -0.17 0.00 0.00 0.00 0.00 36.38 32.26 1tkr s VAL 493 CO -0.04 -0.09 1.10 -0.07 0.00 0.00 0.00 175.10 176.00 1tkr h LEU 494 N 9.09 0.00 -6.86 3.92 3.38 -1.05 -3.47 115.31 120.33 1tkr h LEU 494 Ca -0.27 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.81 1tkr h LEU 494 Cb 1.12 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.64 1tkr h LEU 494 CO 0.79 0.89 0.11 -0.70 0.09 0.00 0.00 178.44 179.63 1tkr s GLU 495 N -2.74 0.48 0.00 1.13 2.56 -0.98 -4.98 118.70 114.18 1tkr s GLU 495 Ca -0.00 1.04 0.01 0.00 0.00 0.00 0.00 54.97 56.01 1tkr s GLU 495 Cb 0.09 0.44 0.01 0.00 2.00 0.00 0.00 34.13 36.67 1tkr s GLU 495 CO 0.81 -0.14 0.70 -0.40 -0.56 0.00 0.00 175.26 175.68 1tkr n ASP 496 N 4.73 1.42 -3.18 -1.70 5.68 -1.26 -0.76 116.55 121.47 1tkr n ASP 496 Ca -0.14 -1.39 -0.22 0.00 -0.50 0.00 0.00 54.79 52.54 1tkr n ASP 496 Cb 0.54 -0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.53 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 -0.14 -4.76 -0.15 -1.12 3.02 -1.26 -4.85 115.26 105.99 1tkr n ASN 497 Ca 0.00 -0.32 -0.06 0.00 -0.03 0.00 0.00 54.58 54.17 1tkr n ASN 497 Cb 0.11 -3.89 0.03 0.00 -0.61 0.00 0.00 39.78 35.41 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 -1.12 0.39 -0.14 6.41 4.64 -1.94 -1.84 113.55 119.95 1tkr h SER 498 Ca -0.47 0.01 0.05 0.00 -0.47 0.00 0.00 61.79 60.91 1tkr h SER 498 Cb 1.32 -0.07 -0.07 0.00 -0.31 0.00 0.00 62.40 63.28 1tkr h SER 498 CO 0.54 0.28 -0.39 0.00 -0.87 0.00 0.00 176.83 176.39 1tkr h ALA 499 N 1.23 -0.53 -0.98 5.18 0.00 -2.01 -1.48 119.26 120.67 1tkr h ALA 499 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.18 1tkr h ALA 499 Cb 0.06 0.74 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 1tkr h ALA 499 CO -0.11 -0.89 0.62 1.25 0.00 0.00 0.00 179.25 180.12 1tkr h LEU 500 N -0.46 0.99 -1.42 0.00 5.85 -1.84 -1.17 115.31 117.26 1tkr h LEU 500 Ca 0.08 0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.89 1tkr h LEU 500 Cb 0.61 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 1tkr h LEU 500 CO -0.39 0.62 0.46 -0.78 -0.34 0.00 0.00 178.44 178.00 1tkr h ASP 501 N 1.12 0.61 -0.04 1.25 3.58 -0.44 -1.03 116.42 121.48 1tkr h ASP 501 Ca 0.43 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.74 1tkr h ASP 501 Cb 0.20 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 1tkr h ASP 501 CO -0.18 0.39 -0.43 0.50 -2.88 0.00 0.00 179.24 176.64 1tkr h LYS 502 N 0.70 0.57 -0.09 0.28 3.11 -0.53 -3.06 116.57 117.55 1tkr h LYS 502 Ca 0.30 -0.31 -0.11 0.00 -2.81 0.00 0.00 60.65 57.73 1tkr h LYS 502 Cb 0.29 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.54 1tkr h LYS 502 CO -0.10 0.90 -0.38 0.52 -2.81 0.00 0.00 179.45 177.58 1tkr h MET 503 N 0.46 0.42 0.00 1.90 2.86 -0.94 -3.29 114.93 116.33 1tkr h MET 503 Ca 0.03 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 1tkr h MET 503 Cb 0.95 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1tkr h MET 503 CO 0.08 0.96 0.00 -0.07 1.06 0.00 0.00 176.91 178.94 1tkr h LEU 504 N -0.03 0.00 -0.01 1.22 3.38 -1.27 -1.88 115.31 116.72 1tkr h LEU 504 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1tkr h LEU 504 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1tkr h LEU 504 CO 0.08 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.59 1tkr n GLN 505 N -2.61 0.29 0.00 1.13 10.64 -1.16 -2.55 117.38 123.13 1tkr n GLN 505 Ca 0.00 -0.01 0.11 0.00 -1.83 0.00 0.00 57.00 55.27 1tkr n GLN 505 Cb 0.19 -1.50 0.12 0.00 -0.86 0.00 0.00 30.24 28.19 1tkr n GLN 505 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 1tkr n ASN 506 N -1.34 1.09 -4.32 2.61 2.85 -0.71 -4.92 115.26 110.51 1tkr n ASN 506 Ca 0.12 -0.88 -0.27 0.00 -0.11 0.00 0.00 54.58 53.43 1tkr n ASN 506 Cb 0.28 0.49 -0.13 0.00 1.24 0.00 0.00 39.78 41.66 1tkr n ASN 506 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1tkr s VAL 507 N -2.78 1.97 -1.20 3.44 0.11 -1.06 -3.40 120.40 117.49 1tkr s VAL 507 Ca 0.15 -1.51 -0.21 0.00 -2.93 0.00 0.00 61.98 57.48 1tkr s VAL 507 Cb 0.18 -1.73 -0.02 0.00 -1.53 0.00 0.00 36.38 33.27 1tkr s VAL 507 CO 0.68 0.13 1.83 -1.10 -3.33 0.00 0.00 175.10 173.32 1tkr s GLN 508 N -1.66 3.13 0.37 1.54 -0.21 0.14 -4.95 119.66 118.02 1tkr s GLN 508 Ca 0.10 -1.41 -0.25 0.00 0.02 0.00 0.00 55.36 53.82 1tkr s GLN 508 Cb -0.10 -5.35 -0.09 0.00 1.00 0.00 0.00 33.01 28.47 1tkr s GLN 508 CO 0.04 -3.18 1.05 1.41 -2.12 0.00 0.00 175.29 172.49 1tkr s MET 509 N 5.57 4.29 0.84 2.91 1.75 -1.26 -4.36 119.30 129.04 1tkr s MET 509 Ca 0.62 1.55 -0.12 0.00 -1.25 0.00 0.00 55.69 56.48 1tkr s MET 509 Cb 0.01 -2.68 0.10 0.00 2.84 0.00 0.00 34.83 35.09 1tkr s MET 509 CO 0.09 -0.04 1.14 -1.25 -0.65 0.00 0.00 175.02 174.30 1tkr s PRO 510 N -2.27 1.71 0.41 4.11 0.04 -1.26 -4.51 135.00 133.23 1tkr s PRO 510 Ca 0.55 0.33 0.07 0.00 0.04 0.00 0.00 61.00 61.99 1tkr s PRO 510 Cb -0.23 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 1tkr s PRO 510 CO 0.30 -1.81 0.16 -1.54 0.04 0.00 0.00 177.00 174.14 1tkr s SER 511 N -4.18 4.38 -0.06 6.66 1.04 0.97 -4.94 113.70 117.57 1tkr s SER 511 Ca 0.62 -1.09 -0.01 0.00 0.48 0.00 0.00 55.95 55.95 1tkr s SER 511 Cb -0.13 -0.48 0.03 0.00 0.10 0.00 0.00 66.02 65.53 1tkr s SER 511 CO 0.52 -0.52 -0.00 -0.75 0.98 0.00 0.00 173.24 173.47 1tkr s LYS 512 N -3.88 0.59 -0.18 4.02 2.20 -1.26 0.49 119.74 121.71 1tkr s LYS 512 Ca 0.40 0.09 -0.09 0.00 -0.36 0.00 0.00 55.97 56.02 1tkr s LYS 512 Cb 0.04 -0.91 -0.05 0.00 -1.51 0.00 0.00 37.83 35.41 1tkr s LYS 512 CO 0.22 -0.27 0.10 0.21 -0.36 0.00 0.00 175.35 175.26 1tkr s LYS 513 N 1.79 4.02 -0.35 4.03 2.20 -0.57 -4.97 119.74 125.88 1tkr s LYS 513 Ca 0.02 -0.26 0.03 0.00 -0.36 0.00 0.00 55.97 55.40 1tkr s LYS 513 Cb -0.13 -3.31 0.10 0.00 -1.51 0.00 0.00 37.83 32.99 1tkr s LYS 513 CO -0.04 0.34 0.07 -1.17 -0.36 0.00 0.00 175.35 174.19 1tkr s LEU 514 N 0.22 4.37 0.00 5.43 0.20 -1.26 -2.06 118.68 125.58 1tkr s LEU 514 Ca 0.07 -2.14 0.00 0.00 0.69 0.00 0.00 54.13 52.75 1tkr s LEU 514 Cb -0.12 -1.52 0.00 0.00 -0.43 0.00 0.00 46.19 44.13 1tkr s LEU 514 CO -0.01 -0.38 0.00 -0.67 -0.29 0.00 0.00 176.35 175.01 1tkr n ASP 515 N 4.26 0.34 -4.07 3.68 2.03 -1.20 -5.03 116.55 116.56 1tkr n ASP 515 Ca 0.03 -0.43 -0.14 0.00 0.52 0.00 0.00 54.79 54.77 1tkr n ASP 515 Cb 0.41 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.72 1tkr n ASP 515 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1tkr s PHE 516 N -1.16 1.35 -0.01 -0.67 -0.71 -1.26 -1.46 117.98 114.06 1tkr s PHE 516 Ca 0.00 -1.39 0.01 0.00 -1.04 0.00 0.00 56.93 54.51 1tkr s PHE 516 Cb 0.00 -0.66 0.00 0.00 -1.21 0.00 0.00 43.02 41.15 1tkr s PHE 516 CO 0.00 -0.62 -0.03 -1.50 -1.34 0.00 0.00 175.22 171.72 1tkr s ILE 517 N -3.94 0.30 -0.23 -4.49 1.10 -0.48 -4.92 121.20 108.54 1tkr s ILE 517 Ca 0.39 -0.14 -0.17 0.00 -0.51 0.00 0.00 60.65 60.22 1tkr s ILE 517 Cb 0.06 -0.27 -0.03 0.00 0.15 0.00 0.00 42.46 42.37 1tkr s ILE 517 CO 0.15 0.10 0.48 -0.51 -2.11 0.00 0.00 174.94 173.04 1tkr s ILE 518 N 0.06 5.12 -0.04 2.00 -1.16 -1.26 -1.31 121.20 124.60 1tkr s ILE 518 Ca -0.00 0.83 0.04 0.00 -0.51 0.00 0.00 60.65 61.01 1tkr s ILE 518 Cb -0.03 -3.80 -0.00 0.00 0.61 0.00 0.00 42.46 39.24 1tkr s ILE 518 CO -0.00 0.15 -0.16 -0.76 -2.81 0.00 0.00 174.94 171.36 1tkr s LEU 519 N 1.90 1.89 -1.41 8.50 1.43 -0.47 -4.81 118.68 125.71 1tkr s LEU 519 Ca 0.21 -0.32 -0.07 0.00 -1.03 0.00 0.00 54.13 52.92 1tkr s LEU 519 Cb -0.15 -0.90 0.01 0.00 0.03 0.00 0.00 46.19 45.17 1tkr s LEU 519 CO 0.09 0.14 0.32 0.59 0.23 0.00 0.00 176.35 177.72 1tkr n ASN 520 N 3.18 -0.74 -3.77 2.29 5.03 -1.26 -1.81 115.26 118.18 1tkr n ASN 520 Ca -0.18 -1.16 -0.24 0.00 0.87 0.00 0.00 54.58 53.87 1tkr n ASN 520 Cb 0.53 -2.31 0.03 0.00 -1.02 0.00 0.00 39.78 37.01 1tkr n ASN 520 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 1tkr n GLU 521 N -4.55 -4.96 -3.64 3.52 4.07 -1.26 -4.97 120.64 108.84 1tkr n GLU 521 Ca -0.27 0.60 -0.05 0.00 -0.06 0.00 0.00 57.16 57.38 1tkr n GLU 521 Cb 0.67 -5.21 -0.07 0.00 -0.06 0.00 0.00 31.44 26.77 1tkr n GLU 521 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 1tkr s THR 522 N -3.60 0.00 0.06 6.31 -1.32 -0.75 -5.17 115.64 111.18 1tkr s THR 522 Ca 0.17 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.43 1tkr s THR 522 Cb -0.09 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.84 1tkr s THR 522 CO 0.82 0.00 0.66 -1.59 -2.21 0.00 0.00 174.62 172.30 1tkr s LYS 523 N 0.98 4.37 -0.10 7.08 -2.85 -1.26 -1.37 119.74 126.59 1tkr s LYS 523 Ca -0.05 0.89 0.02 0.00 -1.00 0.00 0.00 55.97 55.83 1tkr s LYS 523 Cb -0.04 -3.30 0.01 0.00 -2.06 0.00 0.00 37.83 32.44 1tkr s LYS 523 CO -0.12 0.48 -0.17 -0.06 0.10 0.00 0.00 175.35 175.58 1tkr s PHE 524 N -0.65 2.04 0.27 1.78 0.40 -0.43 -4.97 117.98 116.43 1tkr s PHE 524 Ca 0.33 -0.91 -0.24 0.00 -0.60 0.00 0.00 56.93 55.50 1tkr s PHE 524 Cb -0.20 -1.44 -0.09 0.00 0.51 0.00 0.00 43.02 41.80 1tkr s PHE 524 CO 0.21 -0.44 0.85 -1.58 0.70 0.00 0.00 175.22 174.96 1tkr s TRP 525 N 0.80 3.71 0.28 0.36 0.52 -1.26 -1.38 118.94 121.97 1tkr s TRP 525 Ca -0.10 1.64 0.05 0.00 0.02 0.00 0.00 56.10 57.70 1tkr s TRP 525 Cb -0.16 -2.80 -0.06 0.00 -1.15 0.00 0.00 33.47 29.30 1tkr s TRP 525 CO 0.01 0.30 -0.01 1.52 0.02 0.00 0.00 176.95 178.79 1tkr s TYR 526 N -1.52 1.85 0.02 -1.98 1.13 -0.53 -1.90 117.35 114.42 1tkr s TYR 526 Ca 0.46 -0.84 0.02 0.00 -1.41 0.00 0.00 57.07 55.30 1tkr s TYR 526 Cb -0.19 -1.11 -0.01 0.00 -1.10 0.00 0.00 41.96 39.55 1tkr s TYR 526 CO 0.23 0.11 -0.07 -1.14 -2.51 0.00 0.00 175.55 172.18 1tkr s GLN 527 N -3.81 0.51 -0.11 -3.49 0.74 0.30 -3.23 119.66 110.57 1tkr s GLN 527 Ca 0.31 -0.47 -0.03 0.00 0.05 0.00 0.00 55.36 55.22 1tkr s GLN 527 Cb 0.06 -0.40 0.05 0.00 1.10 0.00 0.00 33.01 33.82 1tkr s GLN 527 CO 0.12 0.09 0.15 -1.64 -0.55 0.00 0.00 175.29 173.47 1tkr s MET 528 N -0.82 0.05 -0.78 1.67 -1.94 -0.87 0.13 119.30 116.74 1tkr s MET 528 Ca -0.03 0.42 -0.19 0.00 -1.71 0.00 0.00 55.69 54.17 1tkr s MET 528 Cb -0.06 -0.61 0.12 0.00 2.01 0.00 0.00 34.83 36.29 1tkr s MET 528 CO 0.00 -0.40 0.97 0.42 -0.01 0.00 0.00 175.02 176.00 1tkr s ILE 529 N 2.27 4.70 0.11 2.53 1.09 -0.65 -1.52 121.20 129.72 1tkr s ILE 529 Ca 0.04 -1.19 -0.30 0.00 -1.10 0.00 0.00 60.65 58.10 1tkr s ILE 529 Cb -0.13 -4.67 -0.06 0.00 -1.06 0.00 0.00 42.46 36.54 1tkr s ILE 529 CO -0.07 -1.38 0.94 -0.76 -0.10 0.00 0.00 174.94 173.58 1tkr s LEU 530 N 2.88 4.50 0.85 2.97 1.43 0.18 -3.17 118.68 128.32 1tkr s LEU 530 Ca 0.24 1.77 -0.12 0.00 -1.03 0.00 0.00 54.13 54.99 1tkr s LEU 530 Cb -0.12 -3.56 0.11 0.00 0.03 0.00 0.00 46.19 42.65 1tkr s LEU 530 CO -0.01 -0.06 1.18 -2.84 0.23 0.00 0.00 176.35 174.86 1tkr s PRO 531 N -0.02 1.39 0.37 1.29 0.02 -1.26 -0.02 135.00 136.76 1tkr s PRO 531 Ca 0.46 1.67 -0.27 0.00 0.02 0.00 0.00 61.00 62.88 1tkr s PRO 531 Cb -0.23 -1.76 -0.11 0.00 0.02 0.00 0.00 34.50 32.42 1tkr s PRO 531 CO 0.29 -2.38 1.30 -2.30 -0.33 0.00 0.00 177.00 173.57 1tkr n PRO 532 N -3.68 2.11 -3.62 5.54 -0.02 -1.26 -2.69 135.00 131.37 1tkr n PRO 532 Ca 0.13 0.74 -0.20 0.00 -2.02 0.00 0.00 63.50 62.15 1tkr n PRO 532 Cb 0.51 -2.37 0.05 0.00 -0.02 0.00 0.00 33.50 31.68 1tkr n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1tkr n HIS 533 N 0.19 -2.05 -1.63 6.00 8.25 -1.26 -4.84 115.22 119.88 1tkr n HIS 533 Ca 0.05 0.88 -0.48 0.00 -0.26 0.00 0.00 57.72 57.91 1tkr n HIS 533 Cb 0.37 -4.61 -0.05 0.00 1.12 0.00 0.00 29.99 26.82 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 -4.27 2.15 -3.50 4.41 7.35 -1.10 -4.93 117.46 117.56 1tkr n PHE 534 Ca -0.27 0.02 -0.42 0.00 -0.76 0.00 0.00 57.45 56.02 1tkr n PHE 534 Cb 0.67 -2.65 -0.08 0.00 0.35 0.00 0.00 39.48 37.76 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 5.32 5.84 0.00 -2.13 -1.08 -1.26 -4.94 116.67 118.42 1tkr s ASP 535 Ca 0.97 -1.61 0.00 0.00 -0.52 0.00 0.00 52.55 51.39 1tkr s ASP 535 Cb -0.67 -2.07 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 1tkr s ASP 535 CO 0.49 -0.64 0.87 1.17 0.52 0.00 0.00 175.17 177.57 1tkr n LYS 536 N 5.02 0.00 0.00 4.34 4.81 -1.26 -1.26 118.16 129.82 1tkr n LYS 536 Ca -0.11 0.37 -0.11 0.00 -0.87 0.00 0.00 58.31 57.59 1tkr n LYS 536 Cb 0.42 -1.50 -0.14 0.00 0.02 0.00 0.00 35.03 33.83 1tkr n LYS 536 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 1tkr h SER 537 N 0.00 0.11 -4.40 3.14 0.02 -1.92 -3.40 113.55 107.10 1tkr h SER 537 Ca 0.00 -0.21 -0.50 0.00 -0.84 0.00 0.00 61.79 60.24 1tkr h SER 537 Cb 0.00 -0.04 0.07 0.00 0.14 0.00 0.00 62.40 62.57 1tkr h SER 537 CO 0.00 1.18 0.42 -0.75 -1.14 0.00 0.00 176.83 176.54 1tkr s LYS 538 N -2.61 3.32 -0.34 3.45 2.36 -0.39 -4.97 119.74 120.57 1tkr s LYS 538 Ca -0.07 0.64 -0.07 0.00 -2.55 0.00 0.00 55.97 53.92 1tkr s LYS 538 Cb 0.08 -2.06 0.04 0.00 -1.05 0.00 0.00 37.83 34.84 1tkr s LYS 538 CO 0.82 -0.75 0.11 0.15 1.55 0.00 0.00 175.35 177.23 1tkr s LYS 539 N -5.25 2.67 0.29 4.03 -0.14 -1.26 -4.46 119.74 115.62 1tkr s LYS 539 Ca 0.56 -1.15 -0.01 0.00 -1.36 0.00 0.00 55.97 54.02 1tkr s LYS 539 Cb -0.11 -3.48 -0.04 0.00 -1.68 0.00 0.00 37.83 32.52 1tkr s LYS 539 CO 0.53 -0.65 0.50 0.71 -0.76 0.00 0.00 175.35 175.68 1tkr s TYR 540 N 1.42 3.49 0.27 3.18 2.02 0.52 -4.51 117.35 123.75 1tkr s TYR 540 Ca -0.01 0.41 -0.20 0.00 -0.37 0.00 0.00 57.07 56.90 1tkr s TYR 540 Cb -0.19 -1.93 -0.09 0.00 -0.40 0.00 0.00 41.96 39.35 1tkr s TYR 540 CO 0.03 0.21 0.79 -1.25 -1.57 0.00 0.00 175.55 173.76 1tkr s PRO 541 N -3.85 4.27 -0.05 -1.71 0.04 -1.26 -0.19 135.00 132.25 1tkr s PRO 541 Ca 0.40 0.94 0.05 0.00 0.04 0.00 0.00 61.00 62.43 1tkr s PRO 541 Cb -0.10 -2.74 -0.01 0.00 0.04 0.00 0.00 34.50 31.70 1tkr s PRO 541 CO 0.32 0.30 -0.20 -1.17 0.04 0.00 0.00 177.00 176.29 1tkr s LEU 542 N -2.25 1.97 -0.26 -3.56 2.96 -0.35 -2.00 118.68 115.19 1tkr s LEU 542 Ca 0.48 -0.42 -0.03 0.00 -0.22 0.00 0.00 54.13 53.94 1tkr s LEU 542 Cb -0.15 -1.14 0.02 0.00 0.50 0.00 0.00 46.19 45.42 1tkr s LEU 542 CO 0.20 0.18 -0.03 -0.22 -1.32 0.00 0.00 176.35 175.17 1tkr s LEU 543 N 0.01 3.36 -0.53 -0.68 0.20 0.90 0.51 118.68 122.45 1tkr s LEU 543 Ca -0.05 -0.84 -0.24 0.00 0.69 0.00 0.00 54.13 53.69 1tkr s LEU 543 Cb -0.13 -1.72 0.04 0.00 -0.43 0.00 0.00 46.19 43.95 1tkr s LEU 543 CO 0.03 -0.14 0.93 -0.22 -0.29 0.00 0.00 176.35 176.66 1tkr s LEU 544 N 1.37 4.09 -0.37 -0.68 2.96 0.35 -1.67 118.68 124.72 1tkr s LEU 544 Ca 0.01 -0.25 -0.29 0.00 -0.22 0.00 0.00 54.13 53.38 1tkr s LEU 544 Cb -0.17 -2.91 0.02 0.00 0.50 0.00 0.00 46.19 43.64 1tkr s LEU 544 CO -0.03 -1.18 1.09 -0.62 -1.32 0.00 0.00 176.35 174.29 1tkr s ASP 545 N 2.70 6.84 0.07 3.68 -1.08 -0.14 -1.36 116.67 127.39 1tkr s ASP 545 Ca 0.32 0.87 0.06 0.00 -0.52 0.00 0.00 52.55 53.28 1tkr s ASP 545 Cb -0.12 -2.54 -0.03 0.00 -1.46 0.00 0.00 42.92 38.77 1tkr s ASP 545 CO 0.21 -0.99 -0.15 0.54 0.52 0.00 0.00 175.17 175.30 1tkr s VAL 546 N 3.88 1.23 0.23 1.11 0.11 0.24 -4.35 120.40 122.84 1tkr s VAL 546 Ca 0.46 -1.31 0.00 0.00 -2.93 0.00 0.00 61.98 58.20 1tkr s VAL 546 Cb -0.11 -1.16 0.00 0.00 -1.53 0.00 0.00 36.38 33.59 1tkr s VAL 546 CO 0.20 -0.16 0.00 0.00 -3.33 0.00 0.00 175.10 171.81 1tkr n TYR 547 N 1.32 -1.71 -0.90 1.54 4.19 -1.26 -3.97 117.16 116.37 1tkr n TYR 547 Ca -0.20 0.30 -0.02 0.00 3.31 0.00 0.00 57.90 61.28 1tkr n TYR 547 Cb 0.54 0.39 -0.01 0.00 0.49 0.00 0.00 39.34 40.75 1tkr n TYR 547 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1tkr n ALA 548 N -3.49 -0.04 -0.85 2.98 0.00 -1.26 -3.30 120.51 114.55 1tkr n ALA 548 Ca 0.00 0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.19 1tkr n ALA 548 Cb 0.00 -1.28 0.19 0.00 0.00 0.00 0.00 19.45 18.37 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 -1.73 1.59 0.18 0.00 0.00 -1.26 -4.74 107.32 101.37 1tkr s GLY 549 Ca 0.00 -0.02 -0.33 0.00 0.00 0.00 0.00 44.72 44.37 1tkr s GLY 549 CO 0.00 0.57 1.63 -1.05 0.00 0.00 0.00 173.10 174.25 1tkr n PRO 550 N -4.41 2.40 -2.27 2.90 -0.02 -1.26 -1.91 135.00 130.44 1tkr n PRO 550 Ca 0.06 0.86 -0.20 0.00 -2.02 0.00 0.00 63.50 62.20 1tkr n PRO 550 Cb 0.55 -2.66 -0.02 0.00 -0.02 0.00 0.00 33.50 31.34 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 -2.20 5.66 -0.26 0.00 1.04 -0.80 -4.10 113.70 113.04 1tkr s SER 552 Ca 0.00 0.11 -0.01 0.00 0.48 0.00 0.00 55.95 56.53 1tkr s SER 552 Cb 0.00 -1.26 0.13 0.00 0.10 0.00 0.00 66.02 65.00 1tkr s SER 552 CO 0.00 -0.82 0.33 -1.58 0.98 0.00 0.00 173.24 172.15 1tkr s GLN 553 N -4.57 0.32 0.02 4.02 0.74 -1.26 -2.26 119.66 116.67 1tkr s GLN 553 Ca 0.51 0.17 0.22 0.00 0.05 0.00 0.00 55.36 56.32 1tkr s GLN 553 Cb -0.10 -0.65 -0.04 0.00 1.10 0.00 0.00 33.01 33.32 1tkr s GLN 553 CO 0.37 -0.85 0.95 1.63 -0.55 0.00 0.00 175.29 176.85 1tkr n LYS 554 N 5.34 0.22 -3.56 1.67 4.76 -1.26 -4.80 118.16 120.52 1tkr n LYS 554 Ca -0.03 -0.03 -0.41 0.00 -2.87 0.00 0.00 58.31 54.98 1tkr n LYS 554 Cb 0.49 -1.55 -0.09 0.00 -1.84 0.00 0.00 35.03 32.03 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 -3.16 3.35 0.00 7.82 0.00 -1.26 -4.86 121.76 123.64 1tkr s ALA 555 Ca 0.04 -2.22 0.00 0.00 0.00 0.00 0.00 51.96 49.78 1tkr s ALA 555 Cb 0.15 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.53 1tkr s ALA 555 CO 0.83 -1.71 0.00 -0.40 0.00 0.00 0.00 175.76 174.47 1tkr n ASP 556 N 4.96 0.00 -0.80 0.00 5.68 -1.26 -4.53 116.55 120.59 1tkr n ASP 556 Ca -0.10 -0.45 0.09 0.00 -0.50 0.00 0.00 54.79 53.83 1tkr n ASP 556 Cb 0.43 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.53 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 0.00 0.32 -1.91 2.12 -2.24 -1.10 -4.93 114.28 106.54 1tkr n THR 557 Ca 0.00 -0.66 -0.41 0.00 -2.27 0.00 0.00 64.05 60.71 1tkr n THR 557 Cb 0.00 1.09 -0.01 0.00 -2.10 0.00 0.00 70.33 69.31 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 -1.32 2.33 -0.15 2.28 1.01 -1.26 -2.21 120.40 121.07 1tkr s VAL 558 Ca 0.26 0.31 -0.19 0.00 0.00 0.00 0.00 61.98 62.35 1tkr s VAL 558 Cb 0.16 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 1tkr s VAL 558 CO 0.23 0.07 0.55 0.12 0.00 0.00 0.00 175.10 176.06 1tkr s PHE 559 N -0.74 3.45 0.13 5.22 5.36 0.51 -4.91 117.98 127.00 1tkr s PHE 559 Ca 0.55 0.90 0.07 0.00 -0.96 0.00 0.00 56.93 57.49 1tkr s PHE 559 Cb -0.44 -2.67 -0.04 0.00 -0.34 0.00 0.00 43.02 39.53 1tkr s PHE 559 CO 0.55 0.00 -0.16 1.03 -1.46 0.00 0.00 175.22 175.18 1tkr s ARG 560 N 1.23 1.11 -0.58 10.12 0.52 -1.26 -4.91 118.95 125.18 1tkr s ARG 560 Ca 0.27 -1.28 0.04 0.00 -0.52 0.00 0.00 55.73 54.24 1tkr s ARG 560 Cb -0.16 -1.08 0.17 0.00 0.52 0.00 0.00 34.95 34.40 1tkr s ARG 560 CO 0.11 0.22 0.42 -0.51 0.02 0.00 0.00 175.30 175.56 1tkr s LEU 561 N -2.46 3.51 0.00 2.53 1.43 -1.26 -4.89 118.68 117.53 1tkr s LEU 561 Ca 0.11 -3.50 0.00 0.00 -1.03 0.00 0.00 54.13 49.71 1tkr s LEU 561 Cb -0.06 -1.19 0.00 0.00 0.03 0.00 0.00 46.19 44.98 1tkr s LEU 561 CO 0.04 -0.13 0.00 -0.46 0.23 0.00 0.00 176.35 176.04 1tkr n ASN 562 N 2.39 1.28 -0.30 2.29 0.23 -1.26 -4.99 115.26 114.89 1tkr n ASN 562 Ca 0.22 -0.54 0.05 0.00 -0.53 0.00 0.00 54.58 53.78 1tkr n ASN 562 Cb 0.39 0.00 0.26 0.00 -2.08 0.00 0.00 39.78 38.35 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 0.54 1.03 -0.06 -2.53 7.01 -1.98 -0.78 115.95 119.17 1tkr h TRP 563 Ca 0.00 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.00 1tkr h TRP 563 Cb 0.00 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 26.72 1tkr h TRP 563 CO 0.00 0.51 -0.10 0.00 -2.79 0.00 0.00 178.44 176.06 1tkr h ALA 564 N 1.52 1.72 -0.06 2.65 0.00 -1.99 -1.02 119.26 122.09 1tkr h ALA 564 Ca 0.40 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1tkr h ALA 564 Cb 0.28 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1tkr h ALA 564 CO -0.16 0.21 0.03 1.15 0.00 0.00 0.00 179.25 180.48 1tkr h THR 565 N 0.09 1.05 -0.33 0.00 2.02 -1.48 -1.55 112.91 112.71 1tkr h THR 565 Ca 0.02 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1tkr h THR 565 Cb 0.24 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1tkr h THR 565 CO 0.01 0.04 0.15 0.22 0.37 0.00 0.00 175.52 176.32 1tkr h TYR 566 N 0.04 0.48 -0.76 3.16 3.20 -1.37 0.29 116.97 122.01 1tkr h TYR 566 Ca 0.02 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.95 1tkr h TYR 566 Cb 0.04 -0.15 -0.07 0.00 1.54 0.00 0.00 36.73 38.09 1tkr h TYR 566 CO -0.06 0.44 0.41 -0.07 -1.64 0.00 0.00 178.16 177.24 1tkr h LEU 567 N 0.39 0.58 0.18 2.82 3.38 -0.99 0.24 115.31 121.92 1tkr h LEU 567 Ca 0.11 0.05 -0.27 0.00 0.09 0.00 0.00 57.88 57.86 1tkr h LEU 567 Cb 0.14 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 40.86 1tkr h LEU 567 CO -0.01 0.34 -1.24 0.00 0.09 0.00 0.00 178.44 177.62 1tkr h ALA 568 N 1.43 -0.06 0.14 1.53 0.00 -1.17 0.59 119.26 121.72 1tkr h ALA 568 Ca 0.36 -0.86 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1tkr h ALA 568 Cb 0.33 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1tkr h ALA 568 CO -0.24 0.62 -0.07 1.03 0.00 0.00 0.00 179.25 180.59 1tkr h SER 569 N -0.13 -0.16 0.00 0.00 0.87 -0.81 -3.04 113.55 110.27 1tkr h SER 569 Ca -0.23 -0.25 -0.07 0.00 -1.23 0.00 0.00 61.79 60.01 1tkr h SER 569 Cb 1.90 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.89 1tkr h SER 569 CO 0.19 0.17 -0.78 0.41 -0.53 0.00 0.00 176.83 176.29 1tkr n THR 570 N -5.03 1.45 1.45 2.23 -1.04 0.06 -4.44 114.28 108.96 1tkr n THR 570 Ca -0.09 0.13 0.13 0.00 -2.04 0.00 0.00 64.05 62.18 1tkr n THR 570 Cb 0.22 -2.28 0.72 0.00 -1.82 0.00 0.00 70.33 67.16 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 -4.55 0.62 -2.34 -2.82 -0.58 -1.05 -4.90 120.64 105.02 1tkr n GLU 571 Ca -0.15 0.02 -0.20 0.00 -0.42 0.00 0.00 57.16 56.41 1tkr n GLU 571 Cb 0.40 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.76 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 -1.12 -5.68 -4.83 1.62 5.03 -0.59 -4.93 115.26 104.77 1tkr n ASN 572 Ca 0.16 0.04 -0.37 0.00 0.87 0.00 0.00 54.58 55.29 1tkr n ASN 572 Cb 0.14 -4.75 -0.06 0.00 -1.02 0.00 0.00 39.78 34.08 1tkr n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1tkr s ILE 573 N -2.97 5.36 -0.27 2.41 1.01 0.10 -4.58 121.20 122.25 1tkr s ILE 573 Ca 0.00 0.40 -0.24 0.00 0.00 0.00 0.00 60.65 60.81 1tkr s ILE 573 Cb 0.00 -3.51 -0.00 0.00 0.01 0.00 0.00 42.46 38.95 1tkr s ILE 573 CO 0.00 0.55 0.82 -0.63 0.00 0.00 0.00 174.94 175.68 1tkr s ILE 574 N -0.63 4.81 -0.48 2.92 1.01 -0.85 -3.04 121.20 124.95 1tkr s ILE 574 Ca 0.16 1.43 -0.11 0.00 0.00 0.00 0.00 60.65 62.13 1tkr s ILE 574 Cb -0.13 -4.13 0.12 0.00 0.01 0.00 0.00 42.46 38.32 1tkr s ILE 574 CO 0.05 -0.15 0.37 -0.69 0.00 0.00 0.00 174.94 174.52 1tkr s VAL 575 N 2.91 4.44 0.01 2.92 1.01 -1.19 -0.07 120.40 130.43 1tkr s VAL 575 Ca 0.34 -1.67 0.02 0.00 0.00 0.00 0.00 61.98 60.67 1tkr s VAL 575 Cb -0.15 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1tkr s VAL 575 CO 0.09 -0.76 -0.00 0.00 0.00 0.00 0.00 175.10 174.43 1tkr s ALA 576 N 1.42 3.27 0.04 5.51 0.00 -0.67 -1.64 121.76 129.69 1tkr s ALA 576 Ca 0.05 -0.98 0.06 0.00 0.00 0.00 0.00 51.96 51.09 1tkr s ALA 576 Cb -0.27 -1.31 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 1tkr s ALA 576 CO 0.01 0.65 -0.17 -1.12 0.00 0.00 0.00 175.76 175.13 1tkr s SER 577 N -1.67 2.07 -0.04 0.00 0.01 0.12 -0.97 113.70 113.22 1tkr s SER 577 Ca 0.20 -0.49 0.01 0.00 1.31 0.00 0.00 55.95 56.99 1tkr s SER 577 Cb -0.12 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 65.98 1tkr s SER 577 CO 0.11 0.10 -0.05 0.12 0.41 0.00 0.00 173.24 173.93 1tkr s PHE 578 N -0.83 0.76 -0.80 2.43 5.36 -1.26 0.11 117.98 123.75 1tkr s PHE 578 Ca 0.05 -0.21 -0.13 0.00 -0.96 0.00 0.00 56.93 55.67 1tkr s PHE 578 Cb -0.08 -0.66 0.21 0.00 -0.34 0.00 0.00 43.02 42.15 1tkr s PHE 578 CO 0.02 -0.18 0.73 -0.51 -1.46 0.00 0.00 175.22 173.82 1tkr s ASP 579 N 0.81 6.63 0.00 6.13 1.01 -0.80 -4.82 116.67 125.63 1tkr s ASP 579 Ca -0.11 -2.68 0.00 0.00 0.71 0.00 0.00 52.55 50.47 1tkr s ASP 579 Cb -0.14 -2.18 0.00 0.00 1.01 0.00 0.00 42.92 41.61 1tkr s ASP 579 CO 0.00 -0.56 0.00 0.61 0.21 0.00 0.00 175.17 175.43 1tkr n GLY 580 N 3.97 1.07 3.75 0.21 0.00 -1.26 -4.30 105.19 108.62 1tkr n GLY 580 Ca 0.13 -1.63 -0.37 0.00 0.00 0.00 0.00 46.02 44.15 1tkr n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tkr s ARG 581 N 1.16 2.94 0.00 1.61 0.52 -1.26 -2.13 118.95 121.79 1tkr s ARG 581 Ca 0.00 1.96 0.00 0.00 -0.52 0.00 0.00 55.73 57.17 1tkr s ARG 581 Cb 0.00 -2.00 0.00 0.00 0.52 0.00 0.00 34.95 33.47 1tkr s ARG 581 CO 0.00 -1.27 0.00 0.41 0.02 0.00 0.00 175.30 174.46 1tkr n GLY 582 N 0.65 2.97 3.60 -3.53 0.00 -0.35 -4.19 105.19 104.34 1tkr n GLY 582 Ca 0.13 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1tkr n GLY 582 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tkr n SER 583 N 0.34 -0.32 -2.62 1.61 3.41 -0.90 -0.76 113.62 114.37 1tkr n SER 583 Ca 0.00 0.27 -0.07 0.00 -0.26 0.00 0.00 58.87 58.81 1tkr n SER 583 Cb 0.00 -1.41 -0.01 0.00 -0.26 0.00 0.00 64.21 62.53 1tkr n SER 583 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tkr n GLY 584 N 0.54 3.79 2.39 5.00 0.00 -0.96 -2.85 105.19 113.10 1tkr n GLY 584 Ca 0.09 -2.24 -0.01 0.00 0.00 0.00 0.00 46.02 43.86 1tkr n GLY 584 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1tkr n TYR 585 N -0.41 0.00 -1.41 1.61 4.01 -1.26 -4.82 117.16 114.87 1tkr n TYR 585 Ca -0.04 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.74 1tkr n TYR 585 Cb 0.15 -0.96 0.05 0.00 -0.31 0.00 0.00 39.34 38.26 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 -1.57 0.70 0.00 -0.72 6.02 -1.26 -4.48 117.38 116.07 1tkr n GLN 586 Ca -0.01 -1.57 0.00 0.00 -0.01 0.00 0.00 57.00 55.41 1tkr n GLN 586 Cb 0.22 -0.91 0.00 0.00 1.02 0.00 0.00 30.24 30.57 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 -0.57 2.34 0.24 1.08 0.00 -1.26 -4.66 105.19 102.37 1tkr n GLY 587 Ca 0.06 -1.85 -0.04 0.00 0.00 0.00 0.00 46.02 44.18 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 0.54 -1.15 1.61 3.32 -0.17 -1.91 116.42 118.66 1tkr h ASP 588 Ca 0.00 -0.19 0.33 0.00 0.02 0.00 0.00 57.03 57.19 1tkr h ASP 588 Cb 0.00 -0.15 -0.10 0.00 0.22 0.00 0.00 39.33 39.30 1tkr h ASP 588 CO 0.00 0.78 0.75 0.50 -1.72 0.00 0.00 179.24 179.55 1tkr h LYS 589 N 0.47 0.25 0.02 3.56 1.63 -1.87 0.83 116.57 121.45 1tkr h LYS 589 Ca 0.07 -0.01 -0.35 0.00 -0.85 0.00 0.00 60.65 59.50 1tkr h LYS 589 Cb 0.69 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 32.22 1tkr h LYS 589 CO 0.05 0.16 -1.97 -0.89 -3.45 0.00 0.00 179.45 173.35 1tkr n ILE 590 N -4.60 1.56 -0.07 2.00 5.41 -1.10 -3.99 119.36 118.57 1tkr n ILE 590 Ca 0.29 -0.31 0.02 0.00 1.00 0.00 0.00 62.75 63.75 1tkr n ILE 590 Cb 1.10 -1.87 0.33 0.00 -0.71 0.00 0.00 39.64 38.49 1tkr n ILE 590 CO 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 176.55 176.52 1tkr h MET 591 N -0.72 0.68 -0.12 0.38 4.05 -0.60 -0.77 114.93 117.83 1tkr h MET 591 Ca -0.51 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 58.83 1tkr h MET 591 Cb 1.59 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 32.25 1tkr h MET 591 CO -0.23 0.52 0.00 0.72 0.23 0.00 0.00 176.91 178.15 1tkr n HIS 592 N -4.40 0.15 -0.23 1.39 8.25 0.28 -4.27 115.22 116.40 1tkr n HIS 592 Ca 0.04 -0.07 0.01 0.00 -0.26 0.00 0.00 57.72 57.44 1tkr n HIS 592 Cb 0.11 0.00 0.13 0.00 1.12 0.00 0.00 29.99 31.34 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 4.10 0.89 -0.36 -1.41 0.00 -1.55 -1.18 119.26 119.74 1tkr h ALA 593 Ca 0.00 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1tkr h ALA 593 Cb 0.46 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1tkr h ALA 593 CO 0.00 -0.12 0.12 0.44 0.00 0.00 0.00 179.25 179.69 1tkr n ILE 594 N -4.93 1.64 -1.88 0.00 -5.35 -1.26 -4.86 119.36 102.72 1tkr n ILE 594 Ca 0.10 -0.79 -0.42 0.00 -0.27 0.00 0.00 62.75 61.38 1tkr n ILE 594 Cb 0.28 -0.53 -0.02 0.00 -1.74 0.00 0.00 39.64 37.63 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 -0.28 6.51 0.00 7.28 3.04 -0.45 -1.54 114.94 129.50 1tkr s ASN 595 Ca 0.27 2.77 0.00 0.00 0.04 0.00 0.00 52.86 55.94 1tkr s ASN 595 Cb 0.22 -2.62 0.00 0.00 -1.54 0.00 0.00 41.25 37.31 1tkr s ASN 595 CO 0.07 -0.83 0.00 0.54 -3.04 0.00 0.00 177.10 173.84 1tkr n ARG 596 N 2.88 -1.33 -2.52 0.43 1.74 0.10 -4.79 116.66 113.18 1tkr n ARG 596 Ca 0.10 0.29 -0.13 0.00 -0.77 0.00 0.00 57.85 57.34 1tkr n ARG 596 Cb 0.38 -4.47 0.03 0.00 -1.02 0.00 0.00 32.46 27.38 1tkr n ARG 596 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1tkr n ARG 597 N 0.04 2.39 -1.86 5.56 3.00 -0.59 -4.91 116.66 120.28 1tkr n ARG 597 Ca 0.00 -3.80 -0.38 0.00 -0.01 0.00 0.00 57.85 53.67 1tkr n ARG 597 Cb 0.29 -1.82 0.04 0.00 0.00 0.00 0.00 32.46 30.97 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 -3.56 3.82 -0.21 0.55 1.02 -1.22 -3.53 118.68 115.55 1tkr s LEU 598 Ca 0.37 2.66 -0.01 0.00 0.02 0.00 0.00 54.13 57.16 1tkr s LEU 598 Cb 0.39 -4.34 0.00 0.00 0.02 0.00 0.00 46.19 42.26 1tkr s LEU 598 CO -0.03 -1.55 0.18 0.61 0.02 0.00 0.00 176.35 175.59 1tkr n GLY 599 N 0.69 0.64 0.00 -3.19 0.00 -1.26 -4.86 105.19 97.21 1tkr n GLY 599 Ca 0.11 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.61 0.00 -0.25 2.61 -2.24 -1.23 -4.86 114.28 105.69 1tkr n THR 600 Ca -0.01 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.79 1tkr n THR 600 Cb 0.51 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.84 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 -0.31 -1.00 4.78 0.04 -1.95 0.98 116.94 119.48 1tkr h PHE 601 Ca 0.00 0.06 0.21 0.00 2.80 0.00 0.00 57.97 61.04 1tkr h PHE 601 Cb 0.00 0.25 -0.10 0.00 2.20 0.00 0.00 35.95 38.30 1tkr h PHE 601 CO 0.00 -0.30 0.62 1.05 -0.60 0.00 0.00 178.31 179.08 1tkr h GLU 602 N 0.02 0.63 0.00 1.51 4.11 -1.90 0.47 114.58 119.42 1tkr h GLU 602 Ca 0.36 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.74 1tkr h GLU 602 Cb 0.58 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1tkr h GLU 602 CO -0.73 0.42 -0.05 0.28 0.07 0.00 0.00 179.01 178.99 1tkr h VAL 603 N 0.65 1.70 -0.24 -1.06 2.07 0.36 -3.20 116.25 116.52 1tkr h VAL 603 Ca 0.58 -2.11 0.05 0.00 0.82 0.00 0.00 66.70 66.04 1tkr h VAL 603 Cb 1.06 3.12 -0.05 0.00 -1.52 0.00 0.00 31.29 33.91 1tkr h VAL 603 CO -0.36 0.55 -0.06 -0.33 0.02 0.00 0.00 177.57 177.39 1tkr h GLU 604 N -0.84 0.00 -0.81 1.57 5.08 0.83 -2.22 114.58 118.19 1tkr h GLU 604 Ca -0.01 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1tkr h GLU 604 Cb 0.93 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.13 1tkr h GLU 604 CO 0.01 0.00 0.53 -0.44 -1.00 0.00 0.00 179.01 178.11 1tkr h ASP 605 N 0.00 0.75 -0.69 1.42 3.32 -0.24 -1.31 116.42 119.68 1tkr h ASP 605 Ca 0.12 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.19 1tkr h ASP 605 Cb 0.18 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 1tkr h ASP 605 CO -0.25 0.47 0.44 -0.61 -1.72 0.00 0.00 179.24 177.57 1tkr h GLN 606 N 0.84 0.86 -0.20 3.56 5.75 -1.39 0.17 115.11 124.70 1tkr h GLN 606 Ca 0.36 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 58.77 1tkr h GLN 606 Cb 0.31 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 1tkr h GLN 606 CO -0.13 0.57 -0.02 0.82 -2.65 0.00 0.00 178.83 177.42 1tkr h ILE 607 N 0.89 1.27 -0.16 2.39 2.04 -1.05 -2.91 117.51 119.98 1tkr h ILE 607 Ca 0.26 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 1tkr h ILE 607 Cb -0.05 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1tkr h ILE 607 CO -0.08 0.28 0.06 -0.33 0.00 0.00 0.00 178.15 178.09 1tkr h GLU 608 N 0.11 0.21 -0.66 2.37 4.39 -0.84 -1.70 114.58 118.46 1tkr h GLU 608 Ca 0.05 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.75 1tkr h GLU 608 Cb 0.43 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1tkr h GLU 608 CO 0.01 0.18 0.43 0.00 -1.16 0.00 0.00 179.01 178.47 1tkr h ALA 609 N 1.86 0.84 0.09 3.43 0.00 -0.47 0.49 119.26 125.50 1tkr h ALA 609 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1tkr h ALA 609 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1tkr h ALA 609 CO -0.01 0.24 -0.08 0.00 0.00 0.00 0.00 179.25 179.40 1tkr h ALA 610 N 1.25 -0.16 -0.68 0.00 0.00 -1.28 0.20 119.26 118.60 1tkr h ALA 610 Ca 0.25 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.26 1tkr h ALA 610 Cb -0.07 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 17.74 1tkr h ALA 610 CO -0.07 -0.60 0.21 0.00 0.00 0.00 0.00 179.25 178.79 1tkr h ARG 611 N -0.18 0.34 -0.23 0.00 3.08 -1.07 0.25 114.38 116.57 1tkr h ARG 611 Ca 0.00 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1tkr h ARG 611 Cb 0.17 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1tkr h ARG 611 CO -0.02 0.22 -0.15 1.96 -1.07 0.00 0.00 179.97 180.92 1tkr h GLN 612 N 0.35 0.38 -0.09 0.04 1.08 -0.33 -1.73 115.11 114.81 1tkr h GLN 612 Ca 0.36 -0.10 -0.06 0.00 -1.45 0.00 0.00 58.65 57.40 1tkr h GLN 612 Cb 0.54 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 1tkr h GLN 612 CO -0.40 0.53 -0.18 0.74 -0.95 0.00 0.00 178.83 178.56 1tkr h PHE 613 N 0.35 0.36 -0.54 2.96 0.04 0.24 -3.10 116.94 117.26 1tkr h PHE 613 Ca 0.07 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 1tkr h PHE 613 Cb 0.47 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.53 1tkr h PHE 613 CO 0.01 0.79 0.31 0.66 -0.60 0.00 0.00 178.31 179.48 1tkr h SER 614 N -0.17 0.64 -0.99 2.17 4.64 -0.56 -0.57 113.55 118.71 1tkr h SER 614 Ca 0.00 -0.04 0.16 0.00 -0.47 0.00 0.00 61.79 61.44 1tkr h SER 614 Cb 0.77 -0.16 -0.10 0.00 -0.31 0.00 0.00 62.40 62.60 1tkr h SER 614 CO 0.04 0.51 0.61 0.11 -0.87 0.00 0.00 176.83 177.22 1tkr h LYS 615 N 0.74 0.83 0.00 4.77 1.57 -1.25 0.62 116.57 123.85 1tkr h LYS 615 Ca 0.19 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1tkr h LYS 615 Cb -0.01 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.11 1tkr h LYS 615 CO -0.04 0.55 0.14 -1.33 -0.57 0.00 0.00 179.45 178.21 1tkr n MET 616 N -4.71 0.04 -0.36 3.15 2.81 -0.22 -4.83 117.12 113.00 1tkr n MET 616 Ca 0.21 0.46 0.00 0.00 -1.81 0.00 0.00 57.70 56.56 1tkr n MET 616 Cb 0.47 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 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 -1.34 2.28 1.57 3.03 0.00 0.22 -4.87 105.19 106.08 1tkr n GLY 617 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.00 1.77 -5.02 1.61 1.16 -1.26 -4.76 117.46 108.96 1tkr n PHE 618 Ca 0.00 -0.93 -0.32 0.00 -1.87 0.00 0.00 57.45 54.33 1tkr n PHE 618 Cb 0.00 -0.49 -0.15 0.00 -1.61 0.00 0.00 39.48 37.22 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 -2.87 2.56 -0.53 1.97 1.01 -1.26 -0.35 120.40 120.93 1tkr s VAL 619 Ca 0.51 -0.86 -0.24 0.00 0.00 0.00 0.00 61.98 61.38 1tkr s VAL 619 Cb 0.40 -2.01 0.04 0.00 0.00 0.00 0.00 36.38 34.80 1tkr s VAL 619 CO 0.12 0.55 0.93 -0.62 0.00 0.00 0.00 175.10 176.09 1tkr s ASP 620 N 0.10 6.38 0.47 3.32 2.15 0.73 -4.77 116.67 125.04 1tkr s ASP 620 Ca -0.09 -0.24 0.20 0.00 0.43 0.00 0.00 52.55 52.85 1tkr s ASP 620 Cb -0.15 -2.44 1.20 0.00 -0.30 0.00 0.00 42.92 41.23 1tkr s ASP 620 CO 0.05 -1.18 1.96 0.78 -0.17 0.00 0.00 175.17 176.61 1tkr h ASN 621 N 9.25 0.22 0.73 -0.34 2.35 -1.97 -0.79 115.58 125.03 1tkr h ASN 621 Ca -0.26 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1tkr h ASN 621 Cb 1.07 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.41 1tkr h ASN 621 CO 1.07 0.12 0.00 0.29 -1.65 0.00 0.00 177.43 177.26 1tkr n LYS 622 N -4.43 0.03 -3.45 0.81 5.02 -1.26 -4.10 118.16 110.78 1tkr n LYS 622 Ca 0.12 0.11 -0.26 0.00 -2.02 0.00 0.00 58.31 56.26 1tkr n LYS 622 Cb 0.55 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.97 1tkr n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1tkr n ARG 623 N -1.48 1.13 -3.99 1.97 1.74 -0.30 -4.80 116.66 110.93 1tkr n ARG 623 Ca 0.06 -3.75 -0.30 0.00 -0.77 0.00 0.00 57.85 53.09 1tkr n ARG 623 Cb 0.25 -1.79 -0.16 0.00 -1.02 0.00 0.00 32.46 29.74 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 -1.09 1.55 0.51 0.55 1.01 -1.26 -1.21 121.20 121.26 1tkr s ILE 624 Ca 0.33 -0.86 0.05 0.00 0.00 0.00 0.00 60.65 60.17 1tkr s ILE 624 Cb 0.08 -1.59 0.01 0.00 0.01 0.00 0.00 42.46 40.96 1tkr s ILE 624 CO -0.13 0.24 0.28 0.00 0.00 0.00 0.00 174.94 175.32 1tkr s ALA 625 N 1.45 4.20 -0.20 9.38 0.00 0.18 -0.71 121.76 136.06 1tkr s ALA 625 Ca 0.01 -1.26 -0.25 0.00 0.00 0.00 0.00 51.96 50.45 1tkr s ALA 625 Cb -0.15 -0.53 0.07 0.00 0.00 0.00 0.00 23.12 22.51 1tkr s ALA 625 CO -0.09 -0.30 0.67 -1.50 0.00 0.00 0.00 175.76 174.54 1tkr s ILE 626 N -2.75 0.00 0.09 0.00 2.07 -1.18 -0.50 121.20 118.93 1tkr s ILE 626 Ca 0.30 -0.01 -0.18 0.00 -1.41 0.00 0.00 60.65 59.35 1tkr s ILE 626 Cb -0.00 -0.94 0.04 0.00 0.13 0.00 0.00 42.46 41.68 1tkr s ILE 626 CO 0.18 -0.01 0.44 -1.66 -1.91 0.00 0.00 174.94 171.98 1tkr s TRP 627 N -0.02 -0.28 0.21 3.50 1.48 -0.46 -1.90 118.94 121.46 1tkr s TRP 627 Ca -0.03 0.12 -0.23 0.00 -1.06 0.00 0.00 56.10 54.90 1tkr s TRP 627 Cb -0.04 0.28 0.05 0.00 -1.16 0.00 0.00 33.47 32.60 1tkr s TRP 627 CO 0.03 -0.66 0.75 0.20 -4.06 0.00 0.00 176.95 173.21 1tkr s GLY 628 N -2.42 -0.26 -0.09 3.67 0.00 -1.06 -0.59 107.32 106.57 1tkr s GLY 628 Ca -0.01 0.05 0.04 0.00 0.00 0.00 0.00 44.72 44.80 1tkr s GLY 628 CO -0.07 0.02 -0.21 0.86 0.00 0.00 0.00 173.10 173.69 1tkr s TRP 629 N -3.70 2.24 0.00 1.90 -0.11 -1.25 -1.92 118.94 116.10 1tkr s TRP 629 Ca 0.09 -0.88 0.00 0.00 1.22 0.00 0.00 56.10 56.52 1tkr s TRP 629 Cb -0.04 -1.52 0.00 0.00 -1.50 0.00 0.00 33.47 30.41 1tkr s TRP 629 CO 0.00 -0.36 0.00 0.45 -4.62 0.00 0.00 176.95 172.42 1tkr n SER 630 N 3.54 0.00 0.01 5.86 2.88 0.26 -1.41 113.62 124.76 1tkr n SER 630 Ca -0.20 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1tkr n SER 630 Cb 0.53 0.00 0.53 0.00 -0.75 0.00 0.00 64.21 64.51 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 0.32 -0.41 0.66 5.03 -1.84 0.18 116.97 120.92 1tkr h TYR 631 Ca 0.00 0.01 -0.10 0.00 2.58 0.00 0.00 58.73 61.22 1tkr h TYR 631 Cb 0.00 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.16 1tkr h TYR 631 CO 0.00 0.18 -0.15 0.78 -1.32 0.00 0.00 178.16 177.65 1tkr h GLY 632 N 0.32 0.89 1.02 1.82 0.00 -1.23 -0.90 103.07 104.99 1tkr h GLY 632 Ca 0.19 -0.77 -0.02 0.00 0.00 0.00 0.00 47.33 46.73 1tkr h GLY 632 CO -0.04 0.70 0.44 -1.33 0.00 0.00 0.00 176.54 176.30 1tkr h GLY 633 N 0.63 1.21 0.81 4.60 0.00 -0.67 0.38 103.07 110.04 1tkr h GLY 633 Ca 0.10 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 1tkr h GLY 633 CO 0.05 0.53 -0.21 -1.82 0.00 0.00 0.00 176.54 175.09 1tkr h TYR 634 N 1.13 -0.56 -0.22 5.60 3.20 -0.42 0.62 116.97 126.32 1tkr h TYR 634 Ca 0.28 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 1tkr h TYR 634 Cb 0.04 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 1tkr h TYR 634 CO 0.00 -0.32 0.09 0.28 -1.64 0.00 0.00 178.16 176.58 1tkr h VAL 635 N -0.49 1.16 -0.95 1.81 2.07 -0.92 -0.02 116.25 118.91 1tkr h VAL 635 Ca -0.01 -0.48 0.17 0.00 0.82 0.00 0.00 66.70 67.19 1tkr h VAL 635 Cb 0.43 1.07 -0.10 0.00 -1.52 0.00 0.00 31.29 31.17 1tkr h VAL 635 CO -0.02 0.16 0.56 0.74 0.02 0.00 0.00 177.57 179.03 1tkr h THR 636 N 0.21 0.74 -0.07 2.57 2.02 -0.05 0.20 112.91 118.53 1tkr h THR 636 Ca 0.07 -0.26 -0.23 0.00 0.77 0.00 0.00 66.41 66.77 1tkr h THR 636 Cb 0.17 -0.07 0.01 0.00 -1.74 0.00 0.00 68.15 66.52 1tkr h THR 636 CO -0.01 0.14 -0.84 0.28 0.37 0.00 0.00 175.52 175.46 1tkr h SER 637 N 0.75 0.86 -0.08 4.18 0.02 -0.49 -1.50 113.55 117.29 1tkr h SER 637 Ca 0.53 -0.69 -0.05 0.00 -0.84 0.00 0.00 61.79 60.75 1tkr h SER 637 Cb 0.76 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 1tkr h SER 637 CO -0.36 1.43 -0.07 0.24 -1.14 0.00 0.00 176.83 176.93 1tkr h MET 638 N 0.38 0.34 0.04 3.45 2.86 0.10 -2.45 114.93 119.65 1tkr h MET 638 Ca -0.09 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1tkr h MET 638 Cb 1.49 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 33.10 1tkr h MET 638 CO 0.17 0.43 -0.02 0.28 1.06 0.00 0.00 176.91 178.82 1tkr h VAL 639 N 0.33 1.33 -0.05 -2.22 2.07 -0.62 -3.01 116.25 114.07 1tkr h VAL 639 Ca 0.07 -1.41 0.01 0.00 0.82 0.00 0.00 66.70 66.19 1tkr h VAL 639 Cb 0.33 2.24 -0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1tkr h VAL 639 CO 0.02 0.35 0.24 -0.07 0.02 0.00 0.00 177.57 178.12 1tkr h LEU 640 N -0.71 0.00 -3.37 2.57 3.38 -1.09 0.18 115.31 116.27 1tkr h LEU 640 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1tkr h LEU 640 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1tkr h LEU 640 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 1tkr n GLY 641 N -1.23 3.52 0.18 0.83 0.00 -0.94 -4.41 105.19 103.14 1tkr n GLY 641 Ca -0.01 -0.97 0.12 0.00 0.00 0.00 0.00 46.02 45.16 1tkr n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1tkr h SER 642 N 2.81 0.00 -0.16 1.61 4.64 -0.50 -3.44 113.55 118.51 1tkr h SER 642 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1tkr h SER 642 Cb 1.64 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.71 1tkr h SER 642 CO 0.33 0.01 -0.06 0.61 -0.87 0.00 0.00 176.83 176.84 1tkr n GLY 643 N 1.13 0.64 0.08 -0.77 0.00 -1.26 -4.93 105.19 100.08 1tkr n GLY 643 Ca 0.02 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.07 0.00 1.61 4.64 -1.91 -3.47 113.55 114.35 1tkr h SER 644 Ca -0.07 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1tkr h SER 644 Cb 0.26 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1tkr h SER 644 CO 0.10 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 176.88 1tkr n GLY 645 N -0.40 0.86 0.10 -0.77 0.00 -1.26 -4.98 105.19 98.74 1tkr n GLY 645 Ca -0.08 -0.39 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 1tkr n GLY 645 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1tkr n VAL 646 N -2.33 1.41 -4.17 1.61 0.31 -1.26 -4.95 118.33 108.95 1tkr n VAL 646 Ca 0.00 -0.85 -0.34 0.00 -0.01 0.00 0.00 64.34 63.13 1tkr n VAL 646 Cb 0.03 -0.51 -0.08 0.00 -0.91 0.00 0.00 33.84 32.37 1tkr n VAL 646 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1tkr s PHE 647 N -2.50 3.29 -0.06 3.52 0.08 -1.26 -4.55 117.98 116.50 1tkr s PHE 647 Ca -0.10 0.26 0.04 0.00 0.12 0.00 0.00 56.93 57.25 1tkr s PHE 647 Cb 0.06 -1.79 -0.25 0.00 -0.57 0.00 0.00 43.02 40.47 1tkr s PHE 647 CO 0.83 0.55 0.59 -0.22 -0.10 0.00 0.00 175.22 176.87 1tkr h LYS 648 N 4.68 0.12 -3.17 0.44 3.64 -1.23 -3.47 116.57 117.58 1tkr h LYS 648 Ca -0.51 -0.20 0.04 0.00 -1.27 0.00 0.00 60.65 58.70 1tkr h LYS 648 Cb 1.19 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 33.03 1tkr h LYS 648 CO 0.58 0.82 0.14 0.00 -2.27 0.00 0.00 179.45 178.72 1tkr s GLY 650 N -2.95 -0.48 -0.07 0.00 0.00 -0.61 -3.13 107.32 100.08 1tkr s GLY 650 Ca 0.14 0.68 0.02 0.00 0.00 0.00 0.00 44.72 45.56 1tkr s GLY 650 CO 0.08 0.22 -0.11 -0.42 0.00 0.00 0.00 173.10 172.87 1tkr s ILE 651 N -3.40 1.04 -0.21 0.90 1.01 -0.80 -2.08 121.20 117.67 1tkr s ILE 651 Ca 0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 1tkr s ILE 651 Cb -0.01 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.48 1tkr s ILE 651 CO -0.09 0.34 -0.09 0.00 0.00 0.00 0.00 174.94 175.10 1tkr s ALA 652 N 0.86 2.65 -0.16 9.38 0.00 -0.66 -2.56 121.76 131.26 1tkr s ALA 652 Ca -0.11 -1.23 -0.03 0.00 0.00 0.00 0.00 51.96 50.58 1tkr s ALA 652 Cb -0.15 -1.54 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 1tkr s ALA 652 CO 0.01 -0.47 -0.05 0.08 0.00 0.00 0.00 175.76 175.34 1tkr s VAL 653 N 1.40 3.73 -1.37 0.00 1.01 -0.81 -2.12 120.40 122.24 1tkr s VAL 653 Ca 0.05 -0.41 -0.17 0.00 0.00 0.00 0.00 61.98 61.45 1tkr s VAL 653 Cb -0.14 -2.64 0.02 0.00 0.00 0.00 0.00 36.38 33.62 1tkr s VAL 653 CO -0.06 0.48 0.38 0.00 0.00 0.00 0.00 175.10 175.90 1tkr n ALA 654 N 3.74 -2.31 -1.91 5.51 0.00 -0.01 -0.57 120.51 124.95 1tkr n ALA 654 Ca -0.17 -0.48 -0.29 0.00 0.00 0.00 0.00 53.44 52.50 1tkr n ALA 654 Cb 0.52 -1.84 0.10 0.00 0.00 0.00 0.00 19.45 18.23 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 -7.29 1.80 -0.15 0.00 0.04 -1.26 -2.97 135.00 125.17 1tkr s PRO 655 Ca 0.25 -0.02 -0.06 0.00 0.04 0.00 0.00 61.00 61.21 1tkr s PRO 655 Cb -0.13 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 1tkr s PRO 655 CO 0.97 -1.67 0.07 0.08 0.04 0.00 0.00 177.00 176.50 1tkr s VAL 656 N -3.58 4.92 -0.24 -0.36 1.01 -1.25 -4.57 120.40 116.33 1tkr s VAL 656 Ca 0.64 0.00 -0.08 0.00 0.00 0.00 0.00 61.98 62.53 1tkr s VAL 656 Cb -0.10 -3.17 -0.12 0.00 0.00 0.00 0.00 36.38 32.99 1tkr s VAL 656 CO 0.49 0.53 -0.28 -1.54 0.00 0.00 0.00 175.10 174.30 1tkr n SER 657 N 2.83 1.86 -3.83 3.32 3.41 -1.26 -4.40 113.62 115.55 1tkr n SER 657 Ca -0.18 0.18 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 1tkr n SER 657 Cb 0.53 -0.62 -0.15 0.00 -0.26 0.00 0.00 64.21 63.71 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 -2.45 -0.01 0.08 4.33 1.70 -1.26 -1.41 118.95 119.93 1tkr s ARG 658 Ca -0.33 0.08 0.04 0.00 -0.47 0.00 0.00 55.73 55.05 1tkr s ARG 658 Cb 0.12 -0.12 0.23 0.00 -0.57 0.00 0.00 34.95 34.61 1tkr s ARG 658 CO 0.46 -0.08 1.05 0.91 -1.08 0.00 0.00 175.30 176.56 1tkr n TRP 659 N 3.58 0.14 1.09 5.89 7.02 -1.26 -0.94 117.44 132.97 1tkr n TRP 659 Ca -0.19 0.08 0.14 0.00 -1.02 0.00 0.00 57.50 56.50 1tkr n TRP 659 Cb 0.55 -0.53 0.59 0.00 -2.42 0.00 0.00 31.31 29.50 1tkr n TRP 659 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1tkr n GLU 660 N -1.59 0.11 0.00 -0.99 1.02 -1.26 -3.30 120.64 114.63 1tkr n GLU 660 Ca -0.00 -0.02 0.11 0.00 -0.02 0.00 0.00 57.16 57.23 1tkr n GLU 660 Cb 0.11 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.10 1tkr n GLU 660 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1tkr n TYR 661 N -1.43 0.00 -2.92 -0.32 4.01 -0.11 -3.72 117.16 112.67 1tkr n TYR 661 Ca 0.08 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.62 1tkr n TYR 661 Cb 0.32 -0.10 0.02 0.00 -0.31 0.00 0.00 39.34 39.27 1tkr n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1tkr s TYR 662 N -2.89 2.98 0.79 -0.72 5.04 -1.21 -4.82 117.35 116.52 1tkr s TYR 662 Ca 0.12 -0.04 -0.13 0.00 -2.44 0.00 0.00 57.07 54.57 1tkr s TYR 662 Cb 0.17 -2.46 0.07 0.00 0.35 0.00 0.00 41.96 40.09 1tkr s TYR 662 CO 0.74 -0.53 1.17 0.16 -1.34 0.00 0.00 175.55 175.75 1tkr s ASP 663 N -4.32 3.91 0.06 4.32 1.47 -1.26 -1.43 116.67 119.41 1tkr s ASP 663 Ca 0.53 2.22 -0.22 0.00 1.18 0.00 0.00 52.55 56.26 1tkr s ASP 663 Cb -0.10 -2.57 -0.14 0.00 -0.34 0.00 0.00 42.92 39.77 1tkr s ASP 663 CO 0.36 -2.45 1.53 0.77 0.68 0.00 0.00 175.17 176.06 1tkr h SER 664 N -0.84 0.16 -0.37 2.11 4.64 -1.28 -2.13 113.55 115.84 1tkr h SER 664 Ca -0.46 -0.25 0.05 0.00 -0.47 0.00 0.00 61.79 60.66 1tkr h SER 664 Cb 1.28 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 63.28 1tkr h SER 664 CO 0.48 0.37 0.11 0.58 -0.87 0.00 0.00 176.83 177.50 1tkr h VAL 665 N -0.06 0.86 0.06 0.95 2.07 -1.93 -0.27 116.25 117.94 1tkr h VAL 665 Ca 0.03 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1tkr h VAL 665 Cb 0.28 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1tkr h VAL 665 CO 0.00 0.05 -0.03 0.22 0.02 0.00 0.00 177.57 177.83 1tkr h TYR 666 N 0.25 -0.08 0.61 1.57 5.03 -1.94 -3.05 116.97 119.36 1tkr h TYR 666 Ca 0.17 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.46 1tkr h TYR 666 Cb 0.17 0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.46 1tkr h TYR 666 CO -0.16 0.50 -0.49 1.15 -1.32 0.00 0.00 178.16 177.84 1tkr h THR 667 N -0.87 0.03 -0.31 1.81 2.02 -1.38 -2.70 112.91 111.51 1tkr h THR 667 Ca -0.01 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.25 1tkr h THR 667 Cb 0.62 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1tkr h THR 667 CO 0.01 0.00 0.22 -0.33 0.37 0.00 0.00 175.52 175.80 1tkr h GLU 668 N -1.07 0.05 -0.75 6.66 5.08 -1.21 0.38 114.58 123.72 1tkr h GLU 668 Ca -0.08 -0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.41 1tkr h GLU 668 Cb 0.90 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.08 1tkr h GLU 668 CO 0.00 0.04 0.50 -0.09 -1.00 0.00 0.00 179.01 178.46 1tkr h ARG 669 N 0.06 0.48 0.00 2.33 2.43 -1.36 0.84 114.38 119.16 1tkr h ARG 669 Ca 0.15 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.11 1tkr h ARG 669 Cb 0.52 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 1tkr h ARG 669 CO -0.01 0.32 -1.68 0.66 -1.51 0.00 0.00 179.97 177.75 1tkr n TYR 670 N -4.49 0.00 0.25 2.20 4.01 -0.54 -4.63 117.16 113.95 1tkr n TYR 670 Ca 0.14 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.99 1tkr n TYR 670 Cb 0.46 -0.48 -0.06 0.00 -0.31 0.00 0.00 39.34 38.95 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 -2.34 0.50 0.00 -0.72 2.81 0.12 0.01 117.12 117.50 1tkr n MET 671 Ca -0.16 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.70 1tkr n MET 671 Cb 0.80 -1.64 0.00 0.00 -0.71 0.00 0.00 33.22 31.67 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 1.28 0.10 3.56 3.03 0.00 0.28 -4.66 105.19 108.78 1tkr n GLY 672 Ca -0.01 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.63 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 3.12 0.00 0.99 1.02 -1.26 -4.25 118.68 118.30 1tkr s LEU 673 Ca 0.00 -0.05 -0.04 0.00 0.02 0.00 0.00 54.13 54.06 1tkr s LEU 673 Cb 0.00 -1.68 -0.20 0.00 0.02 0.00 0.00 46.19 44.33 1tkr s LEU 673 CO 0.00 0.35 3.00 -0.81 0.02 0.00 0.00 176.35 178.91 1tkr n PRO 674 N 2.31 1.61 -4.38 1.29 -0.04 -1.26 -1.36 135.00 133.16 1tkr n PRO 674 Ca -0.18 -0.75 -0.30 0.00 -0.04 0.00 0.00 63.50 62.24 1tkr n PRO 674 Cb 0.53 -1.82 -0.12 0.00 -0.04 0.00 0.00 33.50 32.05 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 1.16 2.81 0.62 0.52 -4.23 -1.26 -4.58 115.64 110.68 1tkr s THR 675 Ca 0.50 -1.44 0.34 0.00 -1.18 0.00 0.00 61.69 59.91 1tkr s THR 675 Cb 0.24 -2.27 0.38 0.00 1.34 0.00 0.00 72.50 72.19 1tkr s THR 675 CO 0.00 0.15 2.24 1.55 -0.54 0.00 0.00 174.62 178.02 1tkr h PRO 676 N 3.91 0.00 0.00 3.99 0.13 -1.95 -0.66 132.00 137.41 1tkr h PRO 676 Ca -0.49 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.47 1tkr h PRO 676 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1tkr h PRO 676 CO 0.46 0.00 -0.81 0.93 -0.23 0.00 0.00 178.00 178.35 1tkr h GLU 677 N 0.00 0.00 0.00 0.86 3.07 -1.95 -3.44 114.58 113.12 1tkr h GLU 677 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1tkr h GLU 677 Cb 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 1tkr h GLU 677 CO -0.00 0.81 0.00 -3.47 -1.40 0.00 0.00 179.01 174.95 1tkr n ASP 678 N -3.51 0.00 -1.12 1.42 -0.08 -0.42 -5.00 116.55 107.84 1tkr n ASP 678 Ca -0.00 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.32 1tkr n ASP 678 Cb 0.80 0.00 0.09 0.00 2.34 0.00 0.00 41.12 44.35 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 1.25 -0.25 1.67 4.05 -0.47 -4.86 115.26 116.66 1tkr n ASN 679 Ca 0.00 -2.71 0.00 0.00 0.45 0.00 0.00 54.58 52.32 1tkr n ASN 679 Cb 0.00 -0.38 0.12 0.00 1.23 0.00 0.00 39.78 40.75 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 0.96 0.55 -0.77 1.20 5.85 -1.10 -2.65 115.31 119.35 1tkr h LEU 680 Ca -0.14 0.04 0.17 0.00 0.84 0.00 0.00 57.88 58.80 1tkr h LEU 680 Cb 1.55 -0.06 -0.13 0.00 0.37 0.00 0.00 40.66 42.38 1tkr h LEU 680 CO 0.06 0.34 -0.00 0.44 -0.34 0.00 0.00 178.44 178.93 1tkr h ASP 681 N 0.69 -0.37 1.05 1.25 3.32 -1.89 0.36 116.42 120.82 1tkr h ASP 681 Ca 0.34 0.20 -0.10 0.00 0.02 0.00 0.00 57.03 57.49 1tkr h ASP 681 Cb 0.28 0.36 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 1tkr h ASP 681 CO -0.22 -0.19 -0.46 -0.74 -1.72 0.00 0.00 179.24 175.91 1tkr h HIS 682 N 0.09 0.00 -0.78 4.55 2.76 -1.85 -2.95 115.15 116.96 1tkr h HIS 682 Ca 0.42 0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.61 1tkr h HIS 682 Cb 0.74 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.65 1tkr h HIS 682 CO -0.44 0.46 0.51 1.88 -1.30 0.00 0.00 177.93 179.04 1tkr h TYR 683 N 0.00 0.96 0.00 5.26 -1.99 -0.77 -2.25 116.97 118.17 1tkr h TYR 683 Ca -0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1tkr h TYR 683 Cb 1.11 -0.32 0.00 0.00 2.00 0.00 0.00 36.73 39.52 1tkr h TYR 683 CO 0.00 0.57 0.00 0.00 -0.00 0.00 0.00 178.16 178.73 1tkr h ARG 684 N 1.01 0.00 -0.00 4.88 2.47 -1.40 -3.22 114.38 118.11 1tkr h ARG 684 Ca 0.30 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.02 1tkr h ARG 684 Cb -0.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.27 1tkr h ARG 684 CO -0.09 0.00 -0.54 -1.71 0.56 0.00 0.00 179.97 178.19 1tkr n ASN 685 N -2.94 0.87 -1.07 7.04 2.85 -0.99 -4.21 115.26 116.81 1tkr n ASN 685 Ca 0.04 -0.67 0.07 0.00 -0.11 0.00 0.00 54.58 53.90 1tkr n ASN 685 Cb 0.48 0.39 0.27 0.00 1.24 0.00 0.00 39.78 42.16 1tkr n ASN 685 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1tkr n SER 686 N -1.15 4.04 -4.91 1.20 3.41 -0.88 -5.01 113.62 110.33 1tkr n SER 686 Ca 0.07 -3.07 -0.28 0.00 -0.26 0.00 0.00 58.87 55.33 1tkr n SER 686 Cb 0.35 -0.58 0.02 0.00 -0.26 0.00 0.00 64.21 63.75 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 -2.86 4.01 -0.14 6.66 -4.23 -1.26 -4.78 115.64 113.04 1tkr s THR 687 Ca 0.44 0.20 0.17 0.00 -1.18 0.00 0.00 61.69 61.33 1tkr s THR 687 Cb 0.36 -3.59 -0.09 0.00 1.34 0.00 0.00 72.50 70.52 1tkr s THR 687 CO 0.09 -0.64 0.93 0.58 -0.54 0.00 0.00 174.62 175.04 1tkr h VAL 688 N -0.17 0.46 -0.14 2.29 2.07 -1.57 -3.34 116.25 115.86 1tkr h VAL 688 Ca -0.46 -1.87 -0.05 0.00 0.82 0.00 0.00 66.70 65.15 1tkr h VAL 688 Cb 1.24 2.00 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 1tkr h VAL 688 CO 0.61 0.26 -0.14 0.24 0.02 0.00 0.00 177.57 178.57 1tkr h MET 689 N 0.00 0.21 0.00 1.57 2.86 -1.91 -1.94 114.93 115.72 1tkr h MET 689 Ca -0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 1tkr h MET 689 Cb 1.47 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.10 1tkr h MET 689 CO 0.04 0.36 0.00 -1.13 1.06 0.00 0.00 176.91 177.24 1tkr n SER 690 N -4.27 0.00 -0.55 1.22 3.41 -1.25 -2.01 113.62 110.17 1tkr n SER 690 Ca -0.01 0.31 0.06 0.00 -0.26 0.00 0.00 58.87 58.97 1tkr n SER 690 Cb 0.27 -0.41 0.10 0.00 -0.26 0.00 0.00 64.21 63.91 1tkr n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1tkr n ARG 691 N -1.41 1.63 -0.31 4.33 1.74 -0.73 -4.74 116.66 117.17 1tkr n ARG 691 Ca 0.05 -1.59 0.11 0.00 -0.77 0.00 0.00 57.85 55.65 1tkr n ARG 691 Cb 0.16 -1.24 0.24 0.00 -1.02 0.00 0.00 32.46 30.59 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 2.17 1.03 -0.74 7.54 0.00 -1.38 -1.20 119.26 126.68 1tkr h ALA 692 Ca 0.00 0.29 0.07 0.00 0.00 0.00 0.00 54.91 55.27 1tkr h ALA 692 Cb 0.60 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 1tkr h ALA 692 CO 0.00 -0.49 0.48 1.49 0.00 0.00 0.00 179.25 180.73 1tkr h GLU 693 N 0.07 0.74 0.00 0.00 4.57 -1.85 -1.60 114.58 116.51 1tkr h GLU 693 Ca 0.52 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.66 1tkr h GLU 693 Cb 1.01 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 1tkr h GLU 693 CO -0.79 0.49 0.00 0.09 -1.18 0.00 0.00 179.01 177.61 1tkr n ASN 694 N -4.48 0.30 0.00 1.04 4.13 -0.45 -2.89 115.26 112.90 1tkr n ASN 694 Ca 0.11 0.55 0.06 0.00 1.68 0.00 0.00 54.58 56.99 1tkr n ASN 694 Cb 0.24 -0.62 0.32 0.00 -1.54 0.00 0.00 39.78 38.18 1tkr n ASN 694 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1tkr n PHE 695 N -1.81 0.00 0.73 3.10 3.72 -0.60 -2.43 117.46 120.18 1tkr n PHE 695 Ca 0.04 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.55 1tkr n PHE 695 Cb 0.28 -0.29 0.45 0.00 -0.94 0.00 0.00 39.48 38.98 1tkr n PHE 695 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1tkr n LYS 696 N -1.29 0.00 -0.11 -1.08 5.02 -1.14 -2.97 118.16 116.59 1tkr n LYS 696 Ca 0.06 0.13 0.12 0.00 -2.02 0.00 0.00 58.31 56.60 1tkr n LYS 696 Cb 0.10 -1.50 0.17 0.00 -0.02 0.00 0.00 35.03 33.79 1tkr n LYS 696 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1tkr n GLN 697 N -1.50 2.44 -3.95 1.97 6.02 -1.02 -4.97 117.38 116.37 1tkr n GLN 697 Ca 0.05 -2.14 -0.09 0.00 -0.01 0.00 0.00 57.00 54.82 1tkr n GLN 697 Cb 0.25 -1.49 -0.09 0.00 1.02 0.00 0.00 30.24 29.92 1tkr n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1tkr s VAL 698 N -1.71 0.15 -0.27 5.09 -7.23 -1.16 -4.95 120.40 110.32 1tkr s VAL 698 Ca 0.35 -1.21 -0.24 0.00 -1.81 0.00 0.00 61.98 59.07 1tkr s VAL 698 Cb 0.22 -0.99 -0.00 0.00 0.56 0.00 0.00 36.38 36.16 1tkr s VAL 698 CO 0.31 -0.67 0.80 -1.61 -0.31 0.00 0.00 175.10 173.62 1tkr s GLU 699 N -2.85 4.10 0.00 4.82 2.02 -0.92 -4.97 118.70 120.89 1tkr s GLU 699 Ca -0.03 0.78 0.03 0.00 0.02 0.00 0.00 54.97 55.78 1tkr s GLU 699 Cb 0.00 -3.68 -0.03 0.00 0.10 0.00 0.00 34.13 30.52 1tkr s GLU 699 CO -0.06 -0.57 -0.07 -0.47 0.02 0.00 0.00 175.26 174.11 1tkr s TYR 700 N 2.86 2.88 -0.20 1.61 5.04 -1.26 -1.58 117.35 126.71 1tkr s TYR 700 Ca 0.33 -0.04 -0.01 0.00 -2.44 0.00 0.00 57.07 54.91 1tkr s TYR 700 Cb -0.15 -1.61 0.05 0.00 0.35 0.00 0.00 41.96 40.61 1tkr s TYR 700 CO 0.09 0.37 -0.03 -1.17 -1.34 0.00 0.00 175.55 173.48 1tkr s LEU 701 N -1.40 1.81 -0.16 6.97 0.20 -0.88 -0.62 118.68 124.60 1tkr s LEU 701 Ca 0.17 -0.89 -0.07 0.00 0.69 0.00 0.00 54.13 54.03 1tkr s LEU 701 Cb -0.11 -0.91 -0.04 0.00 -0.43 0.00 0.00 46.19 44.70 1tkr s LEU 701 CO 0.07 -0.24 0.08 -0.22 -0.29 0.00 0.00 176.35 175.75 1tkr s LEU 702 N 1.62 3.97 -0.00 -0.68 0.20 0.29 -1.66 118.68 122.42 1tkr s LEU 702 Ca -0.02 0.20 -0.05 0.00 0.69 0.00 0.00 54.13 54.94 1tkr s LEU 702 Cb -0.17 -1.99 -0.00 0.00 -0.43 0.00 0.00 46.19 43.60 1tkr s LEU 702 CO -0.07 0.25 0.10 -0.63 -0.29 0.00 0.00 176.35 175.71 1tkr s ILE 703 N -0.11 0.07 -0.24 6.68 1.01 -0.90 -0.41 121.20 127.31 1tkr s ILE 703 Ca 0.08 -0.61 -0.28 0.00 0.00 0.00 0.00 60.65 59.84 1tkr s ILE 703 Cb -0.12 -0.35 0.15 0.00 0.01 0.00 0.00 42.46 42.15 1tkr s ILE 703 CO 0.01 -0.33 1.16 -2.28 0.00 0.00 0.00 174.94 173.49 1tkr s HIS 704 N -1.12 -0.27 0.06 3.97 2.46 -1.11 -0.83 115.29 118.44 1tkr s HIS 704 Ca -0.12 0.56 -0.23 0.00 0.47 0.00 0.00 55.06 55.73 1tkr s HIS 704 Cb -0.07 0.44 -0.06 0.00 -0.13 0.00 0.00 32.58 32.77 1tkr s HIS 704 CO 0.01 -0.20 0.71 0.20 -2.47 0.00 0.00 174.74 172.99 1tkr s GLY 705 N -0.57 2.76 0.29 1.59 0.00 -1.26 -1.59 107.32 108.53 1tkr s GLY 705 Ca 0.03 0.21 0.25 0.00 0.00 0.00 0.00 44.72 45.21 1tkr s GLY 705 CO -0.05 0.91 1.74 -0.91 0.00 0.00 0.00 173.10 174.79 1tkr h THR 706 N 3.92 0.00 -0.40 0.90 1.35 -1.39 -3.12 112.91 114.16 1tkr h THR 706 Ca -0.45 -0.27 -0.24 0.00 -0.55 0.00 0.00 66.41 64.90 1tkr h THR 706 Cb 1.21 1.03 -0.15 0.00 -1.73 0.00 0.00 68.15 68.50 1tkr h THR 706 CO 0.69 0.00 -0.21 0.00 -0.25 0.00 0.00 175.52 175.75 1tkr n ALA 707 N -1.81 4.48 -2.58 6.62 0.00 -0.78 -4.73 120.51 121.71 1tkr n ALA 707 Ca 0.02 -3.31 -0.43 0.00 0.00 0.00 0.00 53.44 49.72 1tkr n ALA 707 Cb 0.24 -0.68 -0.02 0.00 0.00 0.00 0.00 19.45 18.99 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 -2.78 6.71 0.33 0.00 -1.08 -1.18 -4.22 116.67 114.45 1tkr s ASP 708 Ca 0.46 0.76 0.18 0.00 -0.52 0.00 0.00 52.55 53.42 1tkr s ASP 708 Cb 0.41 -2.55 0.19 0.00 -1.46 0.00 0.00 42.92 39.52 1tkr s ASP 708 CO -0.01 -1.13 1.51 -2.24 0.52 0.00 0.00 175.17 173.82 1tkr h ASP 709 N 8.98 0.00 0.00 -0.34 2.03 -1.93 -3.33 116.42 121.82 1tkr h ASP 709 Ca -0.23 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.07 1tkr h ASP 709 Cb 1.07 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.57 1tkr h ASP 709 CO 1.09 0.36 0.00 -3.20 -1.03 0.00 0.00 179.24 176.45 1tkr n ASN 710 N -3.20 0.00 -4.36 4.15 4.05 -1.26 -4.66 115.26 109.98 1tkr n ASN 710 Ca 0.02 0.00 -0.45 0.00 0.45 0.00 0.00 54.58 54.60 1tkr n ASN 710 Cb 0.66 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 41.63 1tkr n ASN 710 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1tkr s VAL 711 N 0.00 5.03 0.64 3.44 1.01 -1.26 -4.86 120.40 124.41 1tkr s VAL 711 Ca 0.00 -1.41 -0.17 0.00 0.00 0.00 0.00 61.98 60.40 1tkr s VAL 711 Cb 0.00 -4.48 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 1tkr s VAL 711 CO 0.00 -1.09 0.80 1.41 0.00 0.00 0.00 175.10 176.23 1tkr n HIS 712 N 5.71 0.20 0.24 5.22 8.25 -1.25 -4.74 115.22 128.84 1tkr n HIS 712 Ca -0.04 0.41 0.08 0.00 -0.26 0.00 0.00 57.72 57.91 1tkr n HIS 712 Cb 0.43 -2.05 0.62 0.00 1.12 0.00 0.00 29.99 30.11 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 0.12 0.04 -0.91 4.41 3.57 -1.77 -1.31 116.94 121.08 1tkr h PHE 713 Ca -0.47 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.27 1tkr h PHE 713 Cb 1.36 -0.01 -0.13 0.00 2.79 0.00 0.00 35.95 39.96 1tkr h PHE 713 CO 0.36 0.03 0.39 0.37 -2.23 0.00 0.00 178.31 177.23 1tkr h GLN 714 N 0.04 0.34 -0.76 1.11 4.15 -1.95 0.27 115.11 118.31 1tkr h GLN 714 Ca 0.01 -0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.46 1tkr h GLN 714 Cb 0.01 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 27.57 1tkr h GLN 714 CO -0.00 0.22 0.46 1.96 -1.93 0.00 0.00 178.83 179.55 1tkr h GLN 715 N 0.35 0.84 0.00 1.69 4.20 -1.56 -0.05 115.11 120.58 1tkr h GLN 715 Ca 0.59 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 59.19 1tkr h GLN 715 Cb 1.17 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 1tkr h GLN 715 CO -0.57 0.56 -0.37 0.77 -0.67 0.00 0.00 178.83 178.54 1tkr h SER 716 N 0.87 0.00 -0.62 1.46 0.02 -1.36 -3.12 113.55 110.80 1tkr h SER 716 Ca 0.33 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.19 1tkr h SER 716 Cb 0.12 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1tkr h SER 716 CO -0.15 0.25 0.04 0.00 -1.14 0.00 0.00 176.83 175.82 1tkr h ALA 717 N 1.75 0.88 0.00 3.77 0.00 0.12 -1.57 119.26 124.21 1tkr h ALA 717 Ca -0.01 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 1tkr h ALA 717 Cb 1.20 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1tkr h ALA 717 CO 0.03 0.67 -0.58 1.96 0.00 0.00 0.00 179.25 181.32 1tkr h GLN 718 N 0.99 0.00 0.33 0.00 1.08 -1.06 -2.56 115.11 113.89 1tkr h GLN 718 Ca 0.18 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1tkr h GLN 718 Cb 0.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 1tkr h GLN 718 CO 0.02 0.58 -0.16 0.82 -0.95 0.00 0.00 178.83 179.15 1tkr h ILE 719 N 0.00 0.62 -0.57 2.54 2.04 -1.38 -2.02 117.51 118.75 1tkr h ILE 719 Ca -0.01 -0.62 0.07 0.00 1.00 0.00 0.00 64.86 65.31 1tkr h ILE 719 Cb 1.07 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.99 1tkr h ILE 719 CO 0.08 0.11 0.24 0.77 0.00 0.00 0.00 178.15 179.34 1tkr h SER 720 N -0.83 0.28 -0.64 1.72 4.64 -1.35 -1.78 113.55 115.59 1tkr h SER 720 Ca -0.05 0.06 0.05 0.00 -0.47 0.00 0.00 61.79 61.38 1tkr h SER 720 Cb 0.52 0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 62.58 1tkr h SER 720 CO 0.08 0.18 0.36 0.50 -0.87 0.00 0.00 176.83 177.08 1tkr h LYS 721 N 0.44 0.66 -0.67 4.77 3.64 -1.45 -0.52 116.57 123.44 1tkr h LYS 721 Ca 0.27 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.54 1tkr h LYS 721 Cb 0.28 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1tkr h LYS 721 CO -0.25 0.44 0.14 0.00 -2.27 0.00 0.00 179.45 177.51 1tkr h ALA 722 N 1.32 0.98 -0.72 5.00 0.00 -0.71 -1.53 119.26 123.60 1tkr h ALA 722 Ca 0.28 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1tkr h ALA 722 Cb 0.14 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1tkr h ALA 722 CO -0.16 0.65 0.19 -0.07 0.00 0.00 0.00 179.25 179.86 1tkr h LEU 723 N 1.02 1.08 -1.14 0.00 3.38 -0.70 -2.26 115.31 116.69 1tkr h LEU 723 Ca 0.21 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1tkr h LEU 723 Cb 0.39 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1tkr h LEU 723 CO 0.01 1.02 -0.16 0.58 0.09 0.00 0.00 178.44 179.99 1tkr h VAL 724 N 1.09 1.23 -0.57 1.22 2.07 -0.78 0.12 116.25 120.63 1tkr h VAL 724 Ca 0.23 -1.02 -0.09 0.00 0.82 0.00 0.00 66.70 66.64 1tkr h VAL 724 Cb 0.35 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1tkr h VAL 724 CO -0.00 0.33 -0.01 0.44 0.02 0.00 0.00 177.57 178.35 1tkr h ASP 725 N 0.38 0.99 -0.32 0.57 3.32 -0.73 -2.35 116.42 118.28 1tkr h ASP 725 Ca 0.07 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1tkr h ASP 725 Cb 0.50 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1tkr h ASP 725 CO 0.03 1.06 0.00 1.33 -1.72 0.00 0.00 179.24 179.94 1tkr n VAL 726 N -4.23 0.42 -3.35 -1.35 0.24 -0.92 -4.96 118.33 104.18 1tkr n VAL 726 Ca 0.02 -0.48 -0.18 0.00 -2.04 0.00 0.00 64.34 61.66 1tkr n VAL 726 Cb 0.34 0.33 0.07 0.00 -1.47 0.00 0.00 33.84 33.11 1tkr n VAL 726 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tkr n GLY 727 N 1.15 -1.09 3.14 7.63 0.00 -0.28 -4.98 105.19 110.76 1tkr n GLY 727 Ca 0.14 0.54 -0.33 0.00 0.00 0.00 0.00 46.02 46.37 1tkr n GLY 727 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tkr s VAL 728 N -3.41 2.08 0.21 1.61 0.11 -0.13 -5.02 120.40 115.86 1tkr s VAL 728 Ca 0.44 -0.94 -0.30 0.00 -2.93 0.00 0.00 61.98 58.25 1tkr s VAL 728 Cb -0.08 -1.86 -0.08 0.00 -1.53 0.00 0.00 36.38 32.83 1tkr s VAL 728 CO 0.76 0.54 1.08 -0.62 -3.33 0.00 0.00 175.10 173.53 1tkr s ASP 729 N 1.16 7.31 0.31 3.54 2.15 -1.26 -4.58 116.67 125.30 1tkr s ASP 729 Ca 0.02 2.11 -0.10 0.00 0.43 0.00 0.00 52.55 55.00 1tkr s ASP 729 Cb -0.14 -2.61 0.01 0.00 -0.30 0.00 0.00 42.92 39.88 1tkr s ASP 729 CO -0.10 -0.16 0.54 0.72 -0.17 0.00 0.00 175.17 176.01 1tkr s PHE 730 N -0.54 0.54 -0.09 -5.34 -0.71 -1.26 -4.74 117.98 105.83 1tkr s PHE 730 Ca 0.47 -0.92 -0.06 0.00 -1.04 0.00 0.00 56.93 55.39 1tkr s PHE 730 Cb -0.29 0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.71 1tkr s PHE 730 CO 0.36 -1.16 0.13 -0.65 -1.34 0.00 0.00 175.22 172.56 1tkr s GLN 731 N -3.37 3.39 0.07 1.99 -1.52 0.21 -5.02 119.66 115.40 1tkr s GLN 731 Ca 0.24 -0.20 0.03 0.00 -1.95 0.00 0.00 55.36 53.47 1tkr s GLN 731 Cb -0.02 -3.13 -0.03 0.00 -0.22 0.00 0.00 33.01 29.62 1tkr s GLN 731 CO 0.13 0.75 -0.09 0.00 -0.25 0.00 0.00 175.29 175.83 1tkr s ALA 732 N -1.08 0.83 -0.24 6.09 0.00 -1.26 -0.55 121.76 125.55 1tkr s ALA 732 Ca 0.17 -0.97 -0.12 0.00 0.00 0.00 0.00 51.96 51.05 1tkr s ALA 732 Cb -0.12 0.04 0.08 0.00 0.00 0.00 0.00 23.12 23.12 1tkr s ALA 732 CO 0.07 -0.02 0.57 1.41 0.00 0.00 0.00 175.76 177.78 1tkr s MET 733 N -2.16 0.55 0.14 0.00 1.75 0.45 -4.93 119.30 115.10 1tkr s MET 733 Ca -0.03 1.12 0.10 0.00 -1.25 0.00 0.00 55.69 55.64 1tkr s MET 733 Cb -0.06 0.25 -0.04 0.00 2.84 0.00 0.00 34.83 37.82 1tkr s MET 733 CO -0.00 -0.18 -0.22 1.67 -0.65 0.00 0.00 175.02 175.64 1tkr s TRP 734 N 1.93 2.41 -0.34 4.11 -2.14 -1.26 -2.75 118.94 120.90 1tkr s TRP 734 Ca -0.08 -0.33 0.04 0.00 2.66 0.00 0.00 56.10 58.39 1tkr s TRP 734 Cb -0.08 -1.26 0.10 0.00 -3.10 0.00 0.00 33.47 29.12 1tkr s TRP 734 CO -0.17 0.40 0.05 0.71 -2.66 0.00 0.00 176.95 175.28 1tkr s TYR 735 N -1.26 3.74 -0.26 1.66 1.51 -0.62 -4.95 117.35 117.16 1tkr s TYR 735 Ca 0.17 -2.95 -0.42 0.00 -1.01 0.00 0.00 57.07 52.87 1tkr s TYR 735 Cb -0.10 -2.88 -0.18 0.00 -0.11 0.00 0.00 41.96 38.70 1tkr s TYR 735 CO 0.09 -0.95 1.58 2.41 -1.11 0.00 0.00 175.55 177.57 1tkr n THR 736 N 4.27 0.14 -1.60 -0.71 -1.04 -1.26 -1.37 114.28 112.72 1tkr n THR 736 Ca 0.03 -0.03 -0.19 0.00 -2.04 0.00 0.00 64.05 61.82 1tkr n THR 736 Cb 0.42 -0.83 -0.08 0.00 -1.82 0.00 0.00 70.33 68.02 1tkr n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1tkr n ASP 737 N 4.17 -5.05 -4.86 8.00 8.00 -1.26 -4.88 116.55 120.67 1tkr n ASP 737 Ca 0.26 0.45 -0.37 0.00 0.71 0.00 0.00 54.79 55.84 1tkr n ASP 737 Cb 0.08 -4.49 -0.06 0.00 -0.02 0.00 0.00 41.12 36.63 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 -3.69 3.66 0.00 -1.24 0.41 -0.47 -4.70 118.70 112.67 1tkr s GLU 738 Ca 0.00 0.11 0.00 0.00 -0.41 0.00 0.00 54.97 54.67 1tkr s GLU 738 Cb 0.00 -3.19 0.00 0.00 -1.78 0.00 0.00 34.13 29.16 1tkr s GLU 738 CO 0.00 0.73 0.00 -0.40 -0.49 0.00 0.00 175.26 175.10 1tkr n ASP 739 N 1.80 0.00 0.17 -0.19 5.68 -1.26 -1.87 116.55 120.88 1tkr n ASP 739 Ca -0.16 -0.14 0.11 0.00 -0.50 0.00 0.00 54.79 54.10 1tkr n ASP 739 Cb 0.54 0.00 0.64 0.00 -1.14 0.00 0.00 41.12 41.15 1tkr n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1tkr h HIS 740 N -0.09 0.04 0.00 2.11 -0.00 -1.91 -2.19 115.15 113.11 1tkr h HIS 740 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 60.37 60.20 1tkr h HIS 740 Cb 0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 27.37 1tkr h HIS 740 CO 0.00 0.02 -0.82 0.78 -0.00 0.00 0.00 177.93 177.92 1tkr h GLY 741 N 0.04 0.02 -6.08 5.26 0.00 -1.99 -3.46 103.07 96.85 1tkr h GLY 741 Ca 0.08 -0.03 -0.43 0.00 0.00 0.00 0.00 47.33 46.96 1tkr h GLY 741 CO -0.01 0.03 -0.64 1.39 0.00 0.00 0.00 176.54 177.31 1tkr n ILE 742 N -3.58 -0.71 1.16 2.60 5.41 -0.82 -4.80 119.36 118.61 1tkr n ILE 742 Ca -0.01 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.87 1tkr n ILE 742 Cb 0.78 -1.34 0.27 0.00 -0.71 0.00 0.00 39.64 38.64 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 -3.74 3.31 -1.65 -1.39 0.00 -1.26 -3.43 120.51 112.35 1tkr n ALA 743 Ca 0.04 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 52.62 1tkr n ALA 743 Cb 0.50 -1.06 0.01 0.00 0.00 0.00 0.00 19.45 18.90 1tkr n ALA 743 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1tkr n SER 744 N -0.72 1.84 -0.34 0.00 3.41 -1.26 -4.52 113.62 112.03 1tkr n SER 744 Ca 0.10 1.10 -0.09 0.00 -0.26 0.00 0.00 58.87 59.72 1tkr n SER 744 Cb 0.36 -1.40 -0.06 0.00 -0.26 0.00 0.00 64.21 62.85 1tkr n SER 744 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1tkr h SER 745 N 1.90 -1.89 -0.11 4.04 4.64 -1.99 0.63 113.55 120.77 1tkr h SER 745 Ca -0.45 0.30 -0.01 0.00 -0.47 0.00 0.00 61.79 61.16 1tkr h SER 745 Cb 1.32 0.85 -0.00 0.00 -0.31 0.00 0.00 62.40 64.26 1tkr h SER 745 CO 0.59 -0.28 0.03 0.71 -0.87 0.00 0.00 176.83 177.00 1tkr h THR 746 N -0.09 1.20 -0.41 2.95 1.35 -1.98 -2.39 112.91 113.55 1tkr h THR 746 Ca 0.19 -0.63 0.04 0.00 -0.55 0.00 0.00 66.41 65.46 1tkr h THR 746 Cb 0.50 1.41 -0.04 0.00 -1.73 0.00 0.00 68.15 68.28 1tkr h THR 746 CO -0.86 0.18 0.18 0.00 -0.25 0.00 0.00 175.52 174.77 1tkr h ALA 747 N 0.81 0.50 -0.72 6.62 0.00 -1.69 0.50 119.26 125.28 1tkr h ALA 747 Ca 0.04 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1tkr h ALA 747 Cb 0.26 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1tkr h ALA 747 CO 0.00 -0.19 0.41 1.25 0.00 0.00 0.00 179.25 180.72 1tkr h HIS 748 N 0.37 0.74 -0.26 0.00 2.76 0.33 -1.36 115.15 117.73 1tkr h HIS 748 Ca 0.18 0.03 -0.15 0.00 -2.20 0.00 0.00 60.37 58.23 1tkr h HIS 748 Cb 0.12 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 28.84 1tkr h HIS 748 CO -0.12 0.34 -0.44 1.96 -1.30 0.00 0.00 177.93 178.37 1tkr h GLN 749 N 0.73 0.66 -0.56 5.26 4.20 -0.91 -3.14 115.11 121.35 1tkr h GLN 749 Ca 0.33 -0.36 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 1tkr h GLN 749 Cb 0.23 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1tkr h GLN 749 CO -0.20 0.97 0.03 1.25 -0.67 0.00 0.00 178.83 180.21 1tkr h HIS 750 N 0.53 1.05 -0.02 2.96 2.76 -0.14 -2.81 115.15 119.48 1tkr h HIS 750 Ca 0.04 -0.17 -0.01 0.00 -2.20 0.00 0.00 60.37 58.03 1tkr h HIS 750 Cb 0.98 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.66 1tkr h HIS 750 CO 0.05 0.94 -0.02 0.97 -1.30 0.00 0.00 177.93 178.57 1tkr h ILE 751 N 0.85 1.37 0.00 6.26 2.10 -1.32 -1.96 117.51 124.80 1tkr h ILE 751 Ca 0.16 -1.12 -0.01 0.00 1.08 0.00 0.00 64.86 64.97 1tkr h ILE 751 Cb 0.51 2.08 -0.00 0.00 -1.09 0.00 0.00 36.82 38.32 1tkr h ILE 751 CO 0.02 0.30 -0.06 1.88 -1.08 0.00 0.00 178.15 179.21 1tkr h TYR 752 N -0.41 0.00 -0.03 2.19 0.05 -1.61 0.52 116.97 117.68 1tkr h TYR 752 Ca 0.00 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.71 1tkr h TYR 752 Cb 0.49 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.23 1tkr h TYR 752 CO 0.09 0.06 -0.25 1.15 -1.05 0.00 0.00 178.16 178.16 1tkr h THR 753 N 0.00 1.48 0.00 -2.88 2.02 -1.42 -1.89 112.91 110.23 1tkr h THR 753 Ca -0.00 -1.78 -0.00 0.00 0.77 0.00 0.00 66.41 65.40 1tkr h THR 753 Cb 0.19 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.12 1tkr h THR 753 CO 0.01 0.50 -0.00 -0.74 0.37 0.00 0.00 175.52 175.65 1tkr h HIS 754 N -0.36 -0.01 -1.01 3.16 -0.00 -0.51 -2.29 115.15 114.14 1tkr h HIS 754 Ca -0.02 -0.00 0.14 0.00 -0.00 0.00 0.00 60.37 60.48 1tkr h HIS 754 Cb 0.94 0.00 -0.09 0.00 -0.00 0.00 0.00 27.41 28.26 1tkr h HIS 754 CO 0.15 0.16 0.63 1.98 -0.00 0.00 0.00 177.93 180.85 1tkr h MET 755 N -0.17 0.92 -0.21 5.26 -1.53 -0.06 -1.77 114.93 117.36 1tkr h MET 755 Ca -0.00 -0.06 -0.02 0.00 -3.44 0.00 0.00 59.70 56.18 1tkr h MET 755 Cb 0.17 -0.21 -0.01 0.00 -0.55 0.00 0.00 31.60 31.01 1tkr h MET 755 CO 0.00 0.61 0.05 0.77 0.14 0.00 0.00 176.91 178.47 1tkr h SER 756 N 0.94 0.33 -0.97 1.39 0.02 -0.98 -1.90 113.55 112.38 1tkr h SER 756 Ca 0.52 -0.24 0.08 0.00 -0.84 0.00 0.00 61.79 61.31 1tkr h SER 756 Cb 0.59 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 62.97 1tkr h SER 756 CO -0.29 0.48 0.62 0.45 -1.14 0.00 0.00 176.83 176.95 1tkr h HIS 757 N 0.16 1.14 0.27 3.45 3.86 -0.79 0.40 115.15 123.64 1tkr h HIS 757 Ca 0.07 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1tkr h HIS 757 Cb 0.29 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 1tkr h HIS 757 CO 0.01 0.54 -0.21 0.35 0.86 0.00 0.00 177.93 179.48 1tkr h PHE 758 N 1.08 -0.56 -0.31 2.45 3.57 -1.11 -0.79 116.94 121.26 1tkr h PHE 758 Ca 0.44 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.94 1tkr h PHE 758 Cb 0.26 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 1tkr h PHE 758 CO -0.01 -0.33 0.19 0.82 -2.23 0.00 0.00 178.31 176.76 1tkr h ILE 759 N -0.50 1.10 -0.78 1.41 1.08 -0.60 -0.46 117.51 118.77 1tkr h ILE 759 Ca -0.02 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 64.23 1tkr h ILE 759 Cb 0.44 0.69 -0.04 0.00 -3.07 0.00 0.00 36.82 34.84 1tkr h ILE 759 CO -0.01 0.10 0.50 0.11 -0.69 0.00 0.00 178.15 178.16 1tkr h LYS 760 N 0.41 1.04 -0.85 2.37 1.57 -0.85 -0.69 116.57 119.57 1tkr h LYS 760 Ca 0.11 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1tkr h LYS 760 Cb -0.01 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.04 1tkr h LYS 760 CO -0.02 0.70 0.39 0.37 -0.57 0.00 0.00 179.45 180.32 1tkr h GLN 761 N 1.06 1.23 0.00 3.15 -0.00 -0.82 0.42 115.11 120.15 1tkr h GLN 761 Ca 0.28 -0.19 -0.07 0.00 -0.00 0.00 0.00 58.65 58.67 1tkr h GLN 761 Cb -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 27.48 27.16 1tkr h GLN 761 CO -0.06 0.95 -0.35 0.00 0.00 0.00 0.00 178.83 179.37 1tkr n PHE 763 N -3.64 0.00 -2.54 0.00 3.72 -0.33 -4.96 117.46 109.71 1tkr n PHE 763 Ca -0.01 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.34 1tkr n PHE 763 Cb 0.46 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.02 1tkr n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1tkr n SER 764 N 0.21 -2.78 -4.62 4.37 7.64 0.40 -5.06 113.62 113.78 1tkr n SER 764 Ca 0.10 -0.09 -0.24 0.00 1.01 0.00 0.00 58.87 59.65 1tkr n SER 764 Cb 0.47 -1.60 -0.08 0.00 -1.01 0.00 0.00 64.21 62.00 1tkr n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1tkr s LEU 765 N -2.18 3.11 0.00 -3.43 1.43 0.12 -5.01 118.68 112.72 1tkr s LEU 765 Ca 0.09 -0.66 0.31 0.00 -1.03 0.00 0.00 54.13 52.84 1tkr s LEU 765 Cb -0.04 -1.66 1.82 0.00 0.03 0.00 0.00 46.19 46.34 1tkr s LEU 765 CO 0.12 0.03 2.15 -0.81 0.23 0.00 0.00 176.35 178.06