#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n1m n ARG 40 N 0.00 0.00 -4.55 4.33 1.74 -1.26 -4.64 116.66 112.28 1n1m n ARG 40 Ca 0.00 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 1n1m n ARG 40 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 1n1m n ARG 40 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1n1m n LYS 41 N -0.21 0.79 -4.02 5.56 0.00 -1.26 -4.92 118.16 114.10 1n1m n LYS 41 Ca 0.00 -3.61 -0.27 0.00 -0.00 0.00 0.00 58.31 54.43 1n1m n LYS 41 Cb 0.00 0.92 -0.02 0.00 -0.00 0.00 0.00 35.03 35.92 1n1m n LYS 41 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1n1m s THR 42 N -2.79 1.68 -0.56 0.58 -4.23 -1.26 -0.61 115.64 108.44 1n1m s THR 42 Ca 0.03 -1.58 -0.25 0.00 -1.18 0.00 0.00 61.69 58.70 1n1m s THR 42 Cb -0.00 -2.25 0.04 0.00 1.34 0.00 0.00 72.50 71.62 1n1m s THR 42 CO 0.02 0.00 1.03 -0.47 -0.54 0.00 0.00 174.62 174.65 1n1m s TYR 43 N -2.76 2.72 0.63 3.99 5.04 -1.26 -4.88 117.35 120.84 1n1m s TYR 43 Ca 0.31 0.12 -0.03 0.00 -2.44 0.00 0.00 57.07 55.02 1n1m s TYR 43 Cb -0.01 -4.23 0.05 0.00 0.35 0.00 0.00 41.96 38.12 1n1m s TYR 43 CO 0.19 -1.44 0.91 0.95 -1.34 0.00 0.00 175.55 174.81 1n1m s THR 44 N 4.30 2.47 0.17 4.34 -4.23 -1.26 -3.80 115.64 117.63 1n1m s THR 44 Ca 0.34 -0.44 -0.12 0.00 -1.18 0.00 0.00 61.69 60.29 1n1m s THR 44 Cb -0.11 -3.01 0.08 0.00 1.34 0.00 0.00 72.50 70.80 1n1m s THR 44 CO 0.21 -0.01 1.75 0.25 -0.54 0.00 0.00 174.62 176.28 1n1m h LEU 45 N -0.30 0.81 -0.29 4.79 5.85 -1.95 -2.35 115.31 121.88 1n1m h LEU 45 Ca -0.43 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.18 1n1m h LEU 45 Cb 1.31 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1n1m h LEU 45 CO 0.57 0.74 0.04 0.74 -0.34 0.00 0.00 178.44 180.19 1n1m h THR 46 N 0.83 0.84 -0.64 1.05 2.02 -1.98 0.16 112.91 115.19 1n1m h THR 46 Ca 0.20 -0.05 0.14 0.00 0.77 0.00 0.00 66.41 67.47 1n1m h THR 46 Cb 0.16 0.69 -0.11 0.00 -1.74 0.00 0.00 68.15 67.15 1n1m h THR 46 CO -0.02 0.03 -0.04 0.44 0.37 0.00 0.00 175.52 176.29 1n1m h ASP 47 N 0.14 -0.38 -0.25 4.18 3.32 -1.83 1.41 116.42 123.01 1n1m h ASP 47 Ca 0.13 0.17 -0.06 0.00 0.02 0.00 0.00 57.03 57.29 1n1m h ASP 47 Cb 0.15 0.32 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1n1m h ASP 47 CO -0.19 -0.15 -0.09 0.22 -1.72 0.00 0.00 179.24 177.30 1n1m h TYR 48 N 0.08 0.57 -0.18 4.55 3.20 -0.84 0.90 116.97 125.25 1n1m h TYR 48 Ca 0.33 -0.13 -0.20 0.00 3.14 0.00 0.00 58.73 61.87 1n1m h TYR 48 Cb 0.54 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.68 1n1m h TYR 48 CO -0.42 0.74 -0.69 -0.07 -1.64 0.00 0.00 178.16 176.09 1n1m h LEU 49 N 0.24 0.86 -0.54 2.82 3.38 0.21 -3.03 115.31 119.25 1n1m h LEU 49 Ca 0.06 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1n1m h LEU 49 Cb 0.58 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1n1m h LEU 49 CO 0.03 1.31 -0.03 0.29 0.09 0.00 0.00 178.44 180.13 1n1m n LYS 50 N -3.94 1.28 -3.88 1.13 4.76 0.48 -4.94 118.16 113.04 1n1m n LYS 50 Ca -0.06 -0.54 -0.26 0.00 -2.87 0.00 0.00 58.31 54.58 1n1m n LYS 50 Cb 0.70 -1.49 -0.00 0.00 -1.84 0.00 0.00 35.03 32.39 1n1m n LYS 50 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1n1m n ASN 51 N -0.39 -1.20 0.16 4.39 4.05 0.16 -4.86 115.26 117.58 1n1m n ASN 51 Ca 0.20 -0.99 0.13 0.00 0.45 0.00 0.00 54.58 54.37 1n1m n ASN 51 Cb 0.27 -3.22 0.46 0.00 1.23 0.00 0.00 39.78 38.52 1n1m n ASN 51 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 1n1m h THR 52 N -1.86 0.00 -3.47 -0.44 1.35 -1.43 -3.37 112.91 103.69 1n1m h THR 52 Ca -0.63 -0.46 -0.66 0.00 -0.55 0.00 0.00 66.41 64.11 1n1m h THR 52 Cb 1.37 1.35 -0.40 0.00 -1.73 0.00 0.00 68.15 68.75 1n1m h THR 52 CO 0.59 0.00 -0.60 -0.31 -0.25 0.00 0.00 175.52 174.95 1n1m s TYR 53 N -3.31 3.36 -0.13 4.73 2.02 -1.26 -5.09 117.35 117.67 1n1m s TYR 53 Ca 0.06 -3.04 -0.23 0.00 -0.37 0.00 0.00 57.07 53.49 1n1m s TYR 53 Cb 0.10 -2.92 -0.03 0.00 -0.40 0.00 0.00 41.96 38.71 1n1m s TYR 53 CO 0.52 -0.81 0.70 0.50 -1.57 0.00 0.00 175.55 174.89 1n1m s ARG 54 N 0.05 4.34 -0.04 -0.62 6.06 -1.26 -5.05 118.95 122.43 1n1m s ARG 54 Ca 0.15 0.82 -0.30 0.00 -2.50 0.00 0.00 55.73 53.90 1n1m s ARG 54 Cb -0.24 -3.51 -0.03 0.00 0.06 0.00 0.00 34.95 31.24 1n1m s ARG 54 CO -0.02 -0.10 1.06 -0.51 -2.50 0.00 0.00 175.30 173.23 1n1m s LEU 55 N 1.39 4.31 0.31 -0.88 1.43 -1.26 -4.82 118.68 119.15 1n1m s LEU 55 Ca 0.35 1.69 -0.22 0.00 -1.03 0.00 0.00 54.13 54.92 1n1m s LEU 55 Cb -0.17 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.39 1n1m s LEU 55 CO 0.14 -0.42 0.86 -0.54 0.23 0.00 0.00 176.35 176.62 1n1m s LYS 56 N 1.63 4.36 0.45 1.70 1.02 -1.26 -5.07 119.74 122.57 1n1m s LYS 56 Ca 0.52 1.08 0.04 0.00 0.02 0.00 0.00 55.97 57.63 1n1m s LYS 56 Cb -0.22 -2.69 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 1n1m s LYS 56 CO 0.23 0.25 0.02 -0.51 -0.92 0.00 0.00 175.35 174.42 1n1m s LEU 57 N -2.31 2.47 -0.42 3.17 1.43 -1.26 -4.89 118.68 116.87 1n1m s LEU 57 Ca 0.50 -1.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.11 1n1m s LEU 57 Cb -0.16 -0.71 0.17 0.00 0.03 0.00 0.00 46.19 45.52 1n1m s LEU 57 CO 0.20 -0.70 0.44 -0.47 0.23 0.00 0.00 176.35 176.06 1n1m s TYR 58 N -2.88 -0.08 -0.29 0.29 6.14 -1.26 -4.97 117.35 114.30 1n1m s TYR 58 Ca 0.20 -1.34 -0.20 0.00 0.64 0.00 0.00 57.07 56.37 1n1m s TYR 58 Cb 0.05 -0.43 -0.01 0.00 0.42 0.00 0.00 41.96 41.99 1n1m s TYR 58 CO 0.10 -0.99 0.60 -1.12 0.64 0.00 0.00 175.55 174.79 1n1m s SER 59 N 0.79 6.49 0.21 4.32 0.01 -1.26 -5.05 113.70 119.21 1n1m s SER 59 Ca 0.26 0.47 0.09 0.00 1.31 0.00 0.00 55.95 58.07 1n1m s SER 59 Cb -0.05 -2.32 -0.05 0.00 0.21 0.00 0.00 66.02 63.81 1n1m s SER 59 CO -0.09 -0.43 -0.17 -1.48 0.41 0.00 0.00 173.24 171.48 1n1m s LEU 60 N 2.53 2.53 -0.21 2.44 0.05 -1.26 -4.39 118.68 120.36 1n1m s LEU 60 Ca 0.24 -0.98 -0.03 0.00 0.05 0.00 0.00 54.13 53.42 1n1m s LEU 60 Cb -0.15 -0.80 0.07 0.00 -2.05 0.00 0.00 46.19 43.25 1n1m s LEU 60 CO 0.11 -0.09 0.05 -0.60 -0.55 0.00 0.00 176.35 175.27 1n1m s ARG 61 N -3.37 0.61 0.19 1.48 3.00 -0.44 -4.93 118.95 115.48 1n1m s ARG 61 Ca 0.22 -0.50 -0.32 0.00 -1.00 0.00 0.00 55.73 54.14 1n1m s ARG 61 Cb -0.03 -2.03 -0.11 0.00 0.00 0.00 0.00 34.95 32.78 1n1m s ARG 61 CO 0.08 -0.71 1.63 -1.58 0.00 0.00 0.00 175.30 174.73 1n1m s TRP 62 N 1.85 2.99 -1.58 5.12 0.52 -1.26 -0.22 118.94 126.36 1n1m s TRP 62 Ca 0.01 0.52 0.13 0.00 0.02 0.00 0.00 56.10 56.78 1n1m s TRP 62 Cb -0.17 -4.02 0.14 0.00 -1.15 0.00 0.00 33.47 28.28 1n1m s TRP 62 CO -0.12 -3.78 0.97 0.44 0.02 0.00 0.00 176.95 174.48 1n1m n ILE 63 N 3.92 0.14 -3.01 2.03 -5.35 0.32 -4.89 119.36 112.53 1n1m n ILE 63 Ca 0.14 -0.57 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 1n1m n ILE 63 Cb 0.37 1.17 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 1n1m n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1n1m n SER 64 N 0.74 0.00 -0.77 7.28 3.41 -1.09 -4.94 113.62 118.25 1n1m n SER 64 Ca 0.09 -0.47 0.13 0.00 -0.26 0.00 0.00 58.87 58.35 1n1m n SER 64 Cb 0.35 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.58 1n1m n SER 64 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1n1m n ASP 65 N -0.22 2.40 0.00 4.04 2.03 -1.26 -2.27 116.55 121.26 1n1m n ASP 65 Ca 0.00 -1.80 0.00 0.00 0.52 0.00 0.00 54.79 53.51 1n1m n ASP 65 Cb 0.00 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 1n1m n ASP 65 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1n1m n HIS 66 N 0.86 0.00 -4.08 -0.67 8.25 -1.26 -4.53 115.22 113.79 1n1m n HIS 66 Ca 0.16 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.50 1n1m n HIS 66 Cb 0.49 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.49 1n1m n HIS 66 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1n1m s GLU 67 N -1.32 0.59 0.09 -0.41 2.02 -1.26 -1.61 118.70 116.79 1n1m s GLU 67 Ca 0.00 -0.87 0.02 0.00 0.02 0.00 0.00 54.97 54.14 1n1m s GLU 67 Cb 0.00 -0.27 -0.04 0.00 0.10 0.00 0.00 34.13 33.93 1n1m s GLU 67 CO 0.00 0.03 -0.08 1.52 0.02 0.00 0.00 175.26 176.76 1n1m s TYR 68 N -1.84 0.92 -0.01 1.61 -0.85 -1.06 -0.52 117.35 115.61 1n1m s TYR 68 Ca -0.06 -0.78 -0.06 0.00 -0.52 0.00 0.00 57.07 55.66 1n1m s TYR 68 Cb -0.07 -0.52 -0.04 0.00 0.38 0.00 0.00 41.96 41.71 1n1m s TYR 68 CO -0.01 -0.09 0.24 -0.51 -1.52 0.00 0.00 175.55 173.66 1n1m s LEU 69 N -2.69 4.37 -0.40 -3.49 1.43 0.69 -0.64 118.68 117.96 1n1m s LEU 69 Ca 0.07 0.50 0.01 0.00 -1.03 0.00 0.00 54.13 53.68 1n1m s LEU 69 Cb 0.01 -2.61 0.13 0.00 0.03 0.00 0.00 46.19 43.75 1n1m s LEU 69 CO -0.03 0.27 0.20 -0.47 0.23 0.00 0.00 176.35 176.56 1n1m s TYR 70 N -1.28 1.77 -0.64 0.29 5.04 0.12 -1.32 117.35 121.33 1n1m s TYR 70 Ca 0.26 -2.18 -0.26 0.00 -2.44 0.00 0.00 57.07 52.46 1n1m s TYR 70 Cb -0.13 -1.73 -0.09 0.00 0.35 0.00 0.00 41.96 40.36 1n1m s TYR 70 CO 0.16 -0.81 2.35 0.15 -1.34 0.00 0.00 175.55 176.06 1n1m s LYS 71 N 0.73 1.95 0.00 4.97 1.02 -1.26 -2.47 119.74 124.67 1n1m s LYS 71 Ca 0.16 0.91 0.00 0.00 0.02 0.00 0.00 55.97 57.06 1n1m s LYS 71 Cb -0.23 -4.68 0.00 0.00 -0.52 0.00 0.00 37.83 32.41 1n1m s LYS 71 CO -0.05 -3.73 0.00 0.94 -0.92 0.00 0.00 175.35 171.59 1n1m n GLN 72 N 8.94 2.68 -0.09 1.68 7.27 -0.92 -5.00 117.38 131.95 1n1m n GLN 72 Ca 0.40 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 57.35 1n1m n GLN 72 Cb 0.50 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 33.10 1n1m n GLN 72 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1n1m n GLU 73 N 0.00 0.50 -0.04 3.69 2.13 -1.26 -4.73 120.64 120.93 1n1m n GLU 73 Ca 0.00 0.47 -0.02 0.00 0.66 0.00 0.00 57.16 58.27 1n1m n GLU 73 Cb 0.00 -1.65 -0.02 0.00 0.27 0.00 0.00 31.44 30.04 1n1m n GLU 73 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1n1m h ASN 74 N -1.00 -0.02 -3.49 4.31 2.35 -2.00 -3.49 115.58 112.24 1n1m h ASN 74 Ca -0.14 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1n1m h ASN 74 Cb 0.87 0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.25 1n1m h ASN 74 CO -0.09 0.54 0.00 -0.46 -1.65 0.00 0.00 177.43 175.78 1n1m n ASN 75 N -4.77 1.02 -4.13 5.81 6.94 -1.26 -4.03 115.26 114.83 1n1m n ASN 75 Ca -0.02 -1.00 -0.26 0.00 -0.02 0.00 0.00 54.58 53.28 1n1m n ASN 75 Cb 0.08 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.34 1n1m n ASN 75 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1n1m s ILE 76 N -0.02 1.45 0.22 1.53 1.01 -1.09 -2.15 121.20 122.14 1n1m s ILE 76 Ca 0.00 -0.71 0.11 0.00 0.00 0.00 0.00 60.65 60.04 1n1m s ILE 76 Cb 0.00 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 1n1m s ILE 76 CO 0.00 0.42 -0.17 -0.76 0.00 0.00 0.00 174.94 174.43 1n1m s LEU 77 N 0.13 2.69 -0.08 2.97 1.43 -1.03 0.01 118.68 124.80 1n1m s LEU 77 Ca -0.06 -0.80 0.03 0.00 -1.03 0.00 0.00 54.13 52.27 1n1m s LEU 77 Cb -0.13 -1.34 -0.02 0.00 0.03 0.00 0.00 46.19 44.74 1n1m s LEU 77 CO 0.03 0.09 -0.17 0.54 0.23 0.00 0.00 176.35 177.06 1n1m s VAL 78 N -1.93 2.72 0.09 -1.59 0.11 -0.38 0.14 120.40 119.55 1n1m s VAL 78 Ca 0.25 -0.81 0.08 0.00 -2.93 0.00 0.00 61.98 58.56 1n1m s VAL 78 Cb -0.07 -2.07 -0.04 0.00 -1.53 0.00 0.00 36.38 32.66 1n1m s VAL 78 CO 0.13 0.56 -0.17 -0.36 -3.33 0.00 0.00 175.10 171.94 1n1m s PHE 79 N -0.14 2.58 -0.41 1.54 0.08 0.18 -2.10 117.98 119.72 1n1m s PHE 79 Ca -0.02 -0.24 -0.15 0.00 0.12 0.00 0.00 56.93 56.63 1n1m s PHE 79 Cb -0.14 -1.40 0.02 0.00 -0.57 0.00 0.00 43.02 40.93 1n1m s PHE 79 CO 0.04 0.34 0.33 1.21 -0.10 0.00 0.00 175.22 177.04 1n1m s ASN 80 N -1.89 6.13 0.28 1.36 3.84 -0.61 -2.55 114.94 121.49 1n1m s ASN 80 Ca 0.17 -0.81 0.00 0.00 0.21 0.00 0.00 52.86 52.43 1n1m s ASN 80 Cb -0.11 -2.17 0.54 0.00 -0.55 0.00 0.00 41.25 38.96 1n1m s ASN 80 CO 0.09 -0.46 1.82 0.00 -2.79 0.00 0.00 177.10 175.75 1n1m h ALA 81 N 8.64 1.45 -0.00 1.71 0.00 -1.63 0.20 119.26 129.62 1n1m h ALA 81 Ca -0.27 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1n1m h ALA 81 Cb 1.12 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1n1m h ALA 81 CO 0.74 0.15 -0.01 1.49 0.00 0.00 0.00 179.25 181.63 1n1m h GLU 82 N 0.91 -0.01 0.00 0.00 4.57 -1.93 -3.37 114.58 114.75 1n1m h GLU 82 Ca 0.49 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 58.36 1n1m h GLU 82 Cb 0.52 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.05 1n1m h GLU 82 CO -0.28 -0.01 -2.16 0.66 -1.18 0.00 0.00 179.01 176.04 1n1m n TYR 83 N -5.10 0.00 0.00 0.92 4.01 -1.14 -5.02 117.16 110.83 1n1m n TYR 83 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 1n1m n TYR 83 Cb 0.04 -0.82 0.00 0.00 -0.31 0.00 0.00 39.34 38.25 1n1m n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n1m n GLY 84 N 2.16 0.48 3.82 2.72 0.00 0.68 -5.06 105.19 109.99 1n1m n GLY 84 Ca -0.31 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 1n1m n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1m s ASN 85 N -2.25 5.25 0.22 1.61 4.22 -1.26 -4.73 114.94 118.01 1n1m s ASN 85 Ca 0.00 1.57 -0.13 0.00 -2.14 0.00 0.00 52.86 52.17 1n1m s ASN 85 Cb 0.00 -2.43 -0.00 0.00 1.28 0.00 0.00 41.25 40.10 1n1m s ASN 85 CO 0.00 -1.52 0.44 -0.94 -2.04 0.00 0.00 177.10 173.04 1n1m s SER 86 N -3.81 -0.09 0.04 3.54 1.04 -1.26 -1.57 113.70 111.59 1n1m s SER 86 Ca 0.58 -0.86 0.01 0.00 0.48 0.00 0.00 55.95 56.17 1n1m s SER 86 Cb -0.14 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 1n1m s SER 86 CO 0.55 -1.07 -0.06 -0.44 0.98 0.00 0.00 173.24 173.20 1n1m s SER 87 N -2.99 0.64 0.10 7.02 0.01 -0.89 -4.99 113.70 112.60 1n1m s SER 87 Ca 0.20 -0.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.57 1n1m s SER 87 Cb 0.00 0.07 -0.06 0.00 0.21 0.00 0.00 66.02 66.24 1n1m s SER 87 CO 0.05 -0.28 1.10 -0.69 0.41 0.00 0.00 173.24 173.84 1n1m s VAL 88 N -1.69 4.16 -0.01 3.43 1.01 -1.26 -1.25 120.40 124.78 1n1m s VAL 88 Ca -0.10 1.68 0.06 0.00 0.00 0.00 0.00 61.98 63.62 1n1m s VAL 88 Cb -0.08 -4.08 -0.24 0.00 0.00 0.00 0.00 36.38 31.98 1n1m s VAL 88 CO -0.01 0.21 0.78 0.15 0.00 0.00 0.00 175.10 176.23 1n1m h PHE 89 N 6.00 0.16 -1.34 5.22 3.04 -0.74 -3.47 116.94 125.81 1n1m h PHE 89 Ca -0.43 -0.12 0.15 0.00 3.98 0.00 0.00 57.97 61.55 1n1m h PHE 89 Cb 1.21 -0.01 -0.30 0.00 2.56 0.00 0.00 35.95 39.42 1n1m h PHE 89 CO 0.65 1.18 0.56 -0.48 -2.02 0.00 0.00 178.31 178.20 1n1m s LEU 90 N -6.51 -0.31 1.10 0.59 -0.00 -1.21 -5.02 118.68 107.32 1n1m s LEU 90 Ca -0.07 0.52 -0.12 0.00 -0.00 0.00 0.00 54.13 54.46 1n1m s LEU 90 Cb 0.08 1.48 0.25 0.00 -0.00 0.00 0.00 46.19 48.00 1n1m s LEU 90 CO 0.82 -0.08 1.05 -1.61 -0.00 0.00 0.00 176.35 176.53 1n1m s GLU 91 N 1.01 -0.41 -0.08 1.48 8.01 -1.26 -2.66 118.70 124.79 1n1m s GLU 91 Ca -0.06 0.86 -0.27 0.00 0.01 0.00 0.00 54.97 55.51 1n1m s GLU 91 Cb -0.03 -1.61 -0.23 0.00 -4.31 0.00 0.00 34.13 27.95 1n1m s GLU 91 CO -0.12 -3.39 1.03 -2.95 0.01 0.00 0.00 175.26 169.84 1n1m h ASN 92 N -2.39 0.01 0.17 -0.19 -1.07 -1.93 -3.28 115.58 106.89 1n1m h ASN 92 Ca -0.58 -0.73 0.00 0.00 0.07 0.00 0.00 56.30 55.06 1n1m h ASN 92 Cb 1.32 -0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.57 1n1m h ASN 92 CO 0.51 0.74 0.00 0.77 0.07 0.00 0.00 177.43 179.51 1n1m h SER 93 N -0.72 0.00 -0.67 6.14 4.64 -1.93 -3.12 113.55 117.89 1n1m h SER 93 Ca -0.00 0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.51 1n1m h SER 93 Cb 0.74 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.80 1n1m h SER 93 CO 0.00 0.00 0.93 0.74 -0.87 0.00 0.00 176.83 177.64 1n1m h THR 94 N 0.00 0.09 0.00 2.95 2.02 -1.94 0.88 112.91 116.91 1n1m h THR 94 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1n1m h THR 94 Cb 0.08 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1n1m h THR 94 CO 0.00 0.00 -0.23 0.49 0.37 0.00 0.00 175.52 176.15 1n1m n PHE 95 N -3.23 0.00 -0.05 3.16 3.72 -1.18 -4.87 117.46 115.01 1n1m n PHE 95 Ca 0.14 -0.89 -0.10 0.00 -0.05 0.00 0.00 57.45 56.55 1n1m n PHE 95 Cb 1.15 -0.15 -0.07 0.00 -0.94 0.00 0.00 39.48 39.47 1n1m n PHE 95 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1n1m h ASP 96 N 0.23 -1.22 -0.24 4.37 3.32 -1.02 -1.40 116.42 120.46 1n1m h ASP 96 Ca -0.01 0.15 -0.17 0.00 0.02 0.00 0.00 57.03 57.02 1n1m h ASP 96 Cb 1.11 0.49 -0.07 0.00 0.22 0.00 0.00 39.33 41.08 1n1m h ASP 96 CO 0.01 -0.30 0.13 -1.84 -1.72 0.00 0.00 179.24 175.51 1n1m n GLU 97 N -4.50 1.49 0.11 3.56 0.28 -1.26 -4.06 120.64 116.24 1n1m n GLU 97 Ca -0.03 -0.82 -0.17 0.00 -0.16 0.00 0.00 57.16 55.98 1n1m n GLU 97 Cb 0.24 -1.41 -0.14 0.00 1.43 0.00 0.00 31.44 31.57 1n1m n GLU 97 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1n1m h PHE 98 N 1.53 0.55 0.00 -1.84 3.57 -1.62 -3.48 116.94 115.66 1n1m h PHE 98 Ca 0.15 -0.40 0.00 0.00 3.53 0.00 0.00 57.97 61.25 1n1m h PHE 98 Cb 1.01 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.73 1n1m h PHE 98 CO 0.69 1.33 0.00 0.41 -2.23 0.00 0.00 178.31 178.51 1n1m n GLY 99 N 1.57 0.36 3.15 2.40 0.00 -1.26 -5.06 105.19 106.34 1n1m n GLY 99 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 1n1m n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1n1m s HIS 100 N -2.00 0.72 -0.17 1.61 3.76 -1.26 -5.13 115.29 112.81 1n1m s HIS 100 Ca 0.00 -1.14 -0.16 0.00 -0.15 0.00 0.00 55.06 53.61 1n1m s HIS 100 Cb 0.00 -0.42 -0.04 0.00 1.11 0.00 0.00 32.58 33.23 1n1m s HIS 100 CO 0.00 -0.49 0.38 0.45 -0.85 0.00 0.00 174.74 174.23 1n1m s SER 101 N -3.00 6.49 -0.12 1.40 0.15 -1.26 -5.05 113.70 112.31 1n1m s SER 101 Ca 0.19 0.58 -0.12 0.00 0.70 0.00 0.00 55.95 57.29 1n1m s SER 101 Cb 0.07 -2.23 -0.05 0.00 -1.71 0.00 0.00 66.02 62.11 1n1m s SER 101 CO -0.02 -0.00 0.28 -0.63 1.20 0.00 0.00 173.24 174.06 1n1m s ILE 102 N 0.89 5.29 -0.25 6.45 1.01 -1.26 -4.43 121.20 128.90 1n1m s ILE 102 Ca 0.20 0.52 0.03 0.00 0.00 0.00 0.00 60.65 61.39 1n1m s ILE 102 Cb -0.14 -3.59 0.06 0.00 0.01 0.00 0.00 42.46 38.80 1n1m s ILE 102 CO 0.07 0.49 0.95 -0.46 0.00 0.00 0.00 174.94 175.99 1n1m n ASN 103 N 2.82 1.99 -3.60 3.58 6.94 -0.40 -5.02 115.26 121.58 1n1m n ASN 103 Ca -0.14 -1.80 -0.02 0.00 -0.02 0.00 0.00 54.58 52.60 1n1m n ASN 103 Cb 0.53 -0.04 -0.06 0.00 -2.36 0.00 0.00 39.78 37.84 1n1m n ASN 103 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1n1m s ASP 104 N -0.82 -0.51 -0.23 0.53 -1.08 -1.23 -5.01 116.67 108.32 1n1m s ASP 104 Ca 0.05 0.80 -0.02 0.00 -0.52 0.00 0.00 52.55 52.86 1n1m s ASP 104 Cb 0.03 1.28 0.01 0.00 -1.46 0.00 0.00 42.92 42.78 1n1m s ASP 104 CO 0.04 -0.12 -0.07 -0.31 0.52 0.00 0.00 175.17 175.22 1n1m s TYR 105 N 1.53 2.98 -0.35 -5.34 1.51 -1.26 -1.17 117.35 115.25 1n1m s TYR 105 Ca -0.08 -1.33 0.00 0.00 -1.01 0.00 0.00 57.07 54.65 1n1m s TYR 105 Cb -0.04 -2.06 0.09 0.00 -0.11 0.00 0.00 41.96 39.84 1n1m s TYR 105 CO -0.15 -0.67 0.07 0.45 -1.11 0.00 0.00 175.55 174.14 1n1m s SER 106 N 1.38 4.93 -0.04 2.29 0.15 -0.19 -4.93 113.70 117.28 1n1m s SER 106 Ca 0.03 -1.83 -0.28 0.00 0.70 0.00 0.00 55.95 54.57 1n1m s SER 106 Cb -0.15 -1.71 -0.03 0.00 -1.71 0.00 0.00 66.02 62.42 1n1m s SER 106 CO -0.05 -0.39 0.91 -0.63 1.20 0.00 0.00 173.24 174.28 1n1m s ILE 107 N 1.09 4.90 0.66 6.45 1.01 -1.26 -0.32 121.20 133.73 1n1m s ILE 107 Ca 0.04 1.88 -0.17 0.00 0.00 0.00 0.00 60.65 62.40 1n1m s ILE 107 Cb -0.21 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.03 1n1m s ILE 107 CO -0.05 0.15 1.26 -0.94 0.00 0.00 0.00 174.94 175.36 1n1m s SER 108 N 0.98 4.54 0.34 3.58 1.04 -0.88 -4.83 113.70 118.47 1n1m s SER 108 Ca 0.47 2.53 0.20 0.00 0.48 0.00 0.00 55.95 59.64 1n1m s SER 108 Cb -0.19 -2.61 1.11 0.00 0.10 0.00 0.00 66.02 64.43 1n1m s SER 108 CO 0.23 -2.04 1.60 1.55 0.98 0.00 0.00 173.24 175.56 1n1m h PRO 109 N 0.36 0.00 -0.02 4.02 0.13 -1.78 -1.65 132.00 133.05 1n1m h PRO 109 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 1n1m h PRO 109 Cb 1.32 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 1n1m h PRO 109 CO 0.52 0.00 -0.01 -0.44 -0.23 0.00 0.00 178.00 177.84 1n1m h ASP 110 N 0.00 0.05 0.00 1.44 3.32 -1.62 -3.47 116.42 116.14 1n1m h ASP 110 Ca 0.00 -0.41 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1n1m h ASP 110 Cb 0.16 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1n1m h ASP 110 CO 0.00 0.45 0.00 0.61 -1.72 0.00 0.00 179.24 178.58 1n1m n GLY 111 N 0.01 0.74 0.01 2.75 0.00 -0.62 -4.96 105.19 103.13 1n1m n GLY 111 Ca -0.08 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.05 1n1m n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1n1m n GLN 112 N -1.74 0.48 -4.19 1.61 6.02 -1.26 -4.89 117.38 113.40 1n1m n GLN 112 Ca 0.00 -0.13 -0.13 0.00 -0.01 0.00 0.00 57.00 56.73 1n1m n GLN 112 Cb 0.00 -1.53 -0.10 0.00 1.02 0.00 0.00 30.24 29.63 1n1m n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1n1m s PHE 113 N -3.37 1.06 -0.08 1.08 0.08 -1.26 0.76 117.98 116.25 1n1m s PHE 113 Ca -0.03 -0.77 -0.01 0.00 0.12 0.00 0.00 56.93 56.24 1n1m s PHE 113 Cb 0.14 -0.57 0.03 0.00 -0.57 0.00 0.00 43.02 42.05 1n1m s PHE 113 CO 0.89 -0.03 -0.02 0.42 -0.10 0.00 0.00 175.22 176.39 1n1m s ILE 114 N -3.09 0.50 -0.15 0.64 1.01 -0.69 -2.07 121.20 117.34 1n1m s ILE 114 Ca 0.11 0.03 -0.26 0.00 0.00 0.00 0.00 60.65 60.53 1n1m s ILE 114 Cb 0.01 -0.62 -0.02 0.00 0.01 0.00 0.00 42.46 41.84 1n1m s ILE 114 CO -0.01 0.28 0.84 -0.22 0.00 0.00 0.00 174.94 175.82 1n1m s LEU 115 N 1.84 4.19 -0.23 2.97 2.96 0.56 -1.31 118.68 129.67 1n1m s LEU 115 Ca 0.04 1.21 -0.09 0.00 -0.22 0.00 0.00 54.13 55.07 1n1m s LEU 115 Cb -0.12 -3.25 -0.04 0.00 0.50 0.00 0.00 46.19 43.27 1n1m s LEU 115 CO -0.05 -0.38 0.11 -0.76 -1.32 0.00 0.00 176.35 173.94 1n1m s LEU 116 N 2.02 3.84 -0.23 -0.68 1.43 0.16 -1.02 118.68 124.20 1n1m s LEU 116 Ca 0.39 0.01 -0.06 0.00 -1.03 0.00 0.00 54.13 53.44 1n1m s LEU 116 Cb -0.17 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.01 1n1m s LEU 116 CO 0.13 0.07 0.04 -0.70 0.23 0.00 0.00 176.35 176.12 1n1m s GLU 117 N 1.04 3.65 0.23 1.70 2.12 -0.32 -2.04 118.70 125.08 1n1m s GLU 117 Ca 0.06 -0.49 -0.06 0.00 0.36 0.00 0.00 54.97 54.84 1n1m s GLU 117 Cb -0.14 -3.23 -0.02 0.00 0.26 0.00 0.00 34.13 31.00 1n1m s GLU 117 CO 0.04 -0.09 0.29 1.52 -0.54 0.00 0.00 175.26 176.47 1n1m s TYR 118 N 1.33 0.85 -1.04 5.30 1.13 -0.67 -1.27 117.35 122.98 1n1m s TYR 118 Ca 0.05 -1.12 -0.05 0.00 -1.41 0.00 0.00 57.07 54.53 1n1m s TYR 118 Cb -0.15 -0.25 0.01 0.00 -1.10 0.00 0.00 41.96 40.47 1n1m s TYR 118 CO 0.02 -0.81 0.90 0.09 -2.51 0.00 0.00 175.55 173.25 1n1m n ASN 119 N -0.39 -4.51 -4.58 -0.18 3.02 -1.26 0.45 115.26 107.82 1n1m n ASN 119 Ca 0.01 -0.44 -0.41 0.00 -0.03 0.00 0.00 54.58 53.70 1n1m n ASN 119 Cb 0.64 -4.10 -0.03 0.00 -0.61 0.00 0.00 39.78 35.68 1n1m n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1n1m s TYR 120 N -3.26 1.71 -0.47 3.10 5.04 -1.26 -4.18 117.35 118.03 1n1m s TYR 120 Ca 0.33 0.74 0.00 0.00 -2.44 0.00 0.00 57.07 55.71 1n1m s TYR 120 Cb -0.15 -4.08 0.12 0.00 0.35 0.00 0.00 41.96 38.21 1n1m s TYR 120 CO 0.58 -2.70 0.23 0.08 -1.34 0.00 0.00 175.55 172.40 1n1m s VAL 121 N 7.99 2.98 0.73 3.14 1.01 -0.46 -5.02 120.40 130.78 1n1m s VAL 121 Ca 0.77 -2.61 -0.16 0.00 0.00 0.00 0.00 61.98 59.97 1n1m s VAL 121 Cb -0.19 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 1n1m s VAL 121 CO 0.29 -0.74 0.52 1.17 0.00 0.00 0.00 175.10 176.34 1n1m n LYS 122 N 3.93 0.27 0.00 2.72 4.81 -1.26 -1.65 118.16 126.97 1n1m n LYS 122 Ca 0.03 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 1n1m n LYS 122 Cb 0.39 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 33.61 1n1m n LYS 122 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1n1m n GLN 123 N -0.78 0.00 0.00 1.64 7.27 -0.97 -4.78 117.38 119.77 1n1m n GLN 123 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.17 1n1m n GLN 123 Cb 0.50 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.15 1n1m n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1n1m n TRP 124 N 0.00 0.00 -0.13 3.69 5.03 -1.24 -4.96 117.44 119.83 1n1m n TRP 124 Ca 0.00 0.00 -0.08 0.00 3.03 0.00 0.00 57.50 60.45 1n1m n TRP 124 Cb 0.00 0.00 -0.00 0.00 -1.03 0.00 0.00 31.31 30.28 1n1m n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 1n1m h ARG 125 N 0.00 0.54 0.00 -0.99 9.65 -1.98 -3.39 114.38 118.21 1n1m h ARG 125 Ca 0.00 -0.06 -0.21 0.00 -1.10 0.00 0.00 59.98 58.62 1n1m h ARG 125 Cb 0.00 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 1n1m h ARG 125 CO 0.00 0.42 -1.73 0.72 2.80 0.00 0.00 179.97 182.18 1n1m n HIS 126 N -4.76 0.00 -0.66 2.20 8.25 -1.26 -5.06 115.22 113.93 1n1m n HIS 126 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.15 1n1m n HIS 126 Cb 0.07 -0.48 0.18 0.00 1.12 0.00 0.00 29.99 30.88 1n1m n HIS 126 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1n1m n SER 127 N -3.29 -0.94 0.00 0.41 3.41 -1.26 -4.88 113.62 107.07 1n1m n SER 127 Ca -0.24 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 1n1m n SER 127 Cb 0.71 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.34 1n1m n SER 127 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1m n TYR 128 N -4.29 0.00 -4.31 7.33 0.18 -1.26 -2.29 117.16 112.52 1n1m n TYR 128 Ca 0.08 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.60 1n1m n TYR 128 Cb 0.54 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.41 1n1m n TYR 128 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1n1m s THR 129 N -2.00 3.11 0.14 -3.48 -4.23 -0.66 -4.73 115.64 103.79 1n1m s THR 129 Ca 0.00 -1.78 -0.25 0.00 -1.18 0.00 0.00 61.69 58.48 1n1m s THR 129 Cb 0.00 -2.56 0.07 0.00 1.34 0.00 0.00 72.50 71.35 1n1m s THR 129 CO 0.00 -0.17 1.00 0.00 -0.54 0.00 0.00 174.62 174.91 1n1m s ALA 130 N -1.85 -1.70 0.04 3.99 0.00 -1.05 -1.35 121.76 119.83 1n1m s ALA 130 Ca 0.26 0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.36 1n1m s ALA 130 Cb -0.08 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1n1m s ALA 130 CO 0.15 -1.05 0.13 -1.12 0.00 0.00 0.00 175.76 173.88 1n1m s SER 131 N -2.99 5.92 0.10 0.00 0.01 0.17 -2.59 113.70 114.32 1n1m s SER 131 Ca 0.13 0.16 0.05 0.00 1.31 0.00 0.00 55.95 57.60 1n1m s SER 131 Cb -0.01 -1.73 -0.03 0.00 0.21 0.00 0.00 66.02 64.46 1n1m s SER 131 CO 0.02 0.21 -0.13 -0.31 0.41 0.00 0.00 173.24 173.44 1n1m s TYR 132 N -1.37 1.28 -0.01 2.43 1.51 -1.26 -1.67 117.35 118.26 1n1m s TYR 132 Ca 0.29 -0.55 -0.09 0.00 -1.01 0.00 0.00 57.07 55.71 1n1m s TYR 132 Cb -0.12 -0.69 0.01 0.00 -0.11 0.00 0.00 41.96 41.05 1n1m s TYR 132 CO 0.21 0.09 0.19 -0.51 -1.11 0.00 0.00 175.55 174.42 1n1m s ASP 133 N -2.25 -0.06 -0.12 2.29 1.01 -0.87 -4.50 116.67 112.18 1n1m s ASP 133 Ca 0.05 -0.06 0.02 0.00 0.71 0.00 0.00 52.55 53.27 1n1m s ASP 133 Cb -0.06 0.26 -0.01 0.00 1.01 0.00 0.00 42.92 44.12 1n1m s ASP 133 CO 0.02 -0.35 -0.18 -0.63 0.21 0.00 0.00 175.17 174.24 1n1m s ILE 134 N -1.17 2.59 -0.33 0.77 1.01 -1.26 0.38 121.20 123.19 1n1m s ILE 134 Ca -0.12 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.60 1n1m s ILE 134 Cb -0.06 -2.05 0.00 0.00 0.01 0.00 0.00 42.46 40.36 1n1m s ILE 134 CO 0.02 0.54 0.17 -0.47 0.00 0.00 0.00 174.94 175.20 1n1m s TYR 135 N 0.38 3.20 -0.23 3.97 5.04 -0.43 -0.89 117.35 128.38 1n1m s TYR 135 Ca -0.14 -0.69 -0.29 0.00 -2.44 0.00 0.00 57.07 53.51 1n1m s TYR 135 Cb -0.17 -2.38 -0.00 0.00 0.35 0.00 0.00 41.96 39.76 1n1m s TYR 135 CO 0.07 -0.51 1.25 0.34 -1.34 0.00 0.00 175.55 175.36 1n1m s ASP 136 N 1.59 6.84 0.31 4.32 -1.08 -0.16 -1.71 116.67 126.79 1n1m s ASP 136 Ca 0.04 1.43 0.16 0.00 -0.52 0.00 0.00 52.55 53.66 1n1m s ASP 136 Cb -0.18 -2.54 0.35 0.00 -1.46 0.00 0.00 42.92 39.10 1n1m s ASP 136 CO 0.06 -0.89 1.58 -0.07 0.52 0.00 0.00 175.17 176.37 1n1m h LEU 137 N 10.20 0.00 0.16 -1.34 3.38 0.05 -1.08 115.31 126.68 1n1m h LEU 137 Ca -0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1n1m h LEU 137 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1n1m h LEU 137 CO 1.00 0.50 -0.08 0.78 0.09 0.00 0.00 178.44 180.73 1n1m h ASN 138 N 0.00 -0.18 -0.13 -0.43 2.35 -1.92 -3.04 115.58 112.23 1n1m h ASN 138 Ca -0.00 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 1n1m h ASN 138 Cb 1.17 0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.59 1n1m h ASN 138 CO 0.06 0.06 0.00 2.29 -1.65 0.00 0.00 177.43 178.20 1n1m n LYS 139 N -5.09 1.90 -4.17 0.81 2.85 -1.25 -4.94 118.16 108.28 1n1m n LYS 139 Ca -0.09 -1.33 -0.34 0.00 -1.05 0.00 0.00 58.31 55.50 1n1m n LYS 139 Cb 0.19 -1.45 -0.03 0.00 -0.65 0.00 0.00 35.03 33.09 1n1m n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1n1m n ARG 140 N 0.58 -3.14 -4.07 -1.58 1.74 -0.46 -4.95 116.66 104.78 1n1m n ARG 140 Ca 0.17 0.37 -0.11 0.00 -0.77 0.00 0.00 57.85 57.51 1n1m n ARG 140 Cb 0.41 -4.93 -0.11 0.00 -1.02 0.00 0.00 32.46 26.82 1n1m n ARG 140 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1n1m s GLN 141 N -6.87 0.55 0.18 5.56 1.11 -0.92 -4.99 119.66 114.28 1n1m s GLN 141 Ca 0.56 -0.90 -0.30 0.00 0.01 0.00 0.00 55.36 54.73 1n1m s GLN 141 Cb -0.30 -0.13 -0.08 0.00 -1.01 0.00 0.00 33.01 31.49 1n1m s GLN 141 CO 0.92 -0.00 0.99 -0.51 0.01 0.00 0.00 175.29 176.69 1n1m s LEU 142 N -2.00 4.56 0.07 2.90 1.43 -1.26 -0.98 118.68 123.39 1n1m s LEU 142 Ca -0.05 1.93 -0.31 0.00 -1.03 0.00 0.00 54.13 54.67 1n1m s LEU 142 Cb -0.05 -3.60 -0.07 0.00 0.03 0.00 0.00 46.19 42.50 1n1m s LEU 142 CO -0.02 -0.01 1.36 -0.63 0.23 0.00 0.00 176.35 177.28 1n1m s ILE 143 N -0.55 3.56 -0.75 -0.59 1.01 -0.07 -4.89 121.20 118.93 1n1m s ILE 143 Ca 0.45 1.08 0.09 0.00 0.00 0.00 0.00 60.65 62.27 1n1m s ILE 143 Cb -0.26 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 1n1m s ILE 143 CO 0.32 0.06 0.55 0.35 0.00 0.00 0.00 174.94 176.22 1n1m n THR 144 N 4.18 0.00 -4.23 2.92 -2.24 -1.26 -4.70 114.28 108.94 1n1m n THR 144 Ca 0.12 -0.36 -0.27 0.00 -2.27 0.00 0.00 64.05 61.26 1n1m n THR 144 Cb 0.43 1.08 -0.08 0.00 -2.10 0.00 0.00 70.33 69.66 1n1m n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1n1m s GLU 145 N -1.49 2.27 -1.28 -0.78 1.03 -1.26 -4.63 118.70 112.56 1n1m s GLU 145 Ca 0.07 -1.15 -0.14 0.00 0.03 0.00 0.00 54.97 53.77 1n1m s GLU 145 Cb 0.08 -2.29 0.13 0.00 -0.80 0.00 0.00 34.13 31.24 1n1m s GLU 145 CO 0.28 0.45 0.46 0.39 -1.33 0.00 0.00 175.26 175.51 1n1m n GLU 146 N -0.01 -2.30 -1.28 -4.83 -0.58 -1.26 -4.75 120.64 105.63 1n1m n GLU 146 Ca -0.10 0.24 -0.31 0.00 -0.42 0.00 0.00 57.16 56.57 1n1m n GLU 146 Cb 0.55 -4.86 0.10 0.00 -0.57 0.00 0.00 31.44 26.66 1n1m n GLU 146 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1n1m s ARG 147 N -6.35 2.00 0.08 3.49 1.70 -1.26 -4.85 118.95 113.76 1n1m s ARG 147 Ca 0.51 1.03 -0.31 0.00 -0.47 0.00 0.00 55.73 56.50 1n1m s ARG 147 Cb -0.29 -1.88 -0.08 0.00 -0.57 0.00 0.00 34.95 32.13 1n1m s ARG 147 CO 0.63 -1.78 1.64 0.42 -1.08 0.00 0.00 175.30 175.13 1n1m s ILE 148 N -2.93 3.00 0.26 4.99 1.01 -1.26 -4.95 121.20 121.31 1n1m s ILE 148 Ca 0.62 0.48 -0.29 0.00 0.00 0.00 0.00 60.65 61.46 1n1m s ILE 148 Cb -0.17 -3.31 -0.15 0.00 0.01 0.00 0.00 42.46 38.84 1n1m s ILE 148 CO 0.56 0.00 0.94 -2.65 0.00 0.00 0.00 174.94 173.79 1n1m n PRO 149 N 5.45 1.07 -2.12 2.79 -0.02 -1.26 -4.51 135.00 136.40 1n1m n PRO 149 Ca 0.16 0.38 -0.35 0.00 -2.02 0.00 0.00 63.50 61.66 1n1m n PRO 149 Cb 0.40 -1.70 0.02 0.00 -0.02 0.00 0.00 33.50 32.20 1n1m n PRO 149 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1n1m s ASN 150 N -0.56 5.49 -0.10 2.55 0.01 -1.26 -3.07 114.94 117.99 1n1m s ASN 150 Ca 0.62 2.20 0.00 0.00 -0.71 0.00 0.00 52.86 54.97 1n1m s ASN 150 Cb -0.77 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.31 1n1m s ASN 150 CO 0.58 -1.38 0.00 0.59 -1.51 0.00 0.00 177.10 175.38 1n1m n ASN 151 N -1.55 -1.73 -4.75 -1.22 3.02 -1.24 -5.01 115.26 102.78 1n1m n ASN 151 Ca 0.12 0.01 -0.41 0.00 -0.03 0.00 0.00 54.58 54.27 1n1m n ASN 151 Cb 0.51 -0.74 -0.04 0.00 -0.61 0.00 0.00 39.78 38.89 1n1m n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1n1m s THR 152 N -2.05 3.65 -0.02 3.41 2.01 -1.07 -4.60 115.64 116.97 1n1m s THR 152 Ca 0.00 1.56 -0.03 0.00 0.31 0.00 0.00 61.69 63.53 1n1m s THR 152 Cb 0.00 -3.99 -0.27 0.00 0.01 0.00 0.00 72.50 68.24 1n1m s THR 152 CO 0.00 0.33 0.77 1.56 -0.69 0.00 0.00 174.62 176.59 1n1m h GLN 153 N 4.37 0.24 -2.27 4.92 4.20 -1.45 -2.79 115.11 122.35 1n1m h GLN 153 Ca -0.46 -0.42 -0.07 0.00 0.06 0.00 0.00 58.65 57.77 1n1m h GLN 153 Cb 1.21 0.15 -0.21 0.00 0.30 0.00 0.00 27.48 28.94 1n1m h GLN 153 CO 0.69 1.09 0.03 -0.46 -0.67 0.00 0.00 178.83 179.51 1n1m s TRP 154 N -2.61 -0.62 -0.02 2.96 -0.11 -1.20 -4.64 118.94 112.71 1n1m s TRP 154 Ca -0.11 1.36 0.00 0.00 1.22 0.00 0.00 56.10 58.58 1n1m s TRP 154 Cb 0.07 0.27 0.01 0.00 -1.50 0.00 0.00 33.47 32.32 1n1m s TRP 154 CO 0.84 -0.41 -0.01 0.08 -4.62 0.00 0.00 176.95 172.84 1n1m s VAL 155 N -0.26 0.14 -0.12 5.86 1.01 -1.26 -0.19 120.40 125.57 1n1m s VAL 155 Ca -0.04 0.03 -0.07 0.00 0.00 0.00 0.00 61.98 61.89 1n1m s VAL 155 Cb -0.03 -0.19 0.05 0.00 0.00 0.00 0.00 36.38 36.20 1n1m s VAL 155 CO 0.04 0.09 0.29 0.28 0.00 0.00 0.00 175.10 175.80 1n1m s THR 156 N 0.55 -0.03 0.64 3.92 -1.32 0.10 -5.01 115.64 114.50 1n1m s THR 156 Ca -0.05 0.10 -0.12 0.00 -1.21 0.00 0.00 61.69 60.41 1n1m s THR 156 Cb -0.08 -0.44 -0.02 0.00 -1.51 0.00 0.00 72.50 70.45 1n1m s THR 156 CO -0.01 0.04 1.04 0.26 -2.21 0.00 0.00 174.62 173.74 1n1m s TRP 157 N 1.05 3.31 0.85 9.09 0.52 -1.26 -1.60 118.94 130.91 1n1m s TRP 157 Ca -0.07 1.39 -0.11 0.00 0.02 0.00 0.00 56.10 57.32 1n1m s TRP 157 Cb -0.08 -2.83 0.10 0.00 -1.15 0.00 0.00 33.47 29.51 1n1m s TRP 157 CO -0.08 -0.94 1.09 -1.54 0.02 0.00 0.00 176.95 175.50 1n1m s SER 158 N -3.74 3.93 0.38 2.95 1.04 -0.48 -4.90 113.70 112.88 1n1m s SER 158 Ca 0.58 1.47 0.10 0.00 0.48 0.00 0.00 55.95 58.58 1n1m s SER 158 Cb -0.13 -2.17 0.75 0.00 0.10 0.00 0.00 66.02 64.57 1n1m s SER 158 CO 0.50 -2.35 1.87 -0.65 0.98 0.00 0.00 173.24 173.60 1n1m h PRO 159 N -1.35 0.16 0.00 4.02 0.11 -1.82 -3.41 132.00 129.72 1n1m h PRO 159 Ca -0.48 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 1n1m h PRO 159 Cb 1.27 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1n1m h PRO 159 CO 0.56 0.39 -1.07 1.33 -0.21 0.00 0.00 178.00 179.00 1n1m n VAL 160 N -4.21 0.46 0.00 3.15 0.24 -1.26 -4.70 118.33 112.01 1n1m n VAL 160 Ca -0.01 0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1n1m n VAL 160 Cb 0.32 -1.60 0.00 0.00 -1.47 0.00 0.00 33.84 31.10 1n1m n VAL 160 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n1m n GLY 161 N 2.77 -0.97 1.36 7.63 0.00 -1.26 -3.74 105.19 110.98 1n1m n GLY 161 Ca -0.08 -0.24 0.02 0.00 0.00 0.00 0.00 46.02 45.72 1n1m n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1n1m n HIS 162 N 0.00 0.00 -1.89 1.61 1.44 -1.26 -3.05 115.22 112.07 1n1m n HIS 162 Ca 0.00 -0.47 -0.32 0.00 -2.01 0.00 0.00 57.72 54.92 1n1m n HIS 162 Cb 0.00 -0.03 0.02 0.00 0.12 0.00 0.00 29.99 30.10 1n1m n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1n1m s LYS 163 N 0.00 3.17 -0.02 -1.40 1.02 -1.26 -4.41 119.74 116.84 1n1m s LYS 163 Ca 0.26 1.14 0.01 0.00 0.02 0.00 0.00 55.97 57.40 1n1m s LYS 163 Cb 0.30 -2.02 0.02 0.00 -0.52 0.00 0.00 37.83 35.61 1n1m s LYS 163 CO -0.13 -0.92 -0.01 -0.51 -0.92 0.00 0.00 175.35 172.86 1n1m s LEU 164 N -4.83 1.40 -0.09 3.17 1.43 0.17 -1.38 118.68 118.55 1n1m s LEU 164 Ca 0.62 -0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.72 1n1m s LEU 164 Cb -0.16 -0.20 0.00 0.00 0.03 0.00 0.00 46.19 45.87 1n1m s LEU 164 CO 0.42 -0.06 -0.19 0.00 0.23 0.00 0.00 176.35 176.75 1n1m s ALA 165 N 0.72 1.82 0.04 4.21 0.00 -0.62 0.67 121.76 128.59 1n1m s ALA 165 Ca -0.07 -0.76 -0.07 0.00 0.00 0.00 0.00 51.96 51.07 1n1m s ALA 165 Cb -0.10 -0.71 -0.01 0.00 0.00 0.00 0.00 23.12 22.30 1n1m s ALA 165 CO -0.01 0.23 0.13 1.52 0.00 0.00 0.00 175.76 177.62 1n1m s TYR 166 N 0.45 0.16 -0.07 0.00 -0.85 -0.12 -0.72 117.35 116.20 1n1m s TYR 166 Ca -0.17 -0.44 0.01 0.00 -0.52 0.00 0.00 57.07 55.95 1n1m s TYR 166 Cb -0.17 -0.11 -0.03 0.00 0.38 0.00 0.00 41.96 42.03 1n1m s TYR 166 CO 0.07 -0.39 -0.08 0.08 -1.52 0.00 0.00 175.55 173.71 1n1m s VAL 167 N -2.65 3.63 -0.15 -3.49 1.01 0.73 -0.57 120.40 118.91 1n1m s VAL 167 Ca -0.05 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 1n1m s VAL 167 Cb -0.01 -2.48 0.07 0.00 0.00 0.00 0.00 36.38 33.96 1n1m s VAL 167 CO -0.05 0.59 0.33 0.86 0.00 0.00 0.00 175.10 176.84 1n1m s TRP 168 N -0.76 -0.56 -1.42 5.22 -0.00 -0.65 -1.20 118.94 119.57 1n1m s TRP 168 Ca 0.12 1.18 -0.07 0.00 -0.00 0.00 0.00 56.10 57.33 1n1m s TRP 168 Cb -0.11 0.12 0.01 0.00 -0.00 0.00 0.00 33.47 33.49 1n1m s TRP 168 CO 0.01 -0.39 0.87 0.09 -0.00 0.00 0.00 176.95 177.53 1n1m n ASN 169 N 5.15 -6.15 -0.64 5.86 5.03 -1.26 -2.33 115.26 120.91 1n1m n ASN 169 Ca -0.10 -0.40 -0.08 0.00 0.87 0.00 0.00 54.58 54.86 1n1m n ASN 169 Cb 0.50 -4.87 -0.04 0.00 -1.02 0.00 0.00 39.78 34.35 1n1m n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1n1m n ASN 170 N -2.63 -4.62 -4.29 6.41 5.03 -1.26 -4.37 115.26 109.52 1n1m n ASN 170 Ca -0.05 0.21 -0.25 0.00 0.87 0.00 0.00 54.58 55.35 1n1m n ASN 170 Cb 0.59 -2.86 -0.13 0.00 -1.02 0.00 0.00 39.78 36.36 1n1m n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1n1m s ASP 171 N -2.57 2.63 0.14 6.41 1.01 -0.99 -2.30 116.67 121.00 1n1m s ASP 171 Ca 0.00 -0.65 -0.21 0.00 0.71 0.00 0.00 52.55 52.40 1n1m s ASP 171 Cb 0.00 -0.17 -0.07 0.00 1.01 0.00 0.00 42.92 43.68 1n1m s ASP 171 CO 0.00 0.11 0.68 -0.63 0.21 0.00 0.00 175.17 175.53 1n1m s ILE 172 N -1.04 4.57 -0.01 0.77 1.01 -1.26 -1.64 121.20 123.60 1n1m s ILE 172 Ca 0.08 1.40 0.02 0.00 0.00 0.00 0.00 60.65 62.15 1n1m s ILE 172 Cb -0.10 -3.98 -0.00 0.00 0.01 0.00 0.00 42.46 38.40 1n1m s ILE 172 CO 0.04 0.47 -0.06 -0.31 0.00 0.00 0.00 174.94 175.07 1n1m s TYR 173 N -1.21 0.62 -0.08 3.97 1.51 0.27 -0.94 117.35 121.48 1n1m s TYR 173 Ca 0.34 -0.13 0.05 0.00 -1.01 0.00 0.00 57.07 56.33 1n1m s TYR 173 Cb -0.20 -0.43 -0.00 0.00 -0.11 0.00 0.00 41.96 41.21 1n1m s TYR 173 CO 0.22 -0.04 -0.24 0.08 -1.11 0.00 0.00 175.55 174.47 1n1m s VAL 174 N 0.01 2.01 -0.27 0.71 1.01 -0.67 -0.95 120.40 122.26 1n1m s VAL 174 Ca 0.00 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 60.95 1n1m s VAL 174 Cb -0.05 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.64 1n1m s VAL 174 CO -0.00 0.55 -0.03 -0.54 0.00 0.00 0.00 175.10 175.08 1n1m s LYS 175 N 0.14 2.75 0.21 2.72 1.02 0.21 -0.75 119.74 126.05 1n1m s LYS 175 Ca -0.12 -1.04 0.09 0.00 0.02 0.00 0.00 55.97 54.91 1n1m s LYS 175 Cb -0.16 -3.08 0.12 0.00 -0.52 0.00 0.00 37.83 34.19 1n1m s LYS 175 CO 0.07 -0.46 1.47 0.82 -0.92 0.00 0.00 175.35 176.32 1n1m h ILE 176 N 6.20 1.55 -3.39 2.17 2.04 -1.84 0.50 117.51 124.75 1n1m h ILE 176 Ca -0.29 -2.67 -0.42 0.00 1.00 0.00 0.00 64.86 62.47 1n1m h ILE 176 Cb 1.10 2.44 -0.35 0.00 -0.74 0.00 0.00 36.82 39.27 1n1m h ILE 176 CO 0.57 0.76 -0.77 -1.61 0.00 0.00 0.00 178.15 177.09 1n1m s GLU 177 N -3.23 0.82 0.50 2.37 0.41 -1.26 -4.49 118.70 113.83 1n1m s GLU 177 Ca -0.00 -0.06 0.25 0.00 -0.41 0.00 0.00 54.97 54.75 1n1m s GLU 177 Cb 0.11 -0.93 0.86 0.00 -1.78 0.00 0.00 34.13 32.40 1n1m s GLU 177 CO 0.79 -0.15 1.11 -2.30 -0.49 0.00 0.00 175.26 174.22 1n1m n PRO 178 N 4.39 0.01 -0.00 0.39 -0.02 -1.26 -0.49 135.00 138.02 1n1m n PRO 178 Ca -0.19 0.86 0.02 0.00 -2.02 0.00 0.00 63.50 62.16 1n1m n PRO 178 Cb 0.51 -2.11 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 1n1m n PRO 178 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1n1m n ASN 179 N -3.02 0.77 -4.85 2.55 6.94 -1.26 -4.86 115.26 111.53 1n1m n ASN 179 Ca 0.22 -0.50 -0.30 0.00 -0.02 0.00 0.00 54.58 53.98 1n1m n ASN 179 Cb 1.34 1.03 0.05 0.00 -2.36 0.00 0.00 39.78 39.84 1n1m n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1n1m s LEU 180 N -2.34 2.91 1.06 -4.53 1.02 0.36 -4.34 118.68 112.81 1n1m s LEU 180 Ca 0.01 1.32 -0.16 0.00 0.02 0.00 0.00 54.13 55.32 1n1m s LEU 180 Cb 0.03 -4.12 0.08 0.00 0.02 0.00 0.00 46.19 42.20 1n1m s LEU 180 CO 0.16 -1.47 0.15 -2.65 0.02 0.00 0.00 176.35 172.56 1n1m n PRO 181 N -3.11 -1.11 -4.26 1.29 -0.02 -1.26 -4.84 135.00 121.69 1n1m n PRO 181 Ca 0.07 -0.30 -0.35 0.00 -2.02 0.00 0.00 63.50 60.90 1n1m n PRO 181 Cb 0.56 -1.76 -0.09 0.00 -0.02 0.00 0.00 33.50 32.20 1n1m n PRO 181 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n1m s SER 182 N -1.90 5.47 -0.29 2.55 0.15 -1.26 -4.66 113.70 113.76 1n1m s SER 182 Ca 0.56 0.19 -0.16 0.00 0.70 0.00 0.00 55.95 57.24 1n1m s SER 182 Cb -0.15 -1.58 -0.03 0.00 -1.71 0.00 0.00 66.02 62.55 1n1m s SER 182 CO 0.67 0.37 0.43 -0.31 1.20 0.00 0.00 173.24 175.59 1n1m s TYR 183 N -0.96 3.24 -0.54 3.44 2.02 0.07 -4.89 117.35 119.73 1n1m s TYR 183 Ca 0.15 0.38 -0.27 0.00 -0.37 0.00 0.00 57.07 56.96 1n1m s TYR 183 Cb -0.12 -2.67 -0.02 0.00 -0.40 0.00 0.00 41.96 38.75 1n1m s TYR 183 CO 0.04 -0.31 1.82 1.03 -1.57 0.00 0.00 175.55 176.57 1n1m s ARG 184 N 2.17 2.83 0.28 -0.62 1.81 -1.26 -1.67 118.95 122.49 1n1m s ARG 184 Ca 0.17 0.80 0.15 0.00 -1.72 0.00 0.00 55.73 55.13 1n1m s ARG 184 Cb -0.16 -4.33 0.22 0.00 -0.45 0.00 0.00 34.95 30.23 1n1m s ARG 184 CO 0.10 -2.49 1.51 0.82 -0.68 0.00 0.00 175.30 174.57 1n1m h ILE 185 N 6.85 1.02 -3.59 1.52 1.08 -1.41 -3.39 117.51 119.60 1n1m h ILE 185 Ca -0.28 -2.19 -0.16 0.00 -0.39 0.00 0.00 64.86 61.84 1n1m h ILE 185 Cb 1.16 2.33 -0.22 0.00 -3.07 0.00 0.00 36.82 37.03 1n1m h ILE 185 CO 1.17 0.53 -0.54 0.28 -0.69 0.00 0.00 178.15 178.90 1n1m s THR 186 N -3.14 0.08 0.00 -0.27 -1.32 -1.18 -4.76 115.64 105.05 1n1m s THR 186 Ca 0.02 -0.63 0.00 0.00 -1.21 0.00 0.00 61.69 59.87 1n1m s THR 186 Cb 0.09 -0.36 0.00 0.00 -1.51 0.00 0.00 72.50 70.72 1n1m s THR 186 CO 0.74 -0.34 0.61 0.79 -2.21 0.00 0.00 174.62 174.20 1n1m n TRP 187 N 1.71 0.00 1.34 9.09 7.02 -1.26 -4.42 117.44 130.92 1n1m n TRP 187 Ca -0.21 -0.17 0.13 0.00 -1.02 0.00 0.00 57.50 56.23 1n1m n TRP 187 Cb 0.56 -0.02 0.39 0.00 -2.42 0.00 0.00 31.31 29.82 1n1m n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1n1m n THR 188 N -0.17 0.00 -1.69 -0.99 -2.24 -1.26 -4.96 114.28 102.97 1n1m n THR 188 Ca 0.00 -0.33 -0.44 0.00 -2.27 0.00 0.00 64.05 61.01 1n1m n THR 188 Cb 0.18 0.81 -0.04 0.00 -2.10 0.00 0.00 70.33 69.18 1n1m n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n1m n GLY 189 N 1.23 1.46 3.07 3.38 0.00 -1.26 -4.73 105.19 108.35 1n1m n GLY 189 Ca 0.17 0.70 -0.12 0.00 0.00 0.00 0.00 46.02 46.77 1n1m n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n1m s LYS 190 N 2.09 0.20 -0.05 1.61 2.20 -1.07 -4.89 119.74 119.83 1n1m s LYS 190 Ca 0.81 0.79 -0.39 0.00 -0.36 0.00 0.00 55.97 56.82 1n1m s LYS 190 Cb -0.57 0.03 -0.19 0.00 -1.51 0.00 0.00 37.83 35.59 1n1m s LYS 190 CO 0.38 -0.26 1.07 -1.91 -0.36 0.00 0.00 175.35 174.27 1n1m n GLU 191 N 5.21 0.00 -0.71 4.03 2.13 -1.26 -0.63 120.64 129.41 1n1m n GLU 191 Ca -0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.73 1n1m n GLU 191 Cb 0.50 -1.43 0.00 0.00 0.27 0.00 0.00 31.44 30.79 1n1m n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1n1m n ASP 192 N 1.65 -3.50 0.03 4.31 8.00 -1.26 -4.66 116.55 121.12 1n1m n ASP 192 Ca 0.20 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.69 1n1m n ASP 192 Cb 0.06 -2.73 -0.00 0.00 -0.02 0.00 0.00 41.12 38.43 1n1m n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1n1m n ILE 193 N -1.62 1.14 -4.89 0.53 2.08 0.20 -4.73 119.36 112.07 1n1m n ILE 193 Ca 0.00 0.35 -0.31 0.00 0.56 0.00 0.00 62.75 63.35 1n1m n ILE 193 Cb 0.29 -1.60 -0.17 0.00 -0.75 0.00 0.00 39.64 37.41 1n1m n ILE 193 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1n1m s ILE 194 N -1.98 1.87 -0.23 1.39 1.01 0.08 0.71 121.20 124.05 1n1m s ILE 194 Ca -0.02 -0.89 -0.01 0.00 0.00 0.00 0.00 60.65 59.73 1n1m s ILE 194 Cb 0.00 -1.64 0.03 0.00 0.01 0.00 0.00 42.46 40.85 1n1m s ILE 194 CO 0.04 0.52 -0.10 -0.31 0.00 0.00 0.00 174.94 175.08 1n1m s TYR 195 N 0.60 3.02 -0.23 3.97 1.51 0.48 -2.59 117.35 124.10 1n1m s TYR 195 Ca -0.13 -1.62 -0.05 0.00 -1.01 0.00 0.00 57.07 54.25 1n1m s TYR 195 Cb -0.17 -2.01 -0.01 0.00 -0.11 0.00 0.00 41.96 39.66 1n1m s TYR 195 CO 0.04 -0.75 -0.00 -0.80 -1.11 0.00 0.00 175.55 172.92 1n1m s ASN 196 N 1.30 4.58 0.00 2.29 0.01 -0.97 -0.84 114.94 121.30 1n1m s ASN 196 Ca 0.01 -0.35 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 1n1m s ASN 196 Cb -0.16 -1.80 0.00 0.00 0.41 0.00 0.00 41.25 39.70 1n1m s ASN 196 CO -0.06 -0.03 0.00 0.61 -1.51 0.00 0.00 177.10 176.10 1n1m n GLY 197 N 4.84 1.85 3.18 0.66 0.00 -0.93 -4.25 105.19 110.53 1n1m n GLY 197 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 1n1m n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1n1m s ILE 198 N -2.58 0.67 0.49 -0.61 -4.36 -1.26 -0.40 121.20 113.15 1n1m s ILE 198 Ca 0.00 -1.94 -0.02 0.00 -0.26 0.00 0.00 60.65 58.43 1n1m s ILE 198 Cb 0.00 -1.75 -0.00 0.00 1.25 0.00 0.00 42.46 41.96 1n1m s ILE 198 CO 0.00 -0.82 0.74 0.42 0.24 0.00 0.00 174.94 175.53 1n1m s THR 199 N -3.64 4.00 0.59 8.37 -4.23 -0.31 -4.71 115.64 115.71 1n1m s THR 199 Ca 0.14 -0.29 0.02 0.00 -1.18 0.00 0.00 61.69 60.37 1n1m s THR 199 Cb 0.05 -3.51 0.06 0.00 1.34 0.00 0.00 72.50 70.44 1n1m s THR 199 CO -0.04 -0.42 0.82 1.51 -0.54 0.00 0.00 174.62 175.95 1n1m s ASP 200 N -4.23 5.04 0.23 3.99 -4.77 -1.26 -4.81 116.67 110.86 1n1m s ASP 200 Ca 0.50 -0.22 -0.15 0.00 -3.30 0.00 0.00 52.55 49.37 1n1m s ASP 200 Cb -0.10 -0.51 0.26 0.00 -1.09 0.00 0.00 42.92 41.48 1n1m s ASP 200 CO 0.40 -1.32 1.58 -0.25 0.70 0.00 0.00 175.17 176.28 1n1m h TRP 201 N -0.03 -0.78 -0.11 2.11 7.01 -2.00 -1.47 115.95 120.69 1n1m h TRP 201 Ca -0.39 0.08 -0.16 0.00 2.11 0.00 0.00 58.89 60.53 1n1m h TRP 201 Cb 1.29 0.47 -0.01 0.00 -2.10 0.00 0.00 29.16 28.81 1n1m h TRP 201 CO 0.23 -0.38 -0.62 -0.24 -2.79 0.00 0.00 178.44 174.64 1n1m h VAL 202 N -0.05 1.36 -0.37 2.65 3.04 -1.94 -2.06 116.25 118.88 1n1m h VAL 202 Ca 0.34 -1.95 -0.11 0.00 -1.01 0.00 0.00 66.70 63.97 1n1m h VAL 202 Cb 0.60 1.95 -0.01 0.00 -2.01 0.00 0.00 31.29 31.81 1n1m h VAL 202 CO -0.86 0.59 -0.22 1.88 -1.01 0.00 0.00 177.57 177.95 1n1m h TYR 203 N 0.28 0.83 -0.06 3.17 -1.99 -1.81 0.15 116.97 117.54 1n1m h TYR 203 Ca -0.01 -0.18 -0.00 0.00 2.00 0.00 0.00 58.73 60.54 1n1m h TYR 203 Cb 1.15 -0.20 -0.00 0.00 2.00 0.00 0.00 36.73 39.68 1n1m h TYR 203 CO 0.03 0.88 0.02 1.49 -0.00 0.00 0.00 178.16 180.59 1n1m h GLU 204 N 0.64 0.09 0.13 4.88 4.81 -1.10 -0.69 114.58 123.34 1n1m h GLU 204 Ca 0.09 -0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.13 1n1m h GLU 204 Cb 0.71 -0.01 0.02 0.00 0.63 0.00 0.00 28.75 30.09 1n1m h GLU 204 CO 0.05 0.23 -0.77 1.49 -0.73 0.00 0.00 179.01 179.28 1n1m h GLU 205 N -0.06 0.27 0.03 1.92 4.57 -1.34 -2.09 114.58 117.88 1n1m h GLU 205 Ca 0.02 -0.46 -0.35 0.00 -1.18 0.00 0.00 59.36 57.39 1n1m h GLU 205 Cb 0.17 0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 28.89 1n1m h GLU 205 CO -0.00 1.22 -1.95 0.39 -1.18 0.00 0.00 179.01 177.49 1n1m n GLU 206 N -4.16 0.64 -0.09 1.92 -0.58 0.52 -4.41 120.64 114.48 1n1m n GLU 206 Ca -0.14 0.35 -0.23 0.00 -0.42 0.00 0.00 57.16 56.72 1n1m n GLU 206 Cb 0.80 -1.64 -0.12 0.00 -0.57 0.00 0.00 31.44 29.91 1n1m n GLU 206 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 1n1m n VAL 207 N -3.94 1.58 -0.03 2.62 3.14 -1.11 -4.63 118.33 115.96 1n1m n VAL 207 Ca -0.40 -0.27 -0.12 0.00 -2.96 0.00 0.00 64.34 60.60 1n1m n VAL 207 Cb 0.88 -1.90 -0.14 0.00 -1.06 0.00 0.00 33.84 31.61 1n1m n VAL 207 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 1n1m n PHE 208 N -4.12 0.94 -2.80 1.45 3.01 -0.28 -4.97 117.46 110.69 1n1m n PHE 208 Ca -0.38 0.30 -0.17 0.00 1.01 0.00 0.00 57.45 58.21 1n1m n PHE 208 Cb 0.82 -1.16 0.03 0.00 -0.01 0.00 0.00 39.48 39.16 1n1m n PHE 208 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1n1m n SER 209 N -3.12 -5.09 -3.48 4.37 2.88 -0.83 -4.97 113.62 103.38 1n1m n SER 209 Ca -0.22 -0.20 -0.10 0.00 -1.33 0.00 0.00 58.87 57.01 1n1m n SER 209 Cb 1.06 -3.96 -0.02 0.00 -0.75 0.00 0.00 64.21 60.54 1n1m n SER 209 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n1m s ALA 210 N -3.01 -1.65 -0.06 -1.46 0.00 -0.92 -5.00 121.76 109.67 1n1m s ALA 210 Ca 0.21 0.59 -0.06 0.00 0.00 0.00 0.00 51.96 52.71 1n1m s ALA 210 Cb -0.09 0.73 -0.28 0.00 0.00 0.00 0.00 23.12 23.48 1n1m s ALA 210 CO 0.27 -0.77 0.62 -0.92 0.00 0.00 0.00 175.76 174.96 1n1m h TYR 211 N 2.00 0.52 -3.86 0.00 3.20 -1.90 -3.37 116.97 113.56 1n1m h TYR 211 Ca -0.29 -0.38 -0.53 0.00 3.14 0.00 0.00 58.73 60.67 1n1m h TYR 211 Cb 1.28 -0.02 0.08 0.00 1.54 0.00 0.00 36.73 39.61 1n1m h TYR 211 CO 0.25 1.58 0.69 0.45 -1.64 0.00 0.00 178.16 179.49 1n1m s SER 212 N -7.03 6.64 -0.17 -2.11 0.15 -1.26 -1.16 113.70 108.75 1n1m s SER 212 Ca -0.15 2.79 0.15 0.00 0.70 0.00 0.00 55.95 59.44 1n1m s SER 212 Cb 0.06 -2.65 0.44 0.00 -1.71 0.00 0.00 66.02 62.16 1n1m s SER 212 CO 0.83 -0.64 1.19 0.00 1.20 0.00 0.00 173.24 175.82 1n1m n ALA 213 N 0.83 3.44 -2.83 5.45 0.00 0.47 -4.70 120.51 123.17 1n1m n ALA 213 Ca 0.01 -3.08 -0.14 0.00 0.00 0.00 0.00 53.44 50.23 1n1m n ALA 213 Cb 0.41 -0.49 -0.13 0.00 0.00 0.00 0.00 19.45 19.24 1n1m n ALA 213 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1n1m s LEU 214 N -2.48 2.12 -0.11 0.00 0.05 -1.24 -1.62 118.68 115.41 1n1m s LEU 214 Ca 0.38 -0.29 -0.03 0.00 0.05 0.00 0.00 54.13 54.24 1n1m s LEU 214 Cb 0.38 -0.17 0.04 0.00 -2.05 0.00 0.00 46.19 44.39 1n1m s LEU 214 CO -0.08 -0.08 0.06 0.26 -0.55 0.00 0.00 176.35 175.96 1n1m s TRP 215 N -0.69 0.35 0.54 3.48 0.51 0.13 -4.98 118.94 118.27 1n1m s TRP 215 Ca -0.04 -0.17 -0.18 0.00 -2.12 0.00 0.00 56.10 53.59 1n1m s TRP 215 Cb -0.05 -0.69 -0.06 0.00 -0.81 0.00 0.00 33.47 31.86 1n1m s TRP 215 CO -0.00 -0.39 1.04 -1.58 -0.51 0.00 0.00 176.95 175.52 1n1m s TRP 216 N 2.08 3.03 0.74 -1.98 0.52 -1.26 -0.34 118.94 121.73 1n1m s TRP 216 Ca 0.03 1.53 -0.11 0.00 0.02 0.00 0.00 56.10 57.57 1n1m s TRP 216 Cb -0.14 -3.01 0.04 0.00 -1.15 0.00 0.00 33.47 29.20 1n1m s TRP 216 CO -0.06 -0.93 1.08 -1.54 0.02 0.00 0.00 176.95 175.52 1n1m s SER 217 N -2.48 5.04 0.29 2.95 1.04 0.44 -4.89 113.70 116.09 1n1m s SER 217 Ca 0.65 1.34 0.04 0.00 0.48 0.00 0.00 55.95 58.45 1n1m s SER 217 Cb -0.16 -2.14 0.75 0.00 0.10 0.00 0.00 66.02 64.57 1n1m s SER 217 CO 0.29 -1.63 1.67 -0.65 0.98 0.00 0.00 173.24 173.91 1n1m h PRO 218 N -0.85 0.30 -0.58 4.02 0.11 -1.90 -1.69 132.00 131.41 1n1m h PRO 218 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1n1m h PRO 218 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1n1m h PRO 218 CO 0.60 0.20 0.00 0.27 -0.21 0.00 0.00 178.00 178.86 1n1m n ASN 219 N -5.12 3.64 0.00 -2.05 0.23 -1.26 -4.37 115.26 106.32 1n1m n ASN 219 Ca 0.22 -1.99 0.00 0.00 -0.53 0.00 0.00 54.58 52.29 1n1m n ASN 219 Cb 0.69 -0.38 0.00 0.00 -2.08 0.00 0.00 39.78 38.01 1n1m n ASN 219 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n1m n GLY 220 N 1.41 0.81 0.10 4.83 0.00 -0.64 -4.74 105.19 106.96 1n1m n GLY 220 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 1n1m n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1n1m h THR 221 N 0.00 1.28 -3.06 2.61 2.02 -1.93 -3.44 112.91 110.38 1n1m h THR 221 Ca 0.00 -0.90 -0.62 0.00 0.77 0.00 0.00 66.41 65.65 1n1m h THR 221 Cb 0.00 1.66 -0.08 0.00 -1.74 0.00 0.00 68.15 67.99 1n1m h THR 221 CO 0.00 0.26 -0.58 -0.36 0.37 0.00 0.00 175.52 175.21 1n1m s PHE 222 N -4.82 3.24 -0.20 3.16 0.08 -1.26 -0.38 117.98 117.81 1n1m s PHE 222 Ca -0.14 0.09 -0.01 0.00 0.12 0.00 0.00 56.93 56.99 1n1m s PHE 222 Cb 0.05 -1.63 0.05 0.00 -0.57 0.00 0.00 43.02 40.92 1n1m s PHE 222 CO 0.71 0.53 -0.03 -1.17 -0.10 0.00 0.00 175.22 175.16 1n1m s LEU 223 N -2.52 1.89 0.12 -0.37 2.96 -0.01 -0.42 118.68 120.33 1n1m s LEU 223 Ca 0.31 -0.90 -0.08 0.00 -0.22 0.00 0.00 54.13 53.24 1n1m s LEU 223 Cb -0.12 -0.95 -0.06 0.00 0.50 0.00 0.00 46.19 45.56 1n1m s LEU 223 CO 0.23 -0.23 0.41 0.00 -1.32 0.00 0.00 176.35 175.44 1n1m s ALA 224 N 1.59 3.73 0.17 5.97 0.00 0.54 -1.29 121.76 132.46 1n1m s ALA 224 Ca -0.02 -0.43 -0.19 0.00 0.00 0.00 0.00 51.96 51.32 1n1m s ALA 224 Cb -0.17 -2.24 0.04 0.00 0.00 0.00 0.00 23.12 20.75 1n1m s ALA 224 CO -0.07 0.60 0.52 1.52 0.00 0.00 0.00 175.76 178.32 1n1m s TYR 225 N -1.55 -0.28 0.20 0.00 1.13 0.05 0.21 117.35 117.12 1n1m s TYR 225 Ca 0.38 -0.02 0.11 0.00 -1.41 0.00 0.00 57.07 56.12 1n1m s TYR 225 Cb -0.13 0.41 -0.04 0.00 -1.10 0.00 0.00 41.96 41.10 1n1m s TYR 225 CO 0.21 -0.84 -0.19 0.00 -2.51 0.00 0.00 175.55 172.22 1n1m s ALA 226 N -3.81 2.70 -0.10 9.51 0.00 -0.64 -0.52 121.76 128.90 1n1m s ALA 226 Ca 0.05 -1.62 0.01 0.00 0.00 0.00 0.00 51.96 50.40 1n1m s ALA 226 Cb -0.00 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.68 1n1m s ALA 226 CO -0.09 0.42 -0.12 -1.14 0.00 0.00 0.00 175.76 174.83 1n1m s GLN 227 N -2.84 1.89 -0.20 0.00 0.74 0.28 -2.20 119.66 117.33 1n1m s GLN 227 Ca 0.23 -0.44 -0.05 0.00 0.05 0.00 0.00 55.36 55.15 1n1m s GLN 227 Cb -0.08 -1.66 -0.02 0.00 1.10 0.00 0.00 33.01 32.35 1n1m s GLN 227 CO 0.12 -0.08 0.00 -0.06 -0.55 0.00 0.00 175.29 174.72 1n1m s PHE 228 N 1.04 3.04 -0.33 1.67 0.08 -0.02 -1.15 117.98 122.31 1n1m s PHE 228 Ca -0.07 -0.44 -0.08 0.00 0.12 0.00 0.00 56.93 56.46 1n1m s PHE 228 Cb -0.15 -2.08 0.02 0.00 -0.57 0.00 0.00 43.02 40.24 1n1m s PHE 228 CO -0.01 -0.23 0.14 1.21 -0.10 0.00 0.00 175.22 176.22 1n1m s ASN 229 N 0.98 5.42 -0.18 1.36 3.84 -0.40 -0.39 114.94 125.57 1n1m s ASN 229 Ca 0.02 -0.83 0.16 0.00 0.21 0.00 0.00 52.86 52.42 1n1m s ASN 229 Cb -0.14 -1.94 0.58 0.00 -0.55 0.00 0.00 41.25 39.20 1n1m s ASN 229 CO 0.02 -0.27 1.48 0.47 -2.79 0.00 0.00 177.10 176.01 1n1m n ASP 230 N 4.92 4.23 -0.32 -4.21 9.92 0.22 -1.70 116.55 129.61 1n1m n ASP 230 Ca -0.13 -2.94 0.16 0.00 -0.53 0.00 0.00 54.79 51.35 1n1m n ASP 230 Cb 0.47 -0.56 0.33 0.00 -0.64 0.00 0.00 41.12 40.72 1n1m n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1n1m h THR 231 N 2.30 0.11 -0.45 -3.53 2.02 -1.85 -0.76 112.91 110.76 1n1m h THR 231 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1n1m h THR 231 Cb 1.52 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 1n1m h THR 231 CO 0.27 0.01 0.00 -0.62 0.37 0.00 0.00 175.52 175.55 1n1m n GLU 232 N -5.38 2.68 -2.50 6.66 1.02 -1.26 -4.95 120.64 116.91 1n1m n GLU 232 Ca 0.24 -2.20 -0.43 0.00 -0.02 0.00 0.00 57.16 54.76 1n1m n GLU 232 Cb 0.81 -1.37 -0.02 0.00 -0.02 0.00 0.00 31.44 30.83 1n1m n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1n1m s VAL 233 N -1.03 4.40 0.78 2.62 1.01 -0.29 -4.65 120.40 123.24 1n1m s VAL 233 Ca 0.31 1.70 -0.15 0.00 0.00 0.00 0.00 61.98 63.84 1n1m s VAL 233 Cb 0.17 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 1n1m s VAL 233 CO 0.22 -0.13 0.55 -2.65 0.00 0.00 0.00 175.10 173.08 1n1m n PRO 234 N 6.38 0.17 -4.39 2.72 -0.02 -1.26 -4.65 135.00 133.95 1n1m n PRO 234 Ca 0.13 0.10 -0.35 0.00 -2.02 0.00 0.00 63.50 61.37 1n1m n PRO 234 Cb 0.45 -1.88 -0.10 0.00 -0.02 0.00 0.00 33.50 31.96 1n1m n PRO 234 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1n1m s LEU 235 N -0.77 3.56 -0.17 2.45 1.43 -1.26 -1.63 118.68 122.29 1n1m s LEU 235 Ca 0.64 0.13 -0.13 0.00 -1.03 0.00 0.00 54.13 53.75 1n1m s LEU 235 Cb -0.31 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 1n1m s LEU 235 CO 0.60 0.38 0.25 -0.51 0.23 0.00 0.00 176.35 177.29 1n1m s ILE 236 N -0.88 5.33 -0.05 -0.59 1.10 -0.53 -4.91 121.20 120.67 1n1m s ILE 236 Ca 0.13 0.45 0.04 0.00 -0.51 0.00 0.00 60.65 60.76 1n1m s ILE 236 Cb -0.11 -3.58 -0.00 0.00 0.15 0.00 0.00 42.46 38.91 1n1m s ILE 236 CO 0.02 0.42 -0.19 -1.61 -2.11 0.00 0.00 174.94 171.47 1n1m s GLU 237 N 0.35 2.03 0.14 3.50 2.02 -1.26 -2.00 118.70 123.47 1n1m s GLU 237 Ca 0.14 -0.67 -0.09 0.00 0.02 0.00 0.00 54.97 54.37 1n1m s GLU 237 Cb -0.12 -1.72 -0.00 0.00 0.10 0.00 0.00 34.13 32.39 1n1m s GLU 237 CO 0.02 0.24 0.26 1.52 0.02 0.00 0.00 175.26 177.33 1n1m s TYR 238 N 0.08 0.28 0.09 1.61 1.13 -0.78 -5.00 117.35 114.75 1n1m s TYR 238 Ca -0.06 -0.66 -0.14 0.00 -1.41 0.00 0.00 57.07 54.80 1n1m s TYR 238 Cb -0.13 -0.03 -0.06 0.00 -1.10 0.00 0.00 41.96 40.63 1n1m s TYR 238 CO 0.03 -0.66 0.49 -1.12 -2.51 0.00 0.00 175.55 171.78 1n1m s SER 239 N -2.92 6.81 -0.12 -0.18 0.01 -1.26 -0.96 113.70 115.08 1n1m s SER 239 Ca 0.12 1.01 0.02 0.00 1.31 0.00 0.00 55.95 58.42 1n1m s SER 239 Cb 0.04 -2.26 0.01 0.00 0.21 0.00 0.00 66.02 64.01 1n1m s SER 239 CO -0.04 0.19 -0.19 0.12 0.41 0.00 0.00 173.24 173.73 1n1m s PHE 240 N -1.31 2.30 -0.09 2.43 5.36 0.10 -4.70 117.98 122.07 1n1m s PHE 240 Ca 0.32 -1.09 0.15 0.00 -0.96 0.00 0.00 56.93 55.36 1n1m s PHE 240 Cb -0.16 -1.60 -0.18 0.00 -0.34 0.00 0.00 43.02 40.74 1n1m s PHE 240 CO 0.18 -0.51 0.73 0.66 -1.46 0.00 0.00 175.22 174.82 1n1m n TYR 241 N 4.02 0.97 -4.38 10.12 4.02 -1.26 -1.55 117.16 129.10 1n1m n TYR 241 Ca -0.20 0.33 0.03 0.00 -0.01 0.00 0.00 57.90 58.05 1n1m n TYR 241 Cb 0.52 -1.13 -0.01 0.00 -0.02 0.00 0.00 39.34 38.70 1n1m n TYR 241 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1n1m n SER 242 N -2.95 -6.13 -4.59 7.72 2.88 -1.26 -4.73 113.62 104.56 1n1m n SER 242 Ca -0.13 0.20 -0.36 0.00 -1.33 0.00 0.00 58.87 57.24 1n1m n SER 242 Cb 0.94 -0.57 0.07 0.00 -0.75 0.00 0.00 64.21 63.91 1n1m n SER 242 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1n1m n ASP 243 N -3.20 0.24 -0.33 -3.46 8.00 -1.26 -4.85 116.55 111.68 1n1m n ASP 243 Ca 0.00 0.69 0.22 0.00 0.71 0.00 0.00 54.79 56.42 1n1m n ASP 243 Cb 0.08 -1.36 0.45 0.00 -0.02 0.00 0.00 41.12 40.27 1n1m n ASP 243 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1n1m h GLU 244 N -0.06 0.32 -0.34 -1.24 4.81 -2.04 -0.29 114.58 115.73 1n1m h GLU 244 Ca -0.47 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 58.84 1n1m h GLU 244 Cb 1.35 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 1n1m h GLU 244 CO 0.47 0.21 0.27 0.66 -0.73 0.00 0.00 179.01 179.89 1n1m h SER 245 N 0.33 0.00 -2.60 1.04 4.64 -1.94 -3.41 113.55 111.60 1n1m h SER 245 Ca 0.71 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.48 1n1m h SER 245 Cb 1.60 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.67 1n1m h SER 245 CO -0.61 0.00 1.15 -0.22 -0.87 0.00 0.00 176.83 176.28 1n1m s LEU 246 N -8.40 4.09 0.04 5.97 0.20 -0.12 -4.88 118.68 115.57 1n1m s LEU 246 Ca -0.05 1.99 -0.23 0.00 0.69 0.00 0.00 54.13 56.54 1n1m s LEU 246 Cb 0.18 -3.53 -0.15 0.00 -0.43 0.00 0.00 46.19 42.26 1n1m s LEU 246 CO 0.66 -1.15 1.43 -0.61 -0.29 0.00 0.00 176.35 176.38 1n1m h GLN 247 N 10.55 0.18 -5.76 1.98 4.15 -1.89 -3.43 115.11 120.88 1n1m h GLN 247 Ca -0.38 -0.07 -0.66 0.00 0.77 0.00 0.00 58.65 58.31 1n1m h GLN 247 Cb 1.18 -0.01 -0.18 0.00 0.21 0.00 0.00 27.48 28.68 1n1m h GLN 247 CO 0.97 0.48 -0.64 0.71 -1.93 0.00 0.00 178.83 178.42 1n1m s TYR 248 N -4.79 3.09 0.57 3.99 1.51 -1.26 -5.10 117.35 115.36 1n1m s TYR 248 Ca -0.15 0.02 -0.19 0.00 -1.01 0.00 0.00 57.07 55.74 1n1m s TYR 248 Cb 0.05 -1.85 -0.05 0.00 -0.11 0.00 0.00 41.96 40.00 1n1m s TYR 248 CO 0.70 0.28 1.14 -2.14 -1.11 0.00 0.00 175.55 174.42 1n1m s PRO 249 N -0.42 3.21 0.19 -1.71 0.02 -1.26 -5.02 135.00 129.99 1n1m s PRO 249 Ca 0.07 1.61 0.06 0.00 0.02 0.00 0.00 61.00 62.77 1n1m s PRO 249 Cb -0.12 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.38 1n1m s PRO 249 CO 0.02 -0.97 0.08 -1.59 -0.33 0.00 0.00 177.00 174.22 1n1m s LYS 250 N -3.42 2.68 -0.26 5.54 -2.85 -0.59 -4.95 119.74 115.90 1n1m s LYS 250 Ca 0.73 -1.01 -0.08 0.00 -1.00 0.00 0.00 55.97 54.61 1n1m s LYS 250 Cb -0.24 -2.50 -0.02 0.00 -2.06 0.00 0.00 37.83 33.01 1n1m s LYS 250 CO 0.30 0.46 0.08 0.99 0.10 0.00 0.00 175.35 177.28 1n1m s THR 251 N -1.83 4.32 -0.03 3.79 2.01 -1.26 -0.72 115.64 121.91 1n1m s THR 251 Ca 0.30 -0.25 -0.25 0.00 0.31 0.00 0.00 61.69 61.80 1n1m s THR 251 Cb -0.09 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.32 1n1m s THR 251 CO 0.22 0.28 0.78 -0.69 -0.69 0.00 0.00 174.62 174.51 1n1m s VAL 252 N 1.60 4.96 -0.05 3.82 1.01 -0.14 -4.92 120.40 126.68 1n1m s VAL 252 Ca 0.06 1.62 -0.01 0.00 0.00 0.00 0.00 61.98 63.65 1n1m s VAL 252 Cb -0.16 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 32.13 1n1m s VAL 252 CO 0.04 0.25 -0.00 0.00 0.00 0.00 0.00 175.10 175.39 1n1m s ARG 253 N 0.71 0.52 -0.01 2.72 3.03 -1.26 -1.87 118.95 122.79 1n1m s ARG 253 Ca 0.41 0.09 0.02 0.00 2.03 0.00 0.00 55.73 58.28 1n1m s ARG 253 Cb -0.19 -0.80 -0.00 0.00 -1.03 0.00 0.00 34.95 32.93 1n1m s ARG 253 CO 0.21 -0.23 -0.08 0.54 -1.13 0.00 0.00 175.30 174.62 1n1m s VAL 254 N 1.59 0.63 0.04 4.99 0.11 -0.85 -4.94 120.40 121.97 1n1m s VAL 254 Ca -0.01 -0.31 -0.30 0.00 -2.93 0.00 0.00 61.98 58.43 1n1m s VAL 254 Cb -0.13 -0.55 -0.09 0.00 -1.53 0.00 0.00 36.38 34.09 1n1m s VAL 254 CO -0.03 0.19 1.91 -2.84 -3.33 0.00 0.00 175.10 171.00 1n1m s PRO 255 N -0.01 4.15 -0.27 1.54 0.02 -1.26 -1.45 135.00 137.72 1n1m s PRO 255 Ca 0.00 2.56 -0.01 0.00 0.02 0.00 0.00 61.00 63.58 1n1m s PRO 255 Cb -0.05 -4.06 0.14 0.00 0.02 0.00 0.00 34.50 30.54 1n1m s PRO 255 CO -0.00 -0.93 0.33 -0.47 -0.33 0.00 0.00 177.00 175.60 1n1m s TYR 256 N 4.17 -0.64 -0.08 6.54 6.14 -0.65 -4.42 117.35 128.42 1n1m s TYR 256 Ca 0.86 0.16 -0.30 0.00 0.64 0.00 0.00 57.07 58.43 1n1m s TYR 256 Cb -0.42 -0.29 -0.04 0.00 0.42 0.00 0.00 41.96 41.63 1n1m s TYR 256 CO 0.39 -0.87 1.42 -1.25 0.64 0.00 0.00 175.55 175.88 1n1m s PRO 257 N 2.43 4.24 0.49 4.97 0.04 -1.26 -4.68 135.00 141.24 1n1m s PRO 257 Ca 0.10 1.91 -0.02 0.00 0.04 0.00 0.00 61.00 63.03 1n1m s PRO 257 Cb -0.14 -3.76 -0.01 0.00 0.04 0.00 0.00 34.50 30.64 1n1m s PRO 257 CO -0.27 -0.69 0.75 0.15 0.04 0.00 0.00 177.00 176.98 1n1m s LYS 258 N 3.25 3.10 -0.19 4.56 1.02 -1.26 -0.83 119.74 129.38 1n1m s LYS 258 Ca 0.63 -0.24 -0.43 0.00 0.02 0.00 0.00 55.97 55.95 1n1m s LYS 258 Cb -0.28 -2.45 -0.20 0.00 -0.52 0.00 0.00 37.83 34.38 1n1m s LYS 258 CO 0.23 -0.38 1.30 0.00 -0.92 0.00 0.00 175.35 175.58 1n1m n ALA 259 N -2.25 -2.62 -0.22 5.17 0.00 0.55 -0.01 120.51 121.13 1n1m n ALA 259 Ca 0.02 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1n1m n ALA 259 Cb 0.57 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1n1m n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1m n GLY 260 N 2.55 2.51 1.57 0.00 0.00 -1.26 -4.87 105.19 105.68 1n1m n GLY 260 Ca 0.24 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 1n1m n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1m n ALA 261 N 0.24 -1.34 -2.65 4.61 0.00 0.98 -4.98 120.51 117.38 1n1m n ALA 261 Ca 0.00 -0.72 -0.41 0.00 0.00 0.00 0.00 53.44 52.31 1n1m n ALA 261 Cb 0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 19.45 19.35 1n1m n ALA 261 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1n1m s VAL 262 N -1.95 4.91 0.53 0.00 1.01 -1.26 -4.92 120.40 118.71 1n1m s VAL 262 Ca 0.31 1.42 -0.06 0.00 0.00 0.00 0.00 61.98 63.65 1n1m s VAL 262 Cb -0.03 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 1n1m s VAL 262 CO 0.24 0.00 0.85 0.20 0.00 0.00 0.00 175.10 176.39 1n1m s ASN 263 N 1.31 6.13 0.44 3.32 0.01 -1.26 -4.20 114.94 120.69 1n1m s ASN 263 Ca 0.32 0.97 -0.22 0.00 -0.71 0.00 0.00 52.86 53.23 1n1m s ASN 263 Cb -0.16 -2.19 -0.09 0.00 0.41 0.00 0.00 41.25 39.23 1n1m s ASN 263 CO 0.09 -0.72 1.04 -2.16 -1.51 0.00 0.00 177.10 173.84 1n1m s PRO 264 N -4.86 3.99 0.36 -0.60 0.04 -1.26 -4.80 135.00 127.87 1n1m s PRO 264 Ca 0.50 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.96 1n1m s PRO 264 Cb -0.10 -2.30 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 1n1m s PRO 264 CO 0.47 -0.28 0.57 0.95 0.04 0.00 0.00 177.00 178.74 1n1m s THR 265 N -1.84 4.93 0.06 1.26 -4.23 -0.69 -4.89 115.64 110.24 1n1m s THR 265 Ca 0.63 -0.46 0.01 0.00 -1.18 0.00 0.00 61.69 60.68 1n1m s THR 265 Cb -0.18 -3.80 -0.04 0.00 1.34 0.00 0.00 72.50 69.82 1n1m s THR 265 CO 0.23 -0.53 -0.05 0.54 -0.54 0.00 0.00 174.62 174.27 1n1m s VAL 266 N -2.36 0.43 0.04 2.29 0.11 -1.26 -1.28 120.40 118.37 1n1m s VAL 266 Ca 0.41 -1.62 -0.01 0.00 -2.93 0.00 0.00 61.98 57.84 1n1m s VAL 266 Cb -0.10 -1.26 -0.03 0.00 -1.53 0.00 0.00 36.38 33.46 1n1m s VAL 266 CO 0.36 -0.79 -0.02 -0.54 -3.33 0.00 0.00 175.10 170.79 1n1m s LYS 267 N -3.18 0.50 -0.04 1.54 1.02 -0.30 -4.96 119.74 114.33 1n1m s LYS 267 Ca 0.03 -0.96 0.04 0.00 0.02 0.00 0.00 55.97 55.10 1n1m s LYS 267 Cb 0.02 0.18 -0.00 0.00 -0.52 0.00 0.00 37.83 37.50 1n1m s LYS 267 CO -0.05 -0.09 -0.16 0.12 -0.92 0.00 0.00 175.35 174.25 1n1m s PHE 268 N -2.92 1.60 0.11 3.18 5.36 -1.26 -0.56 117.98 123.49 1n1m s PHE 268 Ca -0.02 -0.45 0.02 0.00 -0.96 0.00 0.00 56.93 55.52 1n1m s PHE 268 Cb 0.01 -1.08 -0.04 0.00 -0.34 0.00 0.00 43.02 41.56 1n1m s PHE 268 CO -0.06 -0.15 -0.08 -0.06 -1.46 0.00 0.00 175.22 173.41 1n1m s PHE 269 N 0.05 0.96 -0.05 10.12 0.40 0.32 -1.66 117.98 128.13 1n1m s PHE 269 Ca -0.03 -0.85 0.01 0.00 -0.60 0.00 0.00 56.93 55.45 1n1m s PHE 269 Cb -0.11 -0.54 0.02 0.00 0.51 0.00 0.00 43.02 42.90 1n1m s PHE 269 CO 0.02 -0.09 -0.04 0.08 0.70 0.00 0.00 175.22 175.89 1n1m s VAL 270 N -3.41 0.49 0.06 -0.44 1.01 0.46 -0.77 120.40 117.79 1n1m s VAL 270 Ca 0.12 -0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.11 1n1m s VAL 270 Cb 0.04 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 1n1m s VAL 270 CO -0.03 0.22 -0.24 0.54 0.00 0.00 0.00 175.10 175.59 1n1m s VAL 271 N 1.06 1.92 -0.32 2.92 0.11 -0.41 -0.81 120.40 124.86 1n1m s VAL 271 Ca -0.09 -1.37 -0.19 0.00 -2.93 0.00 0.00 61.98 57.40 1n1m s VAL 271 Cb -0.14 -1.67 -0.01 0.00 -1.53 0.00 0.00 36.38 33.03 1n1m s VAL 271 CO -0.01 0.22 0.56 0.21 -3.33 0.00 0.00 175.10 172.76 1n1m s ASN 272 N -1.38 6.41 0.00 3.54 3.04 -1.26 -0.83 114.94 124.45 1n1m s ASN 272 Ca 0.10 0.25 0.14 0.00 0.04 0.00 0.00 52.86 53.38 1n1m s ASN 272 Cb -0.09 -2.30 0.46 0.00 -1.54 0.00 0.00 41.25 37.78 1n1m s ASN 272 CO 0.03 -0.45 1.35 0.35 -3.04 0.00 0.00 177.10 175.34 1n1m n THR 273 N 5.38 0.35 0.34 -5.21 -2.24 0.49 -3.36 114.28 110.03 1n1m n THR 273 Ca -0.03 -0.39 0.06 0.00 -2.27 0.00 0.00 64.05 61.41 1n1m n THR 273 Cb 0.49 0.25 -0.07 0.00 -2.10 0.00 0.00 70.33 68.89 1n1m n THR 273 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1n1m n ASP 274 N 0.37 1.18 -1.66 3.42 8.00 -1.26 -4.56 116.55 122.04 1n1m n ASP 274 Ca 0.13 -0.49 -0.12 0.00 0.71 0.00 0.00 54.79 55.01 1n1m n ASP 274 Cb 0.28 1.19 0.20 0.00 -0.02 0.00 0.00 41.12 42.78 1n1m n ASP 274 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1n1m n SER 275 N -1.50 3.19 -4.57 -2.24 2.88 -1.21 -4.99 113.62 105.18 1n1m n SER 275 Ca 0.01 -3.66 -0.34 0.00 -1.33 0.00 0.00 58.87 53.55 1n1m n SER 275 Cb 0.22 -0.73 -0.11 0.00 -0.75 0.00 0.00 64.21 62.84 1n1m n SER 275 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1n1m s LEU 276 N -3.25 3.26 0.00 2.46 2.34 -1.26 -4.96 118.68 117.27 1n1m s LEU 276 Ca 0.50 -0.03 0.00 0.00 0.06 0.00 0.00 54.13 54.66 1n1m s LEU 276 Cb 0.44 -1.74 0.00 0.00 -0.56 0.00 0.00 46.19 44.33 1n1m s LEU 276 CO 0.06 0.30 0.00 -1.54 -1.06 0.00 0.00 176.35 174.10 1n1m n SER 277 N 2.68 0.00 0.00 1.48 3.41 -1.26 -5.03 113.62 114.89 1n1m n SER 277 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 1n1m n SER 277 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1n1m n SER 277 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1n1m n SER 278 N 0.00 0.00 -0.14 4.04 3.41 -1.26 -4.94 113.62 114.74 1n1m n SER 278 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.32 1n1m n SER 278 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1n1m n SER 278 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1n1m n VAL 279 N 0.00 1.50 -3.26 -3.33 0.31 -1.26 -4.95 118.33 107.34 1n1m n VAL 279 Ca 0.00 -0.38 -0.39 0.00 -0.01 0.00 0.00 64.34 63.56 1n1m n VAL 279 Cb 0.00 -1.87 -0.06 0.00 -0.91 0.00 0.00 33.84 31.01 1n1m n VAL 279 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1n1m s THR 280 N -2.50 4.85 0.64 2.52 2.01 -1.26 -5.06 115.64 116.84 1n1m s THR 280 Ca -0.38 1.20 -0.16 0.00 0.31 0.00 0.00 61.69 62.66 1n1m s THR 280 Cb 0.15 -3.90 -0.01 0.00 0.01 0.00 0.00 72.50 68.75 1n1m s THR 280 CO 0.48 0.49 1.12 0.20 -0.69 0.00 0.00 174.62 176.21 1n1m s ASN 281 N -0.62 5.21 0.44 3.53 0.01 -1.26 -4.36 114.94 117.88 1n1m s ASN 281 Ca 0.29 2.06 -0.25 0.00 -0.71 0.00 0.00 52.86 54.25 1n1m s ASN 281 Cb -0.19 -2.56 -0.08 0.00 0.41 0.00 0.00 41.25 38.84 1n1m s ASN 281 CO 0.17 -1.56 1.32 0.00 -1.51 0.00 0.00 177.10 175.52 1n1m s ALA 282 N -2.19 3.17 -0.43 0.60 0.00 -1.26 -4.96 121.76 116.69 1n1m s ALA 282 Ca 0.69 1.27 -0.12 0.00 0.00 0.00 0.00 51.96 53.80 1n1m s ALA 282 Cb -0.22 -3.51 0.07 0.00 0.00 0.00 0.00 23.12 19.46 1n1m s ALA 282 CO 0.38 -0.96 0.30 0.99 0.00 0.00 0.00 175.76 176.48 1n1m s THR 283 N -1.28 4.66 -0.18 0.00 2.01 -1.26 -5.01 115.64 114.57 1n1m s THR 283 Ca 0.60 -1.21 -0.16 0.00 0.31 0.00 0.00 61.69 61.24 1n1m s THR 283 Cb -0.39 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 1n1m s THR 283 CO 0.49 -0.50 0.39 -0.44 -0.69 0.00 0.00 174.62 173.87 1n1m s SER 284 N 2.23 6.46 -0.08 3.53 0.01 -1.26 -4.52 113.70 120.07 1n1m s SER 284 Ca 0.03 0.55 -0.19 0.00 1.31 0.00 0.00 55.95 57.65 1n1m s SER 284 Cb -0.23 -2.23 -0.05 0.00 0.21 0.00 0.00 66.02 63.73 1n1m s SER 284 CO 0.04 -0.04 0.51 -0.63 0.41 0.00 0.00 173.24 173.53 1n1m s ILE 285 N 1.09 5.10 -0.03 1.44 1.09 0.01 -4.82 121.20 125.07 1n1m s ILE 285 Ca 0.19 1.03 -0.17 0.00 -1.10 0.00 0.00 60.65 60.61 1n1m s ILE 285 Cb -0.14 -3.84 -0.05 0.00 -1.06 0.00 0.00 42.46 37.36 1n1m s ILE 285 CO 0.07 0.37 0.46 -1.58 -0.10 0.00 0.00 174.94 174.16 1n1m s GLN 286 N 0.27 4.13 -0.21 2.79 0.74 -1.26 -0.40 119.66 125.72 1n1m s GLN 286 Ca 0.27 0.47 -0.05 0.00 0.05 0.00 0.00 55.36 56.11 1n1m s GLN 286 Cb -0.16 -3.31 -0.02 0.00 1.10 0.00 0.00 33.01 30.62 1n1m s GLN 286 CO 0.13 0.48 -0.01 0.42 -0.55 0.00 0.00 175.29 175.75 1n1m s ILE 287 N -0.42 3.72 0.00 -2.34 1.01 -0.66 -4.88 121.20 117.62 1n1m s ILE 287 Ca 0.25 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.52 1n1m s ILE 287 Cb -0.16 -2.69 0.00 0.00 0.01 0.00 0.00 42.46 39.62 1n1m s ILE 287 CO 0.13 0.42 0.00 0.35 0.00 0.00 0.00 174.94 175.84 1n1m n THR 288 N 4.54 0.00 -2.94 2.92 -2.24 -1.26 -4.08 114.28 111.22 1n1m n THR 288 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1n1m n THR 288 Cb 0.51 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 1n1m n THR 288 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n1m n ALA 289 N -3.00 0.00 -1.00 6.98 0.00 -1.26 -4.96 120.51 117.27 1n1m n ALA 289 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1n1m n ALA 289 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.58 1n1m n ALA 289 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1n1m s PRO 290 N 0.00 1.66 0.34 0.00 0.02 -1.26 -4.87 135.00 130.88 1n1m s PRO 290 Ca 0.00 1.43 0.04 0.00 0.02 0.00 0.00 61.00 62.49 1n1m s PRO 290 Cb 0.00 -1.81 0.60 0.00 0.02 0.00 0.00 34.50 33.31 1n1m s PRO 290 CO 0.00 -2.14 1.89 0.00 -0.33 0.00 0.00 177.00 176.42 1n1m h ALA 291 N -1.35 1.39 0.00 -1.55 0.00 -1.98 -0.26 119.26 115.50 1n1m h ALA 291 Ca -0.44 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1n1m h ALA 291 Cb 1.26 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1n1m h ALA 291 CO 0.46 0.43 -0.03 0.66 0.00 0.00 0.00 179.25 180.78 1n1m h SER 292 N 0.56 0.00 0.09 0.00 4.64 -2.02 -2.72 113.55 114.09 1n1m h SER 292 Ca 0.12 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.09 1n1m h SER 292 Cb 0.28 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 1n1m h SER 292 CO 0.00 0.03 -1.98 0.80 -0.87 0.00 0.00 176.83 174.81 1n1m n MET 293 N -3.23 0.72 0.02 4.77 0.00 -0.42 -4.19 117.12 114.79 1n1m n MET 293 Ca -0.01 0.29 0.03 0.00 0.00 0.00 0.00 57.70 58.00 1n1m n MET 293 Cb 0.20 -1.69 0.13 0.00 0.00 0.00 0.00 33.22 31.87 1n1m n MET 293 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1n1m n LEU 294 N -3.59 0.08 -0.14 -0.89 4.77 -0.24 -2.74 117.00 114.24 1n1m n LEU 294 Ca -0.34 0.53 -0.03 0.00 -0.03 0.00 0.00 56.01 56.14 1n1m n LEU 294 Cb 0.99 -0.54 0.20 0.00 -2.33 0.00 0.00 43.42 41.74 1n1m n LEU 294 CO 0.37 -0.50 1.01 0.16 -1.33 0.00 0.00 177.39 177.10 1n1m h ILE 295 N 0.00 1.22 -1.43 -0.08 3.07 -1.70 -3.46 117.51 115.13 1n1m h ILE 295 Ca 0.00 -0.76 0.00 0.00 1.55 0.00 0.00 64.86 65.65 1n1m h ILE 295 Cb 0.06 0.60 0.00 0.00 -0.27 0.00 0.00 36.82 37.21 1n1m h ILE 295 CO 0.00 0.29 0.00 0.61 -1.05 0.00 0.00 178.15 178.00 1n1m n GLY 296 N -0.93 4.65 3.72 0.16 0.00 -1.11 -5.14 105.19 106.55 1n1m n GLY 296 Ca 0.04 -1.51 -0.34 0.00 0.00 0.00 0.00 46.02 44.21 1n1m n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1n1m s ASP 297 N 0.15 4.20 0.34 1.61 1.01 -1.26 -4.94 116.67 117.78 1n1m s ASP 297 Ca 0.00 2.37 -0.18 0.00 0.71 0.00 0.00 52.55 55.45 1n1m s ASP 297 Cb 0.00 -2.59 0.05 0.00 1.01 0.00 0.00 42.92 41.39 1n1m s ASP 297 CO 0.00 -2.26 0.81 -1.38 0.21 0.00 0.00 175.17 172.55 1n1m s HIS 298 N -1.97 0.06 0.06 4.23 -3.43 -1.26 -2.05 115.29 110.93 1n1m s HIS 298 Ca 0.75 -0.66 0.03 0.00 -0.80 0.00 0.00 55.06 54.37 1n1m s HIS 298 Cb -0.29 0.80 -0.03 0.00 -1.43 0.00 0.00 32.58 31.63 1n1m s HIS 298 CO 0.45 -1.43 -0.09 0.71 -2.00 0.00 0.00 174.74 172.38 1n1m s TYR 299 N -2.58 0.85 -0.40 0.38 2.02 0.85 -4.80 117.35 113.68 1n1m s TYR 299 Ca 0.15 -0.56 -0.17 0.00 -0.37 0.00 0.00 57.07 56.12 1n1m s TYR 299 Cb -0.05 -0.49 0.01 0.00 -0.40 0.00 0.00 41.96 41.03 1n1m s TYR 299 CO 0.10 -0.05 0.43 -1.17 -1.57 0.00 0.00 175.55 173.29 1n1m s LEU 300 N -1.90 4.70 -0.18 -1.29 2.96 -1.26 -1.97 118.68 119.74 1n1m s LEU 300 Ca -0.04 -0.50 -0.23 0.00 -0.22 0.00 0.00 54.13 53.14 1n1m s LEU 300 Cb -0.07 -2.40 -0.20 0.00 0.50 0.00 0.00 46.19 44.02 1n1m s LEU 300 CO 0.00 -0.52 0.37 0.00 -1.32 0.00 0.00 176.35 174.88 1n1m s ASP 302 N -6.55 -0.08 -0.05 0.00 -1.08 -1.09 -4.75 116.67 103.06 1n1m s ASP 302 Ca -0.24 -0.14 -0.01 0.00 -0.52 0.00 0.00 52.55 51.64 1n1m s ASP 302 Cb 0.03 0.29 0.03 0.00 -1.46 0.00 0.00 42.92 41.81 1n1m s ASP 302 CO 0.59 -0.50 0.00 0.68 0.52 0.00 0.00 175.17 176.47 1n1m s VAL 303 N -1.90 0.26 -0.02 1.11 -7.23 -1.26 -1.35 120.40 110.01 1n1m s VAL 303 Ca -0.10 0.13 0.01 0.00 -1.81 0.00 0.00 61.98 60.21 1n1m s VAL 303 Cb -0.04 -0.40 0.01 0.00 0.56 0.00 0.00 36.38 36.52 1n1m s VAL 303 CO 0.00 0.21 -0.01 -0.89 -0.31 0.00 0.00 175.10 174.10 1n1m s THR 304 N 1.59 0.19 -0.26 5.32 2.01 -0.09 -5.00 115.64 119.41 1n1m s THR 304 Ca -0.01 -0.02 -0.23 0.00 0.31 0.00 0.00 61.69 61.74 1n1m s THR 304 Cb -0.13 -0.23 -0.01 0.00 0.01 0.00 0.00 72.50 72.15 1n1m s THR 304 CO -0.03 0.10 0.75 0.26 -0.69 0.00 0.00 174.62 175.01 1n1m s TRP 305 N 0.47 3.27 -0.10 4.92 0.52 -1.26 0.03 118.94 126.79 1n1m s TRP 305 Ca -0.05 0.95 -0.27 0.00 0.02 0.00 0.00 56.10 56.75 1n1m s TRP 305 Cb -0.07 -3.02 -0.25 0.00 -1.15 0.00 0.00 33.47 28.97 1n1m s TRP 305 CO -0.01 -0.42 0.90 0.00 0.02 0.00 0.00 176.95 177.44 1n1m h ALA 306 N 7.86 -0.00 -3.49 0.98 0.00 -1.50 -3.48 119.26 119.63 1n1m h ALA 306 Ca -0.25 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.04 1n1m h ALA 306 Cb 1.10 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1n1m h ALA 306 CO 0.84 -0.00 -0.13 0.25 0.00 0.00 0.00 179.25 180.21 1n1m n THR 307 N -4.60 0.00 0.22 0.00 -2.24 -1.08 -4.48 114.28 102.10 1n1m n THR 307 Ca -0.10 -0.87 0.13 0.00 -2.27 0.00 0.00 64.05 60.94 1n1m n THR 307 Cb 0.47 0.47 0.68 0.00 -2.10 0.00 0.00 70.33 69.85 1n1m n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1n1m h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.97 -3.04 115.11 110.40 1n1m h GLN 308 Ca -0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 1n1m h GLN 308 Cb 0.49 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.92 1n1m h GLN 308 CO 0.14 0.00 0.00 0.39 -0.95 0.00 0.00 178.83 178.41 1n1m n GLU 309 N -2.41 0.18 -5.21 1.46 1.02 -1.26 -4.92 120.64 109.49 1n1m n GLU 309 Ca -0.01 -0.40 -0.31 0.00 -0.02 0.00 0.00 57.16 56.42 1n1m n GLU 309 Cb 0.07 -0.63 -0.16 0.00 -0.02 0.00 0.00 31.44 30.70 1n1m n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1n1m s ARG 310 N -0.11 2.37 -0.00 3.49 3.52 -1.15 -1.24 118.95 125.83 1n1m s ARG 310 Ca 0.00 -0.88 0.01 0.00 -0.13 0.00 0.00 55.73 54.73 1n1m s ARG 310 Cb 0.00 -2.15 -0.00 0.00 -1.56 0.00 0.00 34.95 31.23 1n1m s ARG 310 CO 0.00 0.49 -0.02 -1.50 -0.81 0.00 0.00 175.30 173.46 1n1m s ILE 311 N -0.44 0.16 -0.08 4.11 2.07 -0.54 -1.20 121.20 125.29 1n1m s ILE 311 Ca 0.05 -0.12 0.03 0.00 -1.41 0.00 0.00 60.65 59.20 1n1m s ILE 311 Cb -0.12 -0.15 -0.01 0.00 0.13 0.00 0.00 42.46 42.31 1n1m s ILE 311 CO 0.01 0.03 -0.19 -0.94 -1.91 0.00 0.00 174.94 171.93 1n1m s SER 312 N -0.10 3.53 -0.10 4.50 1.04 0.10 -0.67 113.70 122.00 1n1m s SER 312 Ca 0.00 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.06 1n1m s SER 312 Cb -0.01 -1.16 0.01 0.00 0.10 0.00 0.00 66.02 64.96 1n1m s SER 312 CO -0.00 0.23 -0.19 -0.76 0.98 0.00 0.00 173.24 173.50 1n1m s LEU 313 N -0.04 1.91 -0.17 2.42 1.02 -0.19 -0.91 118.68 122.71 1n1m s LEU 313 Ca -0.05 -0.48 -0.07 0.00 0.02 0.00 0.00 54.13 53.54 1n1m s LEU 313 Cb -0.14 -1.22 -0.04 0.00 0.02 0.00 0.00 46.19 44.80 1n1m s LEU 313 CO 0.04 0.08 0.06 -1.10 0.02 0.00 0.00 176.35 175.46 1n1m s GLN 314 N 0.66 3.90 0.22 1.70 -0.21 -0.45 0.76 119.66 126.24 1n1m s GLN 314 Ca -0.13 -0.34 0.11 0.00 0.02 0.00 0.00 55.36 55.03 1n1m s GLN 314 Cb -0.16 -3.19 -0.05 0.00 1.00 0.00 0.00 33.01 30.62 1n1m s GLN 314 CO 0.03 0.32 -0.21 -1.58 -2.12 0.00 0.00 175.29 171.73 1n1m s TRP 315 N 0.24 2.35 -0.05 0.91 0.52 0.16 -0.47 118.94 122.61 1n1m s TRP 315 Ca 0.04 -0.33 -0.04 0.00 0.02 0.00 0.00 56.10 55.79 1n1m s TRP 315 Cb -0.12 -1.12 0.01 0.00 -1.15 0.00 0.00 33.47 31.09 1n1m s TRP 315 CO 0.00 0.56 0.12 -1.17 0.02 0.00 0.00 176.95 176.48 1n1m s LEU 316 N -2.93 1.45 0.72 2.99 2.96 -0.83 -0.35 118.68 122.68 1n1m s LEU 316 Ca 0.24 0.24 -0.12 0.00 -0.22 0.00 0.00 54.13 54.27 1n1m s LEU 316 Cb -0.07 0.39 0.03 0.00 0.50 0.00 0.00 46.19 47.04 1n1m s LEU 316 CO 0.12 -0.05 1.09 -0.13 -1.32 0.00 0.00 176.35 176.06 1n1m s ARG 317 N 0.20 2.55 0.43 1.98 0.52 -0.98 -0.10 118.95 123.55 1n1m s ARG 317 Ca -0.01 1.21 0.14 0.00 -0.52 0.00 0.00 55.73 56.55 1n1m s ARG 317 Cb -0.02 -1.93 1.02 0.00 0.52 0.00 0.00 34.95 34.54 1n1m s ARG 317 CO -0.01 -1.42 1.96 -0.09 0.02 0.00 0.00 175.30 175.77 1n1m h ARG 318 N -0.65 0.41 -5.77 3.54 2.43 -1.72 -2.72 114.38 109.90 1n1m h ARG 318 Ca -0.45 -0.02 -0.62 0.00 -0.81 0.00 0.00 59.98 58.08 1n1m h ARG 318 Cb 1.23 -0.09 -0.12 0.00 -0.42 0.00 0.00 29.97 30.57 1n1m h ARG 318 CO 0.53 0.27 1.11 0.42 -1.51 0.00 0.00 179.97 180.79 1n1m s ILE 319 N -5.41 4.16 -0.15 1.20 -1.09 -1.26 -4.80 121.20 113.84 1n1m s ILE 319 Ca -0.08 -0.71 -0.02 0.00 -2.23 0.00 0.00 60.65 57.62 1n1m s ILE 319 Cb 0.20 -4.91 -0.03 0.00 -1.58 0.00 0.00 42.46 36.14 1n1m s ILE 319 CO 0.75 -1.74 1.23 0.00 -1.23 0.00 0.00 174.94 173.96 1n1m n GLN 320 N 8.19 0.54 -0.03 2.79 6.02 -1.03 -3.51 117.38 130.36 1n1m n GLN 320 Ca 0.20 -0.50 -0.01 0.00 -0.01 0.00 0.00 57.00 56.67 1n1m n GLN 320 Cb 0.49 -1.87 -0.07 0.00 1.02 0.00 0.00 30.24 29.82 1n1m n GLN 320 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1n1m n ASN 321 N 3.80 3.01 -3.68 1.08 2.85 -1.26 -2.08 115.26 118.98 1n1m n ASN 321 Ca 0.12 0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.40 1n1m n ASN 321 Cb 0.11 0.92 -0.17 0.00 1.24 0.00 0.00 39.78 41.88 1n1m n ASN 321 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1n1m s TYR 322 N -2.33 0.02 0.18 1.20 6.14 -1.23 -1.88 117.35 119.45 1n1m s TYR 322 Ca -0.04 0.30 0.09 0.00 0.64 0.00 0.00 57.07 58.06 1n1m s TYR 322 Cb 0.03 -0.41 -0.04 0.00 0.42 0.00 0.00 41.96 41.96 1n1m s TYR 322 CO 0.34 -0.19 -0.18 -1.54 0.64 0.00 0.00 175.55 174.62 1n1m s SER 323 N 2.05 2.73 -0.01 4.32 1.04 0.04 -2.31 113.70 121.55 1n1m s SER 323 Ca 0.03 -0.90 0.04 0.00 0.48 0.00 0.00 55.95 55.60 1n1m s SER 323 Cb -0.12 -0.16 -0.01 0.00 0.10 0.00 0.00 66.02 65.83 1n1m s SER 323 CO -0.03 -0.05 -0.12 -0.69 0.98 0.00 0.00 173.24 173.33 1n1m s VAL 324 N -2.22 0.94 -0.14 5.02 1.01 0.52 -1.25 120.40 124.27 1n1m s VAL 324 Ca 0.18 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 1n1m s VAL 324 Cb -0.05 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.52 1n1m s VAL 324 CO 0.07 0.26 -0.04 -0.32 0.00 0.00 0.00 175.10 175.08 1n1m s MET 325 N -0.28 3.55 0.05 2.72 1.75 0.44 0.36 119.30 127.89 1n1m s MET 325 Ca 0.05 -0.51 0.03 0.00 -1.25 0.00 0.00 55.69 54.00 1n1m s MET 325 Cb -0.05 -2.88 -0.04 0.00 2.84 0.00 0.00 34.83 34.71 1n1m s MET 325 CO -0.00 0.31 0.01 0.34 -0.65 0.00 0.00 175.02 175.02 1n1m s ASP 326 N 0.17 5.11 -0.29 1.11 -1.08 0.23 -1.83 116.67 120.10 1n1m s ASP 326 Ca -0.02 -0.09 0.00 0.00 -0.52 0.00 0.00 52.55 51.92 1n1m s ASP 326 Cb -0.14 -1.28 0.09 0.00 -1.46 0.00 0.00 42.92 40.13 1n1m s ASP 326 CO 0.03 0.22 0.04 -0.63 0.52 0.00 0.00 175.17 175.35 1n1m s ILE 327 N -1.23 1.30 0.01 4.11 1.01 -1.26 -1.03 121.20 124.11 1n1m s ILE 327 Ca 0.24 -1.47 0.00 0.00 0.00 0.00 0.00 60.65 59.42 1n1m s ILE 327 Cb -0.12 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1n1m s ILE 327 CO 0.15 -0.47 0.07 0.00 0.00 0.00 0.00 174.94 174.70 1n1m s ASP 329 N -1.82 2.80 0.01 0.00 1.11 0.32 -1.46 116.67 117.62 1n1m s ASP 329 Ca 0.24 -0.45 -0.30 0.00 0.18 0.00 0.00 52.55 52.22 1n1m s ASP 329 Cb -0.12 -0.30 -0.04 0.00 1.07 0.00 0.00 42.92 43.53 1n1m s ASP 329 CO 0.15 0.28 1.11 -0.47 1.18 0.00 0.00 175.17 177.42 1n1m s TYR 330 N -0.59 3.47 -0.61 4.23 5.04 -0.37 -1.41 117.35 127.11 1n1m s TYR 330 Ca 0.09 1.44 -0.18 0.00 -2.44 0.00 0.00 57.07 55.98 1n1m s TYR 330 Cb -0.09 -3.31 0.11 0.00 0.35 0.00 0.00 41.96 39.03 1n1m s TYR 330 CO -0.01 -0.79 0.71 0.34 -1.34 0.00 0.00 175.55 174.46 1n1m s ASP 331 N 1.13 6.23 0.00 4.32 -1.08 -0.54 -4.98 116.67 121.75 1n1m s ASP 331 Ca 0.55 -1.57 0.00 0.00 -0.52 0.00 0.00 52.55 51.02 1n1m s ASP 331 Cb -0.25 -2.29 0.00 0.00 -1.46 0.00 0.00 42.92 38.92 1n1m s ASP 331 CO 0.26 -1.06 0.26 1.21 0.52 0.00 0.00 175.17 176.36 1n1m n GLU 332 N 6.11 0.00 -2.02 4.34 4.07 -1.26 -1.37 120.64 130.50 1n1m n GLU 332 Ca -0.07 0.26 -0.41 0.00 -0.06 0.00 0.00 57.16 56.88 1n1m n GLU 332 Cb 0.43 -0.48 -0.00 0.00 -0.06 0.00 0.00 31.44 31.32 1n1m n GLU 332 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1n1m n SER 333 N -0.97 7.07 0.00 4.31 7.64 -1.26 -3.29 113.62 127.13 1n1m n SER 333 Ca 0.00 -3.06 0.00 0.00 1.01 0.00 0.00 58.87 56.82 1n1m n SER 333 Cb 0.00 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 61.77 1n1m n SER 333 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1n1m n SER 334 N 2.72 0.00 0.00 6.43 7.64 -0.87 -5.02 113.62 124.51 1n1m n SER 334 Ca 0.57 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.45 1n1m n SER 334 Cb 0.28 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1n1m n SER 334 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n1m n GLY 335 N -0.52 0.52 3.84 0.23 0.00 -0.47 -5.00 105.19 103.80 1n1m n GLY 335 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1n1m n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n1m s ARG 336 N -0.50 2.66 -0.25 1.61 3.00 -1.26 -4.91 118.95 119.30 1n1m s ARG 336 Ca 0.00 -1.36 -0.06 0.00 0.00 0.00 0.00 55.73 54.32 1n1m s ARG 336 Cb 0.00 -2.43 -0.01 0.00 0.00 0.00 0.00 34.95 32.51 1n1m s ARG 336 CO 0.00 0.06 0.02 -1.58 0.00 0.00 0.00 175.30 173.80 1n1m s TRP 337 N -2.34 3.04 -0.16 -0.53 0.52 -1.26 -1.47 118.94 116.74 1n1m s TRP 337 Ca 0.41 -0.80 -0.07 0.00 0.02 0.00 0.00 56.10 55.67 1n1m s TRP 337 Cb -0.05 -2.18 -0.04 0.00 -1.15 0.00 0.00 33.47 30.05 1n1m s TRP 337 CO 0.26 -0.50 0.05 -0.80 0.02 0.00 0.00 176.95 175.99 1n1m s ASN 338 N 1.52 5.59 -0.58 2.95 0.02 -0.50 -4.86 114.94 119.09 1n1m s ASN 338 Ca 0.05 0.11 -0.01 0.00 -1.02 0.00 0.00 52.86 51.99 1n1m s ASN 338 Cb -0.15 -1.91 0.15 0.00 0.02 0.00 0.00 41.25 39.36 1n1m s ASN 338 CO 0.00 0.22 0.37 0.00 0.02 0.00 0.00 177.10 177.71 1n1m s LEU 340 N -0.06 4.37 1.21 0.00 1.43 -1.26 -4.95 118.68 119.42 1n1m s LEU 340 Ca 0.16 2.63 -0.17 0.00 -1.03 0.00 0.00 54.13 55.72 1n1m s LEU 340 Cb -0.22 -3.59 0.29 0.00 0.03 0.00 0.00 46.19 42.70 1n1m s LEU 340 CO -0.03 -0.84 1.04 0.54 0.23 0.00 0.00 176.35 177.29 1n1m s VAL 341 N 1.26 1.69 0.00 -1.59 0.11 -1.26 -2.27 120.40 118.34 1n1m s VAL 341 Ca 0.71 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.76 1n1m s VAL 341 Cb -0.44 -2.29 0.00 0.00 -1.53 0.00 0.00 36.38 32.12 1n1m s VAL 341 CO 0.31 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 172.08 1n1m n ALA 342 N -4.90 0.00 1.01 1.54 0.00 -1.26 -4.47 120.51 112.43 1n1m n ALA 342 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.64 1n1m n ALA 342 Cb 0.58 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.17 1n1m n ALA 342 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1n1m n ARG 343 N -0.86 0.07 -2.63 0.00 0.63 -0.96 -4.74 116.66 108.17 1n1m n ARG 343 Ca 0.00 -0.05 -0.28 0.00 -0.92 0.00 0.00 57.85 56.60 1n1m n ARG 343 Cb 0.00 -1.50 -0.00 0.00 0.45 0.00 0.00 32.46 31.41 1n1m n ARG 343 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 1n1m s GLN 344 N -2.96 3.56 -0.04 -0.14 -2.07 -1.24 -4.54 119.66 112.22 1n1m s GLN 344 Ca 0.11 0.23 0.04 0.00 -1.82 0.00 0.00 55.36 53.92 1n1m s GLN 344 Cb 0.17 -2.37 -0.00 0.00 -1.09 0.00 0.00 33.01 29.72 1n1m s GLN 344 CO 0.74 -0.21 -0.16 -1.01 -1.32 0.00 0.00 175.29 173.34 1n1m s HIS 345 N -2.73 1.58 -0.15 9.60 3.76 -0.76 -4.94 115.29 121.64 1n1m s HIS 345 Ca 0.48 -0.45 -0.08 0.00 -0.15 0.00 0.00 55.06 54.86 1n1m s HIS 345 Cb -0.10 -1.07 -0.04 0.00 1.11 0.00 0.00 32.58 32.47 1n1m s HIS 345 CO 0.44 -0.16 0.12 0.42 -0.85 0.00 0.00 174.74 174.71 1n1m s ILE 346 N 0.10 5.31 -0.09 0.60 1.01 -1.26 -0.42 121.20 126.44 1n1m s ILE 346 Ca -0.04 0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.74 1n1m s ILE 346 Cb -0.11 -3.35 0.03 0.00 0.01 0.00 0.00 42.46 39.03 1n1m s ILE 346 CO 0.02 0.54 -0.04 -0.70 0.00 0.00 0.00 174.94 174.76 1n1m s GLU 347 N -0.38 1.11 0.18 2.79 2.12 -0.38 -5.02 118.70 119.12 1n1m s GLU 347 Ca 0.11 -0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.35 1n1m s GLU 347 Cb -0.12 -1.30 -0.04 0.00 0.26 0.00 0.00 34.13 32.93 1n1m s GLU 347 CO 0.01 -0.28 0.07 0.00 -0.54 0.00 0.00 175.26 174.52 1n1m s MET 348 N 1.81 1.12 -0.02 4.30 0.23 -1.26 -0.78 119.30 124.69 1n1m s MET 348 Ca 0.05 -1.56 0.02 0.00 -1.03 0.00 0.00 55.69 53.17 1n1m s MET 348 Cb -0.12 0.03 0.00 0.00 -1.53 0.00 0.00 34.83 33.21 1n1m s MET 348 CO -0.07 -0.26 -0.08 0.45 -2.03 0.00 0.00 175.02 173.03 1n1m s SER 349 N -3.15 1.04 -0.01 -1.18 0.15 -0.79 -4.99 113.70 104.77 1n1m s SER 349 Ca 0.30 -0.16 0.20 0.00 0.70 0.00 0.00 55.95 56.99 1n1m s SER 349 Cb 0.07 -0.26 -0.25 0.00 -1.71 0.00 0.00 66.02 63.87 1n1m s SER 349 CO 0.07 0.06 0.73 0.35 1.20 0.00 0.00 173.24 175.64 1n1m n THR 350 N 3.27 0.00 -0.02 6.45 -2.24 -1.26 -4.41 114.28 116.07 1n1m n THR 350 Ca -0.18 -0.16 0.06 0.00 -2.27 0.00 0.00 64.05 61.51 1n1m n THR 350 Cb 0.55 0.71 -0.13 0.00 -2.10 0.00 0.00 70.33 69.36 1n1m n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1n1m n THR 351 N -1.69 0.14 0.00 4.28 -2.24 -1.26 -5.08 114.28 108.43 1n1m n THR 351 Ca 0.02 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1n1m n THR 351 Cb 0.38 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 1n1m n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n1m n GLY 352 N 1.60 2.56 3.57 3.38 0.00 -1.26 -4.84 105.19 110.19 1n1m n GLY 352 Ca -0.06 0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 1n1m n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1n1m s TRP 353 N 1.83 2.45 -0.24 1.61 -2.14 -1.26 -4.68 118.94 116.52 1n1m s TRP 353 Ca 0.00 -0.44 -0.26 0.00 2.66 0.00 0.00 56.10 58.06 1n1m s TRP 353 Cb 0.00 -1.36 -0.00 0.00 -3.10 0.00 0.00 33.47 29.01 1n1m s TRP 353 CO 0.00 0.57 0.90 0.08 -2.66 0.00 0.00 176.95 175.83 1n1m s VAL 354 N -2.55 4.79 0.00 -0.66 1.01 -0.88 -4.82 120.40 117.28 1n1m s VAL 354 Ca 0.33 1.72 0.00 0.00 0.00 0.00 0.00 61.98 64.03 1n1m s VAL 354 Cb 0.00 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.20 1n1m s VAL 354 CO 0.17 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.78 1n1m n GLY 355 N 3.60 -1.69 0.15 4.51 0.00 -1.26 -3.33 105.19 107.17 1n1m n GLY 355 Ca 0.08 -1.54 -0.10 0.00 0.00 0.00 0.00 46.02 44.45 1n1m n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1n1m h ARG 356 N 0.00 0.42 0.00 1.61 3.08 -1.96 -3.38 114.38 114.15 1n1m h ARG 356 Ca 0.00 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1n1m h ARG 356 Cb 0.00 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1n1m h ARG 356 CO 0.00 0.48 -0.06 1.19 -1.07 0.00 0.00 179.97 180.51 1n1m n PHE 357 N -4.73 0.00 -3.60 3.04 3.72 -1.26 -4.88 117.46 109.74 1n1m n PHE 357 Ca -0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.32 1n1m n PHE 357 Cb 0.16 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.67 1n1m n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1n1m s ARG 358 N -0.28 0.31 0.40 -1.08 1.70 -1.25 -4.95 118.95 113.80 1n1m s ARG 358 Ca 0.00 -0.06 -0.26 0.00 -0.47 0.00 0.00 55.73 54.94 1n1m s ARG 358 Cb 0.00 0.14 -0.10 0.00 -0.57 0.00 0.00 34.95 34.42 1n1m s ARG 358 CO 0.00 -0.12 1.33 -0.35 -1.08 0.00 0.00 175.30 175.08 1n1m n PRO 359 N 0.13 2.13 -1.28 3.89 -0.04 -1.21 -4.32 135.00 134.30 1n1m n PRO 359 Ca -0.01 0.75 -0.34 0.00 -0.04 0.00 0.00 63.50 63.86 1n1m n PRO 359 Cb 0.58 -2.45 0.11 0.00 -0.04 0.00 0.00 33.50 31.70 1n1m n PRO 359 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1n1m s SER 360 N -0.42 3.95 0.07 3.54 1.04 -1.26 -4.95 113.70 115.67 1n1m s SER 360 Ca 0.59 2.32 -0.30 0.00 0.48 0.00 0.00 55.95 59.03 1n1m s SER 360 Cb -0.51 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 62.98 1n1m s SER 360 CO 0.60 -2.43 1.13 -0.70 0.98 0.00 0.00 173.24 172.82 1n1m s GLU 361 N -4.08 4.50 0.28 4.02 2.12 -1.26 -4.92 118.70 119.36 1n1m s GLU 361 Ca 0.73 1.68 -0.20 0.00 0.36 0.00 0.00 54.97 57.53 1n1m s GLU 361 Cb -0.28 -3.36 -0.09 0.00 0.26 0.00 0.00 34.13 30.67 1n1m s GLU 361 CO 0.48 -0.14 0.80 -1.25 -0.54 0.00 0.00 175.26 174.61 1n1m s PRO 362 N 0.73 4.29 -0.32 4.30 0.04 -1.26 -4.51 135.00 138.27 1n1m s PRO 362 Ca 0.55 0.97 0.03 0.00 0.04 0.00 0.00 61.00 62.59 1n1m s PRO 362 Cb -0.28 -2.72 0.09 0.00 0.04 0.00 0.00 34.50 31.63 1n1m s PRO 362 CO 0.30 0.29 0.03 -1.01 0.04 0.00 0.00 177.00 176.65 1n1m s HIS 363 N -1.68 3.29 0.36 0.56 3.76 0.12 -4.95 115.29 116.75 1n1m s HIS 363 Ca 0.48 -2.63 -0.25 0.00 -0.15 0.00 0.00 55.06 52.52 1n1m s HIS 363 Cb -0.15 -2.51 -0.10 0.00 1.11 0.00 0.00 32.58 30.93 1n1m s HIS 363 CO 0.20 -0.92 0.95 -0.06 -0.85 0.00 0.00 174.74 174.07 1n1m s PHE 364 N 1.07 3.56 0.96 1.40 0.40 -1.26 -0.60 117.98 123.51 1n1m s PHE 364 Ca 0.07 1.73 -0.12 0.00 -0.60 0.00 0.00 56.93 58.00 1n1m s PHE 364 Cb -0.19 -2.92 0.17 0.00 0.51 0.00 0.00 43.02 40.59 1n1m s PHE 364 CO -0.10 0.06 1.11 0.95 0.70 0.00 0.00 175.22 177.95 1n1m s THR 365 N -1.76 2.02 0.22 0.64 -4.23 -0.24 -4.86 115.64 107.43 1n1m s THR 365 Ca 0.54 0.01 -0.12 0.00 -1.18 0.00 0.00 61.69 60.93 1n1m s THR 365 Cb -0.16 -2.62 0.26 0.00 1.34 0.00 0.00 72.50 71.31 1n1m s THR 365 CO 0.21 -0.01 1.62 0.25 -0.54 0.00 0.00 174.62 176.16 1n1m h LEU 366 N -1.72 -0.58 -0.07 4.79 5.85 -1.92 0.16 115.31 121.81 1n1m h LEU 366 Ca -0.53 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1n1m h LEU 366 Cb 1.33 0.40 0.00 0.00 0.37 0.00 0.00 40.66 42.77 1n1m h LEU 366 CO 0.60 -0.21 -0.04 -0.90 -0.34 0.00 0.00 178.44 177.54 1n1m n ASP 367 N -5.44 0.16 -1.77 1.25 5.75 -1.26 -4.92 116.55 110.32 1n1m n ASP 367 Ca 0.09 -0.33 -0.15 0.00 -0.01 0.00 0.00 54.79 54.40 1n1m n ASP 367 Cb 0.36 -0.20 -0.00 0.00 -1.03 0.00 0.00 41.12 40.25 1n1m n ASP 367 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n1m n GLY 368 N 1.27 -0.23 0.00 6.12 0.00 0.04 -4.90 105.19 107.50 1n1m n GLY 368 Ca 0.15 -0.24 0.07 0.00 0.00 0.00 0.00 46.02 46.00 1n1m n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1n1m n ASN 369 N -0.89 0.93 -3.98 1.61 4.13 -1.26 -4.92 115.26 110.88 1n1m n ASN 369 Ca -0.16 -0.60 -0.09 0.00 1.68 0.00 0.00 54.58 55.41 1n1m n ASN 369 Cb 0.62 1.22 -0.07 0.00 -1.54 0.00 0.00 39.78 40.01 1n1m n ASN 369 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1n1m s SER 370 N -2.85 0.09 0.20 6.41 1.04 -1.26 -1.35 113.70 115.97 1n1m s SER 370 Ca 0.02 -0.89 -0.19 0.00 0.48 0.00 0.00 55.95 55.37 1n1m s SER 370 Cb 0.11 0.41 0.04 0.00 0.10 0.00 0.00 66.02 66.67 1n1m s SER 370 CO 0.63 -0.85 0.56 0.72 0.98 0.00 0.00 173.24 175.28 1n1m s PHE 371 N -3.97 -0.23 -0.03 5.02 -0.12 -0.82 -1.08 117.98 116.76 1n1m s PHE 371 Ca 0.17 -0.10 0.06 0.00 -0.05 0.00 0.00 56.93 57.01 1n1m s PHE 371 Cb 0.04 0.47 -0.01 0.00 -0.63 0.00 0.00 43.02 42.88 1n1m s PHE 371 CO -0.01 -0.94 -0.23 0.71 -0.05 0.00 0.00 175.22 174.71 1n1m s TYR 372 N -3.85 2.12 0.02 3.49 1.51 0.23 0.56 117.35 121.43 1n1m s TYR 372 Ca 0.07 -0.51 -0.17 0.00 -1.01 0.00 0.00 57.07 55.46 1n1m s TYR 372 Cb -0.02 -1.38 0.03 0.00 -0.11 0.00 0.00 41.96 40.48 1n1m s TYR 372 CO -0.04 -0.11 0.37 -1.59 -1.11 0.00 0.00 175.55 173.07 1n1m s LYS 373 N -0.33 0.83 -0.15 -0.62 -2.85 -0.95 0.14 119.74 115.80 1n1m s LYS 373 Ca 0.03 -0.30 -0.28 0.00 -1.00 0.00 0.00 55.97 54.42 1n1m s LYS 373 Cb -0.11 0.37 -0.01 0.00 -2.06 0.00 0.00 37.83 36.02 1n1m s LYS 373 CO 0.01 -0.26 0.95 0.42 0.10 0.00 0.00 175.35 176.57 1n1m s ILE 374 N -2.06 4.80 0.14 3.79 1.01 -1.26 -1.27 121.20 126.35 1n1m s ILE 374 Ca -0.08 1.90 0.01 0.00 0.00 0.00 0.00 60.65 62.48 1n1m s ILE 374 Cb -0.02 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 1n1m s ILE 374 CO 0.00 -0.02 -0.00 0.27 0.00 0.00 0.00 174.94 175.19 1n1m s ILE 375 N 2.27 0.50 0.28 2.92 -4.36 -0.44 -4.52 121.20 117.85 1n1m s ILE 375 Ca 0.44 -1.94 -0.29 0.00 -0.26 0.00 0.00 60.65 58.60 1n1m s ILE 375 Cb -0.17 -1.97 -0.10 0.00 1.25 0.00 0.00 42.46 41.47 1n1m s ILE 375 CO 0.14 -0.59 1.13 -0.55 0.24 0.00 0.00 174.94 175.31 1n1m s SER 376 N -3.10 7.19 1.03 4.36 0.15 -1.26 -2.00 113.70 120.08 1n1m s SER 376 Ca 0.20 2.32 -0.13 0.00 0.70 0.00 0.00 55.95 59.05 1n1m s SER 376 Cb 0.06 -2.63 0.21 0.00 -1.71 0.00 0.00 66.02 61.96 1n1m s SER 376 CO 0.01 -0.21 1.08 0.20 1.20 0.00 0.00 173.24 175.52 1n1m s ASN 377 N -0.73 2.28 0.24 5.45 0.01 0.35 -4.84 114.94 117.70 1n1m s ASN 377 Ca 0.46 1.22 -0.01 0.00 -0.71 0.00 0.00 52.86 53.82 1n1m s ASN 377 Cb -0.33 -1.91 0.27 0.00 0.41 0.00 0.00 41.25 39.69 1n1m s ASN 377 CO 0.42 -3.35 1.65 -0.08 -1.51 0.00 0.00 177.10 174.23 1n1m h GLU 378 N -2.04 0.62 -0.00 -0.60 4.57 -1.96 -1.33 114.58 113.83 1n1m h GLU 378 Ca -0.56 -0.26 0.00 0.00 -1.18 0.00 0.00 59.36 57.36 1n1m h GLU 378 Cb 1.33 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 1n1m h GLU 378 CO 0.57 0.83 -0.03 -1.91 -1.18 0.00 0.00 179.01 177.29 1n1m n GLU 379 N -4.10 1.01 -0.42 1.92 2.13 -1.26 -4.92 120.64 115.00 1n1m n GLU 379 Ca -0.00 -0.25 0.00 0.00 0.66 0.00 0.00 57.16 57.56 1n1m n GLU 379 Cb 0.44 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.66 1n1m n GLU 379 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1n1m n GLY 380 N 1.13 0.77 3.89 8.31 0.00 -0.50 -4.74 105.19 114.04 1n1m n GLY 380 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 1n1m n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n1m s TYR 381 N -2.21 3.56 -0.28 1.61 1.51 -1.26 0.27 117.35 120.55 1n1m s TYR 381 Ca 0.00 0.57 -0.22 0.00 -1.01 0.00 0.00 57.07 56.40 1n1m s TYR 381 Cb 0.00 -1.99 -0.01 0.00 -0.11 0.00 0.00 41.96 39.85 1n1m s TYR 381 CO 0.00 0.58 0.73 1.03 -1.11 0.00 0.00 175.55 176.79 1n1m s ARG 382 N -1.93 4.05 0.20 -0.62 0.52 -1.26 0.13 118.95 120.03 1n1m s ARG 382 Ca 0.30 0.62 0.00 0.00 -0.52 0.00 0.00 55.73 56.14 1n1m s ARG 382 Cb -0.13 -3.69 -0.04 0.00 0.52 0.00 0.00 34.95 31.61 1n1m s ARG 382 CO 0.18 -0.56 0.07 -1.01 0.02 0.00 0.00 175.30 174.01 1n1m s HIS 383 N 2.76 1.23 -0.10 -0.53 3.76 -0.84 -1.06 115.29 120.50 1n1m s HIS 383 Ca 0.30 -1.20 -0.27 0.00 -0.15 0.00 0.00 55.06 53.74 1n1m s HIS 383 Cb -0.15 -0.68 -0.02 0.00 1.11 0.00 0.00 32.58 32.84 1n1m s HIS 383 CO 0.10 -0.42 0.89 0.42 -0.85 0.00 0.00 174.74 174.88 1n1m s ILE 384 N -3.89 4.87 0.04 0.60 1.01 -1.26 -1.33 121.20 121.24 1n1m s ILE 384 Ca 0.32 1.81 0.04 0.00 0.00 0.00 0.00 60.65 62.82 1n1m s ILE 384 Cb 0.07 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 1n1m s ILE 384 CO 0.08 0.08 -0.07 0.00 0.00 0.00 0.00 174.94 175.04 1n1m s TYR 386 N -1.09 3.18 0.26 0.00 5.04 0.85 -2.25 117.35 123.35 1n1m s TYR 386 Ca 0.19 -0.08 0.10 0.00 -2.44 0.00 0.00 57.07 54.84 1n1m s TYR 386 Cb -0.11 -2.13 -0.04 0.00 0.35 0.00 0.00 41.96 40.02 1n1m s TYR 386 CO 0.10 -0.02 -0.07 -0.06 -1.34 0.00 0.00 175.55 174.16 1n1m s PHE 387 N 0.81 2.57 -0.22 4.97 0.40 0.19 -0.77 117.98 125.92 1n1m s PHE 387 Ca 0.04 -0.25 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1n1m s PHE 387 Cb -0.14 -1.14 0.05 0.00 0.51 0.00 0.00 43.02 42.30 1n1m s PHE 387 CO 0.02 0.64 -0.11 -1.14 0.70 0.00 0.00 175.22 175.33 1n1m s GLN 388 N -3.55 2.15 0.54 0.44 2.00 -1.26 -1.94 119.66 118.04 1n1m s GLN 388 Ca 0.30 -1.04 0.02 0.00 -2.00 0.00 0.00 55.36 52.65 1n1m s GLN 388 Cb -0.06 -2.62 0.08 0.00 0.80 0.00 0.00 33.01 31.21 1n1m s GLN 388 CO 0.18 -0.48 0.86 0.44 -0.50 0.00 0.00 175.29 175.79 1n1m n ILE 389 N 4.59 0.00 0.08 -2.34 -5.35 -0.46 0.11 119.36 115.99 1n1m n ILE 389 Ca -0.15 0.85 0.01 0.00 -0.27 0.00 0.00 62.75 63.20 1n1m n ILE 389 Cb 0.45 -1.68 0.01 0.00 -1.74 0.00 0.00 39.64 36.67 1n1m n ILE 389 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1n1m n ASP 390 N -2.24 1.12 -4.67 7.28 5.68 -1.26 -4.54 116.55 117.91 1n1m n ASP 390 Ca 0.02 -1.06 -0.37 0.00 -0.50 0.00 0.00 54.79 52.88 1n1m n ASP 390 Cb 0.88 0.04 -0.08 0.00 -1.14 0.00 0.00 41.12 40.82 1n1m n ASP 390 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1n1m s LYS 391 N -0.20 4.14 0.36 0.11 3.01 0.30 -4.89 119.74 122.57 1n1m s LYS 391 Ca 0.02 0.03 0.27 0.00 -1.01 0.00 0.00 55.97 55.28 1n1m s LYS 391 Cb 0.02 -3.53 1.15 0.00 -1.01 0.00 0.00 37.83 34.46 1n1m s LYS 391 CO 0.03 0.02 1.81 1.57 0.51 0.00 0.00 175.35 179.28 1n1m h LYS 392 N 7.36 0.00 -6.61 1.68 2.10 -1.87 -3.40 116.57 115.83 1n1m h LYS 392 Ca -0.37 0.00 -0.68 0.00 -2.00 0.00 0.00 60.65 57.59 1n1m h LYS 392 Cb 1.16 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 32.28 1n1m h LYS 392 CO 0.70 0.00 -0.81 0.34 -2.00 0.00 0.00 179.45 177.68 1n1m s ASP 393 N -4.66 3.79 0.47 7.07 -1.08 -1.26 -4.92 116.67 116.08 1n1m s ASP 393 Ca 0.03 -0.46 0.07 0.00 -0.52 0.00 0.00 52.55 51.66 1n1m s ASP 393 Cb 0.09 -0.58 -0.00 0.00 -1.46 0.00 0.00 42.92 40.96 1n1m s ASP 393 CO 0.42 0.24 0.33 0.00 0.52 0.00 0.00 175.17 176.68 1n1m s THR 395 N -2.64 1.70 0.18 0.00 2.01 0.05 -4.85 115.64 112.09 1n1m s THR 395 Ca 0.40 -0.71 -0.31 0.00 0.31 0.00 0.00 61.69 61.38 1n1m s THR 395 Cb -0.01 -1.58 -0.09 0.00 0.01 0.00 0.00 72.50 70.84 1n1m s THR 395 CO 0.23 0.48 1.41 -0.36 -0.69 0.00 0.00 174.62 175.69 1n1m s PHE 396 N 1.43 3.16 -0.57 4.92 0.08 -1.26 -0.11 117.98 125.64 1n1m s PHE 396 Ca 0.05 0.99 0.15 0.00 0.12 0.00 0.00 56.93 58.24 1n1m s PHE 396 Cb -0.13 -3.73 -0.17 0.00 -0.57 0.00 0.00 43.02 38.41 1n1m s PHE 396 CO -0.11 -2.48 0.57 0.44 -0.10 0.00 0.00 175.22 173.53 1n1m n ILE 397 N 3.18 0.00 -4.28 0.64 -5.35 0.05 -4.91 119.36 108.69 1n1m n ILE 397 Ca 0.09 -0.19 -0.19 0.00 -0.27 0.00 0.00 62.75 62.20 1n1m n ILE 397 Cb 0.41 0.84 -0.11 0.00 -1.74 0.00 0.00 39.64 39.05 1n1m n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1n1m s THR 398 N -2.51 1.51 0.16 7.28 -4.23 -1.25 -4.95 115.64 111.66 1n1m s THR 398 Ca 0.04 -1.88 -0.24 0.00 -1.18 0.00 0.00 61.69 58.42 1n1m s THR 398 Cb 0.11 -1.72 0.06 0.00 1.34 0.00 0.00 72.50 72.29 1n1m s THR 398 CO 0.61 -0.45 0.96 -1.59 -0.54 0.00 0.00 174.62 173.61 1n1m s LYS 399 N -2.95 1.24 0.00 3.99 -2.85 -1.26 -4.55 119.74 113.35 1n1m s LYS 399 Ca 0.13 -0.70 0.00 0.00 -1.00 0.00 0.00 55.97 54.40 1n1m s LYS 399 Cb -0.04 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.14 1n1m s LYS 399 CO 0.04 -0.57 0.00 0.41 0.10 0.00 0.00 175.35 175.33 1n1m n GLY 400 N -0.50 1.98 3.22 0.59 0.00 -1.26 -4.91 105.19 104.31 1n1m n GLY 400 Ca -0.06 -2.18 -0.44 0.00 0.00 0.00 0.00 46.02 43.35 1n1m n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n1m n THR 401 N -1.10 4.56 -3.76 2.61 -2.24 -1.26 -4.83 114.28 108.26 1n1m n THR 401 Ca 0.00 -5.06 -0.02 0.00 -2.27 0.00 0.00 64.05 56.70 1n1m n THR 401 Cb 0.00 -2.41 -0.01 0.00 -2.10 0.00 0.00 70.33 65.82 1n1m n THR 401 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1n1m s TRP 402 N -0.25 -0.07 0.13 4.78 1.48 -1.26 -5.04 118.94 118.71 1n1m s TRP 402 Ca 0.37 -0.21 0.06 0.00 -1.06 0.00 0.00 56.10 55.25 1n1m s TRP 402 Cb -0.01 0.63 -0.04 0.00 -1.16 0.00 0.00 33.47 32.90 1n1m s TRP 402 CO -0.00 -0.73 -0.13 -1.21 -4.06 0.00 0.00 176.95 170.81 1n1m s GLU 403 N -2.89 1.04 -0.25 3.25 2.02 -1.26 -4.47 118.70 116.13 1n1m s GLU 403 Ca 0.15 -1.29 -0.24 0.00 0.02 0.00 0.00 54.97 53.61 1n1m s GLU 403 Cb -0.00 -0.85 -0.01 0.00 0.10 0.00 0.00 34.13 33.37 1n1m s GLU 403 CO 0.02 0.15 0.79 0.08 0.02 0.00 0.00 175.26 176.32 1n1m s VAL 404 N -2.39 4.86 -0.02 2.63 1.01 -0.23 -2.59 120.40 123.68 1n1m s VAL 404 Ca 0.11 1.45 -0.25 0.00 0.00 0.00 0.00 61.98 63.29 1n1m s VAL 404 Cb -0.03 -4.09 -0.18 0.00 0.00 0.00 0.00 36.38 32.07 1n1m s VAL 404 CO 0.03 -0.08 1.18 0.40 0.00 0.00 0.00 175.10 176.63 1n1m h ILE 405 N 5.45 1.11 -2.35 2.22 1.08 0.16 -3.46 117.51 121.72 1n1m h ILE 405 Ca -0.24 -1.01 0.02 0.00 -0.39 0.00 0.00 64.86 63.24 1n1m h ILE 405 Cb 1.10 1.74 -0.16 0.00 -3.07 0.00 0.00 36.82 36.43 1n1m h ILE 405 CO 0.86 0.24 0.33 -0.83 -0.69 0.00 0.00 178.15 178.06 1n1m s GLY 406 N -3.09 -0.52 -0.33 5.37 0.00 -1.09 -4.99 107.32 102.67 1n1m s GLY 406 Ca -0.15 1.06 -0.19 0.00 0.00 0.00 0.00 44.72 45.43 1n1m s GLY 406 CO 0.60 0.53 0.58 -0.42 0.00 0.00 0.00 173.10 174.39 1n1m s ILE 407 N -2.58 4.96 -0.06 0.90 1.01 -1.26 -1.11 121.20 123.06 1n1m s ILE 407 Ca -0.01 0.58 0.10 0.00 0.00 0.00 0.00 60.65 61.32 1n1m s ILE 407 Cb -0.01 -4.00 -0.23 0.00 0.01 0.00 0.00 42.46 38.23 1n1m s ILE 407 CO -0.04 -0.21 0.59 -0.62 0.00 0.00 0.00 174.94 174.66 1n1m n GLU 408 N 5.86 0.65 -3.63 2.79 -0.58 0.71 -4.97 120.64 121.46 1n1m n GLU 408 Ca -0.03 0.28 -0.12 0.00 -0.42 0.00 0.00 57.16 56.87 1n1m n GLU 408 Cb 0.49 -1.77 -0.07 0.00 -0.57 0.00 0.00 31.44 29.52 1n1m n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n1m s ALA 409 N -2.59 -1.85 -0.05 0.62 0.00 -1.00 -4.85 121.76 112.05 1n1m s ALA 409 Ca -0.07 2.00 0.05 0.00 0.00 0.00 0.00 51.96 53.93 1n1m s ALA 409 Cb 0.08 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.91 1n1m s ALA 409 CO 0.82 -0.31 -0.19 -1.17 0.00 0.00 0.00 175.76 174.91 1n1m s LEU 410 N 0.39 1.95 0.18 0.00 2.96 -1.26 0.11 118.68 123.01 1n1m s LEU 410 Ca 0.01 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1n1m s LEU 410 Cb -0.05 -1.06 -0.05 0.00 0.50 0.00 0.00 46.19 45.53 1n1m s LEU 410 CO -0.02 0.17 0.03 0.42 -1.32 0.00 0.00 176.35 175.63 1n1m s THR 411 N -0.01 0.54 0.51 3.68 -4.23 0.16 -4.99 115.64 111.30 1n1m s THR 411 Ca -0.04 -1.97 0.20 0.00 -1.18 0.00 0.00 61.69 58.70 1n1m s THR 411 Cb -0.12 -2.18 0.27 0.00 1.34 0.00 0.00 72.50 71.82 1n1m s THR 411 CO 0.02 -0.40 2.14 0.77 -0.54 0.00 0.00 174.62 176.61 1n1m h SER 412 N 2.69 0.00 0.17 3.99 4.64 -2.00 -3.18 113.55 119.86 1n1m h SER 412 Ca -0.37 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.95 1n1m h SER 412 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1n1m h SER 412 CO 0.62 0.05 -0.08 -0.78 -0.87 0.00 0.00 176.83 175.76 1n1m h ASP 413 N 0.00 -0.19 -2.66 4.97 1.82 -1.98 -3.45 116.42 114.93 1n1m h ASP 413 Ca -0.00 0.01 -0.57 0.00 -0.39 0.00 0.00 57.03 56.07 1n1m h ASP 413 Cb 0.09 0.05 -0.13 0.00 0.68 0.00 0.00 39.33 40.02 1n1m h ASP 413 CO 0.01 0.03 -0.52 -0.31 -1.61 0.00 0.00 179.24 176.84 1n1m s TYR 414 N -2.32 1.82 -0.14 0.28 1.51 -1.20 -2.47 117.35 114.83 1n1m s TYR 414 Ca -0.03 -1.20 -0.00 0.00 -1.01 0.00 0.00 57.07 54.83 1n1m s TYR 414 Cb 0.00 -1.25 0.03 0.00 -0.11 0.00 0.00 41.96 40.63 1n1m s TYR 414 CO 0.10 -0.18 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.11 1n1m s LEU 415 N -3.64 1.51 -0.13 -1.29 1.98 -1.03 -0.66 118.68 115.42 1n1m s LEU 415 Ca 0.22 -0.51 -0.10 0.00 -2.89 0.00 0.00 54.13 50.85 1n1m s LEU 415 Cb 0.03 -0.96 -0.05 0.00 0.66 0.00 0.00 46.19 45.87 1n1m s LEU 415 CO 0.13 -0.13 0.20 -0.31 -1.89 0.00 0.00 176.35 174.34 1n1m s TYR 416 N 1.62 3.55 0.22 5.38 1.51 0.30 -1.44 117.35 128.48 1n1m s TYR 416 Ca 0.03 0.55 -0.15 0.00 -1.01 0.00 0.00 57.07 56.50 1n1m s TYR 416 Cb -0.14 -2.11 0.01 0.00 -0.11 0.00 0.00 41.96 39.61 1n1m s TYR 416 CO -0.08 0.53 0.48 1.52 -1.11 0.00 0.00 175.55 176.89 1n1m s TYR 417 N -0.44 0.14 -0.06 2.71 -0.85 0.65 -0.21 117.35 119.29 1n1m s TYR 417 Ca 0.15 -0.51 0.05 0.00 -0.52 0.00 0.00 57.07 56.24 1n1m s TYR 417 Cb -0.13 0.27 -0.02 0.00 0.38 0.00 0.00 41.96 42.47 1n1m s TYR 417 CO 0.04 -0.94 -0.22 0.42 -1.52 0.00 0.00 175.55 173.33 1n1m s ILE 418 N -3.95 2.36 0.20 -3.49 1.01 -0.26 0.64 121.20 117.71 1n1m s ILE 418 Ca 0.16 -0.96 -0.08 0.00 0.00 0.00 0.00 60.65 59.76 1n1m s ILE 418 Cb -0.01 -1.88 -0.02 0.00 0.01 0.00 0.00 42.46 40.57 1n1m s ILE 418 CO 0.03 0.57 0.31 -0.94 0.00 0.00 0.00 174.94 174.91 1n1m s SER 419 N -0.29 0.03 -0.33 3.58 1.04 -0.90 0.18 113.70 117.01 1n1m s SER 419 Ca 0.01 -1.04 0.09 0.00 0.48 0.00 0.00 55.95 55.48 1n1m s SER 419 Cb -0.13 0.47 0.59 0.00 0.10 0.00 0.00 66.02 67.05 1n1m s SER 419 CO 0.03 -0.97 1.63 -0.46 0.98 0.00 0.00 173.24 174.45 1n1m n ASN 420 N -0.29 3.32 -0.15 7.02 0.23 -1.07 -1.36 115.26 122.96 1n1m n ASN 420 Ca -0.03 -3.57 -0.08 0.00 -0.53 0.00 0.00 54.58 50.37 1n1m n ASN 420 Cb 0.63 -0.70 0.06 0.00 -2.08 0.00 0.00 39.78 37.70 1n1m n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1n1m h GLU 421 N 1.33 0.94 -6.45 -3.83 4.81 -1.84 -3.36 114.58 106.18 1n1m h GLU 421 Ca 0.32 -0.33 -0.61 0.00 -0.13 0.00 0.00 59.36 58.60 1n1m h GLU 421 Cb 2.07 -0.07 0.06 0.00 0.63 0.00 0.00 28.75 31.44 1n1m h GLU 421 CO 0.62 0.99 0.63 0.98 -0.73 0.00 0.00 179.01 181.49 1n1m n TYR 422 N -4.15 1.98 -0.85 0.92 9.36 -1.26 -1.48 117.16 121.67 1n1m n TYR 422 Ca 0.02 0.43 0.00 0.00 3.32 0.00 0.00 57.90 61.67 1n1m n TYR 422 Cb 0.39 -2.45 0.00 0.00 -0.63 0.00 0.00 39.34 36.65 1n1m n TYR 422 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1n1m n LYS 423 N 2.77 -1.66 -1.08 2.98 4.01 -1.26 -2.60 118.16 121.32 1n1m n LYS 423 Ca 0.16 0.39 -0.03 0.00 -0.51 0.00 0.00 58.31 58.32 1n1m n LYS 423 Cb 0.26 -4.74 -0.01 0.00 -0.51 0.00 0.00 35.03 30.04 1n1m n LYS 423 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1n1m n GLY 424 N 0.47 0.31 3.47 0.72 0.00 -0.55 -4.94 105.19 104.68 1n1m n GLY 424 Ca 0.00 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1n1m n GLY 424 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1n1m s MET 425 N -2.00 3.05 0.35 1.61 0.23 -1.07 -4.95 119.30 116.53 1n1m s MET 425 Ca 0.00 -0.87 0.23 0.00 -1.03 0.00 0.00 55.69 54.02 1n1m s MET 425 Cb 0.00 -3.97 1.24 0.00 -1.53 0.00 0.00 34.83 30.58 1n1m s MET 425 CO 0.00 -0.80 1.69 -1.00 -2.03 0.00 0.00 175.02 172.89 1n1m h PRO 426 N 8.68 0.00 -0.01 3.16 0.13 -1.89 -1.73 132.00 140.34 1n1m h PRO 426 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1n1m h PRO 426 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1n1m h PRO 426 CO 0.76 0.00 -0.01 0.41 -0.23 0.00 0.00 178.00 178.93 1n1m n GLY 427 N -1.28 -0.08 3.77 1.56 0.00 -1.26 -4.86 105.19 103.03 1n1m n GLY 427 Ca -0.02 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 1n1m n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n1m s GLY 428 N -2.03 2.01 -0.03 -0.02 0.00 -0.65 -2.58 107.32 104.01 1n1m s GLY 428 Ca 0.38 -0.98 0.03 0.00 0.00 0.00 0.00 44.72 44.15 1n1m s GLY 428 CO 0.35 -0.92 -0.11 0.50 0.00 0.00 0.00 173.10 172.92 1n1m s ARG 429 N -2.16 1.20 0.05 2.90 1.81 0.83 -3.97 118.95 119.61 1n1m s ARG 429 Ca 0.27 -0.36 0.00 0.00 -1.72 0.00 0.00 55.73 53.92 1n1m s ARG 429 Cb -0.12 -1.08 -0.03 0.00 -0.45 0.00 0.00 34.95 33.27 1n1m s ARG 429 CO 0.19 0.12 -0.05 -0.80 -0.68 0.00 0.00 175.30 174.08 1n1m s ASN 430 N 0.26 0.64 -0.03 0.23 0.01 -0.47 -1.40 114.94 114.18 1n1m s ASN 430 Ca -0.05 -0.80 -0.20 0.00 -0.71 0.00 0.00 52.86 51.11 1n1m s ASN 430 Cb -0.10 0.12 -0.05 0.00 0.41 0.00 0.00 41.25 41.63 1n1m s ASN 430 CO 0.01 -0.42 0.55 -0.22 -1.51 0.00 0.00 177.10 175.51 1n1m s LEU 431 N -2.34 4.38 0.12 0.60 2.96 -1.26 -2.11 118.68 121.02 1n1m s LEU 431 Ca -0.01 1.06 0.04 0.00 -0.22 0.00 0.00 54.13 55.00 1n1m s LEU 431 Cb -0.00 -2.84 -0.04 0.00 0.50 0.00 0.00 46.19 43.80 1n1m s LEU 431 CO -0.05 0.09 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.66 1n1m s TYR 432 N -0.03 1.16 -0.02 5.38 1.51 0.21 -0.22 117.35 125.33 1n1m s TYR 432 Ca 0.29 -0.73 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1n1m s TYR 432 Cb -0.17 -0.61 0.02 0.00 -0.11 0.00 0.00 41.96 41.08 1n1m s TYR 432 CO 0.15 0.03 -0.00 -1.59 -1.11 0.00 0.00 175.55 173.03 1n1m s LYS 433 N -3.35 0.23 -0.10 -0.62 -2.85 -0.46 -0.25 119.74 112.34 1n1m s LYS 433 Ca 0.12 0.05 0.02 0.00 -1.00 0.00 0.00 55.97 55.16 1n1m s LYS 433 Cb 0.00 -0.38 -0.02 0.00 -2.06 0.00 0.00 37.83 35.38 1n1m s LYS 433 CO -0.00 -0.09 -0.16 -1.50 0.10 0.00 0.00 175.35 173.70 1n1m s ILE 434 N 0.75 2.81 -0.08 3.79 2.07 -0.52 -1.11 121.20 128.90 1n1m s ILE 434 Ca -0.07 -0.77 -0.30 0.00 -1.41 0.00 0.00 60.65 58.10 1n1m s ILE 434 Cb -0.10 -2.13 -0.04 0.00 0.13 0.00 0.00 42.46 40.32 1n1m s ILE 434 CO -0.01 0.55 1.44 -1.58 -1.91 0.00 0.00 174.94 173.42 1n1m s GLN 435 N 0.00 4.23 0.00 3.50 0.74 -0.86 -2.45 119.66 124.82 1n1m s GLN 435 Ca -0.05 1.92 0.15 0.00 0.05 0.00 0.00 55.36 57.43 1n1m s GLN 435 Cb -0.14 -3.80 0.77 0.00 1.10 0.00 0.00 33.01 30.93 1n1m s GLN 435 CO 0.04 -0.72 1.40 1.28 -0.55 0.00 0.00 175.29 176.75 1n1m n LEU 436 N 6.49 0.00 -0.10 3.68 4.32 -1.03 -2.39 117.00 127.97 1n1m n LEU 436 Ca 0.15 0.26 -0.10 0.00 -0.02 0.00 0.00 56.01 56.30 1n1m n LEU 436 Cb 0.44 -0.26 -0.15 0.00 -1.62 0.00 0.00 43.42 41.83 1n1m n LEU 436 CO 0.59 -0.13 -1.14 -1.20 -1.22 0.00 0.00 177.39 174.29 1n1m n SER 437 N -1.26 0.34 -3.52 -1.43 7.64 -1.26 -4.84 113.62 109.29 1n1m n SER 437 Ca 0.07 -0.01 -0.28 0.00 1.01 0.00 0.00 58.87 59.67 1n1m n SER 437 Cb 0.11 0.90 -0.14 0.00 -1.01 0.00 0.00 64.21 64.07 1n1m n SER 437 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1n1m s ASP 438 N -5.43 3.29 0.00 6.43 -1.08 -1.00 -4.98 116.67 113.89 1n1m s ASP 438 Ca -0.11 -1.32 0.03 0.00 -0.52 0.00 0.00 52.55 50.63 1n1m s ASP 438 Cb 0.06 -0.26 0.16 0.00 -1.46 0.00 0.00 42.92 41.42 1n1m s ASP 438 CO 0.78 -0.42 1.00 -1.22 0.52 0.00 0.00 175.17 175.83 1n1m n TYR 439 N 5.14 0.00 0.18 -5.34 4.01 -1.20 -0.56 117.16 119.38 1n1m n TYR 439 Ca -0.04 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.77 1n1m n TYR 439 Cb 0.42 -0.37 0.09 0.00 -0.31 0.00 0.00 39.34 39.17 1n1m n TYR 439 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1n1m h THR 440 N 0.00 0.48 -2.73 -0.72 2.02 -1.93 -3.39 112.91 106.64 1n1m h THR 440 Ca 0.00 -1.67 -0.77 0.00 0.77 0.00 0.00 66.41 64.75 1n1m h THR 440 Cb 0.04 2.23 -0.22 0.00 -1.74 0.00 0.00 68.15 68.46 1n1m h THR 440 CO 0.00 0.27 1.00 0.29 0.37 0.00 0.00 175.52 177.45 1n1m n LYS 441 N -3.17 3.48 -4.09 6.66 5.02 0.27 -4.97 118.16 121.36 1n1m n LYS 441 Ca 0.03 -4.11 -0.35 0.00 -2.02 0.00 0.00 58.31 51.86 1n1m n LYS 441 Cb 0.64 -2.82 -0.12 0.00 -0.02 0.00 0.00 35.03 32.70 1n1m n LYS 441 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1n1m s VAL 442 N 0.24 4.00 -0.07 -0.18 0.11 -1.26 -2.02 120.40 121.22 1n1m s VAL 442 Ca 0.38 -0.30 0.04 0.00 -2.93 0.00 0.00 61.98 59.17 1n1m s VAL 442 Cb -0.05 -2.80 -0.02 0.00 -1.53 0.00 0.00 36.38 31.98 1n1m s VAL 442 CO -0.03 0.43 -0.20 -0.89 -3.33 0.00 0.00 175.10 171.08 1n1m s THR 443 N 0.93 2.49 -0.22 5.04 2.01 -0.27 -4.98 115.64 120.64 1n1m s THR 443 Ca 0.01 -0.91 -0.20 0.00 0.31 0.00 0.00 61.69 60.91 1n1m s THR 443 Cb -0.14 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 1n1m s THR 443 CO 0.02 0.57 0.58 0.00 -0.69 0.00 0.00 174.62 175.10 1n1m h LEU 445 N 8.33 0.00 0.00 0.00 3.38 -0.95 -3.41 115.31 122.65 1n1m h LEU 445 Ca -0.31 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1n1m h LEU 445 Cb 1.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 1n1m h LEU 445 CO 0.76 0.22 -1.31 -1.54 0.09 0.00 0.00 178.44 176.66 1n1m n SER 446 N -2.80 3.54 -0.33 -0.43 3.41 -1.21 -4.75 113.62 111.06 1n1m n SER 446 Ca -0.03 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.53 1n1m n SER 446 Cb 0.66 1.21 -0.00 0.00 -0.26 0.00 0.00 64.21 65.81 1n1m n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1m n GLU 448 N -5.42 0.42 -0.36 0.00 4.71 -1.26 -3.96 120.64 114.78 1n1m n GLU 448 Ca 0.06 -0.22 0.08 0.00 -0.01 0.00 0.00 57.16 57.08 1n1m n GLU 448 Cb 0.36 -1.50 0.26 0.00 -1.01 0.00 0.00 31.44 29.55 1n1m n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1n1m h LEU 449 N 0.53 0.89 -5.00 -4.62 3.38 -1.80 -3.39 115.31 105.30 1n1m h LEU 449 Ca 0.00 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 1n1m h LEU 449 Cb 0.48 -0.11 -0.13 0.00 0.09 0.00 0.00 40.66 40.98 1n1m h LEU 449 CO 0.00 0.44 -0.13 -3.20 0.09 0.00 0.00 178.44 175.64 1n1m n ASN 450 N -4.66 -1.64 -0.34 -0.43 2.85 -1.26 -5.04 115.26 104.74 1n1m n ASN 450 Ca 0.20 -2.19 0.35 0.00 -0.11 0.00 0.00 54.58 52.83 1n1m n ASN 450 Cb 0.40 1.06 0.73 0.00 1.24 0.00 0.00 39.78 43.22 1n1m n ASN 450 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1n1m h PRO 451 N 3.14 0.03 0.49 1.20 0.13 -1.73 0.37 132.00 135.63 1n1m h PRO 451 Ca -0.23 -0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.88 1n1m h PRO 451 Cb 1.17 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1n1m h PRO 451 CO -0.05 0.02 -0.23 0.93 -0.23 0.00 0.00 178.00 178.44 1n1m h GLU 452 N 0.03 -0.63 0.00 0.86 4.39 -1.96 -3.36 114.58 113.91 1n1m h GLU 452 Ca 0.58 0.04 -0.20 0.00 0.34 0.00 0.00 59.36 60.12 1n1m h GLU 452 Cb 2.25 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 31.01 1n1m h GLU 452 CO -0.04 -0.33 -1.19 -0.09 -1.16 0.00 0.00 179.01 176.21 1n1m h ARG 453 N -1.02 0.00 -5.08 2.33 2.43 -1.77 -3.43 114.38 107.85 1n1m h ARG 453 Ca -0.07 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.44 1n1m h ARG 453 Cb 0.59 0.00 -0.35 0.00 -0.42 0.00 0.00 29.97 29.79 1n1m h ARG 453 CO 0.11 0.61 -0.86 0.00 -1.51 0.00 0.00 179.97 178.32 1n1m n GLN 455 N 4.45 0.00 -3.61 0.00 6.02 0.06 -4.20 117.38 120.11 1n1m n GLN 455 Ca -0.20 -0.27 -0.23 0.00 -0.01 0.00 0.00 57.00 56.28 1n1m n GLN 455 Cb 0.50 -0.44 -0.16 0.00 1.02 0.00 0.00 30.24 31.16 1n1m n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1n1m s TYR 456 N 0.00 0.06 0.20 1.08 6.14 -1.20 -0.12 117.35 123.50 1n1m s TYR 456 Ca 0.00 -0.04 0.08 0.00 0.64 0.00 0.00 57.07 57.76 1n1m s TYR 456 Cb 0.00 -0.56 -0.04 0.00 0.42 0.00 0.00 41.96 41.77 1n1m s TYR 456 CO 0.00 -0.44 -0.16 0.71 0.64 0.00 0.00 175.55 176.29 1n1m s TYR 457 N 2.19 1.81 0.10 4.97 1.51 -0.49 -1.52 117.35 125.92 1n1m s TYR 457 Ca 0.03 -0.51 0.01 0.00 -1.01 0.00 0.00 57.07 55.60 1n1m s TYR 457 Cb -0.15 -0.86 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 1n1m s TYR 457 CO -0.08 0.38 -0.05 -1.54 -1.11 0.00 0.00 175.55 173.15 1n1m s SER 458 N -3.07 1.05 0.05 2.29 1.04 -0.49 -4.67 113.70 109.90 1n1m s SER 458 Ca 0.20 -1.03 -0.04 0.00 0.48 0.00 0.00 55.95 55.56 1n1m s SER 458 Cb -0.03 0.12 -0.02 0.00 0.10 0.00 0.00 66.02 66.18 1n1m s SER 458 CO 0.08 -0.50 0.05 0.54 0.98 0.00 0.00 173.24 174.39 1n1m s VAL 459 N -3.68 0.16 -0.23 5.02 0.11 -1.26 -1.36 120.40 119.16 1n1m s VAL 459 Ca 0.13 -1.32 -0.03 0.00 -2.93 0.00 0.00 61.98 57.83 1n1m s VAL 459 Cb 0.06 -1.08 0.07 0.00 -1.53 0.00 0.00 36.38 33.90 1n1m s VAL 459 CO -0.04 -0.73 0.07 -0.55 -3.33 0.00 0.00 175.10 170.52 1n1m s SER 460 N -2.40 3.13 0.41 3.54 0.15 -0.80 -5.00 113.70 112.74 1n1m s SER 460 Ca -0.01 -1.02 -0.07 0.00 0.70 0.00 0.00 55.95 55.56 1n1m s SER 460 Cb 0.02 -0.55 -0.05 0.00 -1.71 0.00 0.00 66.02 63.73 1n1m s SER 460 CO -0.07 -0.36 0.72 -0.36 1.20 0.00 0.00 173.24 174.38 1n1m s PHE 461 N 1.90 3.51 0.87 3.44 0.40 -1.26 -1.12 117.98 125.73 1n1m s PHE 461 Ca 0.03 0.83 -0.12 0.00 -0.60 0.00 0.00 56.93 57.07 1n1m s PHE 461 Cb -0.17 -2.29 0.15 0.00 0.51 0.00 0.00 43.02 41.23 1n1m s PHE 461 CO -0.16 -0.11 1.22 -1.54 0.70 0.00 0.00 175.22 175.33 1n1m s SER 462 N -3.61 3.73 0.23 1.36 1.04 -0.70 -4.89 113.70 110.86 1n1m s SER 462 Ca 0.48 0.31 -0.17 0.00 0.48 0.00 0.00 55.95 57.04 1n1m s SER 462 Cb -0.10 -0.55 0.24 0.00 0.10 0.00 0.00 66.02 65.71 1n1m s SER 462 CO 0.37 -2.34 1.56 0.11 0.98 0.00 0.00 173.24 173.92 1n1m h LYS 463 N -1.28 -0.02 -0.56 4.02 1.79 -1.76 -1.20 116.57 117.56 1n1m h LYS 463 Ca -0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1n1m h LYS 463 Cb 1.27 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 1n1m h LYS 463 CO 0.46 -0.02 0.00 0.39 -1.08 0.00 0.00 179.45 179.21 1n1m n GLU 464 N -5.48 2.91 -2.32 3.15 -0.58 -1.26 -4.96 120.64 112.10 1n1m n GLU 464 Ca 0.10 -2.46 -0.13 0.00 -0.42 0.00 0.00 57.16 54.25 1n1m n GLU 464 Cb 0.40 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.77 1n1m n GLU 464 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n1m n ALA 465 N 1.07 -0.40 0.08 0.62 0.00 -0.46 -4.90 120.51 116.52 1n1m n ALA 465 Ca 0.20 0.11 -0.10 0.00 0.00 0.00 0.00 53.44 53.65 1n1m n ALA 465 Cb 0.59 -1.69 -0.02 0.00 0.00 0.00 0.00 19.45 18.32 1n1m n ALA 465 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1n1m h LYS 466 N -0.15 0.27 -5.22 0.00 3.64 -1.81 -3.41 116.57 109.89 1n1m h LYS 466 Ca -0.30 -0.30 -0.41 0.00 -1.27 0.00 0.00 60.65 58.38 1n1m h LYS 466 Cb 1.22 0.08 -0.14 0.00 -0.41 0.00 0.00 32.23 32.98 1n1m h LYS 466 CO 0.35 1.01 -0.67 0.71 -2.27 0.00 0.00 179.45 178.57 1n1m s TYR 467 N -3.23 1.64 -0.25 1.91 2.02 -1.26 -0.54 117.35 117.64 1n1m s TYR 467 Ca -0.04 -0.83 -0.19 0.00 -0.37 0.00 0.00 57.07 55.64 1n1m s TYR 467 Cb 0.10 -0.93 0.07 0.00 -0.40 0.00 0.00 41.96 40.80 1n1m s TYR 467 CO 0.84 0.07 0.64 1.52 -1.57 0.00 0.00 175.55 177.06 1n1m s TYR 468 N -3.28 -0.81 -0.20 2.71 1.13 -0.12 -1.72 117.35 115.06 1n1m s TYR 468 Ca 0.27 1.82 -0.14 0.00 -1.41 0.00 0.00 57.07 57.62 1n1m s TYR 468 Cb 0.05 0.37 -0.04 0.00 -1.10 0.00 0.00 41.96 41.23 1n1m s TYR 468 CO 0.09 -0.40 0.29 -1.14 -2.51 0.00 0.00 175.55 171.88 1n1m s GLN 469 N 0.84 4.18 -0.04 -3.49 0.74 -0.27 -0.93 119.66 120.70 1n1m s GLN 469 Ca -0.04 0.04 -0.12 0.00 0.05 0.00 0.00 55.36 55.29 1n1m s GLN 469 Cb -0.05 -3.49 -0.05 0.00 1.10 0.00 0.00 33.01 30.52 1n1m s GLN 469 CO -0.07 0.10 0.32 -0.51 -0.55 0.00 0.00 175.29 174.58 1n1m s LEU 470 N 0.90 4.45 -0.29 3.68 1.43 0.11 -1.91 118.68 127.05 1n1m s LEU 470 Ca 0.15 0.80 0.01 0.00 -1.03 0.00 0.00 54.13 54.05 1n1m s LEU 470 Cb -0.14 -2.42 0.09 0.00 0.03 0.00 0.00 46.19 43.75 1n1m s LEU 470 CO 0.05 0.35 0.04 -0.13 0.23 0.00 0.00 176.35 176.89 1n1m s ARG 471 N -1.08 1.16 -0.11 1.70 0.52 -0.47 -1.62 118.95 119.06 1n1m s ARG 471 Ca 0.21 -1.21 -0.15 0.00 -0.52 0.00 0.00 55.73 54.06 1n1m s ARG 471 Cb -0.15 -2.47 -0.05 0.00 0.52 0.00 0.00 34.95 32.80 1n1m s ARG 471 CO 0.10 -0.85 0.36 0.00 0.02 0.00 0.00 175.30 174.94 1n1m n SER 473 N 3.10 1.81 0.00 0.00 3.41 -0.57 -0.79 113.62 120.58 1n1m n SER 473 Ca -0.11 -3.07 0.00 0.00 -0.26 0.00 0.00 58.87 55.43 1n1m n SER 473 Cb 0.52 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1n1m n SER 473 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n1m n GLY 474 N -0.47 3.23 0.21 5.00 0.00 -1.26 0.46 105.19 112.36 1n1m n GLY 474 Ca 0.16 -1.29 0.15 0.00 0.00 0.00 0.00 46.02 45.03 1n1m n GLY 474 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n1m h PRO 475 N 0.00 0.00 0.00 1.61 0.13 -0.78 0.22 132.00 133.18 1n1m h PRO 475 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1n1m h PRO 475 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1n1m h PRO 475 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 1n1m n GLY 476 N 0.23 -0.50 3.77 1.56 0.00 -0.54 -4.52 105.19 105.18 1n1m n GLY 476 Ca 0.02 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.89 1n1m n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1m s LEU 477 N 0.00 4.15 0.27 0.99 1.43 -1.26 -4.57 118.68 119.69 1n1m s LEU 477 Ca 0.00 2.47 -0.27 0.00 -1.03 0.00 0.00 54.13 55.30 1n1m s LEU 477 Cb 0.00 -4.04 -0.15 0.00 0.03 0.00 0.00 46.19 42.03 1n1m s LEU 477 CO 0.00 -0.83 0.72 -2.65 0.23 0.00 0.00 176.35 173.81 1n1m n PRO 478 N -0.07 0.64 -3.81 1.29 -0.02 -1.26 -4.73 135.00 127.04 1n1m n PRO 478 Ca 0.05 0.22 -0.21 0.00 -2.02 0.00 0.00 63.50 61.54 1n1m n PRO 478 Cb 0.46 -1.42 -0.17 0.00 -0.02 0.00 0.00 33.50 32.35 1n1m n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1n1m s LEU 479 N 1.81 0.65 -0.18 2.45 2.96 0.03 -4.27 118.68 122.14 1n1m s LEU 479 Ca 0.61 -0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 54.44 1n1m s LEU 479 Cb -0.79 -0.35 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 1n1m s LEU 479 CO 0.58 -0.18 -0.03 -0.31 -1.32 0.00 0.00 176.35 175.09 1n1m s TYR 480 N 1.78 3.00 0.09 5.38 1.51 -0.05 -1.12 117.35 127.94 1n1m s TYR 480 Ca 0.01 -0.49 0.03 0.00 -1.01 0.00 0.00 57.07 55.62 1n1m s TYR 480 Cb -0.13 -2.02 -0.03 0.00 -0.11 0.00 0.00 41.96 39.67 1n1m s TYR 480 CO -0.04 -0.21 -0.09 0.95 -1.11 0.00 0.00 175.55 175.05 1n1m s THR 481 N 0.79 0.86 -0.09 -0.71 -4.23 -0.64 0.20 115.64 111.83 1n1m s THR 481 Ca -0.01 -1.60 0.04 0.00 -1.18 0.00 0.00 61.69 58.94 1n1m s THR 481 Cb -0.14 -1.30 -0.01 0.00 1.34 0.00 0.00 72.50 72.39 1n1m s THR 481 CO 0.02 -0.57 -0.20 -0.22 -0.54 0.00 0.00 174.62 173.11 1n1m s LEU 482 N -2.39 2.32 0.13 4.79 0.20 -0.61 0.06 118.68 123.19 1n1m s LEU 482 Ca 0.04 -0.44 0.02 0.00 0.69 0.00 0.00 54.13 54.44 1n1m s LEU 482 Cb -0.03 -1.46 -0.04 0.00 -0.43 0.00 0.00 46.19 44.22 1n1m s LEU 482 CO -0.00 0.21 -0.04 -1.00 -0.29 0.00 0.00 176.35 175.23 1n1m s HIS 483 N 0.03 1.06 -0.15 5.38 3.76 -0.10 -1.36 115.29 123.91 1n1m s HIS 483 Ca -0.08 -0.94 -0.02 0.00 -0.15 0.00 0.00 55.06 53.87 1n1m s HIS 483 Cb -0.15 -0.60 -0.02 0.00 1.11 0.00 0.00 32.58 32.92 1n1m s HIS 483 CO 0.05 -0.15 -0.09 -1.54 -0.85 0.00 0.00 174.74 172.16 1n1m s SER 484 N -3.11 4.29 0.48 1.40 1.04 -1.06 -0.95 113.70 115.79 1n1m s SER 484 Ca 0.17 -0.27 0.26 0.00 0.48 0.00 0.00 55.95 56.59 1n1m s SER 484 Cb 0.05 -1.68 1.16 0.00 0.10 0.00 0.00 66.02 65.65 1n1m s SER 484 CO -0.01 0.14 1.94 0.28 0.98 0.00 0.00 173.24 176.57 1n1m h SER 485 N 6.87 0.00 -0.75 7.02 0.02 -1.06 -0.40 113.55 125.25 1n1m h SER 485 Ca -0.29 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 60.81 1n1m h SER 485 Cb 1.20 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.64 1n1m h SER 485 CO 0.59 0.18 0.26 1.62 -1.14 0.00 0.00 176.83 178.34 1n1m h VAL 486 N 0.00 0.60 0.00 2.27 3.04 -1.89 -3.23 116.25 117.04 1n1m h VAL 486 Ca -0.00 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 1n1m h VAL 486 Cb 0.57 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.03 1n1m h VAL 486 CO 0.02 0.07 -0.27 0.59 -1.01 0.00 0.00 177.57 176.97 1n1m n ASN 487 N -5.06 0.46 -3.81 3.17 5.03 -1.24 -5.00 115.26 108.82 1n1m n ASN 487 Ca 0.15 -1.90 -0.29 0.00 0.87 0.00 0.00 54.58 53.40 1n1m n ASN 487 Cb 0.44 -0.17 0.02 0.00 -1.02 0.00 0.00 39.78 39.06 1n1m n ASN 487 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1n1m n ASP 488 N -0.24 -4.82 -4.75 6.41 10.43 -0.19 -4.91 116.55 118.49 1n1m n ASP 488 Ca 0.02 -0.71 -0.41 0.00 2.57 0.00 0.00 54.79 56.26 1n1m n ASP 488 Cb 0.61 -3.86 -0.03 0.00 1.84 0.00 0.00 41.12 39.68 1n1m n ASP 488 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 1n1m s LYS 489 N -6.52 4.46 -0.93 -1.24 2.20 -1.06 -4.88 119.74 111.78 1n1m s LYS 489 Ca 0.62 1.98 -0.18 0.00 -0.36 0.00 0.00 55.97 58.03 1n1m s LYS 489 Cb -0.31 -3.19 0.14 0.00 -1.51 0.00 0.00 37.83 32.96 1n1m s LYS 489 CO 0.77 -0.11 1.10 0.20 -0.36 0.00 0.00 175.35 176.95 1n1m s GLY 490 N -0.07 2.03 0.06 5.54 0.00 -1.26 -2.56 107.32 111.05 1n1m s GLY 490 Ca 0.52 -2.85 -0.24 0.00 0.00 0.00 0.00 44.72 42.16 1n1m s GLY 490 CO 0.41 1.93 1.37 1.41 0.00 0.00 0.00 173.10 178.21 1n1m h LEU 491 N 10.09 -0.97 -7.00 0.66 3.38 -1.58 -3.48 115.31 116.41 1n1m h LEU 491 Ca 0.16 0.08 0.13 0.00 0.09 0.00 0.00 57.88 58.34 1n1m h LEU 491 Cb 1.02 0.33 -0.16 0.00 0.09 0.00 0.00 40.66 41.94 1n1m h LEU 491 CO 1.07 -0.43 0.55 0.00 0.09 0.00 0.00 178.44 179.72 1n1m s ARG 492 N -4.87 0.72 -0.03 1.13 1.70 -1.14 -5.02 118.95 111.45 1n1m s ARG 492 Ca -0.12 -0.24 -0.30 0.00 -0.47 0.00 0.00 55.73 54.60 1n1m s ARG 492 Cb 0.03 0.33 -0.03 0.00 -0.57 0.00 0.00 34.95 34.71 1n1m s ARG 492 CO 0.40 -0.31 1.13 0.08 -1.08 0.00 0.00 175.30 175.51 1n1m s VAL 493 N -2.89 4.41 -0.19 4.99 1.01 -1.26 -1.57 120.40 124.90 1n1m s VAL 493 Ca 0.05 1.72 -0.16 0.00 0.00 0.00 0.00 61.98 63.60 1n1m s VAL 493 Cb -0.01 -4.11 -0.21 0.00 0.00 0.00 0.00 36.38 32.06 1n1m s VAL 493 CO -0.08 0.06 0.20 0.18 0.00 0.00 0.00 175.10 175.46 1n1m n LEU 494 N 4.62 2.14 -3.66 3.92 4.77 0.13 -4.95 117.00 123.97 1n1m n LEU 494 Ca 0.09 0.33 -0.06 0.00 -0.03 0.00 0.00 56.01 56.34 1n1m n LEU 494 Cb 0.48 -1.00 -0.08 0.00 -2.33 0.00 0.00 43.42 40.49 1n1m n LEU 494 CO 0.54 0.50 0.10 -0.70 -1.33 0.00 0.00 177.39 176.49 1n1m s GLU 495 N -2.44 0.40 0.00 3.23 2.56 -1.05 -4.98 118.70 116.42 1n1m s GLU 495 Ca -0.28 1.16 0.13 0.00 0.00 0.00 0.00 54.97 55.97 1n1m s GLU 495 Cb 0.07 0.48 0.16 0.00 2.00 0.00 0.00 34.13 36.84 1n1m s GLU 495 CO 0.64 -0.23 0.99 -0.40 -0.56 0.00 0.00 175.26 175.69 1n1m n ASP 496 N 5.38 2.28 -2.11 -1.70 5.68 -1.26 -0.87 116.55 123.94 1n1m n ASP 496 Ca -0.10 -1.63 -0.17 0.00 -0.50 0.00 0.00 54.79 52.39 1n1m n ASP 496 Cb 0.49 -0.06 -0.03 0.00 -1.14 0.00 0.00 41.12 40.39 1n1m n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1n1m n ASN 497 N 0.70 -4.80 -0.24 -1.12 3.02 -1.26 -4.84 115.26 106.72 1n1m n ASN 497 Ca 0.09 0.19 0.12 0.00 -0.03 0.00 0.00 54.58 54.95 1n1m n ASN 497 Cb 0.35 -4.12 0.39 0.00 -0.61 0.00 0.00 39.78 35.78 1n1m n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1n1m h SER 498 N 0.00 0.62 0.54 6.41 4.64 -1.93 -0.91 113.55 122.92 1n1m h SER 498 Ca -0.38 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 1n1m h SER 498 Cb 1.23 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 63.23 1n1m h SER 498 CO 0.48 0.33 -0.26 0.00 -0.87 0.00 0.00 176.83 176.51 1n1m h ALA 499 N 1.60 -0.73 -0.99 5.18 0.00 -2.00 -2.22 119.26 120.10 1n1m h ALA 499 Ca 0.42 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.23 1n1m h ALA 499 Cb 0.66 0.28 -0.07 0.00 0.00 0.00 0.00 17.79 18.67 1n1m h ALA 499 CO -0.18 -0.86 0.64 1.25 0.00 0.00 0.00 179.25 180.10 1n1m h LEU 500 N -0.83 0.99 0.57 0.00 5.85 -1.73 -2.06 115.31 118.09 1n1m h LEU 500 Ca -0.07 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1n1m h LEU 500 Cb 0.60 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1n1m h LEU 500 CO 0.12 0.60 -0.51 -0.78 -0.34 0.00 0.00 178.44 177.54 1n1m h ASP 501 N 1.10 -1.37 -0.92 1.25 3.58 -1.03 0.35 116.42 119.38 1n1m h ASP 501 Ca 0.44 0.10 0.17 0.00 0.42 0.00 0.00 57.03 58.17 1n1m h ASP 501 Cb 0.26 0.44 -0.08 0.00 1.72 0.00 0.00 39.33 41.68 1n1m h ASP 501 CO -0.19 -0.69 0.59 0.11 -2.88 0.00 0.00 179.24 176.18 1n1m h LYS 502 N -1.06 0.60 -0.08 0.28 1.79 -1.14 -1.47 116.57 115.50 1n1m h LYS 502 Ca -0.07 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.33 1n1m h LYS 502 Cb 0.90 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.41 1n1m h LYS 502 CO -0.03 0.39 -0.09 1.98 -1.08 0.00 0.00 179.45 180.63 1n1m h MET 503 N 0.61 0.20 0.00 3.15 4.05 -0.76 -3.25 114.93 118.93 1n1m h MET 503 Ca 0.49 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.78 1n1m h MET 503 Cb 0.91 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.72 1n1m h MET 503 CO -0.23 0.65 -0.09 -0.07 0.23 0.00 0.00 176.91 177.40 1n1m h LEU 504 N -0.24 0.00 0.00 3.39 3.38 0.60 -2.49 115.31 119.96 1n1m h LEU 504 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1n1m h LEU 504 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1n1m h LEU 504 CO 0.02 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.64 1n1m n GLN 505 N -3.36 0.24 -0.23 1.13 10.64 -0.64 -2.06 117.38 123.09 1n1m n GLN 505 Ca -0.01 0.13 0.11 0.00 -1.83 0.00 0.00 57.00 55.40 1n1m n GLN 505 Cb 0.26 -1.50 0.26 0.00 -0.86 0.00 0.00 30.24 28.41 1n1m n GLN 505 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1n1m n ASN 506 N -1.28 3.28 -3.98 2.61 3.02 -0.94 -4.90 115.26 113.08 1n1m n ASN 506 Ca 0.08 -1.97 -0.18 0.00 -0.03 0.00 0.00 54.58 52.49 1n1m n ASN 506 Cb 0.13 -0.31 -0.15 0.00 -0.61 0.00 0.00 39.78 38.84 1n1m n ASN 506 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1n1m s VAL 507 N -1.39 0.57 -0.87 2.41 0.11 -0.88 -4.06 120.40 116.31 1n1m s VAL 507 Ca 0.40 -0.29 -0.25 0.00 -2.93 0.00 0.00 61.98 58.91 1n1m s VAL 507 Cb 0.22 -0.49 -0.10 0.00 -1.53 0.00 0.00 36.38 34.48 1n1m s VAL 507 CO 0.30 0.17 2.18 -1.10 -3.33 0.00 0.00 175.10 173.32 1n1m s GLN 508 N -0.05 2.03 0.46 1.54 -0.21 0.22 -4.93 119.66 118.72 1n1m s GLN 508 Ca 0.01 0.05 -0.15 0.00 0.02 0.00 0.00 55.36 55.29 1n1m s GLN 508 Cb -0.04 -4.93 -0.08 0.00 1.00 0.00 0.00 33.01 28.96 1n1m s GLN 508 CO -0.00 -4.02 0.90 -1.64 -2.12 0.00 0.00 175.29 168.41 1n1m s MET 509 N 7.97 3.95 0.64 2.91 -1.94 -1.26 -4.38 119.30 127.19 1n1m s MET 509 Ca 0.81 0.82 -0.07 0.00 -1.71 0.00 0.00 55.69 55.54 1n1m s MET 509 Cb -0.09 -2.24 0.02 0.00 2.01 0.00 0.00 34.83 34.53 1n1m s MET 509 CO 0.05 -0.14 0.97 -1.25 -0.01 0.00 0.00 175.02 174.64 1n1m s PRO 510 N -3.79 2.79 0.45 2.03 0.04 -1.26 -4.27 135.00 130.99 1n1m s PRO 510 Ca 0.57 0.07 0.07 0.00 0.04 0.00 0.00 61.00 61.75 1n1m s PRO 510 Cb -0.10 -2.19 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 1n1m s PRO 510 CO 0.27 -0.87 0.34 -1.54 0.04 0.00 0.00 177.00 175.25 1n1m s SER 511 N -4.35 4.78 -0.04 6.66 1.04 -0.25 -4.91 113.70 116.62 1n1m s SER 511 Ca 0.56 -0.97 0.01 0.00 0.48 0.00 0.00 55.95 56.04 1n1m s SER 511 Cb -0.11 -0.26 0.02 0.00 0.10 0.00 0.00 66.02 65.77 1n1m s SER 511 CO 0.47 -0.76 -0.06 -0.75 0.98 0.00 0.00 173.24 173.12 1n1m s LYS 512 N -4.13 0.94 -0.20 4.02 2.20 -1.26 -0.17 119.74 121.15 1n1m s LYS 512 Ca 0.43 -0.16 -0.01 0.00 -0.36 0.00 0.00 55.97 55.87 1n1m s LYS 512 Cb -0.01 -0.90 0.01 0.00 -1.51 0.00 0.00 37.83 35.41 1n1m s LYS 512 CO 0.25 -0.05 -0.13 0.21 -0.36 0.00 0.00 175.35 175.27 1n1m s LYS 513 N 0.81 3.17 -0.14 4.03 2.20 -0.63 -4.94 119.74 124.24 1n1m s LYS 513 Ca -0.12 -0.74 -0.07 0.00 -0.36 0.00 0.00 55.97 54.69 1n1m s LYS 513 Cb -0.14 -2.77 -0.04 0.00 -1.51 0.00 0.00 37.83 33.37 1n1m s LYS 513 CO 0.01 -0.20 0.11 -1.17 -0.36 0.00 0.00 175.35 173.74 1n1m s LEU 514 N 1.37 4.19 0.00 5.43 0.20 -1.26 -1.11 118.68 127.49 1n1m s LEU 514 Ca 0.05 0.34 -0.05 0.00 0.69 0.00 0.00 54.13 55.16 1n1m s LEU 514 Cb -0.14 -2.03 0.02 0.00 -0.43 0.00 0.00 46.19 43.61 1n1m s LEU 514 CO -0.08 0.34 0.23 -0.67 -0.29 0.00 0.00 176.35 175.87 1n1m n ASP 515 N 2.46 -0.41 -3.97 3.68 4.64 -0.53 -5.02 116.55 117.42 1n1m n ASP 515 Ca -0.19 -1.22 -0.10 0.00 -1.38 0.00 0.00 54.79 51.91 1n1m n ASP 515 Cb 0.54 0.66 -0.07 0.00 -1.04 0.00 0.00 41.12 41.21 1n1m n ASP 515 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 1n1m s PHE 516 N -5.29 0.41 0.26 -0.67 -0.71 -1.26 -0.46 117.98 110.25 1n1m s PHE 516 Ca 0.05 -0.78 0.03 0.00 -1.04 0.00 0.00 56.93 55.20 1n1m s PHE 516 Cb -0.01 -0.08 -0.05 0.00 -1.21 0.00 0.00 43.02 41.67 1n1m s PHE 516 CO 0.01 -0.71 0.03 0.96 -1.34 0.00 0.00 175.22 174.18 1n1m s ILE 517 N -3.97 0.99 -0.13 -4.49 -4.36 -0.83 -4.96 121.20 103.45 1n1m s ILE 517 Ca 0.17 -2.02 0.00 0.00 -0.26 0.00 0.00 60.65 58.54 1n1m s ILE 517 Cb 0.04 -2.50 -0.01 0.00 1.25 0.00 0.00 42.46 41.23 1n1m s ILE 517 CO -0.00 -0.19 -0.14 -0.63 0.24 0.00 0.00 174.94 174.22 1n1m s ILE 518 N -3.45 2.95 -0.19 8.37 1.01 -1.26 -1.27 121.20 127.36 1n1m s ILE 518 Ca 0.32 -0.69 -0.01 0.00 0.00 0.00 0.00 60.65 60.27 1n1m s ILE 518 Cb 0.07 -2.24 0.00 0.00 0.01 0.00 0.00 42.46 40.30 1n1m s ILE 518 CO 0.11 0.52 -0.13 -0.76 0.00 0.00 0.00 174.94 174.69 1n1m s LEU 519 N 0.42 2.51 0.00 2.97 1.43 -0.00 -4.89 118.68 121.12 1n1m s LEU 519 Ca -0.11 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 1n1m s LEU 519 Cb -0.16 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.46 1n1m s LEU 519 CO 0.05 0.01 0.00 -0.46 0.23 0.00 0.00 176.35 176.18 1n1m n ASN 520 N 4.57 0.00 0.00 2.29 6.94 -1.26 -1.60 115.26 126.20 1n1m n ASN 520 Ca -0.19 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.37 1n1m n ASN 520 Cb 0.51 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.93 1n1m n ASN 520 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1n1m n GLU 521 N 0.14 0.00 -2.22 -3.83 -0.58 -1.26 -5.00 120.64 107.89 1n1m n GLU 521 Ca 0.00 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.38 1n1m n GLU 521 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1n1m n GLU 521 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1n1m s THR 522 N 0.00 3.04 -0.13 2.62 2.01 -0.63 -5.02 115.64 117.53 1n1m s THR 522 Ca 0.00 0.72 -0.03 0.00 0.31 0.00 0.00 61.69 62.68 1n1m s THR 522 Cb 0.00 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 1n1m s THR 522 CO 0.00 -0.08 -0.02 -1.59 -0.69 0.00 0.00 174.62 172.24 1n1m s LYS 523 N -3.00 3.44 -0.10 4.92 -2.85 -1.26 -0.82 119.74 120.06 1n1m s LYS 523 Ca 0.69 -0.48 0.04 0.00 -1.00 0.00 0.00 55.97 55.22 1n1m s LYS 523 Cb -0.27 -2.88 0.00 0.00 -2.06 0.00 0.00 37.83 32.62 1n1m s LYS 523 CO 0.32 0.40 -0.22 -0.06 0.10 0.00 0.00 175.35 175.89 1n1m s PHE 524 N -0.06 2.44 0.57 1.78 0.40 -0.39 -4.96 117.98 117.76 1n1m s PHE 524 Ca 0.02 -1.03 -0.15 0.00 -0.60 0.00 0.00 56.93 55.18 1n1m s PHE 524 Cb -0.13 -1.65 -0.05 0.00 0.51 0.00 0.00 43.02 41.70 1n1m s PHE 524 CO 0.02 -0.43 1.03 -1.58 0.70 0.00 0.00 175.22 174.96 1n1m s TRP 525 N 0.45 3.26 0.12 0.36 0.52 -1.26 -1.96 118.94 120.43 1n1m s TRP 525 Ca -0.17 1.46 -0.15 0.00 0.02 0.00 0.00 56.10 57.26 1n1m s TRP 525 Cb -0.17 -2.87 0.03 0.00 -1.15 0.00 0.00 33.47 29.30 1n1m s TRP 525 CO 0.07 -0.78 0.36 1.52 0.02 0.00 0.00 176.95 178.15 1n1m s TYR 526 N -2.67 -0.15 0.14 -1.98 -0.85 0.39 -2.01 117.35 110.22 1n1m s TYR 526 Ca 0.60 -0.19 0.05 0.00 -0.52 0.00 0.00 57.07 57.01 1n1m s TYR 526 Cb -0.13 0.20 -0.04 0.00 0.38 0.00 0.00 41.96 42.37 1n1m s TYR 526 CO 0.38 -0.67 -0.11 1.14 -1.52 0.00 0.00 175.55 174.77 1n1m s GLN 527 N -3.79 1.03 -0.14 -3.49 -2.07 -0.55 -1.45 119.66 109.21 1n1m s GLN 527 Ca 0.03 -1.38 -0.04 0.00 -1.82 0.00 0.00 55.36 52.15 1n1m s GLN 527 Cb 0.02 -0.67 0.07 0.00 -1.09 0.00 0.00 33.01 31.34 1n1m s GLN 527 CO -0.12 0.09 0.18 -1.64 -1.32 0.00 0.00 175.29 172.48 1n1m s MET 528 N -3.46 0.10 -0.45 9.60 -1.94 -0.27 -1.85 119.30 121.04 1n1m s MET 528 Ca 0.14 0.35 -0.29 0.00 -1.71 0.00 0.00 55.69 54.18 1n1m s MET 528 Cb 0.01 -0.83 0.03 0.00 2.01 0.00 0.00 34.83 36.04 1n1m s MET 528 CO 0.01 -0.49 1.15 0.42 -0.01 0.00 0.00 175.02 176.10 1n1m s ILE 529 N 2.29 4.23 -0.10 2.53 -1.09 0.34 -1.61 121.20 127.79 1n1m s ILE 529 Ca 0.04 1.28 -0.09 0.00 -2.23 0.00 0.00 60.65 59.66 1n1m s ILE 529 Cb -0.14 -4.56 -0.04 0.00 -1.58 0.00 0.00 42.46 36.14 1n1m s ILE 529 CO -0.09 -0.92 0.20 -0.76 -1.23 0.00 0.00 174.94 172.14 1n1m s LEU 530 N 4.39 4.40 0.60 2.97 1.43 0.77 -2.71 118.68 130.52 1n1m s LEU 530 Ca 0.48 0.56 -0.19 0.00 -1.03 0.00 0.00 54.13 53.95 1n1m s LEU 530 Cb -0.08 -2.18 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 1n1m s LEU 530 CO 0.29 0.38 1.29 -2.84 0.23 0.00 0.00 176.35 175.70 1n1m s PRO 531 N -0.94 2.86 0.41 1.29 0.02 -1.26 -1.09 135.00 136.29 1n1m s PRO 531 Ca 0.16 2.05 -0.24 0.00 0.02 0.00 0.00 61.00 62.99 1n1m s PRO 531 Cb -0.13 -2.00 -0.12 0.00 0.02 0.00 0.00 34.50 32.28 1n1m s PRO 531 CO 0.06 -1.36 0.85 -2.30 -0.33 0.00 0.00 177.00 173.92 1n1m n PRO 532 N -1.53 1.05 -3.78 5.54 -0.02 -1.26 -1.91 135.00 133.09 1n1m n PRO 532 Ca 0.13 0.38 -0.28 0.00 -2.02 0.00 0.00 63.50 61.71 1n1m n PRO 532 Cb 0.48 -1.82 0.05 0.00 -0.02 0.00 0.00 33.50 32.18 1n1m n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1n1m n HIS 533 N -0.56 -2.53 -1.64 6.00 8.25 -1.26 -4.86 115.22 118.61 1n1m n HIS 533 Ca 0.10 0.94 -0.48 0.00 -0.26 0.00 0.00 57.72 58.02 1n1m n HIS 533 Cb 0.38 -4.40 -0.05 0.00 1.12 0.00 0.00 29.99 27.05 1n1m n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1n1m n PHE 534 N -4.81 1.99 -4.04 4.41 7.35 -0.80 -4.97 117.46 116.59 1n1m n PHE 534 Ca 0.03 0.41 -0.32 0.00 -0.76 0.00 0.00 57.45 56.80 1n1m n PHE 534 Cb 0.54 -2.46 -0.15 0.00 0.35 0.00 0.00 39.48 37.76 1n1m n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1n1m s ASP 535 N 0.78 4.55 0.00 -2.13 2.15 -1.26 -4.98 116.67 115.78 1n1m s ASP 535 Ca 0.81 -1.52 0.00 0.00 0.43 0.00 0.00 52.55 52.27 1n1m s ASP 535 Cb -0.78 -1.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.26 1n1m s ASP 535 CO 0.41 -0.23 0.89 2.29 -0.17 0.00 0.00 175.17 178.36 1n1m n LYS 536 N 4.42 0.00 0.01 4.34 2.85 -1.26 -1.01 118.16 127.50 1n1m n LYS 536 Ca -0.11 0.39 -0.14 0.00 -1.05 0.00 0.00 58.31 57.41 1n1m n LYS 536 Cb 0.42 -1.60 -0.14 0.00 -0.65 0.00 0.00 35.03 33.07 1n1m n LYS 536 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1n1m h SER 537 N 0.00 0.20 -4.42 -5.58 0.87 -1.93 -3.37 113.55 99.31 1n1m h SER 537 Ca 0.00 -0.39 -0.49 0.00 -1.23 0.00 0.00 61.79 59.67 1n1m h SER 537 Cb 0.19 -0.06 0.09 0.00 -0.44 0.00 0.00 62.40 62.17 1n1m h SER 537 CO 0.00 1.35 0.40 -0.75 -0.53 0.00 0.00 176.83 177.29 1n1m s LYS 538 N -2.59 2.74 -0.14 2.24 2.20 -0.18 -4.91 119.74 119.10 1n1m s LYS 538 Ca -0.11 0.55 -0.02 0.00 -0.36 0.00 0.00 55.97 56.04 1n1m s LYS 538 Cb 0.07 -2.00 -0.02 0.00 -1.51 0.00 0.00 37.83 34.37 1n1m s LYS 538 CO 0.81 -1.14 -0.09 0.15 -0.36 0.00 0.00 175.35 174.72 1n1m s LYS 539 N -5.28 3.50 0.06 4.03 1.02 -1.26 -4.23 119.74 117.57 1n1m s LYS 539 Ca 0.58 -0.62 0.09 0.00 0.02 0.00 0.00 55.97 56.04 1n1m s LYS 539 Cb -0.12 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.41 1n1m s LYS 539 CO 0.53 0.22 -0.23 0.71 -0.92 0.00 0.00 175.35 175.66 1n1m s TYR 540 N 0.37 2.43 0.56 3.18 1.51 0.34 -4.72 117.35 121.01 1n1m s TYR 540 Ca -0.08 -0.34 -0.18 0.00 -1.01 0.00 0.00 57.07 55.46 1n1m s TYR 540 Cb -0.15 -1.40 -0.05 0.00 -0.11 0.00 0.00 41.96 40.25 1n1m s TYR 540 CO 0.04 0.22 1.09 -1.25 -1.11 0.00 0.00 175.55 174.55 1n1m s PRO 541 N -1.48 3.36 -0.03 -1.71 0.04 -1.26 -0.50 135.00 133.42 1n1m s PRO 541 Ca 0.14 1.45 0.05 0.00 0.04 0.00 0.00 61.00 62.67 1n1m s PRO 541 Cb -0.10 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.41 1n1m s PRO 541 CO 0.04 -0.81 -0.17 -1.17 0.04 0.00 0.00 177.00 174.94 1n1m s LEU 542 N -4.02 1.96 -0.21 -3.56 0.20 0.81 -2.13 118.68 111.73 1n1m s LEU 542 Ca 0.69 -0.33 -0.02 0.00 0.69 0.00 0.00 54.13 55.16 1n1m s LEU 542 Cb -0.20 -0.92 0.01 0.00 -0.43 0.00 0.00 46.19 44.64 1n1m s LEU 542 CO 0.29 0.17 -0.10 -0.22 -0.29 0.00 0.00 176.35 176.21 1n1m s LEU 543 N -0.13 2.69 -0.53 -0.68 0.20 0.56 0.86 118.68 121.65 1n1m s LEU 543 Ca 0.00 -0.55 -0.23 0.00 0.69 0.00 0.00 54.13 54.04 1n1m s LEU 543 Cb -0.09 -1.64 0.04 0.00 -0.43 0.00 0.00 46.19 44.07 1n1m s LEU 543 CO 0.01 -0.03 0.87 -0.22 -0.29 0.00 0.00 176.35 176.69 1n1m s LEU 544 N 1.39 4.27 -0.36 -0.68 2.96 0.12 -1.53 118.68 124.85 1n1m s LEU 544 Ca 0.05 -0.42 -0.24 0.00 -0.22 0.00 0.00 54.13 53.30 1n1m s LEU 544 Cb -0.14 -2.78 0.01 0.00 0.50 0.00 0.00 46.19 43.78 1n1m s LEU 544 CO -0.07 -1.13 0.82 -0.62 -1.32 0.00 0.00 176.35 174.03 1n1m s ASP 545 N 2.72 6.59 0.12 3.68 -1.08 0.73 -1.97 116.67 127.47 1n1m s ASP 545 Ca 0.28 0.42 0.08 0.00 -0.52 0.00 0.00 52.55 52.81 1n1m s ASP 545 Cb -0.14 -2.41 -0.04 0.00 -1.46 0.00 0.00 42.92 38.87 1n1m s ASP 545 CO 0.18 -0.76 -0.18 0.54 0.52 0.00 0.00 175.17 175.47 1n1m s VAL 546 N 3.18 1.61 0.00 1.11 0.11 -0.74 -4.18 120.40 121.50 1n1m s VAL 546 Ca 0.33 -1.65 0.00 0.00 -2.93 0.00 0.00 61.98 57.73 1n1m s VAL 546 Cb -0.13 -1.57 0.00 0.00 -1.53 0.00 0.00 36.38 33.15 1n1m s VAL 546 CO 0.17 -0.20 0.00 0.00 -3.33 0.00 0.00 175.10 171.74 1n1m n TYR 547 N 0.80 0.00 -2.80 1.54 9.36 -1.26 -4.09 117.16 120.71 1n1m n TYR 547 Ca -0.17 0.00 -0.21 0.00 3.32 0.00 0.00 57.90 60.84 1n1m n TYR 547 Cb 0.55 0.26 0.01 0.00 -0.63 0.00 0.00 39.34 39.53 1n1m n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1n1m n ALA 548 N -2.05 -0.85 -1.63 2.98 0.00 -1.26 -3.42 120.51 114.26 1n1m n ALA 548 Ca 0.00 0.20 -0.30 0.00 0.00 0.00 0.00 53.44 53.34 1n1m n ALA 548 Cb 0.00 -2.90 0.07 0.00 0.00 0.00 0.00 19.45 16.62 1n1m n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1n1m s GLY 549 N -2.41 1.63 0.18 0.00 0.00 -1.26 -4.88 107.32 100.58 1n1m s GLY 549 Ca 0.18 -0.17 -0.33 0.00 0.00 0.00 0.00 44.72 44.40 1n1m s GLY 549 CO 0.22 0.21 1.65 -1.55 0.00 0.00 0.00 173.10 173.64 1n1m n PRO 550 N -3.27 2.45 -2.80 2.90 -0.04 -1.26 -2.63 135.00 130.35 1n1m n PRO 550 Ca 0.07 0.88 -0.02 0.00 -0.04 0.00 0.00 63.50 64.39 1n1m n PRO 550 Cb 0.56 -2.69 0.01 0.00 -0.04 0.00 0.00 33.50 31.34 1n1m n PRO 550 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n1m s SER 552 N -2.91 0.82 -0.21 0.00 1.04 -1.08 -4.69 113.70 106.67 1n1m s SER 552 Ca 0.07 -1.18 -0.04 0.00 0.48 0.00 0.00 55.95 55.28 1n1m s SER 552 Cb -0.01 0.19 0.11 0.00 0.10 0.00 0.00 66.02 66.41 1n1m s SER 552 CO 0.61 -0.64 0.34 -1.58 0.98 0.00 0.00 173.24 172.96 1n1m s GLN 553 N -3.97 0.29 0.00 4.02 0.74 -1.26 -1.59 119.66 117.89 1n1m s GLN 553 Ca 0.24 0.60 0.12 0.00 0.05 0.00 0.00 55.36 56.37 1n1m s GLN 553 Cb 0.07 -0.39 0.17 0.00 1.10 0.00 0.00 33.01 33.96 1n1m s GLN 553 CO 0.03 -0.52 1.01 1.63 -0.55 0.00 0.00 175.29 176.89 1n1m n LYS 554 N 5.36 1.37 -3.96 1.67 4.76 -1.26 -4.84 118.16 121.25 1n1m n LYS 554 Ca -0.05 -1.51 -0.31 0.00 -2.87 0.00 0.00 58.31 53.58 1n1m n LYS 554 Cb 0.50 -1.26 -0.15 0.00 -1.84 0.00 0.00 35.03 32.28 1n1m n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1n1m s ALA 555 N -1.03 2.17 0.00 7.82 0.00 -1.26 -4.71 121.76 124.74 1n1m s ALA 555 Ca 0.18 -1.61 0.00 0.00 0.00 0.00 0.00 51.96 50.53 1n1m s ALA 555 Cb 0.11 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.69 1n1m s ALA 555 CO 0.16 -1.29 0.00 -0.40 0.00 0.00 0.00 175.76 174.24 1n1m n ASP 556 N 4.58 0.00 -0.86 0.00 5.68 -1.26 -4.49 116.55 120.20 1n1m n ASP 556 Ca -0.10 -0.92 0.07 0.00 -0.50 0.00 0.00 54.79 53.35 1n1m n ASP 556 Cb 0.43 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.62 1n1m n ASP 556 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1n1m n THR 557 N 0.00 1.18 -2.20 2.12 -2.24 -1.06 -4.90 114.28 107.18 1n1m n THR 557 Ca 0.00 -1.10 -0.38 0.00 -2.27 0.00 0.00 64.05 60.30 1n1m n THR 557 Cb 0.00 0.40 -0.01 0.00 -2.10 0.00 0.00 70.33 68.62 1n1m n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1n1m s VAL 558 N -1.23 2.97 -0.21 2.28 1.01 -1.26 -1.94 120.40 122.01 1n1m s VAL 558 Ca 0.32 0.77 -0.15 0.00 0.00 0.00 0.00 61.98 62.92 1n1m s VAL 558 Cb 0.18 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1n1m s VAL 558 CO 0.19 0.03 0.36 0.12 0.00 0.00 0.00 175.10 175.80 1n1m s PHE 559 N -1.46 3.36 0.10 5.22 5.36 0.17 -4.88 117.98 125.85 1n1m s PHE 559 Ca 0.62 0.54 0.05 0.00 -0.96 0.00 0.00 56.93 57.18 1n1m s PHE 559 Cb -0.31 -2.49 -0.03 0.00 -0.34 0.00 0.00 43.02 39.84 1n1m s PHE 559 CO 0.38 -0.01 -0.14 1.03 -1.46 0.00 0.00 175.22 175.02 1n1m s ARG 560 N 1.33 0.92 -0.30 10.12 0.52 -1.26 -4.89 118.95 125.39 1n1m s ARG 560 Ca 0.17 -1.12 0.02 0.00 -0.52 0.00 0.00 55.73 54.28 1n1m s ARG 560 Cb -0.15 -0.83 0.09 0.00 0.52 0.00 0.00 34.95 34.58 1n1m s ARG 560 CO 0.08 0.17 0.01 -0.51 0.02 0.00 0.00 175.30 175.06 1n1m s LEU 561 N -2.18 3.75 0.00 2.53 1.02 -1.26 -4.89 118.68 117.65 1n1m s LEU 561 Ca 0.04 -1.77 0.00 0.00 0.02 0.00 0.00 54.13 52.42 1n1m s LEU 561 Cb -0.07 -1.41 0.00 0.00 0.02 0.00 0.00 46.19 44.73 1n1m s LEU 561 CO 0.02 -0.33 0.00 -0.46 0.02 0.00 0.00 176.35 175.61 1n1m n ASN 562 N 4.45 0.00 -0.17 2.29 0.23 -1.26 -5.00 115.26 115.80 1n1m n ASN 562 Ca -0.03 -0.75 -0.02 0.00 -0.53 0.00 0.00 54.58 53.26 1n1m n ASN 562 Cb 0.42 0.00 0.08 0.00 -2.08 0.00 0.00 39.78 38.20 1n1m n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 1n1m h TRP 563 N 0.75 0.22 -0.94 -2.53 7.01 -1.98 -0.44 115.95 118.03 1n1m h TRP 563 Ca 0.00 0.03 0.17 0.00 2.11 0.00 0.00 58.89 61.20 1n1m h TRP 563 Cb 0.00 -0.02 -0.08 0.00 -2.10 0.00 0.00 29.16 26.96 1n1m h TRP 563 CO 0.00 0.02 0.60 0.00 -2.79 0.00 0.00 178.44 176.27 1n1m h ALA 564 N 1.40 1.84 -0.18 2.65 0.00 -1.99 -0.39 119.26 122.59 1n1m h ALA 564 Ca 0.27 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.25 1n1m h ALA 564 Cb 0.36 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1n1m h ALA 564 CO -0.33 -0.13 -0.04 1.15 0.00 0.00 0.00 179.25 179.90 1n1m h THR 565 N 0.68 0.82 -0.15 0.00 2.02 -1.42 -2.44 112.91 112.42 1n1m h THR 565 Ca 0.50 -0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.67 1n1m h THR 565 Cb 0.85 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1n1m h THR 565 CO -0.26 0.00 0.08 0.22 0.37 0.00 0.00 175.52 175.94 1n1m h TYR 566 N 0.01 0.21 -0.93 3.16 3.20 -0.98 0.41 116.97 122.05 1n1m h TYR 566 Ca 0.09 -0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.10 1n1m h TYR 566 Cb 0.13 -0.07 -0.08 0.00 1.54 0.00 0.00 36.73 38.26 1n1m h TYR 566 CO -0.20 0.23 0.60 -0.07 -1.64 0.00 0.00 178.16 177.07 1n1m h LEU 567 N 0.14 0.73 0.08 2.82 3.38 -1.14 0.31 115.31 121.63 1n1m h LEU 567 Ca 0.05 0.05 -0.22 0.00 0.09 0.00 0.00 57.88 57.85 1n1m h LEU 567 Cb 0.09 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1n1m h LEU 567 CO -0.01 0.36 -1.13 0.00 0.09 0.00 0.00 178.44 177.75 1n1m h ALA 568 N 1.59 0.15 0.50 1.53 0.00 -1.33 0.11 119.26 121.80 1n1m h ALA 568 Ca 0.48 -1.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 1n1m h ALA 568 Cb 0.71 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1n1m h ALA 568 CO -0.24 0.65 -0.24 1.03 0.00 0.00 0.00 179.25 180.45 1n1m h SER 569 N -0.56 -0.56 0.13 0.00 0.87 -0.67 -2.07 113.55 110.69 1n1m h SER 569 Ca -0.26 -0.06 -0.31 0.00 -1.23 0.00 0.00 61.79 59.94 1n1m h SER 569 Cb 1.54 0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 63.65 1n1m h SER 569 CO 0.00 -0.27 -1.57 0.74 -0.53 0.00 0.00 176.83 175.20 1n1m h THR 570 N -0.86 0.95 -0.48 2.23 2.02 -0.47 -3.38 112.91 112.92 1n1m h THR 570 Ca -0.07 -2.41 0.00 0.00 0.77 0.00 0.00 66.41 64.70 1n1m h THR 570 Cb 0.59 2.68 0.00 0.00 -1.74 0.00 0.00 68.15 69.68 1n1m h THR 570 CO 0.11 0.76 0.00 -0.62 0.37 0.00 0.00 175.52 176.14 1n1m n GLU 571 N -3.80 2.40 -4.14 6.66 -0.58 -0.95 -4.97 120.64 115.27 1n1m n GLU 571 Ca -0.26 -2.14 -0.30 0.00 -0.42 0.00 0.00 57.16 54.03 1n1m n GLU 571 Cb 0.96 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 30.29 1n1m n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1n1m n ASN 572 N 1.29 -0.76 -4.54 1.62 5.03 -0.72 -4.85 115.26 112.34 1n1m n ASN 572 Ca 0.20 -1.09 -0.34 0.00 0.87 0.00 0.00 54.58 54.22 1n1m n ASN 572 Cb 0.54 -2.54 -0.12 0.00 -1.02 0.00 0.00 39.78 36.64 1n1m n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1n1m s ILE 573 N -3.87 3.66 -0.23 2.41 1.01 0.29 -4.55 121.20 119.93 1n1m s ILE 573 Ca 0.22 -0.48 -0.25 0.00 0.00 0.00 0.00 60.65 60.14 1n1m s ILE 573 Cb -0.12 -2.52 -0.01 0.00 0.01 0.00 0.00 42.46 39.82 1n1m s ILE 573 CO 0.93 0.57 0.85 -0.63 0.00 0.00 0.00 174.94 176.66 1n1m s ILE 574 N -0.45 4.83 -0.30 2.92 1.01 -0.91 -3.32 121.20 124.99 1n1m s ILE 574 Ca 0.07 1.63 -0.08 0.00 0.00 0.00 0.00 60.65 62.26 1n1m s ILE 574 Cb -0.12 -4.14 -0.00 0.00 0.01 0.00 0.00 42.46 38.20 1n1m s ILE 574 CO 0.02 -0.06 0.12 -0.69 0.00 0.00 0.00 174.94 174.33 1n1m s VAL 575 N 2.73 4.36 0.10 2.92 1.01 -1.10 -0.32 120.40 130.10 1n1m s VAL 575 Ca 0.36 -0.48 0.10 0.00 0.00 0.00 0.00 61.98 61.97 1n1m s VAL 575 Cb -0.15 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1n1m s VAL 575 CO 0.08 0.11 -0.24 0.00 0.00 0.00 0.00 175.10 175.05 1n1m s ALA 576 N 1.58 2.43 0.05 5.51 0.00 -0.58 -0.50 121.76 130.24 1n1m s ALA 576 Ca 0.04 -1.37 0.05 0.00 0.00 0.00 0.00 51.96 50.67 1n1m s ALA 576 Cb -0.17 -0.49 -0.02 0.00 0.00 0.00 0.00 23.12 22.44 1n1m s ALA 576 CO 0.05 0.55 -0.13 -1.12 0.00 0.00 0.00 175.76 175.11 1n1m s SER 577 N -1.82 1.55 -0.02 0.00 0.01 -0.77 -0.19 113.70 112.46 1n1m s SER 577 Ca 0.14 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.90 1n1m s SER 577 Cb -0.10 -0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.08 1n1m s SER 577 CO 0.06 -0.03 0.02 0.12 0.41 0.00 0.00 173.24 173.83 1n1m s PHE 578 N -1.02 0.03 -0.38 2.43 5.36 -1.26 -1.48 117.98 121.67 1n1m s PHE 578 Ca -0.01 0.10 -0.13 0.00 -0.96 0.00 0.00 56.93 55.93 1n1m s PHE 578 Cb -0.09 -0.20 0.01 0.00 -0.34 0.00 0.00 43.02 42.41 1n1m s PHE 578 CO 0.01 -0.07 0.26 -0.51 -1.46 0.00 0.00 175.22 173.45 1n1m s ASP 579 N 0.87 5.98 0.00 6.13 1.01 -0.85 -4.85 116.67 124.96 1n1m s ASP 579 Ca -0.07 -0.77 0.00 0.00 0.71 0.00 0.00 52.55 52.42 1n1m s ASP 579 Cb -0.11 -2.12 0.00 0.00 1.01 0.00 0.00 42.92 41.71 1n1m s ASP 579 CO -0.02 -0.36 0.00 0.61 0.21 0.00 0.00 175.17 175.60 1n1m n GLY 580 N 5.10 5.78 3.56 0.21 0.00 -1.26 -4.19 105.19 114.39 1n1m n GLY 580 Ca -0.12 -1.98 -0.48 0.00 0.00 0.00 0.00 46.02 43.45 1n1m n GLY 580 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1m n ARG 581 N 0.00 1.07 0.00 1.61 3.00 -1.26 -0.47 116.66 120.60 1n1m n ARG 581 Ca 0.00 0.38 0.00 0.00 -0.01 0.00 0.00 57.85 58.22 1n1m n ARG 581 Cb 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 32.46 30.67 1n1m n ARG 581 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1n1m n GLY 582 N 1.77 2.88 3.65 -0.13 0.00 -0.13 -4.10 105.19 109.12 1n1m n GLY 582 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1n1m n GLY 582 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1n1m n SER 583 N 0.00 0.15 -4.80 1.61 2.88 0.38 0.42 113.62 114.25 1n1m n SER 583 Ca 0.00 0.37 -0.29 0.00 -1.33 0.00 0.00 58.87 57.63 1n1m n SER 583 Cb 0.00 -1.46 -0.05 0.00 -0.75 0.00 0.00 64.21 61.95 1n1m n SER 583 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1n1m s GLY 584 N -2.61 2.64 -1.38 0.46 0.00 -0.62 -2.86 107.32 102.95 1n1m s GLY 584 Ca 0.67 -1.13 0.00 0.00 0.00 0.00 0.00 44.72 44.26 1n1m s GLY 584 CO 0.59 -2.05 0.00 -1.72 0.00 0.00 0.00 173.10 169.92 1n1m n TYR 585 N -1.41 -0.35 -1.40 1.90 4.01 -1.26 -4.83 117.16 113.83 1n1m n TYR 585 Ca -0.09 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.66 1n1m n TYR 585 Cb 0.66 -2.81 0.02 0.00 -0.31 0.00 0.00 39.34 36.89 1n1m n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1n1m n GLN 586 N -2.48 0.43 0.00 -0.72 6.02 -1.26 -4.51 117.38 114.86 1n1m n GLN 586 Ca -0.16 -1.11 0.00 0.00 -0.01 0.00 0.00 57.00 55.72 1n1m n GLN 586 Cb 0.55 -0.68 0.00 0.00 1.02 0.00 0.00 30.24 31.13 1n1m n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1n1m n GLY 587 N -0.24 1.35 0.26 1.08 0.00 -1.26 -4.58 105.19 101.79 1n1m n GLY 587 Ca 0.02 -1.83 0.15 0.00 0.00 0.00 0.00 46.02 44.37 1n1m n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1n1m h ASP 588 N 0.00 0.00 -0.85 1.61 5.19 -0.47 -2.43 116.42 119.46 1n1m h ASP 588 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1n1m h ASP 588 Cb 0.00 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.47 1n1m h ASP 588 CO 0.00 0.07 0.48 0.50 -3.12 0.00 0.00 179.24 177.18 1n1m h LYS 589 N 0.00 1.18 0.06 3.56 3.64 -1.85 0.48 116.57 123.64 1n1m h LYS 589 Ca -0.00 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1n1m h LYS 589 Cb 0.53 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1n1m h LYS 589 CO 0.01 0.85 -0.03 0.82 -2.27 0.00 0.00 179.45 178.84 1n1m h ILE 590 N 1.19 0.00 0.01 2.00 1.08 -1.78 -3.25 117.51 116.76 1n1m h ILE 590 Ca 0.30 -0.87 0.03 0.00 -0.39 0.00 0.00 64.86 63.93 1n1m h ILE 590 Cb 0.00 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 33.70 1n1m h ILE 590 CO -0.05 0.00 -0.36 -0.03 -0.69 0.00 0.00 178.15 177.02 1n1m h MET 591 N -0.95 -0.50 0.00 2.37 4.05 -1.29 -0.06 114.93 118.54 1n1m h MET 591 Ca -0.01 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 1n1m h MET 591 Cb 0.06 0.11 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 1n1m h MET 591 CO 0.01 -0.34 0.00 0.72 0.23 0.00 0.00 176.91 177.54 1n1m n HIS 592 N -5.43 0.00 -0.15 1.39 8.25 0.17 -3.66 115.22 115.78 1n1m n HIS 592 Ca -0.05 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.57 1n1m n HIS 592 Cb 0.35 -0.04 0.53 0.00 1.12 0.00 0.00 29.99 31.95 1n1m n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1n1m h ALA 593 N 3.06 2.18 -0.56 -1.41 0.00 -1.34 -1.46 119.26 119.74 1n1m h ALA 593 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1n1m h ALA 593 Cb 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1n1m h ALA 593 CO 0.00 -0.38 0.00 0.44 0.00 0.00 0.00 179.25 179.31 1n1m n ILE 594 N -4.46 2.20 -1.78 0.00 -5.35 -1.24 -4.92 119.36 103.80 1n1m n ILE 594 Ca 0.14 -1.20 -0.42 0.00 -0.27 0.00 0.00 62.75 61.00 1n1m n ILE 594 Cb 0.56 -0.15 -0.02 0.00 -1.74 0.00 0.00 39.64 38.29 1n1m n ILE 594 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1n1m s ASN 595 N -0.76 6.39 -1.19 7.28 3.04 -0.55 -1.35 114.94 127.80 1n1m s ASN 595 Ca 0.49 2.91 0.00 0.00 0.04 0.00 0.00 52.86 56.29 1n1m s ASN 595 Cb 0.35 -2.62 0.00 0.00 -1.54 0.00 0.00 41.25 37.44 1n1m s ASN 595 CO 0.18 -0.92 0.00 0.54 -3.04 0.00 0.00 177.10 173.86 1n1m n ARG 596 N 2.72 -1.64 -2.74 0.43 1.74 0.51 -4.81 116.66 112.87 1n1m n ARG 596 Ca 0.10 0.83 -0.09 0.00 -0.77 0.00 0.00 57.85 57.92 1n1m n ARG 596 Cb 0.37 -5.14 0.06 0.00 -1.02 0.00 0.00 32.46 26.72 1n1m n ARG 596 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1n1m n ARG 597 N -1.00 1.13 -2.03 5.56 3.00 -0.46 -4.94 116.66 117.92 1n1m n ARG 597 Ca -0.11 -2.68 -0.37 0.00 -0.00 0.00 0.00 57.85 54.69 1n1m n ARG 597 Cb 0.54 -0.88 0.02 0.00 0.00 0.00 0.00 32.46 32.14 1n1m n ARG 597 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1n1m s LEU 598 N -2.99 3.83 -0.35 6.15 1.43 -1.21 -3.60 118.68 121.94 1n1m s LEU 598 Ca 0.26 2.46 -0.01 0.00 -1.03 0.00 0.00 54.13 55.82 1n1m s LEU 598 Cb 0.41 -4.39 0.00 0.00 0.03 0.00 0.00 46.19 42.24 1n1m s LEU 598 CO -0.03 -1.36 0.15 0.61 0.23 0.00 0.00 176.35 175.95 1n1m n GLY 599 N 0.54 0.43 0.00 -3.19 0.00 -1.26 -4.86 105.19 96.85 1n1m n GLY 599 Ca 0.11 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1n1m n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n1m n THR 600 N -3.47 0.00 -0.22 2.61 -2.24 -1.24 -4.84 114.28 104.88 1n1m n THR 600 Ca -0.02 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.74 1n1m n THR 600 Cb 0.53 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.85 1n1m n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1n1m h PHE 601 N 0.00 0.62 -0.75 4.78 0.04 -1.94 0.82 116.94 120.52 1n1m h PHE 601 Ca 0.00 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1n1m h PHE 601 Cb 0.00 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 37.93 1n1m h PHE 601 CO 0.00 0.28 0.43 1.05 -0.60 0.00 0.00 178.31 179.47 1n1m h GLU 602 N 0.63 1.02 -0.12 1.51 9.09 -1.92 0.45 114.58 125.24 1n1m h GLU 602 Ca 0.29 -0.10 -0.13 0.00 0.05 0.00 0.00 59.36 59.48 1n1m h GLU 602 Cb 0.21 -0.21 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 1n1m h GLU 602 CO -0.20 0.74 -0.42 -0.24 0.05 0.00 0.00 179.01 178.94 1n1m h VAL 603 N 1.04 1.37 -0.46 -1.06 3.04 -1.75 -2.77 116.25 115.65 1n1m h VAL 603 Ca 0.27 -1.73 -0.01 0.00 -1.01 0.00 0.00 66.70 64.21 1n1m h VAL 603 Cb -0.01 2.13 -0.02 0.00 -2.01 0.00 0.00 31.29 31.38 1n1m h VAL 603 CO -0.05 0.52 0.23 -0.33 -1.01 0.00 0.00 177.57 176.93 1n1m h GLU 604 N 0.09 0.66 -0.27 4.17 5.08 -0.38 -2.15 114.58 121.78 1n1m h GLU 604 Ca -0.02 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1n1m h GLU 604 Cb 1.05 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1n1m h GLU 604 CO 0.09 0.55 0.07 -0.44 -1.00 0.00 0.00 179.01 178.28 1n1m h ASP 605 N 0.60 0.35 -0.67 1.42 3.32 -0.18 0.25 116.42 121.51 1n1m h ASP 605 Ca 0.16 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 1n1m h ASP 605 Cb 0.10 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1n1m h ASP 605 CO -0.02 0.36 0.11 -0.61 -1.72 0.00 0.00 179.24 177.35 1n1m h GLN 606 N 0.38 1.12 -0.08 3.56 5.75 -1.14 -0.39 115.11 124.31 1n1m h GLN 606 Ca 0.09 -0.30 -0.02 0.00 -0.15 0.00 0.00 58.65 58.28 1n1m h GLN 606 Cb 0.15 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.56 1n1m h GLN 606 CO -0.00 1.02 -0.03 0.82 -2.65 0.00 0.00 178.83 177.98 1n1m h ILE 607 N 1.04 1.31 -0.88 2.39 2.04 -0.61 -2.42 117.51 120.39 1n1m h ILE 607 Ca 0.21 -1.00 0.08 0.00 1.00 0.00 0.00 64.86 65.15 1n1m h ILE 607 Cb 0.44 1.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.26 1n1m h ILE 607 CO 0.01 0.28 0.53 -0.08 0.00 0.00 0.00 178.15 178.89 1n1m h GLU 608 N -0.19 0.89 0.69 2.37 4.22 -0.86 0.11 114.58 121.81 1n1m h GLU 608 Ca 0.02 -0.05 -0.03 0.00 0.08 0.00 0.00 59.36 59.37 1n1m h GLU 608 Cb 0.46 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1n1m h GLU 608 CO 0.01 0.59 -0.33 0.00 -2.18 0.00 0.00 179.01 177.10 1n1m h ALA 609 N 1.45 -0.93 -0.80 2.92 0.00 -1.02 -0.53 119.26 120.35 1n1m h ALA 609 Ca 0.41 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 55.22 1n1m h ALA 609 Cb 0.30 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 1n1m h ALA 609 CO -0.22 -0.95 0.52 0.00 0.00 0.00 0.00 179.25 178.60 1n1m h ALA 610 N -0.85 1.91 -0.83 0.00 0.00 -1.21 0.26 119.26 118.54 1n1m h ALA 610 Ca -0.09 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1n1m h ALA 610 Cb 0.74 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1n1m h ALA 610 CO 0.16 -0.10 0.38 -0.09 0.00 0.00 0.00 179.25 179.59 1n1m h ARG 611 N 0.60 1.20 -0.00 0.00 2.43 -0.47 -1.61 114.38 116.54 1n1m h ARG 611 Ca 0.38 -0.19 -0.19 0.00 -0.81 0.00 0.00 59.98 59.18 1n1m h ARG 611 Cb 0.65 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1n1m h ARG 611 CO -0.15 0.94 -0.84 1.96 -1.51 0.00 0.00 179.97 180.37 1n1m h GLN 612 N 1.18 0.14 -0.33 0.20 4.20 0.10 -3.13 115.11 117.48 1n1m h GLN 612 Ca 0.28 -0.15 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1n1m h GLN 612 Cb 0.15 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1n1m h GLN 612 CO -0.03 0.90 0.17 0.74 -0.67 0.00 0.00 178.83 179.94 1n1m h PHE 613 N 0.08 0.46 0.04 2.96 0.04 -0.28 -3.08 116.94 117.16 1n1m h PHE 613 Ca -0.03 -0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.74 1n1m h PHE 613 Cb 1.45 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 39.43 1n1m h PHE 613 CO 0.02 0.38 -0.19 0.66 -0.60 0.00 0.00 178.31 178.58 1n1m h SER 614 N 0.40 -0.55 0.00 2.17 4.64 -1.33 -1.85 113.55 117.03 1n1m h SER 614 Ca 0.11 0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.47 1n1m h SER 614 Cb 0.08 0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 1n1m h SER 614 CO -0.02 -0.26 0.01 0.29 -0.87 0.00 0.00 176.83 175.98 1n1m n LYS 615 N -5.32 0.71 -0.00 4.77 4.76 -1.16 -3.57 118.16 118.35 1n1m n LYS 615 Ca -0.06 -0.18 0.03 0.00 -2.87 0.00 0.00 58.31 55.23 1n1m n LYS 615 Cb 0.23 -1.42 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 1n1m n LYS 615 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1n1m n MET 616 N 2.08 2.61 0.00 1.97 2.81 -0.70 -5.00 117.12 120.89 1n1m n MET 616 Ca 0.08 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 1n1m n MET 616 Cb 0.34 -0.94 0.00 0.00 -0.71 0.00 0.00 33.22 31.91 1n1m n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n1m n GLY 617 N 1.69 3.10 0.94 3.03 0.00 -1.23 -4.79 105.19 107.93 1n1m n GLY 617 Ca -0.00 -0.96 0.11 0.00 0.00 0.00 0.00 46.02 45.17 1n1m n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1n1m n PHE 618 N 0.00 0.14 -3.67 1.61 1.16 -1.26 -4.62 117.46 110.82 1n1m n PHE 618 Ca 0.00 -0.08 -0.37 0.00 -1.87 0.00 0.00 57.45 55.13 1n1m n PHE 618 Cb 0.00 -0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 37.75 1n1m n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1n1m s VAL 619 N -1.71 4.82 -0.63 1.97 1.01 -1.26 0.13 120.40 124.73 1n1m s VAL 619 Ca 0.29 -0.01 -0.28 0.00 0.00 0.00 0.00 61.98 61.99 1n1m s VAL 619 Cb 0.19 -3.29 0.02 0.00 0.00 0.00 0.00 36.38 33.31 1n1m s VAL 619 CO 0.28 0.29 1.37 -0.62 0.00 0.00 0.00 175.10 176.42 1n1m s ASP 620 N 1.69 6.12 0.30 3.32 -1.08 0.35 -4.79 116.67 122.57 1n1m s ASP 620 Ca 0.07 0.02 0.21 0.00 -0.52 0.00 0.00 52.55 52.33 1n1m s ASP 620 Cb -0.16 -2.55 1.09 0.00 -1.46 0.00 0.00 42.92 39.84 1n1m s ASP 620 CO 0.07 -1.77 1.65 -0.46 0.52 0.00 0.00 175.17 175.18 1n1m n ASN 621 N 9.60 0.57 -0.07 -0.34 6.94 -1.26 -0.81 115.26 129.90 1n1m n ASN 621 Ca 0.09 0.73 0.14 0.00 -0.02 0.00 0.00 54.58 55.52 1n1m n ASN 621 Cb 0.49 -0.82 0.56 0.00 -2.36 0.00 0.00 39.78 37.66 1n1m n ASN 621 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1n1m n LYS 622 N -2.23 0.42 -3.20 -3.83 5.02 -1.26 -4.29 118.16 108.79 1n1m n LYS 622 Ca -0.01 -0.13 -0.23 0.00 -2.02 0.00 0.00 58.31 55.92 1n1m n LYS 622 Cb 0.08 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.54 1n1m n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1n1m n ARG 623 N -1.17 1.37 -4.49 1.97 1.74 0.01 -4.87 116.66 111.21 1n1m n ARG 623 Ca 0.11 -3.69 -0.33 0.00 -0.77 0.00 0.00 57.85 53.18 1n1m n ARG 623 Cb 0.30 -1.65 -0.16 0.00 -1.02 0.00 0.00 32.46 29.94 1n1m n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1n1m s ILE 624 N -2.15 2.52 0.47 0.55 1.01 -1.25 -0.13 121.20 122.21 1n1m s ILE 624 Ca 0.39 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 60.25 1n1m s ILE 624 Cb 0.24 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1n1m s ILE 624 CO -0.09 0.52 0.02 0.00 0.00 0.00 0.00 174.94 175.39 1n1m s ALA 625 N 0.89 3.71 -0.07 9.38 0.00 0.25 -1.82 121.76 134.10 1n1m s ALA 625 Ca -0.04 -1.02 -0.15 0.00 0.00 0.00 0.00 51.96 50.75 1n1m s ALA 625 Cb -0.15 0.14 0.03 0.00 0.00 0.00 0.00 23.12 23.14 1n1m s ALA 625 CO -0.02 -0.08 0.36 -1.50 0.00 0.00 0.00 175.76 174.52 1n1m s ILE 626 N -2.87 0.03 0.02 0.00 2.07 -0.91 0.11 121.20 119.64 1n1m s ILE 626 Ca 0.16 -0.23 -0.25 0.00 -1.41 0.00 0.00 60.65 58.92 1n1m s ILE 626 Cb 0.04 -0.59 0.06 0.00 0.13 0.00 0.00 42.46 42.10 1n1m s ILE 626 CO 0.08 -0.13 0.57 -1.66 -1.91 0.00 0.00 174.94 171.90 1n1m s TRP 627 N -0.61 -0.51 0.21 3.50 1.48 -0.83 -1.28 118.94 120.89 1n1m s TRP 627 Ca -0.07 0.69 -0.20 0.00 -1.06 0.00 0.00 56.10 55.46 1n1m s TRP 627 Cb -0.04 0.37 0.04 0.00 -1.16 0.00 0.00 33.47 32.68 1n1m s TRP 627 CO 0.03 -0.63 0.59 0.20 -4.06 0.00 0.00 176.95 173.08 1n1m s GLY 628 N -1.70 -0.23 0.03 3.67 0.00 -0.92 -1.80 107.32 106.37 1n1m s GLY 628 Ca -0.07 -0.05 0.06 0.00 0.00 0.00 0.00 44.72 44.66 1n1m s GLY 628 CO 0.02 -0.11 -0.19 0.86 0.00 0.00 0.00 173.10 173.68 1n1m s TRP 629 N -3.85 1.68 0.00 1.90 -0.11 -1.26 -1.80 118.94 115.51 1n1m s TRP 629 Ca 0.07 -0.35 0.00 0.00 1.22 0.00 0.00 56.10 57.04 1n1m s TRP 629 Cb -0.02 -1.02 0.00 0.00 -1.50 0.00 0.00 33.47 30.92 1n1m s TRP 629 CO -0.03 0.05 0.00 0.45 -4.62 0.00 0.00 176.95 172.80 1n1m n SER 630 N 2.08 0.00 0.19 5.86 2.88 0.18 -0.43 113.62 124.39 1n1m n SER 630 Ca -0.17 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.52 1n1m n SER 630 Cb 0.54 0.00 0.74 0.00 -0.75 0.00 0.00 64.21 64.74 1n1m n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1n1m h TYR 631 N 0.00 0.00 0.00 0.66 5.03 -1.87 0.79 116.97 121.58 1n1m h TYR 631 Ca 0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1n1m h TYR 631 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.28 1n1m h TYR 631 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 178.16 177.62 1n1m h GLY 632 N 0.00 0.00 1.06 1.82 0.00 -0.76 -1.39 103.07 103.79 1n1m h GLY 632 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.20 1n1m h GLY 632 CO -0.00 0.00 -0.79 -1.33 0.00 0.00 0.00 176.54 174.42 1n1m h GLY 633 N 2.99 0.71 0.98 4.60 0.00 0.66 -1.66 103.07 111.36 1n1m h GLY 633 Ca 0.00 -1.13 -0.04 0.00 0.00 0.00 0.00 47.33 46.16 1n1m h GLY 633 CO 0.00 1.00 -0.44 -1.82 0.00 0.00 0.00 176.54 175.28 1n1m h TYR 634 N 0.29 -1.16 -0.42 5.60 3.20 -1.01 0.95 116.97 124.42 1n1m h TYR 634 Ca -0.08 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 61.85 1n1m h TYR 634 Cb 1.45 0.39 -0.07 0.00 1.54 0.00 0.00 36.73 40.03 1n1m h TYR 634 CO 0.11 -0.71 -0.03 0.28 -1.64 0.00 0.00 178.16 176.17 1n1m h VAL 635 N -1.22 0.64 -0.49 1.81 2.07 -1.33 0.13 116.25 117.86 1n1m h VAL 635 Ca -0.12 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.45 1n1m h VAL 635 Cb 0.94 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.21 1n1m h VAL 635 CO 0.19 0.01 0.14 0.74 0.02 0.00 0.00 177.57 178.67 1n1m h THR 636 N 0.07 0.78 -0.78 2.57 2.02 -1.11 0.47 112.91 116.93 1n1m h THR 636 Ca 0.21 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.25 1n1m h THR 636 Cb 0.31 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1n1m h THR 636 CO -0.38 0.05 0.33 0.28 0.37 0.00 0.00 175.52 176.18 1n1m h SER 637 N 0.29 1.07 -0.28 4.18 0.02 0.63 -0.76 113.55 118.71 1n1m h SER 637 Ca 0.24 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 60.93 1n1m h SER 637 Cb 0.29 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1n1m h SER 637 CO -0.28 0.94 -0.16 0.24 -1.14 0.00 0.00 176.83 176.43 1n1m h MET 638 N 1.13 0.72 -0.19 3.45 2.86 -0.11 -2.19 114.93 120.60 1n1m h MET 638 Ca 0.26 -0.25 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 1n1m h MET 638 Cb 0.19 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1n1m h MET 638 CO -0.02 0.84 -0.07 0.28 1.06 0.00 0.00 176.91 178.99 1n1m h VAL 639 N 0.64 1.30 0.00 -2.22 2.07 -0.58 -1.92 116.25 115.55 1n1m h VAL 639 Ca 0.10 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 1n1m h VAL 639 Cb 0.63 1.63 -0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1n1m h VAL 639 CO 0.04 0.33 -0.05 -0.07 0.02 0.00 0.00 177.57 177.84 1n1m h LEU 640 N 0.08 0.00 -3.11 2.57 3.38 -1.03 -1.31 115.31 115.88 1n1m h LEU 640 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1n1m h LEU 640 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1n1m h LEU 640 CO 0.02 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.22 1n1m n GLY 641 N -0.91 3.00 0.10 0.83 0.00 -0.83 -4.39 105.19 102.99 1n1m n GLY 641 Ca -0.02 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 1n1m n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1n1m h SER 642 N 3.27 0.31 0.00 1.61 4.64 -0.42 -3.43 113.55 119.53 1n1m h SER 642 Ca 0.00 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1n1m h SER 642 Cb 1.31 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1n1m h SER 642 CO 0.19 1.22 0.00 0.61 -0.87 0.00 0.00 176.83 177.98 1n1m n GLY 643 N 1.36 0.74 0.26 -0.77 0.00 -1.26 -4.95 105.19 100.57 1n1m n GLY 643 Ca -0.06 -0.18 0.03 0.00 0.00 0.00 0.00 46.02 45.81 1n1m n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1n1m h SER 644 N 0.00 0.31 0.00 1.61 4.64 -1.91 -3.46 113.55 114.73 1n1m h SER 644 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1n1m h SER 644 Cb 0.00 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1n1m h SER 644 CO 0.00 0.36 0.00 0.61 -0.87 0.00 0.00 176.83 176.93 1n1m n GLY 645 N -1.09 0.52 0.09 -0.77 0.00 -1.26 -4.88 105.19 97.80 1n1m n GLY 645 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1n1m n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1n1m h VAL 646 N 0.00 1.59 -3.22 1.61 2.07 -1.96 -3.45 116.25 112.89 1n1m h VAL 646 Ca 0.00 -3.02 -0.65 0.00 0.82 0.00 0.00 66.70 63.86 1n1m h VAL 646 Cb 0.14 2.70 -0.15 0.00 -1.52 0.00 0.00 31.29 32.45 1n1m h VAL 646 CO 0.00 0.87 -0.59 -0.36 0.02 0.00 0.00 177.57 177.51 1n1m s PHE 647 N -2.92 3.23 0.01 1.57 0.40 -1.26 -4.64 117.98 114.37 1n1m s PHE 647 Ca -0.01 0.12 -0.16 0.00 -0.60 0.00 0.00 56.93 56.28 1n1m s PHE 647 Cb 0.10 -1.94 -0.35 0.00 0.51 0.00 0.00 43.02 41.33 1n1m s PHE 647 CO 0.83 0.31 0.95 -0.22 0.70 0.00 0.00 175.22 177.79 1n1m h LYS 648 N 5.94 0.51 -3.75 0.44 3.64 -1.67 -3.46 116.57 118.21 1n1m h LYS 648 Ca -0.43 -0.87 -0.08 0.00 -1.27 0.00 0.00 60.65 58.00 1n1m h LYS 648 Cb 1.19 0.32 -0.10 0.00 -0.41 0.00 0.00 32.23 33.23 1n1m h LYS 648 CO 0.62 1.42 -0.17 0.00 -2.27 0.00 0.00 179.45 179.05 1n1m s GLY 650 N -3.03 -0.44 -0.06 0.00 0.00 -0.24 -2.14 107.32 101.41 1n1m s GLY 650 Ca 0.24 1.36 0.04 0.00 0.00 0.00 0.00 44.72 46.36 1n1m s GLY 650 CO 0.09 0.67 -0.17 -0.42 0.00 0.00 0.00 173.10 173.28 1n1m s ILE 651 N -2.13 1.49 -0.16 0.90 1.01 -0.41 -1.25 121.20 120.65 1n1m s ILE 651 Ca -0.01 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.95 1n1m s ILE 651 Cb -0.01 -1.30 0.02 0.00 0.01 0.00 0.00 42.46 41.18 1n1m s ILE 651 CO -0.02 0.43 -0.20 0.00 0.00 0.00 0.00 174.94 175.15 1n1m s ALA 652 N 0.33 2.20 -0.18 9.38 0.00 -0.16 -2.17 121.76 131.16 1n1m s ALA 652 Ca -0.11 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 50.72 1n1m s ALA 652 Cb -0.15 -1.07 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 1n1m s ALA 652 CO 0.04 -0.21 -0.06 0.08 0.00 0.00 0.00 175.76 175.61 1n1m s VAL 653 N 1.10 3.44 -1.43 0.00 1.01 -0.74 -1.13 120.40 122.65 1n1m s VAL 653 Ca -0.01 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 1n1m s VAL 653 Cb -0.14 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.73 1n1m s VAL 653 CO -0.08 0.47 0.28 0.00 0.00 0.00 0.00 175.10 175.78 1n1m n ALA 654 N 4.12 -2.15 -1.88 5.51 0.00 0.46 -0.65 120.51 125.92 1n1m n ALA 654 Ca -0.18 -0.40 -0.29 0.00 0.00 0.00 0.00 53.44 52.57 1n1m n ALA 654 Cb 0.52 -1.51 0.07 0.00 0.00 0.00 0.00 19.45 18.53 1n1m n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1n1m s PRO 655 N -7.09 2.33 -0.02 0.00 0.04 -1.26 -3.31 135.00 125.69 1n1m s PRO 655 Ca 0.12 0.27 -0.14 0.00 0.04 0.00 0.00 61.00 61.29 1n1m s PRO 655 Cb -0.06 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 1n1m s PRO 655 CO 0.96 -1.37 0.37 0.08 0.04 0.00 0.00 177.00 177.07 1n1m s VAL 656 N -3.47 5.10 -0.07 -0.36 1.01 -1.26 -4.53 120.40 116.81 1n1m s VAL 656 Ca 0.60 0.75 0.02 0.00 0.00 0.00 0.00 61.98 63.35 1n1m s VAL 656 Cb -0.11 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.54 1n1m s VAL 656 CO 0.50 0.58 -0.04 -1.54 0.00 0.00 0.00 175.10 174.61 1n1m n SER 657 N 1.84 3.42 -3.69 3.32 3.41 -1.26 -4.33 113.62 116.32 1n1m n SER 657 Ca -0.15 -0.03 -0.12 0.00 -0.26 0.00 0.00 58.87 58.31 1n1m n SER 657 Cb 0.53 0.13 -0.12 0.00 -0.26 0.00 0.00 64.21 64.49 1n1m n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1m s ARG 658 N -2.15 0.23 0.57 4.33 1.70 -1.26 0.11 118.95 122.47 1n1m s ARG 658 Ca -0.08 0.73 0.32 0.00 -0.47 0.00 0.00 55.73 56.23 1n1m s ARG 658 Cb 0.02 -0.00 1.45 0.00 -0.57 0.00 0.00 34.95 35.85 1n1m s ARG 658 CO 0.20 -0.22 1.81 -1.49 -1.08 0.00 0.00 175.30 174.52 1n1m h TRP 659 N 7.75 0.00 0.00 5.89 4.06 -1.87 0.11 115.95 131.89 1n1m h TRP 659 Ca -0.26 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.69 1n1m h TRP 659 Cb 1.14 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 1n1m h TRP 659 CO 0.33 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.60 1n1m n GLU 660 N -3.93 0.09 0.05 0.49 1.02 -1.26 -1.67 120.64 115.43 1n1m n GLU 660 Ca 0.17 0.42 0.12 0.00 -0.02 0.00 0.00 57.16 57.85 1n1m n GLU 660 Cb 0.99 -1.71 0.15 0.00 -0.02 0.00 0.00 31.44 30.85 1n1m n GLU 660 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1n1m n TYR 661 N -1.89 0.47 -2.80 -0.32 4.01 0.38 -3.61 117.16 113.40 1n1m n TYR 661 Ca 0.02 0.14 -0.25 0.00 -0.16 0.00 0.00 57.90 57.64 1n1m n TYR 661 Cb 0.14 -0.59 0.01 0.00 -0.31 0.00 0.00 39.34 38.59 1n1m n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1n1m s TYR 662 N -3.16 3.31 0.79 -0.72 5.04 -0.67 -4.82 117.35 117.12 1n1m s TYR 662 Ca 0.06 0.45 -0.14 0.00 -2.44 0.00 0.00 57.07 55.00 1n1m s TYR 662 Cb 0.14 -2.40 0.08 0.00 0.35 0.00 0.00 41.96 40.13 1n1m s TYR 662 CO 0.73 -0.44 1.22 0.16 -1.34 0.00 0.00 175.55 175.88 1n1m s ASP 663 N -4.21 3.65 0.05 4.32 1.47 -1.26 -0.33 116.67 120.36 1n1m s ASP 663 Ca 0.49 2.40 -0.30 0.00 1.18 0.00 0.00 52.55 56.32 1n1m s ASP 663 Cb -0.10 -2.59 -0.18 0.00 -0.34 0.00 0.00 42.92 39.71 1n1m s ASP 663 CO 0.41 -2.63 1.47 0.77 0.68 0.00 0.00 175.17 175.87 1n1m h SER 664 N -0.78 -0.69 -0.51 2.11 4.64 -1.14 -2.70 113.55 114.47 1n1m h SER 664 Ca -0.47 -0.01 0.10 0.00 -0.47 0.00 0.00 61.79 60.94 1n1m h SER 664 Cb 1.30 0.18 -0.10 0.00 -0.31 0.00 0.00 62.40 63.47 1n1m h SER 664 CO 0.47 -0.42 -0.32 0.58 -0.87 0.00 0.00 176.83 176.26 1n1m h VAL 665 N -0.93 0.21 -0.10 0.95 2.07 -1.93 0.44 116.25 116.96 1n1m h VAL 665 Ca -0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 1n1m h VAL 665 Cb 0.67 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1n1m h VAL 665 CO 0.14 0.00 -0.09 0.22 0.02 0.00 0.00 177.57 177.86 1n1m h TYR 666 N -0.19 0.27 0.20 1.57 5.03 -1.93 -3.16 116.97 118.77 1n1m h TYR 666 Ca 0.21 -0.08 -0.01 0.00 2.58 0.00 0.00 58.73 61.43 1n1m h TYR 666 Cb 0.54 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.76 1n1m h TYR 666 CO -0.59 0.65 -0.10 1.15 -1.32 0.00 0.00 178.16 177.95 1n1m h THR 667 N -0.18 0.88 -0.06 1.81 2.02 -1.08 -3.04 112.91 113.26 1n1m h THR 667 Ca 0.02 -0.45 0.02 0.00 0.77 0.00 0.00 66.41 66.77 1n1m h THR 667 Cb 0.60 1.14 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1n1m h THR 667 CO 0.02 0.10 0.05 -0.33 0.37 0.00 0.00 175.52 175.73 1n1m h GLU 668 N -0.49 0.00 -0.84 6.66 5.08 -0.28 0.40 114.58 125.10 1n1m h GLU 668 Ca -0.03 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.42 1n1m h GLU 668 Cb 0.37 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 1n1m h GLU 668 CO 0.05 0.00 0.50 -0.09 -1.00 0.00 0.00 179.01 178.46 1n1m h ARG 669 N 0.00 0.83 0.00 2.33 2.43 -1.49 0.56 114.38 119.04 1n1m h ARG 669 Ca 0.03 -0.05 -0.25 0.00 -0.81 0.00 0.00 59.98 58.89 1n1m h ARG 669 Cb 0.12 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 29.43 1n1m h ARG 669 CO -0.00 0.55 -2.18 0.66 -1.51 0.00 0.00 179.97 177.49 1n1m n TYR 670 N -4.70 0.00 0.77 2.20 4.01 -0.92 -4.64 117.16 113.88 1n1m n TYR 670 Ca 0.13 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.95 1n1m n TYR 670 Cb 0.25 -0.80 -0.06 0.00 -0.31 0.00 0.00 39.34 38.42 1n1m n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1n1m n MET 671 N -2.56 1.60 0.00 -0.72 2.81 0.14 0.19 117.12 118.58 1n1m n MET 671 Ca -0.24 -0.29 0.00 0.00 -1.81 0.00 0.00 57.70 55.36 1n1m n MET 671 Cb 0.96 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 32.18 1n1m n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n1m n GLY 672 N 1.32 -0.42 3.87 3.03 0.00 0.19 -4.68 105.19 108.51 1n1m n GLY 672 Ca 0.04 -1.06 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 1n1m n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1m s LEU 673 N 0.00 4.07 -0.25 0.99 1.02 -1.26 -4.22 118.68 119.03 1n1m s LEU 673 Ca 0.00 1.08 -0.03 0.00 0.02 0.00 0.00 54.13 55.20 1n1m s LEU 673 Cb 0.00 -3.88 0.04 0.00 0.02 0.00 0.00 46.19 42.36 1n1m s LEU 673 CO 0.00 -0.18 2.58 -0.81 0.02 0.00 0.00 176.35 177.96 1n1m n PRO 674 N -0.46 1.92 -4.25 1.29 -0.04 -1.26 -1.92 135.00 130.28 1n1m n PRO 674 Ca 0.02 -1.47 -0.28 0.00 -0.04 0.00 0.00 63.50 61.73 1n1m n PRO 674 Cb 0.53 -1.77 -0.09 0.00 -0.04 0.00 0.00 33.50 32.12 1n1m n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1n1m s THR 675 N -1.28 3.32 0.53 0.52 -4.23 -1.26 -4.61 115.64 108.63 1n1m s THR 675 Ca 0.43 -1.46 0.18 0.00 -1.18 0.00 0.00 61.69 59.66 1n1m s THR 675 Cb 0.27 -2.61 0.28 0.00 1.34 0.00 0.00 72.50 71.78 1n1m s THR 675 CO -0.07 -0.01 2.17 1.55 -0.54 0.00 0.00 174.62 177.71 1n1m h PRO 676 N 3.20 0.00 0.00 3.99 0.13 -1.95 -0.72 132.00 136.65 1n1m h PRO 676 Ca -0.48 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.59 1n1m h PRO 676 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1n1m h PRO 676 CO 0.53 0.00 -0.31 0.93 -0.23 0.00 0.00 178.00 178.93 1n1m h GLU 677 N 0.00 0.00 0.00 0.86 3.07 -1.95 -3.43 114.58 113.13 1n1m h GLU 677 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n1m h GLU 677 Cb 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1n1m h GLU 677 CO 0.00 0.31 0.00 -3.47 -1.40 0.00 0.00 179.01 174.45 1n1m n ASP 678 N -3.43 0.00 -1.04 1.42 -0.08 -0.60 -5.00 116.55 107.81 1n1m n ASP 678 Ca 0.00 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.33 1n1m n ASP 678 Cb 0.49 0.00 0.12 0.00 2.34 0.00 0.00 41.12 44.07 1n1m n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1n1m n ASN 679 N 0.00 1.46 -0.20 1.67 4.05 -0.81 -4.86 115.26 116.57 1n1m n ASN 679 Ca 0.00 -3.06 -0.04 0.00 0.45 0.00 0.00 54.58 51.93 1n1m n ASN 679 Cb 0.00 -0.43 0.07 0.00 1.23 0.00 0.00 39.78 40.65 1n1m n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1n1m h LEU 680 N 1.05 0.50 -0.54 1.20 5.85 -1.25 -2.75 115.31 119.35 1n1m h LEU 680 Ca -0.09 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.76 1n1m h LEU 680 Cb 1.40 -0.08 -0.10 0.00 0.37 0.00 0.00 40.66 42.25 1n1m h LEU 680 CO 0.06 0.34 -0.09 0.44 -0.34 0.00 0.00 178.44 178.85 1n1m h ASP 681 N 0.63 -0.42 0.52 1.25 3.32 -1.89 -0.30 116.42 119.53 1n1m h ASP 681 Ca 0.25 0.15 -0.10 0.00 0.02 0.00 0.00 57.03 57.36 1n1m h ASP 681 Cb 0.11 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1n1m h ASP 681 CO -0.15 -0.15 -0.48 -0.74 -1.72 0.00 0.00 179.24 176.00 1n1m h HIS 682 N 0.04 0.00 -0.38 4.55 2.76 -1.89 0.11 115.15 120.33 1n1m h HIS 682 Ca 0.27 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.45 1n1m h HIS 682 Cb 0.42 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.35 1n1m h HIS 682 CO -0.41 0.48 0.24 1.88 -1.30 0.00 0.00 177.93 178.81 1n1m h TYR 683 N 0.00 0.45 -0.00 5.26 0.05 -0.82 -0.83 116.97 121.08 1n1m h TYR 683 Ca -0.00 0.01 -0.15 0.00 0.05 0.00 0.00 58.73 58.64 1n1m h TYR 683 Cb 0.87 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.44 1n1m h TYR 683 CO 0.00 0.27 -0.70 0.00 -1.05 0.00 0.00 178.16 176.69 1n1m h ARG 684 N 0.48 0.02 0.00 4.88 2.47 -0.83 -3.16 114.38 118.24 1n1m h ARG 684 Ca 0.14 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.85 1n1m h ARG 684 Cb -0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 1n1m h ARG 684 CO -0.05 0.71 -0.11 0.09 0.56 0.00 0.00 179.97 181.17 1n1m n ASN 685 N -3.72 0.17 -1.28 7.04 4.13 -0.01 -3.95 115.26 117.64 1n1m n ASN 685 Ca -0.01 0.35 0.04 0.00 1.68 0.00 0.00 54.58 56.64 1n1m n ASN 685 Cb 0.68 -0.36 0.28 0.00 -1.54 0.00 0.00 39.78 38.84 1n1m n ASN 685 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1n1m n SER 686 N -1.56 4.14 -4.88 6.41 3.41 -0.35 -5.00 113.62 115.79 1n1m n SER 686 Ca 0.07 -3.15 -0.30 0.00 -0.26 0.00 0.00 58.87 55.22 1n1m n SER 686 Cb 0.35 -0.62 -0.02 0.00 -0.26 0.00 0.00 64.21 63.66 1n1m n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1n1m s THR 687 N -2.92 4.77 0.07 6.66 -4.23 -1.25 -4.79 115.64 113.95 1n1m s THR 687 Ca 0.47 0.63 -0.15 0.00 -1.18 0.00 0.00 61.69 61.45 1n1m s THR 687 Cb 0.38 -3.78 -0.17 0.00 1.34 0.00 0.00 72.50 70.27 1n1m s THR 687 CO 0.09 -0.69 1.26 0.58 -0.54 0.00 0.00 174.62 175.33 1n1m h VAL 688 N 0.71 1.32 -0.20 2.29 2.07 -0.66 -3.27 116.25 118.52 1n1m h VAL 688 Ca -0.47 -1.91 0.06 0.00 0.82 0.00 0.00 66.70 65.20 1n1m h VAL 688 Cb 1.19 2.10 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 1n1m h VAL 688 CO 0.63 0.59 0.14 0.00 0.02 0.00 0.00 177.57 178.95 1n1m h MET 689 N 0.32 0.00 0.00 1.57 -0.00 -1.90 0.09 114.93 115.01 1n1m h MET 689 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.65 1n1m h MET 689 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.89 1n1m h MET 689 CO 0.13 0.00 0.00 0.66 -0.00 0.00 0.00 176.91 177.70 1n1m h SER 690 N 0.00 0.00 -0.28 -0.10 4.64 -1.94 -0.98 113.55 114.90 1n1m h SER 690 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1n1m h SER 690 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1n1m h SER 690 CO -0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 1n1m n ARG 691 N -2.31 2.13 -0.36 4.77 1.74 0.01 -4.69 116.66 117.94 1n1m n ARG 691 Ca -0.00 -1.98 0.01 0.00 -0.77 0.00 0.00 57.85 55.11 1n1m n ARG 691 Cb 0.12 -1.40 0.06 0.00 -1.02 0.00 0.00 32.46 30.22 1n1m n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1n1m n ALA 692 N 1.11 -0.04 -0.33 7.54 0.00 -0.37 -1.02 120.51 127.40 1n1m n ALA 692 Ca 0.15 0.98 0.21 0.00 0.00 0.00 0.00 53.44 54.78 1n1m n ALA 692 Cb 0.50 -0.48 0.47 0.00 0.00 0.00 0.00 19.45 19.94 1n1m n ALA 692 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1n1m h GLU 693 N 0.00 0.44 0.00 0.00 4.57 -1.83 0.79 114.58 118.55 1n1m h GLU 693 Ca 0.36 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.52 1n1m h GLU 693 Cb 0.61 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1n1m h GLU 693 CO -0.96 0.29 0.00 0.09 -1.18 0.00 0.00 179.01 177.25 1n1m n ASN 694 N -4.72 0.00 0.00 1.04 5.03 -0.18 -2.98 115.26 113.45 1n1m n ASN 694 Ca 0.26 -0.13 0.10 0.00 0.87 0.00 0.00 54.58 55.69 1n1m n ASN 694 Cb 0.84 -0.27 0.52 0.00 -1.02 0.00 0.00 39.78 39.85 1n1m n ASN 694 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1n1m n PHE 695 N -1.27 0.00 0.28 3.10 3.01 0.27 -3.38 117.46 119.47 1n1m n PHE 695 Ca 0.13 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.70 1n1m n PHE 695 Cb 0.20 -0.34 0.79 0.00 -0.01 0.00 0.00 39.48 40.11 1n1m n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1n1m h LYS 696 N 0.00 0.00 -0.64 -1.08 1.57 -1.71 -2.63 116.57 112.08 1n1m h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1n1m h LYS 696 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1n1m h LYS 696 CO 0.00 0.02 0.00 1.04 -0.57 0.00 0.00 179.45 179.94 1n1m n GLN 697 N -4.10 3.40 -3.93 3.15 1.13 -1.22 -4.97 117.38 110.85 1n1m n GLN 697 Ca -0.03 -2.49 -0.09 0.00 -1.94 0.00 0.00 57.00 52.45 1n1m n GLN 697 Cb 0.10 -1.82 -0.09 0.00 0.11 0.00 0.00 30.24 28.54 1n1m n GLN 697 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1n1m s VAL 698 N -1.82 0.14 -0.40 5.09 -7.23 -0.99 -4.94 120.40 110.25 1n1m s VAL 698 Ca 0.45 -1.18 -0.20 0.00 -1.81 0.00 0.00 61.98 59.24 1n1m s VAL 698 Cb 0.29 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 36.20 1n1m s VAL 698 CO 0.21 -0.65 0.59 -1.61 -0.31 0.00 0.00 175.10 173.34 1n1m s GLU 699 N -2.95 3.42 -0.07 4.82 2.02 -0.98 -4.99 118.70 119.97 1n1m s GLU 699 Ca -0.02 -0.28 0.01 0.00 0.02 0.00 0.00 54.97 54.71 1n1m s GLU 699 Cb 0.01 -3.89 -0.03 0.00 0.10 0.00 0.00 34.13 30.32 1n1m s GLU 699 CO -0.06 -0.86 -0.08 -0.47 0.02 0.00 0.00 175.26 173.81 1n1m s TYR 700 N 2.64 2.90 -0.20 1.61 5.04 -1.26 -1.08 117.35 127.00 1n1m s TYR 700 Ca 0.21 -0.02 0.01 0.00 -2.44 0.00 0.00 57.07 54.83 1n1m s TYR 700 Cb -0.15 -1.70 0.04 0.00 0.35 0.00 0.00 41.96 40.49 1n1m s TYR 700 CO 0.16 0.30 -0.14 -1.17 -1.34 0.00 0.00 175.55 173.36 1n1m s LEU 701 N -0.76 2.36 -0.23 6.97 0.20 -0.38 -0.75 118.68 126.09 1n1m s LEU 701 Ca 0.12 -0.86 -0.07 0.00 0.69 0.00 0.00 54.13 54.01 1n1m s LEU 701 Cb -0.11 -1.35 -0.03 0.00 -0.43 0.00 0.00 46.19 44.27 1n1m s LEU 701 CO 0.01 -0.10 0.06 -0.22 -0.29 0.00 0.00 176.35 175.82 1n1m s LEU 702 N 1.33 3.51 0.02 -0.68 0.20 -0.40 -0.98 118.68 121.67 1n1m s LEU 702 Ca -0.00 -0.14 0.05 0.00 0.69 0.00 0.00 54.13 54.72 1n1m s LEU 702 Cb -0.16 -1.92 -0.02 0.00 -0.43 0.00 0.00 46.19 43.66 1n1m s LEU 702 CO -0.09 0.02 -0.14 -0.63 -0.29 0.00 0.00 176.35 175.22 1n1m s ILE 703 N 1.29 1.10 -0.29 6.68 1.01 -0.28 -2.09 121.20 128.62 1n1m s ILE 703 Ca 0.05 -0.85 -0.20 0.00 0.00 0.00 0.00 60.65 59.65 1n1m s ILE 703 Cb -0.15 -0.97 0.14 0.00 0.01 0.00 0.00 42.46 41.49 1n1m s ILE 703 CO 0.03 0.11 1.02 -2.28 0.00 0.00 0.00 174.94 173.82 1n1m s HIS 704 N -0.66 -0.51 0.32 3.97 2.46 -1.14 -0.40 115.29 119.33 1n1m s HIS 704 Ca 0.03 1.12 -0.28 0.00 0.47 0.00 0.00 55.06 56.40 1n1m s HIS 704 Cb -0.07 0.36 -0.09 0.00 -0.13 0.00 0.00 32.58 32.65 1n1m s HIS 704 CO 0.01 -0.25 1.07 0.20 -2.47 0.00 0.00 174.74 173.29 1n1m s GLY 705 N 0.83 2.96 0.42 1.59 0.00 -1.26 -2.81 107.32 109.04 1n1m s GLY 705 Ca -0.03 0.80 0.23 0.00 0.00 0.00 0.00 44.72 45.72 1n1m s GLY 705 CO -0.11 1.34 1.76 -0.91 0.00 0.00 0.00 173.10 175.18 1n1m h THR 706 N 2.79 0.58 -0.69 0.90 1.35 -1.18 -3.15 112.91 113.50 1n1m h THR 706 Ca -0.47 -1.29 -0.19 0.00 -0.55 0.00 0.00 66.41 63.92 1n1m h THR 706 Cb 1.21 1.88 -0.11 0.00 -1.73 0.00 0.00 68.15 69.40 1n1m h THR 706 CO 0.65 0.25 0.23 0.00 -0.25 0.00 0.00 175.52 176.40 1n1m n ALA 707 N -2.22 4.45 -2.03 6.62 0.00 0.37 -4.71 120.51 123.00 1n1m n ALA 707 Ca 0.01 -2.35 -0.43 0.00 0.00 0.00 0.00 53.44 50.67 1n1m n ALA 707 Cb 0.48 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 1n1m n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1n1m s ASP 708 N -1.12 6.05 0.00 0.00 -1.08 -1.03 -4.30 116.67 115.19 1n1m s ASP 708 Ca 0.54 1.42 0.26 0.00 -0.52 0.00 0.00 52.55 54.25 1n1m s ASP 708 Cb 0.43 -2.53 0.69 0.00 -1.46 0.00 0.00 42.92 40.06 1n1m s ASP 708 CO 0.13 -1.57 1.53 -0.90 0.52 0.00 0.00 175.17 174.88 1n1m n ASP 709 N 9.69 0.87 0.00 -0.34 5.75 -1.26 -3.82 116.55 127.43 1n1m n ASP 709 Ca 0.22 -0.70 0.00 0.00 -0.01 0.00 0.00 54.79 54.29 1n1m n ASP 709 Cb 0.46 0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.72 1n1m n ASP 709 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1n1m n ASN 710 N -0.89 0.00 -4.30 -1.12 2.85 -1.26 -4.77 115.26 105.76 1n1m n ASN 710 Ca 0.10 0.05 -0.46 0.00 -0.11 0.00 0.00 54.58 54.16 1n1m n ASN 710 Cb 0.34 -0.34 -0.05 0.00 1.24 0.00 0.00 39.78 40.97 1n1m n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1n1m s VAL 711 N -0.69 5.19 0.38 3.44 1.01 -1.26 -4.82 120.40 123.64 1n1m s VAL 711 Ca 0.00 -1.74 -0.26 0.00 0.00 0.00 0.00 61.98 59.98 1n1m s VAL 711 Cb 0.00 -4.31 -0.11 0.00 0.00 0.00 0.00 36.38 31.96 1n1m s VAL 711 CO 0.00 -0.89 1.16 1.41 0.00 0.00 0.00 175.10 176.78 1n1m n HIS 712 N 4.94 1.76 -0.22 5.22 8.25 -1.25 -4.69 115.22 129.23 1n1m n HIS 712 Ca -0.08 0.56 0.31 0.00 -0.26 0.00 0.00 57.72 58.26 1n1m n HIS 712 Cb 0.41 -2.32 0.73 0.00 1.12 0.00 0.00 29.99 29.93 1n1m n HIS 712 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1n1m h PHE 713 N 2.03 0.00 -0.89 4.41 3.57 -1.79 0.11 116.94 124.38 1n1m h PHE 713 Ca -0.45 0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.25 1n1m h PHE 713 Cb 1.31 0.00 -0.16 0.00 2.79 0.00 0.00 35.95 39.89 1n1m h PHE 713 CO 0.47 0.00 -0.09 0.37 -2.23 0.00 0.00 178.31 176.83 1n1m h GLN 714 N 0.00 0.03 -0.28 1.11 4.15 -1.94 -0.79 115.11 117.39 1n1m h GLN 714 Ca 0.47 -0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.96 1n1m h GLN 714 Cb 1.97 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 29.59 1n1m h GLN 714 CO -0.00 0.02 -0.21 1.96 -1.93 0.00 0.00 178.83 178.66 1n1m h GLN 715 N 0.03 -0.19 0.00 1.69 1.08 -1.10 -0.84 115.11 115.79 1n1m h GLN 715 Ca 0.48 0.01 -0.11 0.00 -1.45 0.00 0.00 58.65 57.58 1n1m h GLN 715 Cb 0.84 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.30 1n1m h GLN 715 CO -0.86 -0.13 -0.53 0.77 -0.95 0.00 0.00 178.83 177.13 1n1m h SER 716 N -0.20 0.00 0.27 1.46 0.02 -1.45 -2.89 113.55 110.76 1n1m h SER 716 Ca 0.15 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.01 1n1m h SER 716 Cb 0.43 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 1n1m h SER 716 CO -0.40 0.53 -0.38 0.00 -1.14 0.00 0.00 176.83 175.44 1n1m h ALA 717 N 1.47 1.23 0.00 3.77 0.00 -0.40 -0.29 119.26 125.04 1n1m h ALA 717 Ca -0.01 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 1n1m h ALA 717 Cb 1.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1n1m h ALA 717 CO 0.07 0.53 -0.26 1.96 0.00 0.00 0.00 179.25 181.55 1n1m h GLN 718 N 0.13 0.00 0.06 0.00 1.08 -1.05 -2.21 115.11 113.12 1n1m h GLN 718 Ca 0.01 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1n1m h GLN 718 Cb 0.73 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.16 1n1m h GLN 718 CO 0.05 0.26 -0.03 0.82 -0.95 0.00 0.00 178.83 178.99 1n1m h ILE 719 N 0.00 1.12 -0.42 2.54 2.04 -1.17 -2.68 117.51 118.94 1n1m h ILE 719 Ca -0.00 -1.56 0.08 0.00 1.00 0.00 0.00 64.86 64.38 1n1m h ILE 719 Cb 1.13 2.00 -0.07 0.00 -0.74 0.00 0.00 36.82 39.14 1n1m h ILE 719 CO 0.03 0.34 -0.01 0.77 0.00 0.00 0.00 178.15 179.28 1n1m h SER 720 N -0.90 -0.19 -0.07 1.72 4.64 -1.12 -0.66 113.55 116.98 1n1m h SER 720 Ca -0.01 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1n1m h SER 720 Cb 0.61 0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1n1m h SER 720 CO 0.01 -0.06 0.05 0.50 -0.87 0.00 0.00 176.83 176.46 1n1m h LYS 721 N 0.10 0.08 -0.07 4.77 3.64 -1.48 -1.22 116.57 122.38 1n1m h LYS 721 Ca 0.21 -0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.39 1n1m h LYS 721 Cb 0.30 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1n1m h LYS 721 CO -0.35 0.05 -0.76 0.00 -2.27 0.00 0.00 179.45 176.12 1n1m h ALA 722 N 1.96 0.56 -0.29 5.00 0.00 -0.79 -1.93 119.26 123.77 1n1m h ALA 722 Ca 0.03 -0.62 -0.18 0.00 0.00 0.00 0.00 54.91 54.14 1n1m h ALA 722 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1n1m h ALA 722 CO -0.00 0.77 -0.52 -0.07 0.00 0.00 0.00 179.25 179.42 1n1m h LEU 723 N 0.27 0.96 -0.93 0.00 3.38 -0.61 -2.49 115.31 115.90 1n1m h LEU 723 Ca -0.04 -0.53 -0.01 0.00 0.09 0.00 0.00 57.88 57.39 1n1m h LEU 723 Cb 1.34 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 1n1m h LEU 723 CO 0.13 1.31 0.53 0.58 0.09 0.00 0.00 178.44 181.08 1n1m h VAL 724 N 0.65 1.26 0.00 1.22 2.07 -1.21 0.20 116.25 120.44 1n1m h VAL 724 Ca 0.02 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.89 1n1m h VAL 724 Cb 1.13 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1n1m h VAL 724 CO 0.12 0.28 -0.21 0.44 0.02 0.00 0.00 177.57 178.22 1n1m h ASP 725 N 1.29 0.00 0.03 0.57 5.19 -1.18 -2.71 116.42 119.61 1n1m h ASP 725 Ca 0.33 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.74 1n1m h ASP 725 Cb -0.02 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.49 1n1m h ASP 725 CO -0.06 0.21 -0.25 0.52 -3.12 0.00 0.00 179.24 176.54 1n1m n VAL 726 N -4.10 0.00 -1.80 -1.35 0.31 -0.66 -4.97 118.33 105.76 1n1m n VAL 726 Ca -0.02 -0.30 -0.07 0.00 -0.01 0.00 0.00 64.34 63.94 1n1m n VAL 726 Cb 0.28 1.07 -0.01 0.00 -0.91 0.00 0.00 33.84 34.27 1n1m n VAL 726 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n1m n GLY 727 N 1.36 0.38 3.69 2.92 0.00 -0.05 -4.97 105.19 108.52 1n1m n GLY 727 Ca 0.12 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 1n1m n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1m s VAL 728 N -2.31 5.36 0.37 1.61 1.01 -0.54 -5.03 120.40 120.86 1n1m s VAL 728 Ca 0.00 0.27 -0.15 0.00 0.00 0.00 0.00 61.98 62.10 1n1m s VAL 728 Cb 0.00 -3.52 -0.09 0.00 0.00 0.00 0.00 36.38 32.77 1n1m s VAL 728 CO 0.00 0.38 0.79 -0.62 0.00 0.00 0.00 175.10 175.64 1n1m s ASP 729 N 0.74 6.72 0.37 3.32 2.15 -1.26 -4.40 116.67 124.31 1n1m s ASP 729 Ca 0.10 1.32 -0.16 0.00 0.43 0.00 0.00 52.55 54.23 1n1m s ASP 729 Cb -0.13 -2.39 0.06 0.00 -0.30 0.00 0.00 42.92 40.16 1n1m s ASP 729 CO 0.02 -0.30 0.82 0.72 -0.17 0.00 0.00 175.17 176.27 1n1m s PHE 730 N -2.14 0.13 -0.03 -5.34 -0.71 -1.26 -4.78 117.98 103.84 1n1m s PHE 730 Ca 0.55 -0.79 -0.01 0.00 -1.04 0.00 0.00 56.93 55.64 1n1m s PHE 730 Cb -0.10 0.83 -0.04 0.00 -1.21 0.00 0.00 43.02 42.51 1n1m s PHE 730 CO 0.21 -1.52 0.04 -0.65 -1.34 0.00 0.00 175.22 171.97 1n1m s GLN 731 N -2.20 2.99 0.11 1.99 -1.52 0.08 -5.03 119.66 116.07 1n1m s GLN 731 Ca 0.16 -0.48 0.01 0.00 -1.95 0.00 0.00 55.36 53.11 1n1m s GLN 731 Cb -0.05 -2.81 -0.04 0.00 -0.22 0.00 0.00 33.01 29.89 1n1m s GLN 731 CO 0.11 0.66 -0.04 0.00 -0.25 0.00 0.00 175.29 175.77 1n1m s ALA 732 N -1.08 0.97 -0.30 6.09 0.00 -1.26 -1.28 121.76 124.91 1n1m s ALA 732 Ca 0.19 -1.38 -0.15 0.00 0.00 0.00 0.00 51.96 50.61 1n1m s ALA 732 Cb -0.12 0.29 0.16 0.00 0.00 0.00 0.00 23.12 23.46 1n1m s ALA 732 CO 0.09 -0.29 1.00 1.41 0.00 0.00 0.00 175.76 177.98 1n1m s MET 733 N -3.88 0.30 0.24 0.00 0.00 -0.89 -4.93 119.30 110.14 1n1m s MET 733 Ca 0.14 0.67 0.09 0.00 0.00 0.00 0.00 55.69 56.59 1n1m s MET 733 Cb 0.06 0.32 -0.04 0.00 0.00 0.00 0.00 34.83 35.16 1n1m s MET 733 CO -0.04 -0.09 -0.03 1.67 0.00 0.00 0.00 175.02 176.54 1n1m s TRP 734 N 2.10 2.69 -0.27 4.11 -2.14 -1.26 -2.87 118.94 121.30 1n1m s TRP 734 Ca -0.04 -0.21 0.00 0.00 2.66 0.00 0.00 56.10 58.51 1n1m s TRP 734 Cb -0.05 -1.23 0.08 0.00 -3.10 0.00 0.00 33.47 29.17 1n1m s TRP 734 CO -0.16 0.59 0.02 0.71 -2.66 0.00 0.00 176.95 175.45 1n1m s TYR 735 N -2.14 2.23 0.28 1.66 2.02 -1.12 -4.96 117.35 115.33 1n1m s TYR 735 Ca 0.30 -1.84 -0.30 0.00 -0.37 0.00 0.00 57.07 54.86 1n1m s TYR 735 Cb -0.07 -1.77 -0.11 0.00 -0.40 0.00 0.00 41.96 39.61 1n1m s TYR 735 CO 0.19 -0.81 1.52 -0.08 -1.57 0.00 0.00 175.55 174.79 1n1m s THR 736 N 1.44 2.29 -0.45 -0.71 -1.32 -1.26 -1.22 115.64 114.41 1n1m s THR 736 Ca 0.02 0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.76 1n1m s THR 736 Cb -0.18 -3.16 0.00 0.00 -1.51 0.00 0.00 72.50 67.65 1n1m s THR 736 CO -0.13 0.04 0.00 0.47 -2.21 0.00 0.00 174.62 172.80 1n1m n ASP 737 N 2.06 -5.21 -4.90 8.08 8.00 -1.26 -4.84 116.55 118.47 1n1m n ASP 737 Ca 0.07 0.11 -0.30 0.00 0.71 0.00 0.00 54.79 55.38 1n1m n ASP 737 Cb 0.39 -3.08 -0.04 0.00 -0.02 0.00 0.00 41.12 38.36 1n1m n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1n1m s GLU 738 N -2.02 3.61 0.00 -1.24 0.41 -1.08 -4.66 118.70 113.73 1n1m s GLU 738 Ca 0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.46 1n1m s GLU 738 Cb 0.00 -2.78 0.00 0.00 -1.78 0.00 0.00 34.13 29.57 1n1m s GLU 738 CO 0.00 0.38 0.00 -0.40 -0.49 0.00 0.00 175.26 174.75 1n1m n ASP 739 N -0.37 0.64 0.20 -0.19 5.68 -1.26 -0.48 116.55 120.78 1n1m n ASP 739 Ca -0.03 -0.26 0.18 0.00 -0.50 0.00 0.00 54.79 54.19 1n1m n ASP 739 Cb 0.53 0.00 0.82 0.00 -1.14 0.00 0.00 41.12 41.33 1n1m n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1n1m h HIS 740 N 0.08 0.00 0.00 2.11 -0.00 -1.91 -0.53 115.15 114.91 1n1m h HIS 740 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1n1m h HIS 740 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 1n1m h HIS 740 CO 0.00 0.00 -0.79 0.41 -0.00 0.00 0.00 177.93 177.55 1n1m n GLY 741 N -1.37 -1.28 4.03 5.26 0.00 -1.26 -4.92 105.19 105.64 1n1m n GLY 741 Ca 0.03 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.42 1n1m n GLY 741 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1n1m n ILE 742 N -1.91 -0.71 1.08 -0.61 5.41 -0.21 -4.78 119.36 117.64 1n1m n ILE 742 Ca 0.03 -0.35 0.12 0.00 1.00 0.00 0.00 62.75 63.55 1n1m n ILE 742 Cb 0.41 -0.77 0.17 0.00 -0.71 0.00 0.00 39.64 38.74 1n1m n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1n1m n ALA 743 N -3.93 2.52 -1.68 -1.39 0.00 -1.26 -3.75 120.51 111.02 1n1m n ALA 743 Ca -0.22 -0.65 -0.41 0.00 0.00 0.00 0.00 53.44 52.17 1n1m n ALA 743 Cb 0.55 -0.87 0.01 0.00 0.00 0.00 0.00 19.45 19.15 1n1m n ALA 743 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1n1m n SER 744 N 1.10 2.18 -0.21 0.00 3.41 -1.26 -4.69 113.62 114.15 1n1m n SER 744 Ca 0.15 1.08 -0.10 0.00 -0.26 0.00 0.00 58.87 59.74 1n1m n SER 744 Cb 0.55 -1.46 -0.06 0.00 -0.26 0.00 0.00 64.21 62.99 1n1m n SER 744 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1n1m h SER 745 N 1.89 -1.65 -0.61 4.04 0.87 -2.00 0.58 113.55 116.67 1n1m h SER 745 Ca -0.47 0.26 -0.10 0.00 -1.23 0.00 0.00 61.79 60.25 1n1m h SER 745 Cb 1.31 0.73 -0.02 0.00 -0.44 0.00 0.00 62.40 63.98 1n1m h SER 745 CO 0.59 -0.34 -0.01 0.71 -0.53 0.00 0.00 176.83 177.25 1n1m h THR 746 N -0.24 1.27 -0.30 2.23 1.35 -1.98 -2.93 112.91 112.31 1n1m h THR 746 Ca 0.16 -1.17 -0.01 0.00 -0.55 0.00 0.00 66.41 64.84 1n1m h THR 746 Cb 0.56 0.81 -0.01 0.00 -1.73 0.00 0.00 68.15 67.77 1n1m h THR 746 CO -0.70 0.42 0.16 0.00 -0.25 0.00 0.00 175.52 175.16 1n1m h ALA 747 N 0.98 0.38 -0.26 6.62 0.00 -1.75 -1.83 119.26 123.41 1n1m h ALA 747 Ca 0.17 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1n1m h ALA 747 Cb 0.57 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 1n1m h ALA 747 CO 0.03 -0.09 -0.28 1.25 0.00 0.00 0.00 179.25 180.17 1n1m h HIS 748 N 0.37 -0.74 -0.22 0.00 2.76 -0.81 0.34 115.15 116.85 1n1m h HIS 748 Ca 0.11 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.26 1n1m h HIS 748 Cb 0.06 0.37 -0.01 0.00 1.55 0.00 0.00 27.41 29.38 1n1m h HIS 748 CO -0.03 -0.35 -0.14 1.96 -1.30 0.00 0.00 177.93 178.07 1n1m h GLN 749 N -0.28 0.37 -0.12 5.26 4.20 -1.45 -2.41 115.11 120.68 1n1m h GLN 749 Ca 0.14 -0.10 -0.17 0.00 0.06 0.00 0.00 58.65 58.58 1n1m h GLN 749 Cb 0.50 -0.04 0.01 0.00 0.30 0.00 0.00 27.48 28.24 1n1m h GLN 749 CO -0.41 0.51 -0.58 1.25 -0.67 0.00 0.00 178.83 178.92 1n1m h HIS 750 N 0.34 0.81 -0.50 2.96 2.76 -0.35 -1.89 115.15 119.28 1n1m h HIS 750 Ca 0.07 -0.36 -0.10 0.00 -2.20 0.00 0.00 60.37 57.77 1n1m h HIS 750 Cb 0.45 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.27 1n1m h HIS 750 CO 0.01 1.15 -0.10 0.97 -1.30 0.00 0.00 177.93 178.67 1n1m h ILE 751 N 0.23 1.27 0.00 6.26 2.10 -0.29 -0.92 117.51 126.16 1n1m h ILE 751 Ca -0.04 -1.23 -0.08 0.00 1.08 0.00 0.00 64.86 64.59 1n1m h ILE 751 Cb 1.22 1.04 -0.01 0.00 -1.09 0.00 0.00 36.82 37.98 1n1m h ILE 751 CO 0.12 0.43 -0.37 1.88 -1.08 0.00 0.00 178.15 179.13 1n1m h TYR 752 N 0.81 0.00 -0.05 2.19 0.05 -1.50 -0.86 116.97 117.61 1n1m h TYR 752 Ca 0.13 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.82 1n1m h TYR 752 Cb 0.65 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1n1m h TYR 752 CO 0.05 0.37 -0.32 1.15 -1.05 0.00 0.00 178.16 178.36 1n1m h THR 753 N 0.00 1.44 -0.42 -2.88 2.02 -1.05 -2.32 112.91 109.71 1n1m h THR 753 Ca -0.00 -1.77 0.00 0.00 0.77 0.00 0.00 66.41 65.41 1n1m h THR 753 Cb 0.84 2.41 -0.02 0.00 -1.74 0.00 0.00 68.15 69.64 1n1m h THR 753 CO 0.05 0.50 0.27 -0.74 0.37 0.00 0.00 175.52 175.98 1n1m h HIS 754 N -0.21 0.53 -0.84 3.16 -0.00 -1.03 -2.68 115.15 114.08 1n1m h HIS 754 Ca -0.02 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.35 1n1m h HIS 754 Cb 0.99 -0.18 -0.04 0.00 -0.00 0.00 0.00 27.41 28.18 1n1m h HIS 754 CO 0.14 0.34 0.52 0.52 -0.00 0.00 0.00 177.93 179.44 1n1m h MET 755 N 0.57 1.13 -0.04 5.26 2.07 -1.19 -2.29 114.93 120.43 1n1m h MET 755 Ca 0.15 -0.09 0.01 0.00 -2.07 0.00 0.00 59.70 57.70 1n1m h MET 755 Cb -0.06 -0.24 -0.01 0.00 -1.87 0.00 0.00 31.60 29.42 1n1m h MET 755 CO -0.03 0.78 -0.03 0.77 1.07 0.00 0.00 176.91 179.47 1n1m h SER 756 N 1.16 -0.09 -0.37 1.22 0.02 -1.09 -0.12 113.55 114.29 1n1m h SER 756 Ca 0.30 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 61.33 1n1m h SER 756 Cb -0.07 0.05 -0.05 0.00 0.14 0.00 0.00 62.40 62.47 1n1m h SER 756 CO -0.06 -0.04 0.06 0.45 -1.14 0.00 0.00 176.83 176.10 1n1m h HIS 757 N -0.03 0.10 -0.33 3.45 3.86 -1.25 -0.14 115.15 120.81 1n1m h HIS 757 Ca 0.03 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.30 1n1m h HIS 757 Cb 0.07 0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.52 1n1m h HIS 757 CO -0.12 0.00 0.12 0.35 0.86 0.00 0.00 177.93 179.14 1n1m h PHE 758 N 0.18 0.22 -0.30 2.45 3.57 -1.05 -0.38 116.94 121.63 1n1m h PHE 758 Ca 0.18 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.63 1n1m h PHE 758 Cb 0.21 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1n1m h PHE 758 CO -0.20 0.10 -0.07 0.82 -2.23 0.00 0.00 178.31 176.73 1n1m h ILE 759 N 0.27 1.28 0.00 1.41 1.08 -0.44 -2.08 117.51 119.03 1n1m h ILE 759 Ca 0.15 -1.10 0.00 0.00 -0.39 0.00 0.00 64.86 63.51 1n1m h ILE 759 Cb 0.11 1.37 0.00 0.00 -3.07 0.00 0.00 36.82 35.23 1n1m h ILE 759 CO -0.14 0.35 0.00 0.07 -0.69 0.00 0.00 178.15 177.74 1n1m h LYS 760 N 0.36 0.00 -0.01 2.37 2.10 -0.95 -0.57 116.57 119.87 1n1m h LYS 760 Ca 0.08 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 58.47 1n1m h LYS 760 Cb 0.55 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.90 1n1m h LYS 760 CO 0.03 0.00 -1.02 0.37 -2.00 0.00 0.00 179.45 176.83 1n1m h GLN 761 N 0.00 0.67 -0.09 0.07 -0.00 -0.96 0.17 115.11 114.96 1n1m h GLN 761 Ca 0.00 -0.72 -0.15 0.00 -0.00 0.00 0.00 58.65 57.78 1n1m h GLN 761 Cb 0.71 0.20 -0.01 0.00 0.00 0.00 0.00 27.48 28.38 1n1m h GLN 761 CO 0.00 1.30 -0.60 0.00 0.00 0.00 0.00 178.83 179.53 1n1m h PHE 763 N 0.23 0.00 -0.02 0.00 0.04 -1.08 -3.50 116.94 112.62 1n1m h PHE 763 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1n1m h PHE 763 Cb 1.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.26 1n1m h PHE 763 CO 0.03 0.67 0.00 0.43 -0.60 0.00 0.00 178.31 178.84