#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f8s n ARG 40 N 0.00 0.00 -0.85 4.33 3.00 -1.26 -4.01 116.66 117.87 3f8s n ARG 40 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.85 57.56 3f8s n ARG 40 Cb 0.00 0.00 0.22 0.00 0.00 0.00 0.00 32.46 32.68 3f8s n ARG 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 3f8s s LYS 41 N -1.74 -0.28 0.33 5.56 -2.85 -1.26 -4.65 119.74 114.85 3f8s s LYS 41 Ca 0.00 0.69 0.09 0.00 -1.00 0.00 0.00 55.97 55.74 3f8s s LYS 41 Cb 0.00 -1.64 -0.04 0.00 -2.06 0.00 0.00 37.83 34.09 3f8s s LYS 41 CO 0.00 -3.25 0.09 -0.08 0.10 0.00 0.00 175.35 172.21 3f8s s THR 42 N -2.71 3.00 -0.56 3.79 -1.32 -1.26 -1.43 115.64 115.16 3f8s s THR 42 Ca 0.67 -1.78 -0.27 0.00 -1.21 0.00 0.00 61.69 59.09 3f8s s THR 42 Cb -0.22 -2.92 -0.00 0.00 -1.51 0.00 0.00 72.50 67.85 3f8s s THR 42 CO 0.61 -0.21 1.60 -0.47 -2.21 0.00 0.00 174.62 173.93 3f8s s TYR 43 N -2.43 2.02 0.64 9.09 5.04 -1.26 -4.87 117.35 125.58 3f8s s TYR 43 Ca 0.36 0.55 -0.02 0.00 -2.44 0.00 0.00 57.07 55.53 3f8s s TYR 43 Cb -0.02 -4.28 0.07 0.00 0.35 0.00 0.00 41.96 38.07 3f8s s TYR 43 CO 0.22 -2.22 0.91 0.95 -1.34 0.00 0.00 175.55 174.06 3f8s s THR 44 N 7.09 2.41 0.19 4.34 -4.23 -1.26 -4.18 115.64 120.00 3f8s s THR 44 Ca 0.59 -0.52 -0.10 0.00 -1.18 0.00 0.00 61.69 60.48 3f8s s THR 44 Cb -0.13 -2.89 0.11 0.00 1.34 0.00 0.00 72.50 70.93 3f8s s THR 44 CO 0.24 0.00 1.73 0.25 -0.54 0.00 0.00 174.62 176.30 3f8s h LEU 45 N -0.30 0.99 -0.71 4.79 5.85 -1.94 -2.66 115.31 121.34 3f8s h LEU 45 Ca -0.41 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.14 3f8s h LEU 45 Cb 1.29 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 3f8s h LEU 45 CO 0.51 0.94 0.43 0.74 -0.34 0.00 0.00 178.44 180.71 3f8s h THR 46 N 1.00 1.04 -0.54 1.05 2.02 -1.97 0.97 112.91 116.48 3f8s h THR 46 Ca 0.22 -0.28 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 3f8s h THR 46 Cb 0.30 0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 66.84 3f8s h THR 46 CO -0.01 0.15 0.32 0.44 0.37 0.00 0.00 175.52 176.80 3f8s h ASP 47 N 0.81 0.65 0.37 4.18 3.32 -1.85 0.88 116.42 124.78 3f8s h ASP 47 Ca 0.30 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 3f8s h ASP 47 Cb 0.10 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3f8s h ASP 47 CO -0.14 0.50 -0.18 0.22 -1.72 0.00 0.00 179.24 177.92 3f8s h TYR 48 N 0.75 -0.46 -0.57 4.55 3.20 -1.24 -0.90 116.97 122.29 3f8s h TYR 48 Ca 0.20 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.10 3f8s h TYR 48 Cb -0.03 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 3f8s h TYR 48 CO 0.00 -0.16 0.38 -0.07 -1.64 0.00 0.00 178.16 176.67 3f8s h LEU 49 N -1.01 0.53 -2.90 2.82 4.07 -0.35 -2.56 115.31 115.91 3f8s h LEU 49 Ca -0.05 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.91 3f8s h LEU 49 Cb 0.51 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.13 3f8s h LEU 49 CO 0.08 0.36 0.00 0.29 -1.08 0.00 0.00 178.44 178.09 3f8s n LYS 50 N -4.47 2.90 -4.14 1.13 4.76 0.30 -4.96 118.16 113.68 3f8s n LYS 50 Ca 0.07 -2.28 -0.29 0.00 -2.87 0.00 0.00 58.31 52.95 3f8s n LYS 50 Cb 0.18 -1.40 -0.05 0.00 -1.84 0.00 0.00 35.03 31.92 3f8s n LYS 50 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3f8s n ASN 51 N 0.72 -0.18 0.26 4.39 3.02 -0.71 -4.83 115.26 117.93 3f8s n ASN 51 Ca 0.16 -1.12 0.09 0.00 -0.03 0.00 0.00 54.58 53.68 3f8s n ASN 51 Cb 0.52 -2.43 0.69 0.00 -0.61 0.00 0.00 39.78 37.95 3f8s n ASN 51 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3f8s h THR 52 N -1.75 0.91 -3.17 3.41 2.02 -1.45 -3.39 112.91 109.50 3f8s h THR 52 Ca -0.64 0.00 -0.65 0.00 0.77 0.00 0.00 66.41 65.89 3f8s h THR 52 Cb 1.39 0.99 -0.36 0.00 -1.74 0.00 0.00 68.15 68.43 3f8s h THR 52 CO 0.68 0.00 -0.84 -0.31 0.37 0.00 0.00 175.52 175.42 3f8s s TYR 53 N -4.99 2.65 -0.16 3.16 2.02 -1.26 -5.11 117.35 113.66 3f8s s TYR 53 Ca -0.05 -1.60 -0.02 0.00 -0.37 0.00 0.00 57.07 55.02 3f8s s TYR 53 Cb 0.17 -1.83 -0.02 0.00 -0.40 0.00 0.00 41.96 39.89 3f8s s TYR 53 CO 0.65 -0.78 -0.08 1.03 -1.57 0.00 0.00 175.55 174.80 3f8s s ARG 54 N 1.33 3.47 -0.15 -0.62 0.52 -1.26 -5.06 118.95 117.17 3f8s s ARG 54 Ca 0.03 -0.62 -0.29 0.00 -0.52 0.00 0.00 55.73 54.33 3f8s s ARG 54 Cb -0.14 -2.82 -0.02 0.00 0.52 0.00 0.00 34.95 32.49 3f8s s ARG 54 CO -0.11 0.12 1.41 -0.51 0.02 0.00 0.00 175.30 176.22 3f8s s LEU 55 N 0.64 4.16 0.40 2.53 1.43 -1.26 -4.73 118.68 121.85 3f8s s LEU 55 Ca -0.05 1.78 -0.19 0.00 -1.03 0.00 0.00 54.13 54.65 3f8s s LEU 55 Cb -0.15 -3.54 -0.10 0.00 0.03 0.00 0.00 46.19 42.43 3f8s s LEU 55 CO 0.03 -0.89 0.90 -0.54 0.23 0.00 0.00 176.35 176.07 3f8s s LYS 56 N 3.83 4.17 0.48 1.70 1.02 -1.26 -5.09 119.74 124.59 3f8s s LYS 56 Ca 0.62 1.00 0.02 0.00 0.02 0.00 0.00 55.97 57.63 3f8s s LYS 56 Cb -0.25 -2.24 -0.01 0.00 -0.52 0.00 0.00 37.83 34.81 3f8s s LYS 56 CO 0.21 0.01 0.07 -0.51 -0.92 0.00 0.00 175.35 174.22 3f8s s LEU 57 N -3.15 2.08 -0.30 3.17 1.02 -1.26 -4.91 118.68 115.34 3f8s s LEU 57 Ca 0.60 -1.73 -0.02 0.00 0.02 0.00 0.00 54.13 53.00 3f8s s LEU 57 Cb -0.09 -0.37 0.10 0.00 0.02 0.00 0.00 46.19 45.84 3f8s s LEU 57 CO 0.14 -0.97 0.11 -0.47 0.02 0.00 0.00 176.35 175.19 3f8s s TYR 58 N -3.03 1.02 -0.44 0.29 6.14 -1.26 -4.97 117.35 115.10 3f8s s TYR 58 Ca 0.11 -1.30 -0.17 0.00 0.64 0.00 0.00 57.07 56.34 3f8s s TYR 58 Cb 0.01 -1.31 0.04 0.00 0.42 0.00 0.00 41.96 41.12 3f8s s TYR 58 CO 0.08 -0.85 0.44 0.45 0.64 0.00 0.00 175.55 176.31 3f8s s SER 59 N 1.86 6.18 0.37 4.32 0.15 -1.26 -5.06 113.70 120.26 3f8s s SER 59 Ca 0.09 -0.87 0.08 0.00 0.70 0.00 0.00 55.95 55.95 3f8s s SER 59 Cb -0.17 -2.22 -0.05 0.00 -1.71 0.00 0.00 66.02 61.87 3f8s s SER 59 CO -0.31 -0.63 0.12 -1.48 1.20 0.00 0.00 173.24 172.14 3f8s s LEU 60 N 2.06 3.11 -0.20 3.45 -0.00 -1.26 -4.56 118.68 121.28 3f8s s LEU 60 Ca 0.10 -0.99 -0.03 0.00 -0.00 0.00 0.00 54.13 53.21 3f8s s LEU 60 Cb -0.19 -1.47 0.06 0.00 -0.00 0.00 0.00 46.19 44.59 3f8s s LEU 60 CO 0.11 -0.39 0.05 -0.13 -0.00 0.00 0.00 176.35 175.99 3f8s s ARG 61 N -3.83 0.53 0.07 1.48 0.52 -0.79 -4.96 118.95 111.97 3f8s s ARG 61 Ca 0.38 -0.38 -0.31 0.00 -0.52 0.00 0.00 55.73 54.90 3f8s s ARG 61 Cb 0.01 -2.03 -0.09 0.00 0.52 0.00 0.00 34.95 33.36 3f8s s ARG 61 CO 0.22 -0.67 1.77 -1.58 0.02 0.00 0.00 175.30 175.05 3f8s s TRP 62 N 1.91 2.09 -0.95 -0.53 0.52 -1.26 -0.71 118.94 120.02 3f8s s TRP 62 Ca 0.00 0.06 0.09 0.00 0.02 0.00 0.00 56.10 56.27 3f8s s TRP 62 Cb -0.17 -4.08 0.03 0.00 -1.15 0.00 0.00 33.47 28.10 3f8s s TRP 62 CO -0.10 -4.50 0.67 1.51 0.02 0.00 0.00 176.95 174.55 3f8s n ILE 63 N 4.94 0.00 -1.63 2.03 3.06 -0.87 -4.92 119.36 121.97 3f8s n ILE 63 Ca 0.17 -0.45 0.00 0.00 -2.50 0.00 0.00 62.75 59.97 3f8s n ILE 63 Cb 0.40 1.14 0.00 0.00 0.54 0.00 0.00 39.64 41.72 3f8s n ILE 63 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 3f8s n SER 64 N 0.07 0.00 0.04 9.51 3.41 -1.16 -4.93 113.62 120.55 3f8s n SER 64 Ca 0.04 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.77 3f8s n SER 64 Cb 0.20 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.38 3f8s n SER 64 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3f8s n ASP 65 N 0.00 0.59 0.00 4.04 5.75 -1.26 -2.60 116.55 123.07 3f8s n ASP 65 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 54.79 54.81 3f8s n ASP 65 Cb 0.00 0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 3f8s n ASP 65 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3f8s n HIS 66 N -1.88 0.00 -4.53 2.11 1.44 -1.26 -4.34 115.22 106.76 3f8s n HIS 66 Ca 0.04 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.50 3f8s n HIS 66 Cb 0.40 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.40 3f8s n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3f8s s GLU 67 N -0.43 1.77 -0.22 -1.40 2.02 -1.26 0.42 118.70 119.60 3f8s s GLU 67 Ca 0.00 -1.94 -0.27 0.00 0.02 0.00 0.00 54.97 52.79 3f8s s GLU 67 Cb 0.00 -1.50 0.09 0.00 0.10 0.00 0.00 34.13 32.82 3f8s s GLU 67 CO 0.00 0.05 0.84 1.52 0.02 0.00 0.00 175.26 177.70 3f8s s TYR 68 N -2.78 -0.62 0.30 1.61 -0.85 -0.89 -2.05 117.35 112.06 3f8s s TYR 68 Ca 0.33 1.41 -0.19 0.00 -0.52 0.00 0.00 57.07 58.09 3f8s s TYR 68 Cb 0.05 0.34 -0.09 0.00 0.38 0.00 0.00 41.96 42.64 3f8s s TYR 68 CO 0.16 -0.37 0.78 -0.51 -1.52 0.00 0.00 175.55 174.09 3f8s s LEU 69 N -0.10 4.19 -0.15 -3.49 1.43 0.12 -0.56 118.68 120.13 3f8s s LEU 69 Ca -0.01 1.46 -0.10 0.00 -1.03 0.00 0.00 54.13 54.44 3f8s s LEU 69 Cb -0.04 -3.93 0.05 0.00 0.03 0.00 0.00 46.19 42.30 3f8s s LEU 69 CO 0.00 -0.11 0.37 -0.47 0.23 0.00 0.00 176.35 176.37 3f8s s TYR 70 N -1.78 -0.47 -0.65 0.29 5.04 -0.07 -1.89 117.35 117.83 3f8s s TYR 70 Ca 0.50 1.07 -0.21 0.00 -2.44 0.00 0.00 57.07 56.00 3f8s s TYR 70 Cb -0.14 0.18 0.09 0.00 0.35 0.00 0.00 41.96 42.44 3f8s s TYR 70 CO 0.19 -0.26 0.86 0.21 -1.34 0.00 0.00 175.55 175.21 3f8s s LYS 71 N 0.83 3.11 -0.91 4.97 2.20 -1.26 0.26 119.74 128.95 3f8s s LYS 71 Ca -0.05 -1.13 -0.14 0.00 -0.36 0.00 0.00 55.97 54.29 3f8s s LYS 71 Cb -0.06 -4.29 0.21 0.00 -1.51 0.00 0.00 37.83 32.18 3f8s s LYS 71 CO -0.06 -1.69 0.92 -1.14 -0.36 0.00 0.00 175.35 173.02 3f8s s GLN 72 N 3.32 3.73 -0.18 4.03 0.74 -0.58 -4.60 119.66 126.12 3f8s s GLN 72 Ca 0.18 -2.49 -0.00 0.00 0.05 0.00 0.00 55.36 53.09 3f8s s GLN 72 Cb -0.19 -4.56 -0.00 0.00 1.10 0.00 0.00 33.01 29.36 3f8s s GLN 72 CO 0.07 -1.38 0.17 0.39 -0.55 0.00 0.00 175.29 173.99 3f8s n GLU 73 N 4.22 -0.33 0.00 1.67 -0.58 -1.26 -3.99 120.64 120.37 3f8s n GLU 73 Ca 0.18 0.73 0.00 0.00 -0.42 0.00 0.00 57.16 57.65 3f8s n GLU 73 Cb 0.46 -2.54 0.00 0.00 -0.57 0.00 0.00 31.44 28.79 3f8s n GLU 73 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3f8s n ASN 74 N -1.21 0.00 -2.45 1.62 3.02 -1.26 -4.87 115.26 110.10 3f8s n ASN 74 Ca -0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.32 3f8s n ASN 74 Cb 0.50 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 3f8s n ASN 74 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3f8s n ASN 75 N 1.46 -1.93 -4.30 6.41 4.13 -1.26 -4.76 115.26 115.02 3f8s n ASN 75 Ca 0.00 0.41 -0.34 0.00 1.68 0.00 0.00 54.58 56.33 3f8s n ASN 75 Cb 0.00 -0.49 -0.15 0.00 -1.54 0.00 0.00 39.78 37.60 3f8s n ASN 75 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3f8s s ILE 76 N -1.08 2.98 0.21 2.41 1.01 -0.77 -1.53 121.20 124.43 3f8s s ILE 76 Ca 0.33 -0.65 0.10 0.00 0.00 0.00 0.00 60.65 60.43 3f8s s ILE 76 Cb -0.32 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.81 3f8s s ILE 76 CO 0.37 0.49 -0.10 -0.76 0.00 0.00 0.00 174.94 174.94 3f8s s LEU 77 N 1.00 2.93 -0.15 2.97 1.43 0.14 0.49 118.68 127.48 3f8s s LEU 77 Ca -0.01 -0.68 -0.02 0.00 -1.03 0.00 0.00 54.13 52.39 3f8s s LEU 77 Cb -0.15 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.49 3f8s s LEU 77 CO -0.01 0.07 -0.07 -0.69 0.23 0.00 0.00 176.35 175.88 3f8s s VAL 78 N -1.95 3.56 -0.10 -1.59 1.01 -0.79 -0.89 120.40 119.65 3f8s s VAL 78 Ca 0.27 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.76 3f8s s VAL 78 Cb -0.08 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 3f8s s VAL 78 CO 0.16 0.50 -0.07 -0.36 0.00 0.00 0.00 175.10 175.33 3f8s s PHE 79 N 0.42 2.95 -0.36 5.22 0.40 0.28 -2.69 117.98 124.19 3f8s s PHE 79 Ca -0.06 -0.16 -0.19 0.00 -0.60 0.00 0.00 56.93 55.92 3f8s s PHE 79 Cb -0.15 -1.80 0.00 0.00 0.51 0.00 0.00 43.02 41.58 3f8s s PHE 79 CO 0.04 0.15 0.56 1.21 0.70 0.00 0.00 175.22 177.87 3f8s s ASN 80 N -0.30 6.35 0.32 1.36 3.84 -0.08 -2.10 114.94 124.32 3f8s s ASN 80 Ca 0.04 -0.01 0.07 0.00 0.21 0.00 0.00 52.86 53.17 3f8s s ASN 80 Cb -0.13 -2.29 0.53 0.00 -0.55 0.00 0.00 41.25 38.82 3f8s s ASN 80 CO 0.02 -0.54 1.75 0.00 -2.79 0.00 0.00 177.10 175.55 3f8s h ALA 81 N 8.49 1.21 0.48 1.71 0.00 -0.36 1.15 119.26 131.94 3f8s h ALA 81 Ca -0.27 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.26 3f8s h ALA 81 Cb 1.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3f8s h ALA 81 CO 0.80 0.53 -0.23 1.49 0.00 0.00 0.00 179.25 181.84 3f8s h GLU 82 N 0.22 -0.63 0.00 0.00 4.81 -1.94 -3.38 114.58 113.66 3f8s h GLU 82 Ca 0.03 0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 59.03 3f8s h GLU 82 Cb 0.70 0.14 -0.05 0.00 0.63 0.00 0.00 28.75 30.17 3f8s h GLU 82 CO 0.05 -0.33 -2.19 0.66 -0.73 0.00 0.00 179.01 176.47 3f8s n TYR 83 N -5.24 0.00 0.00 0.92 4.01 -1.20 -5.02 117.16 110.63 3f8s n TYR 83 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 3f8s n TYR 83 Cb 0.30 -0.82 0.00 0.00 -0.31 0.00 0.00 39.34 38.51 3f8s n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3f8s n GLY 84 N 1.76 0.36 3.74 2.72 0.00 0.40 -5.05 105.19 109.12 3f8s n GLY 84 Ca -0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 3f8s n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f8s s ASN 85 N -2.23 4.01 0.25 1.61 4.22 -1.25 -4.57 114.94 116.97 3f8s s ASN 85 Ca 0.00 1.81 -0.08 0.00 -2.14 0.00 0.00 52.86 52.46 3f8s s ASN 85 Cb 0.00 -2.46 -0.01 0.00 1.28 0.00 0.00 41.25 40.05 3f8s s ASN 85 CO 0.00 -2.35 0.38 -0.94 -2.04 0.00 0.00 177.10 172.15 3f8s s SER 86 N -3.27 0.14 0.06 3.54 1.04 -1.26 -0.91 113.70 113.04 3f8s s SER 86 Ca 0.63 -1.15 -0.06 0.00 0.48 0.00 0.00 55.95 55.85 3f8s s SER 86 Cb -0.18 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.46 3f8s s SER 86 CO 0.57 -1.08 0.10 -0.44 0.98 0.00 0.00 173.24 173.37 3f8s s SER 87 N -3.09 0.23 0.20 7.02 0.01 -1.10 -4.99 113.70 111.98 3f8s s SER 87 Ca 0.29 -0.69 -0.30 0.00 1.31 0.00 0.00 55.95 56.55 3f8s s SER 87 Cb 0.02 0.26 -0.08 0.00 0.21 0.00 0.00 66.02 66.43 3f8s s SER 87 CO 0.12 -0.62 1.10 0.54 0.41 0.00 0.00 173.24 174.79 3f8s s VAL 88 N -3.41 3.80 -0.21 3.43 0.11 -1.26 -1.88 120.40 120.98 3f8s s VAL 88 Ca 0.02 1.60 0.07 0.00 -2.93 0.00 0.00 61.98 60.73 3f8s s VAL 88 Cb 0.03 -4.02 -0.21 0.00 -1.53 0.00 0.00 36.38 30.65 3f8s s VAL 88 CO -0.08 0.29 0.01 0.33 -3.33 0.00 0.00 175.10 172.32 3f8s n PHE 89 N 2.16 0.24 -3.62 1.54 7.35 0.18 -4.86 117.46 120.44 3f8s n PHE 89 Ca 0.02 0.06 -0.04 0.00 -0.76 0.00 0.00 57.45 56.74 3f8s n PHE 89 Cb 0.46 -1.04 -0.06 0.00 0.35 0.00 0.00 39.48 39.19 3f8s n PHE 89 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 3f8s s LEU 90 N -6.22 -0.74 0.00 -2.13 0.20 -1.11 -5.03 118.68 103.65 3f8s s LEU 90 Ca -0.23 1.15 -0.16 0.00 0.69 0.00 0.00 54.13 55.58 3f8s s LEU 90 Cb 0.08 2.03 -0.06 0.00 -0.43 0.00 0.00 46.19 47.81 3f8s s LEU 90 CO 0.71 -0.18 0.44 -1.61 -0.29 0.00 0.00 176.35 175.43 3f8s s GLU 91 N 1.70 4.01 0.41 1.98 2.02 -1.26 -1.84 118.70 125.71 3f8s s GLU 91 Ca -0.09 0.47 0.14 0.00 0.02 0.00 0.00 54.97 55.51 3f8s s GLU 91 Cb -0.05 -3.24 0.86 0.00 0.10 0.00 0.00 34.13 31.79 3f8s s GLU 91 CO -0.17 0.63 1.90 -0.91 0.02 0.00 0.00 175.26 176.73 3f8s h ASN 92 N 4.86 0.00 -0.06 -0.19 4.21 -1.95 -1.67 115.58 120.78 3f8s h ASN 92 Ca -0.50 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.02 3f8s h ASN 92 Cb 1.21 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.41 3f8s h ASN 92 CO 0.63 0.29 0.51 0.77 -1.29 0.00 0.00 177.43 178.33 3f8s h SER 93 N 0.00 0.00 -0.69 5.81 4.64 -1.99 0.27 113.55 121.59 3f8s h SER 93 Ca -0.00 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.47 3f8s h SER 93 Cb 0.51 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.56 3f8s h SER 93 CO 0.04 0.00 0.47 0.74 -0.87 0.00 0.00 176.83 177.21 3f8s h THR 94 N 0.00 0.78 -0.11 2.95 2.02 -1.71 -3.05 112.91 113.78 3f8s h THR 94 Ca 0.03 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.11 3f8s h THR 94 Cb 1.04 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3f8s h THR 94 CO -0.00 0.05 0.00 0.49 0.37 0.00 0.00 175.52 176.43 3f8s n PHE 95 N -4.45 0.14 -0.27 3.16 3.72 0.94 -4.71 117.46 116.00 3f8s n PHE 95 Ca 0.13 -0.21 0.22 0.00 -0.05 0.00 0.00 57.45 57.54 3f8s n PHE 95 Cb 0.55 -0.01 0.42 0.00 -0.94 0.00 0.00 39.48 39.49 3f8s n PHE 95 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3f8s n ASP 96 N 0.37 0.18 -2.90 4.37 9.92 -1.15 0.12 116.55 127.45 3f8s n ASP 96 Ca 0.06 1.38 -0.35 0.00 -0.53 0.00 0.00 54.79 55.35 3f8s n ASP 96 Cb 0.28 -0.62 0.02 0.00 -0.64 0.00 0.00 41.12 40.15 3f8s n ASP 96 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3f8s n GLU 97 N -4.96 3.36 -0.03 -1.24 1.02 -1.26 -4.61 120.64 112.92 3f8s n GLU 97 Ca 0.28 -4.07 -0.07 0.00 -0.02 0.00 0.00 57.16 53.28 3f8s n GLU 97 Cb 0.94 -2.29 -0.14 0.00 -0.02 0.00 0.00 31.44 29.93 3f8s n GLU 97 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3f8s n PHE 98 N -0.43 0.74 0.00 -0.32 7.35 0.12 -5.00 117.46 119.92 3f8s n PHE 98 Ca 0.47 0.27 0.00 0.00 -0.76 0.00 0.00 57.45 57.43 3f8s n PHE 98 Cb 0.37 -1.12 0.00 0.00 0.35 0.00 0.00 39.48 39.08 3f8s n PHE 98 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3f8s n GLY 99 N 1.58 2.27 3.21 7.13 0.00 -1.26 -5.02 105.19 113.10 3f8s n GLY 99 Ca -0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 3f8s n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3f8s s HIS 100 N -2.41 1.46 0.09 1.61 3.76 -1.26 -5.13 115.29 113.42 3f8s s HIS 100 Ca 0.00 -0.42 -0.27 0.00 -0.15 0.00 0.00 55.06 54.21 3f8s s HIS 100 Cb 0.00 -0.82 -0.06 0.00 1.11 0.00 0.00 32.58 32.81 3f8s s HIS 100 CO 0.00 0.11 0.86 -1.54 -0.85 0.00 0.00 174.74 173.32 3f8s s SER 101 N -1.68 7.37 -0.28 1.40 1.04 -1.26 -4.99 113.70 115.29 3f8s s SER 101 Ca 0.02 1.64 -0.18 0.00 0.48 0.00 0.00 55.95 57.90 3f8s s SER 101 Cb -0.10 -2.53 -0.02 0.00 0.10 0.00 0.00 66.02 63.47 3f8s s SER 101 CO 0.03 -0.01 0.53 -0.63 0.98 0.00 0.00 173.24 174.14 3f8s s ILE 102 N -0.12 5.04 0.06 -1.02 1.01 -1.26 -4.54 121.20 120.37 3f8s s ILE 102 Ca 0.42 0.79 -0.20 0.00 0.00 0.00 0.00 60.65 61.67 3f8s s ILE 102 Cb -0.22 -3.88 -0.11 0.00 0.01 0.00 0.00 42.46 38.26 3f8s s ILE 102 CO 0.27 -0.00 1.45 -1.13 0.00 0.00 0.00 174.94 175.53 3f8s h ASN 103 N 8.12 0.39 -5.06 3.58 -0.00 -1.44 -3.48 115.58 117.68 3f8s h ASN 103 Ca -0.28 -0.37 0.07 0.00 -0.00 0.00 0.00 56.30 55.71 3f8s h ASN 103 Cb 1.13 -0.11 -0.04 0.00 -0.00 0.00 0.00 38.32 39.31 3f8s h ASN 103 CO 0.74 0.67 0.29 -0.62 -0.00 0.00 0.00 177.43 178.51 3f8s s ASP 104 N -5.99 -0.17 0.03 1.15 -1.08 -1.06 -5.03 116.67 104.52 3f8s s ASP 104 Ca -0.14 -0.71 -0.02 0.00 -0.52 0.00 0.00 52.55 51.16 3f8s s ASP 104 Cb 0.06 0.72 -0.02 0.00 -1.46 0.00 0.00 42.92 42.22 3f8s s ASP 104 CO 0.74 -1.36 0.00 -0.72 0.52 0.00 0.00 175.17 174.36 3f8s s TYR 105 N -3.38 0.28 -0.06 -5.34 -0.85 -1.26 -0.78 117.35 105.96 3f8s s TYR 105 Ca 0.13 -0.59 -0.03 0.00 -0.52 0.00 0.00 57.07 56.06 3f8s s TYR 105 Cb -0.05 -0.21 0.04 0.00 0.38 0.00 0.00 41.96 42.12 3f8s s TYR 105 CO 0.07 -0.26 0.09 0.45 -1.52 0.00 0.00 175.55 174.39 3f8s s SER 106 N -1.82 1.09 -0.08 -0.18 0.15 0.16 -4.96 113.70 108.06 3f8s s SER 106 Ca -0.10 0.11 -0.13 0.00 0.70 0.00 0.00 55.95 56.53 3f8s s SER 106 Cb -0.05 -0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.20 3f8s s SER 106 CO -0.03 -0.25 0.32 -0.63 1.20 0.00 0.00 173.24 173.85 3f8s s ILE 107 N 2.21 5.22 0.70 6.45 1.01 -1.26 0.14 121.20 135.67 3f8s s ILE 107 Ca 0.04 0.63 -0.15 0.00 0.00 0.00 0.00 60.65 61.18 3f8s s ILE 107 Cb -0.12 -3.63 0.02 0.00 0.01 0.00 0.00 42.46 38.74 3f8s s ILE 107 CO -0.04 0.51 1.15 -0.94 0.00 0.00 0.00 174.94 175.62 3f8s s SER 108 N -0.47 4.65 0.56 3.58 1.04 -0.53 -4.89 113.70 117.64 3f8s s SER 108 Ca 0.20 2.14 0.28 0.00 0.48 0.00 0.00 55.95 59.06 3f8s s SER 108 Cb -0.14 -2.57 1.46 0.00 0.10 0.00 0.00 66.02 64.87 3f8s s SER 108 CO 0.08 -1.94 1.95 -0.65 0.98 0.00 0.00 173.24 173.66 3f8s h PRO 109 N -0.19 0.00 -0.02 4.02 0.11 -1.82 -2.25 132.00 131.85 3f8s h PRO 109 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3f8s h PRO 109 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3f8s h PRO 109 CO 0.52 0.00 -0.22 -0.25 -0.21 0.00 0.00 178.00 177.84 3f8s n ASP 110 N -4.09 2.30 0.00 -2.05 9.92 -1.21 -4.75 116.55 116.68 3f8s n ASP 110 Ca 0.11 -1.66 0.00 0.00 -0.53 0.00 0.00 54.79 52.70 3f8s n ASP 110 Cb 0.69 0.21 0.00 0.00 -0.64 0.00 0.00 41.12 41.38 3f8s n ASP 110 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3f8s n GLY 111 N 1.36 2.32 0.22 0.44 0.00 -0.85 -4.90 105.19 103.79 3f8s n GLY 111 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 3f8s n GLY 111 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3f8s h GLN 112 N 2.43 0.00 -4.32 1.61 4.20 -1.93 -3.45 115.11 113.65 3f8s h GLN 112 Ca 0.00 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.56 3f8s h GLN 112 Cb 0.00 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 27.62 3f8s h GLN 112 CO 0.00 0.22 -0.69 -0.06 -0.67 0.00 0.00 178.83 177.63 3f8s s PHE 113 N -3.65 0.59 -0.03 2.96 0.08 -1.26 -1.65 117.98 115.02 3f8s s PHE 113 Ca 0.01 -0.97 0.05 0.00 0.12 0.00 0.00 56.93 56.13 3f8s s PHE 113 Cb 0.10 -0.40 -0.01 0.00 -0.57 0.00 0.00 43.02 42.14 3f8s s PHE 113 CO 0.63 -0.30 -0.17 -1.50 -0.10 0.00 0.00 175.22 173.78 3f8s s ILE 114 N -3.58 1.37 -0.30 0.64 2.07 -0.85 -1.45 121.20 119.11 3f8s s ILE 114 Ca 0.06 -0.71 -0.15 0.00 -1.41 0.00 0.00 60.65 58.43 3f8s s ILE 114 Cb 0.05 -1.16 -0.03 0.00 0.13 0.00 0.00 42.46 41.46 3f8s s ILE 114 CO -0.08 0.39 0.37 -0.22 -1.91 0.00 0.00 174.94 173.50 3f8s s LEU 115 N -0.17 4.19 -0.16 8.50 0.20 0.38 -1.59 118.68 130.03 3f8s s LEU 115 Ca 0.01 0.07 -0.08 0.00 0.69 0.00 0.00 54.13 54.83 3f8s s LEU 115 Cb -0.09 -2.40 -0.04 0.00 -0.43 0.00 0.00 46.19 43.23 3f8s s LEU 115 CO 0.01 -0.26 0.12 -0.76 -0.29 0.00 0.00 176.35 175.17 3f8s s LEU 116 N 2.07 4.20 -0.11 -0.68 1.43 0.16 0.39 118.68 126.13 3f8s s LEU 116 Ca 0.14 0.30 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 3f8s s LEU 116 Cb -0.16 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 3f8s s LEU 116 CO 0.11 0.28 -0.19 -0.70 0.23 0.00 0.00 176.35 176.08 3f8s s GLU 117 N -0.23 3.22 0.28 1.70 2.12 0.04 -1.47 118.70 124.36 3f8s s GLU 117 Ca 0.10 -0.78 -0.16 0.00 0.36 0.00 0.00 54.97 54.49 3f8s s GLU 117 Cb -0.12 -2.47 0.01 0.00 0.26 0.00 0.00 34.13 31.82 3f8s s GLU 117 CO 0.01 0.20 0.61 1.52 -0.54 0.00 0.00 175.26 177.05 3f8s s TYR 118 N 0.34 0.15 -0.92 5.30 1.13 0.24 -0.99 117.35 122.61 3f8s s TYR 118 Ca -0.15 -0.58 -0.05 0.00 -1.41 0.00 0.00 57.07 54.88 3f8s s TYR 118 Cb -0.17 0.45 0.01 0.00 -1.10 0.00 0.00 41.96 41.15 3f8s s TYR 118 CO 0.07 -1.16 0.61 0.09 -2.51 0.00 0.00 175.55 172.66 3f8s n ASN 119 N -0.58 -4.68 -4.62 -0.18 3.02 -1.26 0.96 115.26 107.93 3f8s n ASN 119 Ca -0.03 -0.28 -0.43 0.00 -0.03 0.00 0.00 54.58 53.81 3f8s n ASN 119 Cb 0.60 -3.38 -0.03 0.00 -0.61 0.00 0.00 39.78 36.37 3f8s n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3f8s s TYR 120 N -3.10 2.01 -0.25 3.10 6.14 -1.26 -4.07 117.35 119.93 3f8s s TYR 120 Ca 0.30 0.57 -0.05 0.00 0.64 0.00 0.00 57.07 58.54 3f8s s TYR 120 Cb -0.13 -4.07 -0.00 0.00 0.42 0.00 0.00 41.96 38.17 3f8s s TYR 120 CO 0.38 -2.89 0.01 0.08 0.64 0.00 0.00 175.55 173.77 3f8s s VAL 121 N 5.82 3.66 0.39 3.14 1.01 -0.17 -5.00 120.40 129.24 3f8s s VAL 121 Ca 0.74 -0.54 -0.23 0.00 0.00 0.00 0.00 61.98 61.95 3f8s s VAL 121 Cb -0.23 -2.75 -0.10 0.00 0.00 0.00 0.00 36.38 33.29 3f8s s VAL 121 CO 0.31 0.29 0.96 -0.75 0.00 0.00 0.00 175.10 175.91 3f8s s LYS 122 N 1.49 4.34 0.00 2.72 2.20 -1.26 -0.19 119.74 129.04 3f8s s LYS 122 Ca 0.04 1.23 0.00 0.00 -0.36 0.00 0.00 55.97 56.89 3f8s s LYS 122 Cb -0.15 -2.43 0.00 0.00 -1.51 0.00 0.00 37.83 33.73 3f8s s LYS 122 CO -0.01 0.06 0.00 0.94 -0.36 0.00 0.00 175.35 175.99 3f8s n GLN 123 N -0.17 0.00 0.00 4.03 7.27 -1.00 -4.88 117.38 122.64 3f8s n GLN 123 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.12 3f8s n GLN 123 Cb 0.52 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.17 3f8s n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 3f8s n TRP 124 N 0.00 0.00 -0.31 3.69 5.03 -1.23 -4.96 117.44 119.66 3f8s n TRP 124 Ca 0.00 0.00 -0.05 0.00 3.03 0.00 0.00 57.50 60.48 3f8s n TRP 124 Cb 0.00 0.00 0.07 0.00 -1.03 0.00 0.00 31.31 30.35 3f8s n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 3f8s h ARG 125 N 0.00 1.20 0.00 -0.99 2.43 -2.00 -3.32 114.38 111.70 3f8s h ARG 125 Ca 0.00 -0.17 -0.15 0.00 -0.81 0.00 0.00 59.98 58.85 3f8s h ARG 125 Cb 0.00 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.30 3f8s h ARG 125 CO 0.00 0.92 -1.56 0.72 -1.51 0.00 0.00 179.97 178.53 3f8s n HIS 126 N -4.33 0.00 -1.64 2.20 8.25 -1.26 -5.07 115.22 113.37 3f8s n HIS 126 Ca 0.08 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.24 3f8s n HIS 126 Cb 0.13 -0.40 0.07 0.00 1.12 0.00 0.00 29.99 30.91 3f8s n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3f8s s SER 127 N -4.10 4.96 0.13 0.41 1.04 -1.25 -4.69 113.70 110.21 3f8s s SER 127 Ca -0.05 1.34 -0.25 0.00 0.48 0.00 0.00 55.95 57.48 3f8s s SER 127 Cb 0.03 -2.14 0.08 0.00 0.10 0.00 0.00 66.02 64.09 3f8s s SER 127 CO 0.33 -1.67 1.07 -0.72 0.98 0.00 0.00 173.24 173.22 3f8s s TYR 128 N -3.17 -0.01 0.24 5.02 -0.85 -1.26 -2.38 117.35 114.93 3f8s s TYR 128 Ca 0.59 -0.30 0.09 0.00 -0.52 0.00 0.00 57.07 56.93 3f8s s TYR 128 Cb -0.13 0.65 -0.05 0.00 0.38 0.00 0.00 41.96 42.81 3f8s s TYR 128 CO 0.54 -0.75 -0.14 0.95 -1.52 0.00 0.00 175.55 174.62 3f8s s THR 129 N -2.52 1.90 0.13 -3.49 -4.23 0.73 -4.74 115.64 103.43 3f8s s THR 129 Ca 0.19 -2.24 -0.25 0.00 -1.18 0.00 0.00 61.69 58.20 3f8s s THR 129 Cb -0.01 -2.18 0.08 0.00 1.34 0.00 0.00 72.50 71.73 3f8s s THR 129 CO 0.03 -0.50 1.05 0.00 -0.54 0.00 0.00 174.62 174.66 3f8s s ALA 130 N -2.87 -1.75 -0.03 3.99 0.00 -1.13 -1.00 121.76 118.96 3f8s s ALA 130 Ca 0.25 0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.29 3f8s s ALA 130 Cb -0.01 0.65 -0.03 0.00 0.00 0.00 0.00 23.12 23.73 3f8s s ALA 130 CO 0.10 -1.06 -0.09 -1.12 0.00 0.00 0.00 175.76 173.59 3f8s s SER 131 N -3.14 4.44 -0.04 0.00 0.01 0.27 -3.04 113.70 112.20 3f8s s SER 131 Ca 0.17 -0.14 0.03 0.00 1.31 0.00 0.00 55.95 57.32 3f8s s SER 131 Cb -0.01 -1.02 0.00 0.00 0.21 0.00 0.00 66.02 65.20 3f8s s SER 131 CO 0.02 0.32 -0.13 -0.31 0.41 0.00 0.00 173.24 173.55 3f8s s TYR 132 N -0.87 1.38 0.30 2.43 2.02 -1.26 -0.59 117.35 120.76 3f8s s TYR 132 Ca 0.14 -0.39 0.10 0.00 -0.37 0.00 0.00 57.07 56.55 3f8s s TYR 132 Cb -0.11 -0.96 -0.06 0.00 -0.40 0.00 0.00 41.96 40.44 3f8s s TYR 132 CO 0.04 -0.15 -0.13 -0.51 -1.57 0.00 0.00 175.55 173.22 3f8s s ASP 133 N 0.17 3.45 0.03 2.29 1.01 -0.54 -4.55 116.67 118.52 3f8s s ASP 133 Ca -0.05 -1.12 0.06 0.00 0.71 0.00 0.00 52.55 52.15 3f8s s ASP 133 Cb -0.11 -0.29 -0.02 0.00 1.01 0.00 0.00 42.92 43.51 3f8s s ASP 133 CO 0.02 -0.13 -0.17 -0.63 0.21 0.00 0.00 175.17 174.47 3f8s s ILE 134 N -2.66 1.37 -0.05 0.77 1.01 -1.26 -0.67 121.20 119.71 3f8s s ILE 134 Ca 0.30 -1.04 0.05 0.00 0.00 0.00 0.00 60.65 59.96 3f8s s ILE 134 Cb -0.00 -1.20 -0.01 0.00 0.01 0.00 0.00 42.46 41.26 3f8s s ILE 134 CO 0.14 0.14 -0.21 -0.47 0.00 0.00 0.00 174.94 174.55 3f8s s TYR 135 N -0.76 2.04 -0.36 3.97 6.14 -0.62 -0.89 117.35 126.87 3f8s s TYR 135 Ca 0.05 -0.61 -0.20 0.00 0.64 0.00 0.00 57.07 56.95 3f8s s TYR 135 Cb -0.08 -1.36 0.00 0.00 0.42 0.00 0.00 41.96 40.95 3f8s s TYR 135 CO 0.01 -0.20 0.61 0.34 0.64 0.00 0.00 175.55 176.96 3f8s s ASP 136 N -0.03 6.39 0.40 4.32 -1.08 -0.69 -2.00 116.67 123.97 3f8s s ASP 136 Ca -0.04 0.05 0.20 0.00 -0.52 0.00 0.00 52.55 52.23 3f8s s ASP 136 Cb -0.13 -2.31 0.82 0.00 -1.46 0.00 0.00 42.92 39.84 3f8s s ASP 136 CO 0.03 -0.59 1.80 -0.07 0.52 0.00 0.00 175.17 176.86 3f8s h LEU 137 N 9.35 0.00 -0.30 -1.34 3.38 -1.62 -2.37 115.31 122.41 3f8s h LEU 137 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3f8s h LEU 137 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 3f8s h LEU 137 CO 0.83 0.33 0.00 0.78 0.09 0.00 0.00 178.44 180.47 3f8s h ASN 138 N 0.00 0.00 -3.34 -0.43 4.21 -1.91 -3.41 115.58 110.70 3f8s h ASN 138 Ca -0.00 0.00 -0.45 0.00 1.21 0.00 0.00 56.30 57.05 3f8s h ASN 138 Cb 0.77 0.00 -0.36 0.00 -1.12 0.00 0.00 38.32 37.62 3f8s h ASN 138 CO 0.04 0.00 -0.78 -0.54 -1.29 0.00 0.00 177.43 174.86 3f8s s LYS 139 N -3.24 1.04 0.00 0.81 1.02 -0.89 -5.02 119.74 113.45 3f8s s LYS 139 Ca 0.07 -0.12 0.00 0.00 0.02 0.00 0.00 55.97 55.94 3f8s s LYS 139 Cb 0.09 -1.10 0.00 0.00 -0.52 0.00 0.00 37.83 36.30 3f8s s LYS 139 CO 0.58 -0.16 0.04 -2.13 -0.92 0.00 0.00 175.35 172.76 3f8s n ARG 140 N 4.48 0.00 -3.90 1.68 0.63 -1.25 -4.15 116.66 114.15 3f8s n ARG 140 Ca -0.17 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.65 3f8s n ARG 140 Cb 0.51 -1.41 -0.12 0.00 0.45 0.00 0.00 32.46 31.88 3f8s n ARG 140 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 3f8s s GLN 141 N 1.89 0.16 0.13 -0.14 -0.21 -1.24 -5.04 119.66 115.21 3f8s s GLN 141 Ca 0.00 -0.20 -0.31 0.00 0.02 0.00 0.00 55.36 54.87 3f8s s GLN 141 Cb 0.00 0.06 -0.08 0.00 1.00 0.00 0.00 33.01 33.99 3f8s s GLN 141 CO 0.00 -0.03 1.38 -0.51 -2.12 0.00 0.00 175.29 174.01 3f8s s LEU 142 N -0.57 4.38 -0.14 2.90 1.43 -1.26 -1.71 118.68 123.71 3f8s s LEU 142 Ca -0.06 2.35 -0.28 0.00 -1.03 0.00 0.00 54.13 55.10 3f8s s LEU 142 Cb -0.04 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.58 3f8s s LEU 142 CO -0.00 -0.64 0.97 0.27 0.23 0.00 0.00 176.35 177.18 3f8s s ILE 143 N 0.96 4.79 -0.64 -0.59 -4.36 -0.06 -4.93 121.20 116.37 3f8s s ILE 143 Ca 0.64 1.95 0.05 0.00 -0.26 0.00 0.00 60.65 63.03 3f8s s ILE 143 Cb -0.37 -4.27 0.06 0.00 1.25 0.00 0.00 42.46 39.13 3f8s s ILE 143 CO 0.31 -0.02 0.76 1.07 0.24 0.00 0.00 174.94 177.31 3f8s n THR 144 N 4.70 0.19 -4.38 8.37 5.66 -1.26 -4.49 114.28 123.07 3f8s n THR 144 Ca 0.08 -0.60 -0.26 0.00 -3.05 0.00 0.00 64.05 60.23 3f8s n THR 144 Cb 0.48 0.99 -0.13 0.00 -1.55 0.00 0.00 70.33 70.13 3f8s n THR 144 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 3f8s s GLU 145 N -0.56 1.24 -1.25 1.09 -1.05 -1.26 -4.69 118.70 112.22 3f8s s GLU 145 Ca 0.07 -1.18 -0.07 0.00 -0.15 0.00 0.00 54.97 53.65 3f8s s GLU 145 Cb 0.05 -1.54 -0.01 0.00 -0.44 0.00 0.00 34.13 32.19 3f8s s GLU 145 CO 0.07 0.37 0.70 0.39 0.95 0.00 0.00 175.26 177.73 3f8s n GLU 146 N 1.17 -3.24 -2.80 -4.83 -0.58 -1.26 -4.64 120.64 104.46 3f8s n GLU 146 Ca -0.19 0.55 -0.33 0.00 -0.42 0.00 0.00 57.16 56.78 3f8s n GLU 146 Cb 0.53 -4.80 -0.06 0.00 -0.57 0.00 0.00 31.44 26.55 3f8s n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3f8s s ARG 147 N -5.94 4.10 -0.00 3.49 0.52 -1.26 -4.79 118.95 115.08 3f8s s ARG 147 Ca 0.19 0.96 -0.34 0.00 -0.52 0.00 0.00 55.73 56.02 3f8s s ARG 147 Cb -0.06 -2.23 -0.13 0.00 0.52 0.00 0.00 34.95 33.06 3f8s s ARG 147 CO 0.83 -0.04 1.77 -0.89 0.02 0.00 0.00 175.30 176.99 3f8s n ILE 148 N -0.82 0.38 -1.15 1.52 5.41 -1.26 -4.89 119.36 118.55 3f8s n ILE 148 Ca 0.06 -0.07 -0.37 0.00 1.00 0.00 0.00 62.75 63.37 3f8s n ILE 148 Cb 0.54 -1.74 0.05 0.00 -0.71 0.00 0.00 39.64 37.77 3f8s n ILE 148 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3f8s n PRO 149 N 5.50 0.09 -3.18 0.38 -0.02 -1.26 -4.68 135.00 131.82 3f8s n PRO 149 Ca 0.21 0.05 -0.30 0.00 -2.02 0.00 0.00 63.50 61.43 3f8s n PRO 149 Cb 0.29 -1.34 -0.04 0.00 -0.02 0.00 0.00 33.50 32.39 3f8s n PRO 149 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 3f8s s ASN 150 N -1.22 6.55 -0.96 2.55 0.01 -1.26 -3.89 114.94 116.71 3f8s s ASN 150 Ca 0.55 0.97 -0.01 0.00 -0.71 0.00 0.00 52.86 53.66 3f8s s ASN 150 Cb -0.34 -2.25 0.00 0.00 0.41 0.00 0.00 41.25 39.07 3f8s s ASN 150 CO 0.68 -0.23 0.17 0.59 -1.51 0.00 0.00 177.10 176.80 3f8s n ASN 151 N -0.79 -3.99 -4.75 -1.22 3.02 -1.24 -5.01 115.26 101.27 3f8s n ASN 151 Ca 0.01 -0.08 -0.40 0.00 -0.03 0.00 0.00 54.58 54.07 3f8s n ASN 151 Cb 0.53 -3.05 -0.05 0.00 -0.61 0.00 0.00 39.78 36.61 3f8s n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3f8s s THR 152 N -2.74 3.75 -0.11 3.41 2.01 -1.17 -4.61 115.64 116.18 3f8s s THR 152 Ca 0.08 1.73 0.16 0.00 0.31 0.00 0.00 61.69 63.98 3f8s s THR 152 Cb -0.04 -4.10 -0.19 0.00 0.01 0.00 0.00 72.50 68.18 3f8s s THR 152 CO 0.10 0.40 0.67 0.00 -0.69 0.00 0.00 174.62 175.11 3f8s n GLN 153 N 1.44 0.63 -3.59 4.92 6.02 0.92 -2.85 117.38 124.87 3f8s n GLN 153 Ca -0.01 0.20 -0.10 0.00 -0.01 0.00 0.00 57.00 57.08 3f8s n GLN 153 Cb 0.46 -1.76 -0.06 0.00 1.02 0.00 0.00 30.24 29.91 3f8s n GLN 153 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 3f8s s TRP 154 N -2.81 -0.39 -0.04 1.08 -0.11 -1.21 -4.65 118.94 110.82 3f8s s TRP 154 Ca -0.04 0.75 -0.02 0.00 1.22 0.00 0.00 56.10 58.01 3f8s s TRP 154 Cb 0.08 0.43 0.03 0.00 -1.50 0.00 0.00 33.47 32.51 3f8s s TRP 154 CO 0.82 -0.30 0.08 0.08 -4.62 0.00 0.00 176.95 173.01 3f8s s VAL 155 N -0.74 -0.04 0.01 5.86 1.01 -1.26 -0.98 120.40 124.27 3f8s s VAL 155 Ca -0.00 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.15 3f8s s VAL 155 Cb -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 36.38 36.21 3f8s s VAL 155 CO -0.01 0.06 -0.11 0.42 0.00 0.00 0.00 175.10 175.46 3f8s s THR 156 N 0.78 0.83 0.88 3.92 -4.23 0.37 -5.00 115.64 113.18 3f8s s THR 156 Ca -0.06 -0.67 -0.12 0.00 -1.18 0.00 0.00 61.69 59.67 3f8s s THR 156 Cb -0.08 -0.74 0.12 0.00 1.34 0.00 0.00 72.50 73.13 3f8s s THR 156 CO -0.03 0.08 1.10 0.26 -0.54 0.00 0.00 174.62 175.49 3f8s s TRP 157 N -0.55 2.49 0.74 3.99 0.52 -1.26 -1.47 118.94 123.40 3f8s s TRP 157 Ca 0.01 1.14 -0.11 0.00 0.02 0.00 0.00 56.10 57.17 3f8s s TRP 157 Cb -0.06 -3.19 0.05 0.00 -1.15 0.00 0.00 33.47 29.12 3f8s s TRP 157 CO 0.00 -2.24 1.11 -1.54 0.02 0.00 0.00 176.95 174.30 3f8s s SER 158 N -3.66 5.01 0.37 2.95 1.04 -0.79 -4.83 113.70 113.80 3f8s s SER 158 Ca 0.63 0.88 0.10 0.00 0.48 0.00 0.00 55.95 58.05 3f8s s SER 158 Cb -0.16 -1.56 0.72 0.00 0.10 0.00 0.00 66.02 65.12 3f8s s SER 158 CO 0.56 -1.57 1.85 -0.65 0.98 0.00 0.00 173.24 174.41 3f8s h PRO 159 N -0.77 0.14 -3.43 4.02 0.11 -1.81 -3.42 132.00 126.84 3f8s h PRO 159 Ca -0.45 -0.04 -0.40 0.00 0.11 0.00 0.00 66.00 65.22 3f8s h PRO 159 Cb 1.29 -0.01 -0.39 0.00 0.11 0.00 0.00 31.00 32.00 3f8s h PRO 159 CO 0.64 0.40 -0.75 0.54 -0.21 0.00 0.00 178.00 178.62 3f8s s VAL 160 N -4.43 0.05 0.00 3.15 0.11 -1.26 -4.74 120.40 113.28 3f8s s VAL 160 Ca -0.04 0.30 0.00 0.00 -2.93 0.00 0.00 61.98 59.30 3f8s s VAL 160 Cb 0.15 -0.30 0.00 0.00 -1.53 0.00 0.00 36.38 34.70 3f8s s VAL 160 CO 0.73 0.18 0.00 0.61 -3.33 0.00 0.00 175.10 173.30 3f8s n GLY 161 N 5.25 0.12 2.70 6.54 0.00 -1.26 -4.75 105.19 113.80 3f8s n GLY 161 Ca -0.05 -1.90 -0.04 0.00 0.00 0.00 0.00 46.02 44.03 3f8s n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3f8s n HIS 162 N 0.00 1.49 -2.71 1.61 1.44 -1.26 -3.29 115.22 112.50 3f8s n HIS 162 Ca 0.00 -2.22 -0.34 0.00 -2.01 0.00 0.00 57.72 53.16 3f8s n HIS 162 Cb 0.00 -0.26 -0.06 0.00 0.12 0.00 0.00 29.99 29.80 3f8s n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3f8s s LYS 163 N -3.72 4.09 -0.03 -1.40 1.02 -1.26 -4.53 119.74 113.90 3f8s s LYS 163 Ca 0.31 1.24 0.07 0.00 0.02 0.00 0.00 55.97 57.60 3f8s s LYS 163 Cb 0.34 -2.20 -0.02 0.00 -0.52 0.00 0.00 37.83 35.44 3f8s s LYS 163 CO -0.02 -0.17 -0.23 -0.51 -0.92 0.00 0.00 175.35 173.50 3f8s s LEU 164 N -3.21 2.04 -0.05 3.17 1.43 -0.34 -1.88 118.68 119.84 3f8s s LEU 164 Ca 0.63 -0.43 0.06 0.00 -1.03 0.00 0.00 54.13 53.35 3f8s s LEU 164 Cb -0.13 -1.22 -0.01 0.00 0.03 0.00 0.00 46.19 44.87 3f8s s LEU 164 CO 0.17 0.27 -0.23 0.00 0.23 0.00 0.00 176.35 176.78 3f8s s ALA 165 N -0.42 1.98 0.14 4.21 0.00 -0.54 -0.57 121.76 126.57 3f8s s ALA 165 Ca 0.05 -0.95 -0.05 0.00 0.00 0.00 0.00 51.96 51.02 3f8s s ALA 165 Cb -0.10 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 3f8s s ALA 165 CO 0.00 0.38 0.15 1.52 0.00 0.00 0.00 175.76 177.81 3f8s s TYR 166 N -0.11 0.64 -0.08 0.00 -0.85 -0.96 -0.48 117.35 115.52 3f8s s TYR 166 Ca -0.04 -1.02 0.03 0.00 -0.52 0.00 0.00 57.07 55.53 3f8s s TYR 166 Cb -0.13 -0.29 0.01 0.00 0.38 0.00 0.00 41.96 41.93 3f8s s TYR 166 CO 0.03 -0.60 -0.17 0.08 -1.52 0.00 0.00 175.55 173.37 3f8s s VAL 167 N -4.01 1.55 -0.10 -3.49 1.01 -0.15 -1.05 120.40 114.15 3f8s s VAL 167 Ca 0.20 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 3f8s s VAL 167 Cb 0.06 -1.37 0.05 0.00 0.00 0.00 0.00 36.38 35.12 3f8s s VAL 167 CO 0.01 0.45 0.22 0.86 0.00 0.00 0.00 175.10 176.63 3f8s s TRP 168 N 0.51 -0.31 -1.46 5.22 -0.00 0.11 -0.05 118.94 122.96 3f8s s TRP 168 Ca -0.16 0.76 -0.08 0.00 -0.00 0.00 0.00 56.10 56.63 3f8s s TRP 168 Cb -0.17 -0.05 0.03 0.00 -0.00 0.00 0.00 33.47 33.28 3f8s s TRP 168 CO 0.06 -0.27 0.70 0.09 -0.00 0.00 0.00 176.95 177.53 3f8s n ASN 169 N 4.76 -5.37 -0.45 5.86 5.03 -1.26 -2.29 115.26 121.53 3f8s n ASN 169 Ca -0.16 -0.41 -0.06 0.00 0.87 0.00 0.00 54.58 54.82 3f8s n ASN 169 Cb 0.51 -4.34 -0.03 0.00 -1.02 0.00 0.00 39.78 34.91 3f8s n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3f8s n ASN 170 N -2.56 -4.09 -4.33 6.41 4.13 -1.26 -4.49 115.26 109.07 3f8s n ASN 170 Ca -0.05 0.15 -0.29 0.00 1.68 0.00 0.00 54.58 56.06 3f8s n ASN 170 Cb 0.58 -2.11 -0.15 0.00 -1.54 0.00 0.00 39.78 36.57 3f8s n ASN 170 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3f8s s ASP 171 N -2.63 3.06 0.02 6.41 1.01 -0.97 -1.89 116.67 121.67 3f8s s ASP 171 Ca 0.00 -0.58 -0.21 0.00 0.71 0.00 0.00 52.55 52.48 3f8s s ASP 171 Cb 0.00 -0.28 -0.06 0.00 1.01 0.00 0.00 42.92 43.60 3f8s s ASP 171 CO 0.00 0.25 0.60 -0.63 0.21 0.00 0.00 175.17 175.60 3f8s s ILE 172 N -0.80 4.86 0.17 0.77 1.01 -1.26 -0.71 121.20 125.24 3f8s s ILE 172 Ca 0.11 1.27 0.07 0.00 0.00 0.00 0.00 60.65 62.10 3f8s s ILE 172 Cb -0.10 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 3f8s s ILE 172 CO 0.02 0.44 -0.15 -0.31 0.00 0.00 0.00 174.94 174.95 3f8s s TYR 173 N -0.37 1.59 -0.04 3.97 1.51 -0.22 -1.21 117.35 122.58 3f8s s TYR 173 Ca 0.31 -0.57 -0.00 0.00 -1.01 0.00 0.00 57.07 55.80 3f8s s TYR 173 Cb -0.19 -0.78 0.03 0.00 -0.11 0.00 0.00 41.96 40.91 3f8s s TYR 173 CO 0.18 0.26 0.01 0.08 -1.11 0.00 0.00 175.55 174.97 3f8s s VAL 174 N -2.58 0.17 -0.24 0.71 1.01 -0.10 -2.26 120.40 117.11 3f8s s VAL 174 Ca 0.16 0.14 -0.07 0.00 0.00 0.00 0.00 61.98 62.22 3f8s s VAL 174 Cb -0.03 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 3f8s s VAL 174 CO 0.05 0.17 0.05 -0.54 0.00 0.00 0.00 175.10 174.82 3f8s s LYS 175 N 1.35 3.62 0.30 2.72 1.02 0.27 0.89 119.74 129.91 3f8s s LYS 175 Ca -0.05 -0.50 0.13 0.00 0.02 0.00 0.00 55.97 55.57 3f8s s LYS 175 Cb -0.13 -3.25 0.44 0.00 -0.52 0.00 0.00 37.83 34.37 3f8s s LYS 175 CO -0.02 -0.16 1.64 0.82 -0.92 0.00 0.00 175.35 176.71 3f8s h ILE 176 N 5.53 1.26 -3.60 2.17 1.08 -1.84 -0.89 117.51 121.22 3f8s h ILE 176 Ca -0.38 -1.96 -0.14 0.00 -0.39 0.00 0.00 64.86 61.99 3f8s h ILE 176 Cb 1.17 2.09 -0.20 0.00 -3.07 0.00 0.00 36.82 36.82 3f8s h ILE 176 CO 0.59 0.53 -0.51 -1.61 -0.69 0.00 0.00 178.15 176.46 3f8s s GLU 177 N -3.58 0.50 0.40 2.37 2.02 -1.26 -4.41 118.70 114.74 3f8s s GLU 177 Ca -0.01 -0.48 0.17 0.00 0.02 0.00 0.00 54.97 54.67 3f8s s GLU 177 Cb 0.12 0.20 0.84 0.00 0.10 0.00 0.00 34.13 35.39 3f8s s GLU 177 CO 0.74 -0.12 1.85 -1.35 0.02 0.00 0.00 175.26 176.40 3f8s h PRO 178 N 4.17 0.00 0.00 0.39 0.11 -1.86 -2.32 132.00 132.49 3f8s h PRO 178 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3f8s h PRO 178 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3f8s h PRO 178 CO 0.42 0.33 -0.74 0.27 -0.21 0.00 0.00 178.00 178.08 3f8s n ASN 179 N -3.89 0.62 -4.92 -2.05 6.94 -1.26 -4.81 115.26 105.89 3f8s n ASN 179 Ca -0.02 -0.18 -0.26 0.00 -0.02 0.00 0.00 54.58 54.11 3f8s n ASN 179 Cb 0.40 0.45 0.02 0.00 -2.36 0.00 0.00 39.78 38.29 3f8s n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3f8s s LEU 180 N -3.64 3.41 0.48 -4.53 2.01 -0.87 -4.42 118.68 111.10 3f8s s LEU 180 Ca 0.07 0.71 -0.23 0.00 0.01 0.00 0.00 54.13 54.69 3f8s s LEU 180 Cb 0.15 -3.59 -0.07 0.00 0.01 0.00 0.00 46.19 42.70 3f8s s LEU 180 CO 0.75 -0.87 1.29 -2.84 1.01 0.00 0.00 176.35 175.69 3f8s s PRO 181 N -4.86 3.58 0.52 1.29 0.02 -1.26 -4.83 135.00 129.46 3f8s s PRO 181 Ca 0.51 2.10 -0.08 0.00 0.02 0.00 0.00 61.00 63.55 3f8s s PRO 181 Cb -0.10 -2.47 -0.04 0.00 0.02 0.00 0.00 34.50 31.91 3f8s s PRO 181 CO 0.44 -0.79 0.86 -1.54 -0.33 0.00 0.00 177.00 175.65 3f8s s SER 182 N -0.98 6.29 -0.18 2.53 1.04 -1.26 -4.65 113.70 116.49 3f8s s SER 182 Ca 0.64 1.12 -0.05 0.00 0.48 0.00 0.00 55.95 58.14 3f8s s SER 182 Cb -0.37 -2.33 -0.03 0.00 0.10 0.00 0.00 66.02 63.39 3f8s s SER 182 CO 0.45 -0.65 0.01 -0.31 0.98 0.00 0.00 173.24 173.72 3f8s s TYR 183 N -2.83 3.11 -0.01 5.02 1.51 0.26 -4.83 117.35 119.58 3f8s s TYR 183 Ca 0.50 -0.21 -0.30 0.00 -1.01 0.00 0.00 57.07 56.06 3f8s s TYR 183 Cb -0.10 -2.04 -0.05 0.00 -0.11 0.00 0.00 41.96 39.65 3f8s s TYR 183 CO 0.46 -0.03 1.39 0.50 -1.11 0.00 0.00 175.55 176.76 3f8s s ARG 184 N 0.57 4.28 -0.24 -0.62 3.52 -1.26 -0.92 118.95 124.28 3f8s s ARG 184 Ca 0.00 1.94 -0.07 0.00 -0.13 0.00 0.00 55.73 57.47 3f8s s ARG 184 Cb -0.14 -3.58 -0.17 0.00 -1.56 0.00 0.00 34.95 29.50 3f8s s ARG 184 CO 0.02 -0.57 -0.15 -0.89 -0.81 0.00 0.00 175.30 172.89 3f8s n ILE 185 N 4.69 1.55 -4.30 4.11 2.08 -0.35 -4.18 119.36 122.96 3f8s n ILE 185 Ca 0.13 -0.46 -0.28 0.00 0.56 0.00 0.00 62.75 62.70 3f8s n ILE 185 Cb 0.44 -1.69 -0.10 0.00 -0.75 0.00 0.00 39.64 37.53 3f8s n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 3f8s s THR 186 N -2.50 2.97 0.00 1.39 -4.23 -1.21 -4.80 115.64 107.25 3f8s s THR 186 Ca -0.34 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 3f8s s THR 186 Cb 0.10 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.53 3f8s s THR 186 CO 0.58 0.00 0.25 0.79 -0.54 0.00 0.00 174.62 175.70 3f8s n TRP 187 N 0.45 0.00 0.36 3.99 7.02 -1.26 -4.57 117.44 123.43 3f8s n TRP 187 Ca -0.13 -0.02 0.12 0.00 -1.02 0.00 0.00 57.50 56.45 3f8s n TRP 187 Cb 0.54 -0.00 0.13 0.00 -2.42 0.00 0.00 31.31 29.56 3f8s n TRP 187 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 3f8s h THR 188 N 0.68 0.00 -2.73 -0.99 1.35 -1.95 -3.48 112.91 105.80 3f8s h THR 188 Ca 0.00 -0.75 -0.55 0.00 -0.55 0.00 0.00 66.41 64.56 3f8s h THR 188 Cb 0.33 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.14 3f8s h THR 188 CO 0.00 0.00 1.00 -0.83 -0.25 0.00 0.00 175.52 175.44 3f8s s GLY 189 N -3.98 1.62 0.02 5.82 0.00 -1.26 -4.81 107.32 104.72 3f8s s GLY 189 Ca 0.04 0.85 0.05 0.00 0.00 0.00 0.00 44.72 45.66 3f8s s GLY 189 CO 0.73 2.82 -0.16 1.25 0.00 0.00 0.00 173.10 177.74 3f8s s LYS 190 N 3.53 1.13 0.31 2.90 2.20 -0.79 -4.82 119.74 124.20 3f8s s LYS 190 Ca 0.68 -0.70 -0.29 0.00 -0.36 0.00 0.00 55.97 55.29 3f8s s LYS 190 Cb -0.31 -1.14 -0.11 0.00 -1.51 0.00 0.00 37.83 34.76 3f8s s LYS 190 CO 0.26 0.30 1.55 -2.00 -0.36 0.00 0.00 175.35 175.10 3f8s s GLU 191 N -0.82 4.14 0.00 4.03 2.12 -1.26 -1.59 118.70 125.31 3f8s s GLU 191 Ca 0.04 2.54 0.00 0.00 0.36 0.00 0.00 54.97 57.92 3f8s s GLU 191 Cb -0.07 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.30 3f8s s GLU 191 CO 0.01 -0.58 0.00 -0.25 -0.54 0.00 0.00 175.26 173.90 3f8s n ASP 192 N 1.76 -2.03 0.07 -1.70 8.00 -1.26 -4.61 116.55 116.78 3f8s n ASP 192 Ca 0.06 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.56 3f8s n ASP 192 Cb 0.38 -2.57 0.00 0.00 -0.02 0.00 0.00 41.12 38.91 3f8s n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3f8s n ILE 193 N -2.04 0.62 -4.16 0.53 5.41 -0.90 -4.74 119.36 114.07 3f8s n ILE 193 Ca 0.00 0.20 -0.33 0.00 1.00 0.00 0.00 62.75 63.62 3f8s n ILE 193 Cb 0.16 -1.18 -0.16 0.00 -0.71 0.00 0.00 39.64 37.75 3f8s n ILE 193 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3f8s s ILE 194 N -2.00 2.05 -0.21 1.39 -1.09 -0.62 -0.06 121.20 120.66 3f8s s ILE 194 Ca 0.00 -0.94 -0.04 0.00 -2.23 0.00 0.00 60.65 57.45 3f8s s ILE 194 Cb 0.00 -1.85 -0.01 0.00 -1.58 0.00 0.00 42.46 39.02 3f8s s ILE 194 CO 0.00 0.54 -0.04 -0.31 -1.23 0.00 0.00 174.94 173.90 3f8s s TYR 195 N 1.26 2.97 -0.29 3.97 1.51 -0.57 -1.89 117.35 124.30 3f8s s TYR 195 Ca 0.04 -0.78 -0.05 0.00 -1.01 0.00 0.00 57.07 55.27 3f8s s TYR 195 Cb -0.13 -2.08 0.02 0.00 -0.11 0.00 0.00 41.96 39.66 3f8s s TYR 195 CO -0.12 -0.44 0.04 -0.80 -1.11 0.00 0.00 175.55 173.12 3f8s s ASN 196 N 1.27 4.92 0.00 2.29 0.01 -0.79 -0.53 114.94 122.11 3f8s s ASN 196 Ca 0.03 -0.89 0.00 0.00 -0.71 0.00 0.00 52.86 51.29 3f8s s ASN 196 Cb -0.14 -1.80 0.00 0.00 0.41 0.00 0.00 41.25 39.71 3f8s s ASN 196 CO -0.01 -0.21 0.00 0.61 -1.51 0.00 0.00 177.10 175.98 3f8s n GLY 197 N 4.78 0.75 3.13 0.66 0.00 -0.28 -4.13 105.19 110.10 3f8s n GLY 197 Ca -0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 3f8s n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3f8s s ILE 198 N -2.52 0.15 0.47 -0.61 -4.36 -1.26 -1.56 121.20 111.52 3f8s s ILE 198 Ca 0.00 -1.25 -0.02 0.00 -0.26 0.00 0.00 60.65 59.12 3f8s s ILE 198 Cb 0.00 -1.10 -0.01 0.00 1.25 0.00 0.00 42.46 42.60 3f8s s ILE 198 CO 0.00 -0.69 0.73 0.42 0.24 0.00 0.00 174.94 175.64 3f8s s THR 199 N -3.10 4.37 0.17 8.37 -4.23 -0.21 -4.68 115.64 116.32 3f8s s THR 199 Ca -0.01 -0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 60.29 3f8s s THR 199 Cb 0.02 -3.64 0.03 0.00 1.34 0.00 0.00 72.50 70.25 3f8s s THR 199 CO -0.07 -0.54 0.23 -0.90 -0.54 0.00 0.00 174.62 172.80 3f8s n ASP 200 N -2.18 0.24 0.29 3.99 5.75 -1.26 -4.83 116.55 118.56 3f8s n ASP 200 Ca 0.01 -1.22 -0.15 0.00 -0.01 0.00 0.00 54.79 53.42 3f8s n ASP 200 Cb 0.57 -0.15 -0.08 0.00 -1.03 0.00 0.00 41.12 40.42 3f8s n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3f8s h TRP 201 N -0.56 -1.08 -0.73 2.11 7.01 -2.00 -2.16 115.95 118.53 3f8s h TRP 201 Ca -0.08 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.92 3f8s h TRP 201 Cb 0.26 0.40 -0.04 0.00 -2.10 0.00 0.00 29.16 27.69 3f8s h TRP 201 CO 0.00 -0.56 0.45 -0.39 -2.79 0.00 0.00 178.44 175.15 3f8s h VAL 202 N -0.88 1.20 -0.31 2.65 -1.51 -1.97 -1.51 116.25 113.91 3f8s h VAL 202 Ca -0.07 -0.43 -0.04 0.00 -1.23 0.00 0.00 66.70 64.93 3f8s h VAL 202 Cb 0.73 0.16 -0.01 0.00 -2.13 0.00 0.00 31.29 30.04 3f8s h VAL 202 CO 0.02 0.21 0.03 1.88 -1.23 0.00 0.00 177.57 178.47 3f8s h TYR 203 N 1.01 0.58 0.14 5.19 -1.99 -1.93 1.02 116.97 120.99 3f8s h TYR 203 Ca 0.27 -0.09 0.02 0.00 2.00 0.00 0.00 58.73 60.92 3f8s h TYR 203 Cb -0.06 -0.15 -0.04 0.00 2.00 0.00 0.00 36.73 38.47 3f8s h TYR 203 CO 0.00 0.64 -0.42 1.49 -0.00 0.00 0.00 178.16 179.87 3f8s h GLU 204 N 0.35 -0.65 -0.31 4.88 4.81 -1.07 0.17 114.58 122.76 3f8s h GLU 204 Ca 0.09 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 3f8s h GLU 204 Cb 0.39 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3f8s h GLU 204 CO 0.01 -0.43 -0.05 1.49 -0.73 0.00 0.00 179.01 179.30 3f8s h GLU 205 N -0.67 0.58 0.00 1.92 4.57 -1.21 -0.45 114.58 119.32 3f8s h GLU 205 Ca 0.02 -0.21 -0.16 0.00 -1.18 0.00 0.00 59.36 57.82 3f8s h GLU 205 Cb 0.69 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.21 3f8s h GLU 205 CO -0.23 0.76 -1.65 0.39 -1.18 0.00 0.00 179.01 177.09 3f8s n GLU 206 N -4.49 2.24 -0.09 1.92 -0.58 0.35 -4.50 120.64 115.49 3f8s n GLU 206 Ca -0.03 -0.01 -0.16 0.00 -0.42 0.00 0.00 57.16 56.54 3f8s n GLU 206 Cb 0.31 -1.25 -0.05 0.00 -0.57 0.00 0.00 31.44 29.87 3f8s n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3f8s n VAL 207 N -2.32 1.38 0.28 2.62 0.31 -0.39 -4.72 118.33 115.50 3f8s n VAL 207 Ca -0.15 -0.07 0.11 0.00 -0.01 0.00 0.00 64.34 64.22 3f8s n VAL 207 Cb 0.77 -2.03 -0.06 0.00 -0.91 0.00 0.00 33.84 31.61 3f8s n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3f8s n PHE 208 N -4.19 0.32 -3.87 3.52 3.72 0.44 -4.97 117.46 112.42 3f8s n PHE 208 Ca -0.29 0.09 -0.24 0.00 -0.05 0.00 0.00 57.45 56.96 3f8s n PHE 208 Cb 0.63 -0.55 -0.00 0.00 -0.94 0.00 0.00 39.48 38.62 3f8s n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3f8s n SER 209 N -2.20 -0.63 -3.65 4.37 7.64 -0.28 -4.94 113.62 113.93 3f8s n SER 209 Ca -0.01 -0.94 -0.03 0.00 1.01 0.00 0.00 58.87 58.90 3f8s n SER 209 Cb 0.50 -3.39 -0.07 0.00 -1.01 0.00 0.00 64.21 60.25 3f8s n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3f8s s ALA 210 N -3.86 -2.23 0.13 -0.43 0.00 -0.57 -5.00 121.76 109.81 3f8s s ALA 210 Ca 0.01 1.72 -0.09 0.00 0.00 0.00 0.00 51.96 53.60 3f8s s ALA 210 Cb -0.01 -1.76 -0.07 0.00 0.00 0.00 0.00 23.12 21.28 3f8s s ALA 210 CO 0.86 -0.13 1.36 -0.92 0.00 0.00 0.00 175.76 176.94 3f8s h TYR 211 N 3.37 0.91 -3.87 0.00 3.20 -1.86 -3.37 116.97 115.36 3f8s h TYR 211 Ca -0.27 -0.39 -0.51 0.00 3.14 0.00 0.00 58.73 60.70 3f8s h TYR 211 Cb 1.19 -0.14 0.05 0.00 1.54 0.00 0.00 36.73 39.36 3f8s h TYR 211 CO 0.23 1.19 0.55 0.45 -1.64 0.00 0.00 178.16 178.94 3f8s s SER 212 N -7.05 6.89 -0.34 -2.11 0.15 -1.26 -1.04 113.70 108.94 3f8s s SER 212 Ca -0.09 2.47 0.16 0.00 0.70 0.00 0.00 55.95 59.19 3f8s s SER 212 Cb 0.09 -2.63 0.46 0.00 -1.71 0.00 0.00 66.02 62.23 3f8s s SER 212 CO 0.88 -0.43 1.01 0.00 1.20 0.00 0.00 173.24 175.90 3f8s n ALA 213 N 0.78 3.72 -2.38 5.45 0.00 -0.60 -4.71 120.51 122.77 3f8s n ALA 213 Ca 0.00 -3.35 -0.29 0.00 0.00 0.00 0.00 53.44 49.80 3f8s n ALA 213 Cb 0.44 -0.83 -0.15 0.00 0.00 0.00 0.00 19.45 18.91 3f8s n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3f8s s LEU 214 N -3.30 2.13 -0.20 0.00 1.43 -1.26 -1.95 118.68 115.53 3f8s s LEU 214 Ca 0.32 -0.53 -0.05 0.00 -1.03 0.00 0.00 54.13 52.85 3f8s s LEU 214 Cb 0.43 -1.21 0.07 0.00 0.03 0.00 0.00 46.19 45.52 3f8s s LEU 214 CO -0.02 0.25 0.12 0.26 0.23 0.00 0.00 176.35 177.19 3f8s s TRP 215 N -0.73 0.14 0.45 0.29 0.51 0.12 -4.98 118.94 114.74 3f8s s TRP 215 Ca 0.10 -0.35 -0.22 0.00 -2.12 0.00 0.00 56.10 53.51 3f8s s TRP 215 Cb -0.09 -0.68 -0.08 0.00 -0.81 0.00 0.00 33.47 31.80 3f8s s TRP 215 CO 0.01 -0.60 1.07 -1.58 -0.51 0.00 0.00 176.95 175.35 3f8s s TRP 216 N 2.16 3.05 0.71 -1.98 0.52 -1.26 -0.67 118.94 121.47 3f8s s TRP 216 Ca 0.04 1.59 -0.13 0.00 0.02 0.00 0.00 56.10 57.63 3f8s s TRP 216 Cb -0.16 -3.16 0.02 0.00 -1.15 0.00 0.00 33.47 29.02 3f8s s TRP 216 CO -0.15 -0.93 1.10 -1.54 0.02 0.00 0.00 176.95 175.44 3f8s s SER 217 N -1.69 4.90 0.15 2.95 1.04 -0.68 -4.89 113.70 115.49 3f8s s SER 217 Ca 0.63 1.89 -0.22 0.00 0.48 0.00 0.00 55.95 58.74 3f8s s SER 217 Cb -0.21 -2.53 0.04 0.00 0.10 0.00 0.00 66.02 63.42 3f8s s SER 217 CO 0.26 -1.77 1.63 -0.65 0.98 0.00 0.00 173.24 173.70 3f8s h PRO 218 N -0.48 -0.20 -0.99 4.02 0.11 -1.91 0.90 132.00 133.45 3f8s h PRO 218 Ca -0.45 0.01 0.37 0.00 0.11 0.00 0.00 66.00 66.04 3f8s h PRO 218 Cb 1.24 0.05 -0.17 0.00 0.11 0.00 0.00 31.00 32.22 3f8s h PRO 218 CO 0.53 -0.14 0.45 -0.91 -0.21 0.00 0.00 178.00 177.73 3f8s h ASN 219 N -0.21 0.22 0.00 -2.05 2.35 -1.93 -3.37 115.58 110.58 3f8s h ASN 219 Ca 0.15 0.25 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 3f8s h ASN 219 Cb 0.44 0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.09 3f8s h ASN 219 CO -0.40 -0.36 0.00 0.61 -1.65 0.00 0.00 177.43 175.63 3f8s n GLY 220 N -1.31 0.73 0.23 2.83 0.00 0.31 -4.61 105.19 103.37 3f8s n GLY 220 Ca 0.34 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.24 3f8s n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3f8s h THR 221 N 0.00 0.43 -3.21 2.61 2.02 -1.89 -3.45 112.91 109.43 3f8s h THR 221 Ca 0.00 -0.67 -0.57 0.00 0.77 0.00 0.00 66.41 65.94 3f8s h THR 221 Cb 0.00 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 3f8s h THR 221 CO 0.00 0.09 -0.28 -0.36 0.37 0.00 0.00 175.52 175.34 3f8s s PHE 222 N -4.04 3.47 -0.25 3.16 0.08 -1.26 -0.79 117.98 118.35 3f8s s PHE 222 Ca -0.12 0.60 0.02 0.00 0.12 0.00 0.00 56.93 57.55 3f8s s PHE 222 Cb 0.01 -2.04 0.05 0.00 -0.57 0.00 0.00 43.02 40.48 3f8s s PHE 222 CO 0.43 0.41 -0.11 -1.17 -0.10 0.00 0.00 175.22 174.68 3f8s s LEU 223 N -2.68 3.33 0.14 -0.37 0.20 0.11 -1.68 118.68 117.72 3f8s s LEU 223 Ca 0.42 -1.29 -0.14 0.00 0.69 0.00 0.00 54.13 53.81 3f8s s LEU 223 Cb -0.12 -1.56 -0.07 0.00 -0.43 0.00 0.00 46.19 44.01 3f8s s LEU 223 CO 0.24 -0.17 0.54 0.00 -0.29 0.00 0.00 176.35 176.67 3f8s s ALA 224 N 1.14 3.58 0.19 5.97 0.00 0.16 -0.88 121.76 131.92 3f8s s ALA 224 Ca -0.07 -0.13 -0.14 0.00 0.00 0.00 0.00 51.96 51.62 3f8s s ALA 224 Cb -0.19 -2.52 0.01 0.00 0.00 0.00 0.00 23.12 20.42 3f8s s ALA 224 CO -0.06 0.46 0.43 1.52 0.00 0.00 0.00 175.76 178.11 3f8s s TYR 225 N -1.45 0.11 0.17 0.00 -0.85 0.62 0.13 117.35 116.08 3f8s s TYR 225 Ca 0.37 -0.47 0.11 0.00 -0.52 0.00 0.00 57.07 56.57 3f8s s TYR 225 Cb -0.15 0.21 -0.04 0.00 0.38 0.00 0.00 41.96 42.36 3f8s s TYR 225 CO 0.19 -0.85 -0.24 0.00 -1.52 0.00 0.00 175.55 173.12 3f8s s ALA 226 N -3.92 2.50 -0.07 9.51 0.00 -0.82 -0.49 121.76 128.47 3f8s s ALA 226 Ca 0.13 -1.58 0.03 0.00 0.00 0.00 0.00 51.96 50.55 3f8s s ALA 226 Cb 0.01 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.77 3f8s s ALA 226 CO -0.01 0.47 -0.17 -1.14 0.00 0.00 0.00 175.76 174.92 3f8s s GLN 227 N -2.47 2.11 0.01 0.00 0.74 -0.90 -1.12 119.66 118.02 3f8s s GLN 227 Ca 0.19 -0.59 0.04 0.00 0.05 0.00 0.00 55.36 55.05 3f8s s GLN 227 Cb -0.09 -1.69 -0.03 0.00 1.10 0.00 0.00 33.01 32.30 3f8s s GLN 227 CO 0.09 0.11 -0.07 -0.06 -0.55 0.00 0.00 175.29 174.81 3f8s s PHE 228 N 0.45 2.86 -0.23 1.67 0.08 0.31 -2.28 117.98 120.83 3f8s s PHE 228 Ca -0.14 -0.06 0.01 0.00 0.12 0.00 0.00 56.93 56.87 3f8s s PHE 228 Cb -0.16 -1.60 0.03 0.00 -0.57 0.00 0.00 43.02 40.73 3f8s s PHE 228 CO 0.05 0.37 -0.13 1.21 -0.10 0.00 0.00 175.22 176.62 3f8s s ASN 229 N -1.44 3.94 -0.28 1.36 3.84 -0.13 -1.51 114.94 120.73 3f8s s ASN 229 Ca 0.17 -0.96 0.09 0.00 0.21 0.00 0.00 52.86 52.37 3f8s s ASN 229 Cb -0.11 -1.56 0.49 0.00 -0.55 0.00 0.00 41.25 39.52 3f8s s ASN 229 CO 0.08 -0.10 1.43 0.47 -2.79 0.00 0.00 177.10 176.18 3f8s n ASP 230 N 4.57 2.41 -0.09 -4.21 9.92 0.91 -1.37 116.55 128.69 3f8s n ASP 230 Ca -0.17 -3.77 -0.06 0.00 -0.53 0.00 0.00 54.79 50.26 3f8s n ASP 230 Cb 0.46 -0.62 0.00 0.00 -0.64 0.00 0.00 41.12 40.33 3f8s n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3f8s h THR 231 N 1.02 0.69 -0.37 -3.53 2.02 -1.87 -2.65 112.91 108.21 3f8s h THR 231 Ca 0.18 -0.01 -0.16 0.00 0.77 0.00 0.00 66.41 67.20 3f8s h THR 231 Cb 1.56 0.66 -0.09 0.00 -1.74 0.00 0.00 68.15 68.54 3f8s h THR 231 CO 0.33 0.01 -0.00 -0.62 0.37 0.00 0.00 175.52 175.60 3f8s n GLU 232 N -5.24 2.16 -2.73 6.66 1.02 -1.26 -4.95 120.64 116.29 3f8s n GLU 232 Ca 0.01 -3.08 -0.42 0.00 -0.02 0.00 0.00 57.16 53.65 3f8s n GLU 232 Cb 0.19 -1.85 -0.03 0.00 -0.02 0.00 0.00 31.44 29.73 3f8s n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3f8s s VAL 233 N -3.14 4.81 0.76 2.62 1.01 -1.00 -4.63 120.40 120.83 3f8s s VAL 233 Ca 0.45 1.96 -0.12 0.00 0.00 0.00 0.00 61.98 64.26 3f8s s VAL 233 Cb 0.39 -4.28 0.05 0.00 0.00 0.00 0.00 36.38 32.55 3f8s s VAL 233 CO 0.03 0.02 1.12 -2.84 0.00 0.00 0.00 175.10 173.43 3f8s s PRO 234 N 1.94 2.21 -0.12 2.72 0.02 -1.26 -4.69 135.00 135.82 3f8s s PRO 234 Ca 0.46 1.36 -0.01 0.00 0.02 0.00 0.00 61.00 62.83 3f8s s PRO 234 Cb -0.18 -1.88 -0.02 0.00 0.02 0.00 0.00 34.50 32.44 3f8s s PRO 234 CO 0.17 -1.70 -0.07 -0.51 -0.33 0.00 0.00 177.00 174.56 3f8s s LEU 235 N -5.64 3.08 -0.04 -5.54 1.43 -1.26 -1.16 118.68 109.54 3f8s s LEU 235 Ca 0.65 -0.15 -0.21 0.00 -1.03 0.00 0.00 54.13 53.39 3f8s s LEU 235 Cb -0.20 -1.71 -0.05 0.00 0.03 0.00 0.00 46.19 44.26 3f8s s LEU 235 CO 0.51 0.22 0.59 -0.51 0.23 0.00 0.00 176.35 177.39 3f8s s ILE 236 N 0.02 5.00 0.02 -0.59 -1.16 -0.51 -4.90 121.20 119.08 3f8s s ILE 236 Ca -0.01 1.22 0.08 0.00 -0.51 0.00 0.00 60.65 61.43 3f8s s ILE 236 Cb -0.14 -3.93 -0.02 0.00 0.61 0.00 0.00 42.46 38.98 3f8s s ILE 236 CO 0.03 0.36 -0.23 -1.61 -2.81 0.00 0.00 174.94 170.68 3f8s s GLU 237 N 0.20 1.73 0.05 3.50 2.02 -1.26 -1.91 118.70 123.03 3f8s s GLU 237 Ca 0.31 -0.94 -0.27 0.00 0.02 0.00 0.00 54.97 54.10 3f8s s GLU 237 Cb -0.17 -1.78 0.07 0.00 0.10 0.00 0.00 34.13 32.34 3f8s s GLU 237 CO 0.16 0.47 0.64 1.52 0.02 0.00 0.00 175.26 178.07 3f8s s TYR 238 N -0.68 -0.60 0.13 1.61 1.13 -0.63 -4.97 117.35 113.33 3f8s s TYR 238 Ca 0.09 0.73 -0.30 0.00 -1.41 0.00 0.00 57.07 56.18 3f8s s TYR 238 Cb -0.09 0.48 -0.07 0.00 -1.10 0.00 0.00 41.96 41.18 3f8s s TYR 238 CO 0.01 -0.73 1.11 -1.12 -2.51 0.00 0.00 175.55 172.31 3f8s s SER 239 N -1.96 7.23 -0.16 -0.18 0.01 -1.26 -0.23 113.70 117.15 3f8s s SER 239 Ca -0.05 2.02 -0.00 0.00 1.31 0.00 0.00 55.95 59.23 3f8s s SER 239 Cb -0.00 -2.59 -0.00 0.00 0.21 0.00 0.00 66.02 63.63 3f8s s SER 239 CO -0.01 -0.29 -0.15 0.12 0.41 0.00 0.00 173.24 173.32 3f8s s PHE 240 N 0.26 2.80 -0.12 2.43 5.36 0.13 -4.70 117.98 124.13 3f8s s PHE 240 Ca 0.52 -1.07 0.17 0.00 -0.96 0.00 0.00 56.93 55.59 3f8s s PHE 240 Cb -0.28 -1.91 -0.15 0.00 -0.34 0.00 0.00 43.02 40.34 3f8s s PHE 240 CO 0.32 -0.50 0.76 0.66 -1.46 0.00 0.00 175.22 175.00 3f8s n TYR 241 N 4.15 0.88 -4.77 10.12 4.01 -1.26 -0.27 117.16 130.02 3f8s n TYR 241 Ca -0.19 0.29 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 3f8s n TYR 241 Cb 0.52 -1.06 0.00 0.00 -0.31 0.00 0.00 39.34 38.49 3f8s n TYR 241 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3f8s n SER 242 N -2.85 -1.84 -4.79 7.72 2.88 -1.26 -4.74 113.62 108.74 3f8s n SER 242 Ca -0.11 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.09 3f8s n SER 242 Cb 0.85 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.29 3f8s n SER 242 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 3f8s s ASP 243 N -4.00 6.11 0.48 -3.46 1.11 -1.26 -4.90 116.67 110.74 3f8s s ASP 243 Ca 0.00 2.02 0.35 0.00 0.18 0.00 0.00 52.55 55.10 3f8s s ASP 243 Cb 0.00 -2.57 1.49 0.00 1.07 0.00 0.00 42.92 42.91 3f8s s ASP 243 CO 0.00 -0.95 1.65 -0.08 1.18 0.00 0.00 175.17 176.98 3f8s h GLU 244 N 1.42 0.08 0.00 8.23 4.81 -2.05 0.24 114.58 127.31 3f8s h GLU 244 Ca -0.50 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3f8s h GLU 244 Cb 1.24 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 3f8s h GLU 244 CO 0.58 0.05 -0.02 0.66 -0.73 0.00 0.00 179.01 179.56 3f8s h SER 245 N 0.08 0.00 -2.58 1.04 4.64 -1.94 -3.41 113.55 111.39 3f8s h SER 245 Ca 0.79 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 61.57 3f8s h SER 245 Cb 2.70 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 64.74 3f8s h SER 245 CO -0.25 0.02 1.21 -0.22 -0.87 0.00 0.00 176.83 176.72 3f8s s LEU 246 N -7.83 3.41 0.13 5.97 0.20 0.83 -4.90 118.68 116.47 3f8s s LEU 246 Ca -0.05 0.58 -0.22 0.00 0.69 0.00 0.00 54.13 55.14 3f8s s LEU 246 Cb 0.15 -3.05 -0.04 0.00 -0.43 0.00 0.00 46.19 42.83 3f8s s LEU 246 CO 0.57 -1.88 1.68 -0.61 -0.29 0.00 0.00 176.35 175.82 3f8s h GLN 247 N 12.57 -0.12 -5.03 1.98 4.15 -1.88 -3.41 115.11 123.37 3f8s h GLN 247 Ca -0.28 0.01 -0.66 0.00 0.77 0.00 0.00 58.65 58.49 3f8s h GLN 247 Cb 1.13 0.03 -0.30 0.00 0.21 0.00 0.00 27.48 28.55 3f8s h GLN 247 CO 1.15 -0.08 -0.76 0.71 -1.93 0.00 0.00 178.83 177.91 3f8s s TYR 248 N -6.17 2.90 0.72 3.99 1.51 -1.26 -5.10 117.35 113.94 3f8s s TYR 248 Ca -0.14 -1.11 -0.16 0.00 -1.01 0.00 0.00 57.07 54.65 3f8s s TYR 248 Cb 0.10 -2.04 -0.03 0.00 -0.11 0.00 0.00 41.96 39.88 3f8s s TYR 248 CO 0.68 -0.60 0.65 -2.30 -1.11 0.00 0.00 175.55 172.87 3f8s n PRO 249 N 4.68 0.35 -3.81 -1.71 -0.02 -1.26 -4.99 135.00 128.24 3f8s n PRO 249 Ca -0.19 0.16 -0.29 0.00 -2.02 0.00 0.00 63.50 61.17 3f8s n PRO 249 Cb 0.51 -1.94 -0.04 0.00 -0.02 0.00 0.00 33.50 32.01 3f8s n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3f8s s LYS 250 N -2.92 3.50 -0.33 -0.52 2.20 0.63 -4.92 119.74 117.38 3f8s s LYS 250 Ca 0.68 -0.38 -0.09 0.00 -0.36 0.00 0.00 55.97 55.82 3f8s s LYS 250 Cb -0.35 -2.93 0.01 0.00 -1.51 0.00 0.00 37.83 33.06 3f8s s LYS 250 CO 0.56 0.50 0.14 0.99 -0.36 0.00 0.00 175.35 177.17 3f8s s THR 251 N -1.70 4.26 -0.03 3.43 2.01 -1.26 0.22 115.64 122.57 3f8s s THR 251 Ca 0.37 -0.73 -0.25 0.00 0.31 0.00 0.00 61.69 61.39 3f8s s THR 251 Cb -0.12 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.08 3f8s s THR 251 CO 0.28 -0.05 0.77 -0.69 -0.69 0.00 0.00 174.62 174.24 3f8s s VAL 252 N 1.53 4.95 -0.43 3.82 1.01 0.68 -4.89 120.40 127.07 3f8s s VAL 252 Ca 0.02 1.60 0.02 0.00 0.00 0.00 0.00 61.98 63.62 3f8s s VAL 252 Cb -0.18 -4.11 0.13 0.00 0.00 0.00 0.00 36.38 32.22 3f8s s VAL 252 CO 0.05 0.26 0.23 -0.13 0.00 0.00 0.00 175.10 175.50 3f8s s ARG 253 N 0.67 1.28 -0.23 2.72 0.52 -1.26 -1.61 118.95 121.05 3f8s s ARG 253 Ca 0.41 -1.97 -0.06 0.00 -0.52 0.00 0.00 55.73 53.59 3f8s s ARG 253 Cb -0.19 -2.37 -0.02 0.00 0.52 0.00 0.00 34.95 32.89 3f8s s ARG 253 CO 0.21 -1.14 0.02 0.08 0.02 0.00 0.00 175.30 174.48 3f8s s VAL 254 N 0.42 3.91 0.18 3.52 1.01 -0.80 -4.90 120.40 123.73 3f8s s VAL 254 Ca 0.17 -0.31 -0.32 0.00 0.00 0.00 0.00 61.98 61.52 3f8s s VAL 254 Cb -0.24 -2.80 -0.11 0.00 0.00 0.00 0.00 36.38 33.22 3f8s s VAL 254 CO -0.01 0.39 1.74 -2.84 0.00 0.00 0.00 175.10 174.38 3f8s s PRO 255 N 1.42 4.14 -0.29 2.72 0.02 -1.26 -1.42 135.00 140.32 3f8s s PRO 255 Ca 0.05 2.58 -0.04 0.00 0.02 0.00 0.00 61.00 63.61 3f8s s PRO 255 Cb -0.15 -3.25 0.17 0.00 0.02 0.00 0.00 34.50 31.29 3f8s s PRO 255 CO 0.01 -0.77 0.60 -0.47 -0.33 0.00 0.00 177.00 176.04 3f8s s TYR 256 N 1.67 -1.47 -0.18 6.54 6.14 -0.31 -4.49 117.35 125.25 3f8s s TYR 256 Ca 0.76 1.86 -0.28 0.00 0.64 0.00 0.00 57.07 60.06 3f8s s TYR 256 Cb -0.48 0.61 -0.00 0.00 0.42 0.00 0.00 41.96 42.51 3f8s s TYR 256 CO 0.33 -0.80 0.96 -1.25 0.64 0.00 0.00 175.55 175.44 3f8s s PRO 257 N 2.85 4.31 0.54 4.97 0.04 -1.26 -4.47 135.00 141.98 3f8s s PRO 257 Ca 0.12 1.25 -0.02 0.00 0.04 0.00 0.00 61.00 62.39 3f8s s PRO 257 Cb -0.14 -3.59 0.02 0.00 0.04 0.00 0.00 34.50 30.82 3f8s s PRO 257 CO -0.20 -0.45 0.79 0.15 0.04 0.00 0.00 177.00 177.34 3f8s s LYS 258 N 2.54 2.78 -0.26 4.56 1.02 -1.26 -1.46 119.74 127.66 3f8s s LYS 258 Ca 0.43 -0.44 -0.38 0.00 0.02 0.00 0.00 55.97 55.61 3f8s s LYS 258 Cb -0.16 -2.43 -0.17 0.00 -0.52 0.00 0.00 37.83 34.55 3f8s s LYS 258 CO 0.11 -0.61 1.19 0.00 -0.92 0.00 0.00 175.35 175.13 3f8s n ALA 259 N -2.37 -1.92 -0.47 5.17 0.00 -0.75 -0.78 120.51 119.38 3f8s n ALA 259 Ca 0.05 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3f8s n ALA 259 Cb 0.59 -1.58 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3f8s n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f8s n GLY 260 N 2.59 1.55 3.54 0.00 0.00 -1.26 -4.87 105.19 106.75 3f8s n GLY 260 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 3f8s n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f8s n ALA 261 N 0.09 -0.83 -2.05 4.61 0.00 0.04 -4.97 120.51 117.39 3f8s n ALA 261 Ca 0.00 -1.66 -0.42 0.00 0.00 0.00 0.00 53.44 51.35 3f8s n ALA 261 Cb 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 19.45 19.48 3f8s n ALA 261 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3f8s s VAL 262 N -3.36 3.65 0.66 0.00 1.01 -1.26 -4.93 120.40 116.17 3f8s s VAL 262 Ca 0.66 0.77 -0.08 0.00 0.00 0.00 0.00 61.98 63.33 3f8s s VAL 262 Cb -0.02 -3.54 0.02 0.00 0.00 0.00 0.00 36.38 32.84 3f8s s VAL 262 CO 0.45 -0.11 1.00 0.20 0.00 0.00 0.00 175.10 176.64 3f8s s ASN 263 N 3.50 5.38 0.74 3.32 0.02 -1.26 -4.48 114.94 122.16 3f8s s ASN 263 Ca 0.72 0.83 -0.11 0.00 -1.02 0.00 0.00 52.86 53.28 3f8s s ASN 263 Cb -0.31 -1.69 0.04 0.00 0.02 0.00 0.00 41.25 39.31 3f8s s ASN 263 CO 0.28 -1.27 1.08 -2.16 0.02 0.00 0.00 177.10 175.05 3f8s s PRO 264 N -5.19 2.49 0.34 -0.60 0.04 -1.26 -4.75 135.00 126.08 3f8s s PRO 264 Ca 0.57 1.14 0.08 0.00 0.04 0.00 0.00 61.00 62.82 3f8s s PRO 264 Cb -0.11 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 3f8s s PRO 264 CO 0.48 -1.46 0.16 0.95 0.04 0.00 0.00 177.00 177.17 3f8s s THR 265 N -2.88 3.10 0.04 1.26 -4.23 -0.47 -4.92 115.64 107.54 3f8s s THR 265 Ca 0.61 -1.66 0.02 0.00 -1.18 0.00 0.00 61.69 59.48 3f8s s THR 265 Cb -0.17 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.65 3f8s s THR 265 CO 0.54 -0.19 -0.07 0.54 -0.54 0.00 0.00 174.62 174.90 3f8s s VAL 266 N -2.41 0.49 0.06 2.29 0.11 -1.26 -0.95 120.40 118.73 3f8s s VAL 266 Ca 0.38 -1.13 0.04 0.00 -2.93 0.00 0.00 61.98 58.34 3f8s s VAL 266 Cb -0.03 -0.65 -0.03 0.00 -1.53 0.00 0.00 36.38 34.14 3f8s s VAL 266 CO 0.23 -0.44 -0.11 -0.54 -3.33 0.00 0.00 175.10 170.91 3f8s s LYS 267 N -1.75 0.70 -0.08 1.54 1.02 -0.97 -5.01 119.74 115.19 3f8s s LYS 267 Ca -0.09 -0.91 0.03 0.00 0.02 0.00 0.00 55.97 55.03 3f8s s LYS 267 Cb -0.09 -0.56 -0.01 0.00 -0.52 0.00 0.00 37.83 36.65 3f8s s LYS 267 CO -0.00 0.11 -0.19 0.12 -0.92 0.00 0.00 175.35 174.47 3f8s s PHE 268 N -1.50 2.62 0.07 3.18 5.36 -1.24 -2.11 117.98 124.37 3f8s s PHE 268 Ca -0.04 -0.61 0.04 0.00 -0.96 0.00 0.00 56.93 55.36 3f8s s PHE 268 Cb -0.09 -1.69 -0.03 0.00 -0.34 0.00 0.00 43.02 40.87 3f8s s PHE 268 CO 0.01 -0.15 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.44 3f8s s PHE 269 N -0.07 1.08 -0.01 10.12 0.08 0.36 0.47 117.98 130.01 3f8s s PHE 269 Ca -0.04 -0.52 0.03 0.00 0.12 0.00 0.00 56.93 56.52 3f8s s PHE 269 Cb -0.14 -0.61 -0.01 0.00 -0.57 0.00 0.00 43.02 41.69 3f8s s PHE 269 CO 0.04 0.02 -0.09 0.08 -0.10 0.00 0.00 175.22 175.18 3f8s s VAL 270 N -1.60 0.69 0.02 -0.44 1.01 0.11 -0.28 120.40 119.92 3f8s s VAL 270 Ca -0.01 -0.39 0.04 0.00 0.00 0.00 0.00 61.98 61.61 3f8s s VAL 270 Cb -0.08 -0.58 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 3f8s s VAL 270 CO 0.01 0.18 -0.11 -0.69 0.00 0.00 0.00 175.10 174.50 3f8s s VAL 271 N -0.23 0.87 -0.76 2.92 1.01 -0.06 -0.90 120.40 123.25 3f8s s VAL 271 Ca 0.03 -0.72 -0.18 0.00 0.00 0.00 0.00 61.98 61.12 3f8s s VAL 271 Cb -0.04 -0.78 0.14 0.00 0.00 0.00 0.00 36.38 35.71 3f8s s VAL 271 CO -0.00 0.07 0.85 0.21 0.00 0.00 0.00 175.10 176.23 3f8s s ASN 272 N -0.74 6.48 0.00 3.32 3.84 -1.26 0.06 114.94 126.65 3f8s s ASN 272 Ca 0.01 -1.97 0.16 0.00 0.21 0.00 0.00 52.86 51.27 3f8s s ASN 272 Cb -0.06 -2.31 0.80 0.00 -0.55 0.00 0.00 41.25 39.13 3f8s s ASN 272 CO 0.00 -0.95 1.48 0.35 -2.79 0.00 0.00 177.10 175.19 3f8s n THR 273 N 5.09 0.59 0.02 -5.21 -2.24 0.03 -2.03 114.28 110.54 3f8s n THR 273 Ca 0.07 0.15 -0.09 0.00 -2.27 0.00 0.00 64.05 61.91 3f8s n THR 273 Cb 0.46 -0.88 -0.13 0.00 -2.10 0.00 0.00 70.33 67.68 3f8s n THR 273 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3f8s h ASP 274 N 0.00 0.07 -0.88 3.42 3.32 -1.91 -3.36 116.42 117.08 3f8s h ASP 274 Ca 0.00 -0.10 -0.53 0.00 0.02 0.00 0.00 57.03 56.42 3f8s h ASP 274 Cb 0.17 -0.02 -0.28 0.00 0.22 0.00 0.00 39.33 39.42 3f8s h ASP 274 CO 0.00 1.09 0.52 -1.54 -1.72 0.00 0.00 179.24 177.58 3f8s n SER 275 N -3.24 5.04 -4.88 6.45 3.41 -0.86 -5.00 113.62 114.54 3f8s n SER 275 Ca -0.10 -3.71 -0.30 0.00 -0.26 0.00 0.00 58.87 54.50 3f8s n SER 275 Cb 1.01 -0.82 0.06 0.00 -0.26 0.00 0.00 64.21 64.19 3f8s n SER 275 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3f8s s LEU 276 N -3.50 2.76 0.06 1.04 1.43 -1.25 -5.00 118.68 114.22 3f8s s LEU 276 Ca 0.58 1.03 -0.02 0.00 -1.03 0.00 0.00 54.13 54.69 3f8s s LEU 276 Cb 0.47 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.93 3f8s s LEU 276 CO 0.05 -1.54 -0.00 -0.55 0.23 0.00 0.00 176.35 174.53 3f8s s SER 277 N -4.40 0.44 -0.12 2.29 0.15 -1.26 -5.09 113.70 105.70 3f8s s SER 277 Ca 0.59 -1.00 -0.19 0.00 0.70 0.00 0.00 55.95 56.05 3f8s s SER 277 Cb -0.11 0.22 -0.17 0.00 -1.71 0.00 0.00 66.02 64.25 3f8s s SER 277 CO 0.51 -0.63 0.53 0.28 1.20 0.00 0.00 173.24 175.13 3f8s h SER 278 N 3.08 -0.01 0.60 5.45 0.02 -2.00 -3.39 113.55 117.30 3f8s h SER 278 Ca -0.34 -0.65 -0.19 0.00 -0.84 0.00 0.00 61.79 59.77 3f8s h SER 278 Cb 1.15 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.66 3f8s h SER 278 CO 0.64 0.81 -1.54 0.55 -1.14 0.00 0.00 176.83 176.16 3f8s n VAL 279 N -4.68 1.22 -3.38 2.27 3.14 -1.26 -4.88 118.33 110.76 3f8s n VAL 279 Ca -0.07 -0.71 -0.38 0.00 -2.96 0.00 0.00 64.34 60.23 3f8s n VAL 279 Cb 0.31 -0.74 -0.06 0.00 -1.06 0.00 0.00 33.84 32.30 3f8s n VAL 279 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 3f8s s THR 280 N -2.87 5.10 0.25 1.55 2.01 -1.26 -5.06 115.64 115.35 3f8s s THR 280 Ca -0.04 0.93 -0.30 0.00 0.31 0.00 0.00 61.69 62.59 3f8s s THR 280 Cb 0.09 -3.78 -0.10 0.00 0.01 0.00 0.00 72.50 68.71 3f8s s THR 280 CO 0.82 0.43 1.40 0.20 -0.69 0.00 0.00 174.62 176.78 3f8s s ASN 281 N -0.09 6.71 0.55 3.53 -0.87 -1.26 -4.29 114.94 119.21 3f8s s ASN 281 Ca 0.25 2.62 -0.21 0.00 -1.57 0.00 0.00 52.86 53.94 3f8s s ASN 281 Cb -0.16 -2.62 -0.05 0.00 -0.02 0.00 0.00 41.25 38.40 3f8s s ASN 281 CO 0.12 -0.65 1.33 0.00 -2.57 0.00 0.00 177.10 175.33 3f8s s ALA 282 N -0.07 2.78 -0.39 0.60 0.00 -1.26 -4.97 121.76 118.45 3f8s s ALA 282 Ca 0.58 1.29 -0.08 0.00 0.00 0.00 0.00 51.96 53.74 3f8s s ALA 282 Cb -0.41 -3.55 0.06 0.00 0.00 0.00 0.00 23.12 19.23 3f8s s ALA 282 CO 0.43 -1.34 0.21 0.99 0.00 0.00 0.00 175.76 176.06 3f8s s THR 283 N -1.34 4.10 -0.09 0.00 2.01 -1.26 -4.99 115.64 114.08 3f8s s THR 283 Ca 0.72 -1.31 -0.23 0.00 0.31 0.00 0.00 61.69 61.18 3f8s s THR 283 Cb -0.39 -3.46 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 3f8s s THR 283 CO 0.46 -0.41 0.68 -0.44 -0.69 0.00 0.00 174.62 174.22 3f8s s SER 284 N 1.86 6.93 -0.27 3.53 0.01 -1.26 -4.56 113.70 119.94 3f8s s SER 284 Ca 0.02 1.12 -0.12 0.00 1.31 0.00 0.00 55.95 58.28 3f8s s SER 284 Cb -0.22 -2.40 -0.05 0.00 0.21 0.00 0.00 66.02 63.57 3f8s s SER 284 CO 0.02 -0.14 0.25 -0.63 0.41 0.00 0.00 173.24 173.15 3f8s s ILE 285 N 0.98 5.27 -0.05 1.44 1.09 -0.08 -4.89 121.20 124.97 3f8s s ILE 285 Ca 0.36 0.31 -0.29 0.00 -1.10 0.00 0.00 60.65 59.92 3f8s s ILE 285 Cb -0.17 -3.58 -0.02 0.00 -1.06 0.00 0.00 42.46 37.62 3f8s s ILE 285 CO 0.16 0.23 0.96 -1.58 -0.10 0.00 0.00 174.94 174.62 3f8s s GLN 286 N 1.76 4.50 -0.09 2.79 0.74 -1.26 -0.71 119.66 127.39 3f8s s GLN 286 Ca 0.10 1.36 -0.11 0.00 0.05 0.00 0.00 55.36 56.76 3f8s s GLN 286 Cb -0.16 -3.49 -0.05 0.00 1.10 0.00 0.00 33.01 30.42 3f8s s GLN 286 CO 0.10 -0.14 0.26 0.42 -0.55 0.00 0.00 175.29 175.38 3f8s s ILE 287 N 1.36 5.31 0.12 -2.34 1.01 0.18 -4.96 121.20 121.87 3f8s s ILE 287 Ca 0.49 0.48 0.06 0.00 0.00 0.00 0.00 60.65 61.68 3f8s s ILE 287 Cb -0.20 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 3f8s s ILE 287 CO 0.23 0.55 -0.01 -0.89 0.00 0.00 0.00 174.94 174.83 3f8s s THR 288 N -0.69 3.85 0.60 2.92 2.01 -1.26 -3.60 115.64 119.46 3f8s s THR 288 Ca 0.18 -1.16 -0.17 0.00 0.31 0.00 0.00 61.69 60.85 3f8s s THR 288 Cb -0.14 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.48 3f8s s THR 288 CO 0.07 0.05 1.09 0.00 -0.69 0.00 0.00 174.62 175.14 3f8s s ALA 289 N -1.42 2.63 0.46 7.40 0.00 -1.26 -4.97 121.76 124.60 3f8s s ALA 289 Ca 0.26 0.58 -0.23 0.00 0.00 0.00 0.00 51.96 52.56 3f8s s ALA 289 Cb -0.11 -3.30 -0.09 0.00 0.00 0.00 0.00 23.12 19.62 3f8s s ALA 289 CO 0.18 -0.95 1.06 -2.30 0.00 0.00 0.00 175.76 173.75 3f8s n PRO 290 N -1.92 1.38 -0.32 0.00 -0.02 -1.26 -4.74 135.00 128.11 3f8s n PRO 290 Ca 0.10 0.50 0.31 0.00 -2.02 0.00 0.00 63.50 62.39 3f8s n PRO 290 Cb 0.52 -2.15 0.67 0.00 -0.02 0.00 0.00 33.50 32.53 3f8s n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3f8s h ALA 291 N 1.42 2.83 0.00 3.55 0.00 -2.00 0.17 119.26 125.24 3f8s h ALA 291 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3f8s h ALA 291 Cb 1.33 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.20 3f8s h ALA 291 CO 0.56 -1.20 0.00 -1.13 0.00 0.00 0.00 179.25 177.48 3f8s n SER 292 N -4.34 0.62 -0.09 0.00 3.41 -1.26 -2.98 113.62 108.99 3f8s n SER 292 Ca 0.26 0.59 -0.17 0.00 -0.26 0.00 0.00 58.87 59.29 3f8s n SER 292 Cb 1.13 -0.75 -0.10 0.00 -0.26 0.00 0.00 64.21 64.23 3f8s n SER 292 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 3f8s h MET 293 N 0.00 0.00 0.00 4.33 2.07 -1.00 -3.39 114.93 116.95 3f8s h MET 293 Ca 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 3f8s h MET 293 Cb 0.55 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.28 3f8s h MET 293 CO 0.00 0.84 0.24 -0.07 1.07 0.00 0.00 176.91 178.99 3f8s h LEU 294 N -1.00 0.00 -2.29 1.22 -0.00 -1.41 -1.60 115.31 110.23 3f8s h LEU 294 Ca -0.21 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.69 3f8s h LEU 294 Cb 1.08 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.73 3f8s h LEU 294 CO -0.13 0.00 0.07 -0.29 -0.00 0.00 0.00 178.44 178.09 3f8s h ILE 295 N 0.00 0.62 -1.41 1.22 2.10 -1.73 -3.45 117.51 114.86 3f8s h ILE 295 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 3f8s h ILE 295 Cb 0.48 0.94 0.00 0.00 -1.09 0.00 0.00 36.82 37.16 3f8s h ILE 295 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.68 3f8s n GLY 296 N -1.40 2.82 3.73 8.18 0.00 -0.60 -5.14 105.19 112.78 3f8s n GLY 296 Ca -0.01 -0.93 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 3f8s n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3f8s s ASP 297 N 0.71 6.73 0.21 1.61 1.01 -1.26 -4.94 116.67 120.75 3f8s s ASP 297 Ca 0.00 2.53 -0.08 0.00 0.71 0.00 0.00 52.55 55.71 3f8s s ASP 297 Cb 0.00 -2.61 -0.02 0.00 1.01 0.00 0.00 42.92 41.30 3f8s s ASP 297 CO 0.00 -0.67 0.32 -1.38 0.21 0.00 0.00 175.17 173.65 3f8s s HIS 298 N 0.39 0.60 0.30 4.23 -3.43 -1.26 -0.09 115.29 116.03 3f8s s HIS 298 Ca 0.61 -0.93 0.06 0.00 -0.80 0.00 0.00 55.06 54.01 3f8s s HIS 298 Cb -0.40 -0.10 -0.06 0.00 -1.43 0.00 0.00 32.58 30.59 3f8s s HIS 298 CO 0.38 -0.81 -0.04 0.71 -2.00 0.00 0.00 174.74 172.98 3f8s s TYR 299 N -4.04 2.01 -0.32 0.38 2.02 0.34 -4.83 117.35 112.90 3f8s s TYR 299 Ca 0.26 -0.73 -0.11 0.00 -0.37 0.00 0.00 57.07 56.12 3f8s s TYR 299 Cb 0.03 -1.19 -0.01 0.00 -0.40 0.00 0.00 41.96 40.39 3f8s s TYR 299 CO 0.07 0.26 0.18 -1.17 -1.57 0.00 0.00 175.55 173.32 3f8s s LEU 300 N -3.47 4.24 -0.13 -1.29 0.20 -1.26 -1.57 118.68 115.39 3f8s s LEU 300 Ca 0.31 -0.50 0.12 0.00 0.69 0.00 0.00 54.13 54.75 3f8s s LEU 300 Cb 0.05 -2.04 -0.17 0.00 -0.43 0.00 0.00 46.19 43.60 3f8s s LEU 300 CO 0.13 -0.21 0.05 0.00 -0.29 0.00 0.00 176.35 176.03 3f8s s ASP 302 N -4.64 0.01 -0.31 0.00 2.15 -1.11 -4.81 116.67 107.96 3f8s s ASP 302 Ca -0.07 0.00 -0.01 0.00 0.43 0.00 0.00 52.55 52.91 3f8s s ASP 302 Cb 0.04 -0.01 0.10 0.00 -0.30 0.00 0.00 42.92 42.75 3f8s s ASP 302 CO 0.56 -0.01 0.10 -0.69 -0.17 0.00 0.00 175.17 174.95 3f8s s VAL 303 N 0.10 0.91 -0.21 1.11 1.01 -1.26 -0.23 120.40 121.82 3f8s s VAL 303 Ca -0.01 -1.41 0.02 0.00 0.00 0.00 0.00 61.98 60.57 3f8s s VAL 303 Cb -0.01 -1.69 0.04 0.00 0.00 0.00 0.00 36.38 34.72 3f8s s VAL 303 CO -0.00 -0.67 -0.12 -0.89 0.00 0.00 0.00 175.10 173.41 3f8s s THR 304 N 1.60 1.88 0.17 3.92 2.01 -0.73 -5.02 115.64 119.48 3f8s s THR 304 Ca 0.10 -1.20 -0.31 0.00 0.31 0.00 0.00 61.69 60.59 3f8s s THR 304 Cb -0.17 -1.92 -0.09 0.00 0.01 0.00 0.00 72.50 70.32 3f8s s THR 304 CO -0.25 0.17 1.47 0.26 -0.69 0.00 0.00 174.62 175.58 3f8s s TRP 305 N 1.28 3.13 -0.25 4.92 0.52 -1.26 -0.54 118.94 126.73 3f8s s TRP 305 Ca -0.03 0.85 -0.00 0.00 0.02 0.00 0.00 56.10 56.94 3f8s s TRP 305 Cb -0.17 -3.81 -0.16 0.00 -1.15 0.00 0.00 33.47 28.19 3f8s s TRP 305 CO -0.08 -2.84 -0.24 0.00 0.02 0.00 0.00 176.95 173.81 3f8s n ALA 306 N 3.56 1.43 -3.48 0.98 0.00 0.95 -4.89 120.51 119.07 3f8s n ALA 306 Ca 0.11 -1.07 -0.09 0.00 0.00 0.00 0.00 53.44 52.39 3f8s n ALA 306 Cb 0.40 -0.05 -0.03 0.00 0.00 0.00 0.00 19.45 19.78 3f8s n ALA 306 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3f8s n THR 307 N -3.37 0.00 0.25 0.00 -2.24 -0.99 -4.55 114.28 103.38 3f8s n THR 307 Ca -0.46 -0.91 0.09 0.00 -2.27 0.00 0.00 64.05 60.50 3f8s n THR 307 Cb 0.96 0.47 0.65 0.00 -2.10 0.00 0.00 70.33 70.30 3f8s n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3f8s h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.96 -3.12 115.11 110.33 3f8s h GLN 308 Ca -0.09 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.11 3f8s h GLN 308 Cb 0.47 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 3f8s h GLN 308 CO 0.13 0.12 -0.00 0.39 -0.95 0.00 0.00 178.83 178.52 3f8s n GLU 309 N -4.08 2.31 -3.99 1.46 1.02 -1.26 -4.91 120.64 111.18 3f8s n GLU 309 Ca -0.02 -1.29 -0.29 0.00 -0.02 0.00 0.00 57.16 55.54 3f8s n GLU 309 Cb 0.20 -0.89 -0.17 0.00 -0.02 0.00 0.00 31.44 30.56 3f8s n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3f8s s ARG 310 N -0.80 1.97 -0.12 3.49 3.52 -1.18 0.14 118.95 125.97 3f8s s ARG 310 Ca 0.00 -0.43 -0.02 0.00 -0.13 0.00 0.00 55.73 55.15 3f8s s ARG 310 Cb 0.00 -1.88 -0.03 0.00 -1.56 0.00 0.00 34.95 31.49 3f8s s ARG 310 CO 0.00 -0.24 -0.04 0.42 -0.81 0.00 0.00 175.30 174.63 3f8s s ILE 311 N 1.55 3.95 -0.16 4.11 1.01 0.12 -0.03 121.20 131.75 3f8s s ILE 311 Ca 0.04 -0.36 -0.15 0.00 0.00 0.00 0.00 60.65 60.18 3f8s s ILE 311 Cb -0.13 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 3f8s s ILE 311 CO -0.09 0.54 0.36 -0.55 0.00 0.00 0.00 174.94 175.20 3f8s s SER 312 N -0.15 6.49 -0.03 3.58 0.15 0.30 0.66 113.70 124.69 3f8s s SER 312 Ca 0.03 0.58 0.07 0.00 0.70 0.00 0.00 55.95 57.33 3f8s s SER 312 Cb -0.13 -2.22 -0.01 0.00 -1.71 0.00 0.00 66.02 61.95 3f8s s SER 312 CO 0.02 0.03 -0.24 -0.76 1.20 0.00 0.00 173.24 173.49 3f8s s LEU 313 N 0.72 2.05 -0.04 3.45 1.43 0.11 -1.77 118.68 124.64 3f8s s LEU 313 Ca 0.19 -0.46 0.07 0.00 -1.03 0.00 0.00 54.13 52.90 3f8s s LEU 313 Cb -0.14 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.78 3f8s s LEU 313 CO 0.06 0.27 -0.25 -1.10 0.23 0.00 0.00 176.35 175.57 3f8s s GLN 314 N -0.39 2.36 0.13 1.70 -0.21 0.68 0.43 119.66 124.36 3f8s s GLN 314 Ca 0.04 -0.90 0.05 0.00 0.02 0.00 0.00 55.36 54.56 3f8s s GLN 314 Cb -0.11 -2.12 -0.04 0.00 1.00 0.00 0.00 33.01 31.73 3f8s s GLN 314 CO 0.01 0.47 -0.11 -1.58 -2.12 0.00 0.00 175.29 171.96 3f8s s TRP 315 N -0.39 1.24 -0.15 0.91 0.52 -0.57 -0.89 118.94 119.61 3f8s s TRP 315 Ca 0.03 -0.69 -0.08 0.00 0.02 0.00 0.00 56.10 55.39 3f8s s TRP 315 Cb -0.12 -0.64 0.06 0.00 -1.15 0.00 0.00 33.47 31.61 3f8s s TRP 315 CO 0.01 0.08 0.35 -1.17 0.02 0.00 0.00 176.95 176.24 3f8s s LEU 316 N -2.83 0.02 0.49 2.99 2.96 -0.61 -1.80 118.68 119.90 3f8s s LEU 316 Ca 0.12 0.76 -0.22 0.00 -0.22 0.00 0.00 54.13 54.57 3f8s s LEU 316 Cb -0.00 1.11 -0.06 0.00 0.50 0.00 0.00 46.19 47.73 3f8s s LEU 316 CO 0.01 -0.19 1.20 -0.13 -1.32 0.00 0.00 176.35 175.92 3f8s s ARG 317 N 1.50 3.55 0.58 1.98 0.52 -1.10 0.13 118.95 126.11 3f8s s ARG 317 Ca -0.08 1.84 0.28 0.00 -0.52 0.00 0.00 55.73 57.24 3f8s s ARG 317 Cb -0.09 -2.30 1.69 0.00 0.52 0.00 0.00 34.95 34.77 3f8s s ARG 317 CO -0.11 -0.74 2.18 -0.09 0.02 0.00 0.00 175.30 176.55 3f8s h ARG 318 N 1.77 0.00 -5.83 3.54 2.43 -0.82 -3.15 114.38 112.32 3f8s h ARG 318 Ca -0.50 0.00 -0.61 0.00 -0.81 0.00 0.00 59.98 58.06 3f8s h ARG 318 Cb 1.26 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 30.70 3f8s h ARG 318 CO 0.59 0.00 0.41 0.42 -1.51 0.00 0.00 179.97 179.88 3f8s s ILE 319 N -4.69 4.72 -0.66 1.20 1.09 -1.26 -4.87 121.20 116.74 3f8s s ILE 319 Ca -0.05 0.98 -0.03 0.00 -1.10 0.00 0.00 60.65 60.46 3f8s s ILE 319 Cb 0.15 -4.22 0.26 0.00 -1.06 0.00 0.00 42.46 37.60 3f8s s ILE 319 CO 0.56 -0.41 2.27 0.00 -0.10 0.00 0.00 174.94 177.26 3f8s n GLN 320 N 6.43 2.56 0.00 2.79 6.02 -1.19 -4.03 117.38 129.97 3f8s n GLN 320 Ca 0.04 -2.98 0.08 0.00 -0.01 0.00 0.00 57.00 54.13 3f8s n GLN 320 Cb 0.48 -2.19 0.03 0.00 1.02 0.00 0.00 30.24 29.59 3f8s n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3f8s n ASN 321 N -0.07 1.97 -3.79 1.08 0.23 -1.26 -1.87 115.26 111.55 3f8s n ASN 321 Ca 0.52 -1.49 -0.15 0.00 -0.53 0.00 0.00 54.58 52.93 3f8s n ASN 321 Cb 0.41 0.22 -0.16 0.00 -2.08 0.00 0.00 39.78 38.17 3f8s n ASN 321 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 3f8s s TYR 322 N -1.56 0.13 0.01 -2.53 5.04 -1.26 0.55 117.35 117.72 3f8s s TYR 322 Ca 0.16 0.08 -0.09 0.00 -2.44 0.00 0.00 57.07 54.77 3f8s s TYR 322 Cb 0.13 -0.28 0.01 0.00 0.35 0.00 0.00 41.96 42.16 3f8s s TYR 322 CO 0.28 -0.10 0.18 -1.54 -1.34 0.00 0.00 175.55 173.04 3f8s s SER 323 N 0.98 -0.01 -0.08 4.32 1.04 0.26 -2.70 113.70 117.51 3f8s s SER 323 Ca -0.09 -0.19 0.01 0.00 0.48 0.00 0.00 55.95 56.16 3f8s s SER 323 Cb -0.12 0.24 0.02 0.00 0.10 0.00 0.00 66.02 66.25 3f8s s SER 323 CO -0.02 -0.42 -0.09 -0.69 0.98 0.00 0.00 173.24 173.00 3f8s s VAL 324 N -1.60 0.95 0.16 5.02 1.01 -0.74 -1.00 120.40 124.20 3f8s s VAL 324 Ca -0.13 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 61.42 3f8s s VAL 324 Cb -0.06 -0.93 -0.07 0.00 0.00 0.00 0.00 36.38 35.33 3f8s s VAL 324 CO 0.01 0.33 0.50 -0.32 0.00 0.00 0.00 175.10 175.62 3f8s s MET 325 N 1.11 3.83 -0.10 2.72 1.75 -0.35 -1.52 119.30 126.75 3f8s s MET 325 Ca -0.07 0.28 0.00 0.00 -1.25 0.00 0.00 55.69 54.66 3f8s s MET 325 Cb -0.14 -2.84 0.02 0.00 2.84 0.00 0.00 34.83 34.71 3f8s s MET 325 CO -0.01 0.44 -0.09 -0.51 -0.65 0.00 0.00 175.02 174.20 3f8s s ASP 326 N -2.02 2.05 -0.24 1.11 1.01 0.17 -2.76 116.67 115.99 3f8s s ASP 326 Ca 0.40 -0.30 -0.16 0.00 0.71 0.00 0.00 52.55 53.20 3f8s s ASP 326 Cb -0.13 -0.84 -0.04 0.00 1.01 0.00 0.00 42.92 42.92 3f8s s ASP 326 CO 0.20 -0.07 0.40 -0.63 0.21 0.00 0.00 175.17 175.29 3f8s s ILE 327 N 1.36 5.17 -0.24 0.77 1.09 -1.26 0.10 121.20 128.19 3f8s s ILE 327 Ca -0.01 0.67 0.02 0.00 -1.10 0.00 0.00 60.65 60.23 3f8s s ILE 327 Cb -0.14 -3.73 0.06 0.00 -1.06 0.00 0.00 42.46 37.59 3f8s s ILE 327 CO -0.04 0.18 -0.08 0.00 -0.10 0.00 0.00 174.94 174.89 3f8s s ASP 329 N 1.26 6.77 0.04 0.00 1.01 -1.05 -0.70 116.67 124.00 3f8s s ASP 329 Ca -0.07 1.06 -0.29 0.00 0.71 0.00 0.00 52.55 53.96 3f8s s ASP 329 Cb -0.19 -2.28 -0.04 0.00 1.01 0.00 0.00 42.92 41.41 3f8s s ASP 329 CO -0.06 0.02 0.93 -0.47 0.21 0.00 0.00 175.17 175.80 3f8s s TYR 330 N -1.62 3.72 -0.99 4.23 5.04 0.12 -1.33 117.35 126.53 3f8s s TYR 330 Ca 0.42 1.68 -0.17 0.00 -2.44 0.00 0.00 57.07 56.56 3f8s s TYR 330 Cb -0.14 -3.04 0.15 0.00 0.35 0.00 0.00 41.96 39.29 3f8s s TYR 330 CO 0.20 0.12 1.18 0.34 -1.34 0.00 0.00 175.55 176.04 3f8s s ASP 331 N 0.47 6.75 0.00 4.32 2.15 0.69 -4.94 116.67 126.10 3f8s s ASP 331 Ca 0.47 -2.33 0.00 0.00 0.43 0.00 0.00 52.55 51.12 3f8s s ASP 331 Cb -0.22 -2.39 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 3f8s s ASP 331 CO 0.27 -0.95 0.00 1.21 -0.17 0.00 0.00 175.17 175.53 3f8s n GLU 332 N 6.14 0.00 -0.03 4.34 2.13 -1.26 -0.62 120.64 131.34 3f8s n GLU 332 Ca 0.26 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.95 3f8s n GLU 332 Cb 0.47 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 32.08 3f8s n GLU 332 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3f8s h SER 333 N 0.00 0.06 -0.22 4.31 4.64 -1.97 -3.28 113.55 117.08 3f8s h SER 333 Ca 0.00 -0.63 0.00 0.00 -0.47 0.00 0.00 61.79 60.69 3f8s h SER 333 Cb 0.00 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3f8s h SER 333 CO 0.00 0.67 0.00 -1.54 -0.87 0.00 0.00 176.83 175.09 3f8s n SER 334 N -4.74 1.47 -2.46 4.97 3.41 -0.59 -4.90 113.62 110.78 3f8s n SER 334 Ca -0.09 -1.85 -0.12 0.00 -0.26 0.00 0.00 58.87 56.56 3f8s n SER 334 Cb 0.34 -0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 64.13 3f8s n SER 334 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3f8s n GLY 335 N 1.01 -0.50 0.00 5.00 0.00 0.21 -4.92 105.19 106.00 3f8s n GLY 335 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3f8s n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f8s n ARG 336 N -2.80 1.94 -3.61 1.61 5.12 -1.24 -4.92 116.66 112.76 3f8s n ARG 336 Ca -0.14 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.60 3f8s n ARG 336 Cb 0.60 0.00 -0.15 0.00 -1.16 0.00 0.00 32.46 31.75 3f8s n ARG 336 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 3f8s s TRP 337 N -0.34 -0.17 -0.12 -1.55 0.52 -1.26 -0.22 118.94 115.80 3f8s s TRP 337 Ca 0.00 0.42 -0.02 0.00 0.02 0.00 0.00 56.10 56.51 3f8s s TRP 337 Cb 0.00 -0.33 -0.03 0.00 -1.15 0.00 0.00 33.47 31.96 3f8s s TRP 337 CO 0.00 -0.39 -0.03 -0.80 0.02 0.00 0.00 176.95 175.75 3f8s s ASN 338 N 2.29 4.91 -0.74 2.95 0.01 -0.44 -4.91 114.94 119.00 3f8s s ASN 338 Ca 0.04 -0.03 -0.01 0.00 -0.71 0.00 0.00 52.86 52.15 3f8s s ASN 338 Cb -0.13 -1.58 0.19 0.00 0.41 0.00 0.00 41.25 40.13 3f8s s ASN 338 CO -0.08 0.26 0.58 0.00 -1.51 0.00 0.00 177.10 176.35 3f8s n LEU 340 N 2.75 2.68 0.29 0.00 4.32 -1.26 -4.88 117.00 120.89 3f8s n LEU 340 Ca 0.15 1.06 0.17 0.00 -0.02 0.00 0.00 56.01 57.36 3f8s n LEU 340 Cb 0.37 -1.27 0.88 0.00 -1.62 0.00 0.00 43.42 41.77 3f8s n LEU 340 CO 0.34 -0.42 1.05 0.58 -1.22 0.00 0.00 177.39 177.72 3f8s h VAL 341 N 4.60 0.31 0.00 4.08 2.07 -1.97 -2.02 116.25 123.31 3f8s h VAL 341 Ca -0.47 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 3f8s h VAL 341 Cb 1.30 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 32.31 3f8s h VAL 341 CO 0.91 0.05 -0.14 0.00 0.02 0.00 0.00 177.57 178.41 3f8s h ALA 342 N 1.95 1.09 0.00 1.67 0.00 -2.00 -2.90 119.26 119.07 3f8s h ALA 342 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3f8s h ALA 342 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3f8s h ALA 342 CO 0.01 0.17 -0.92 0.54 0.00 0.00 0.00 179.25 179.05 3f8s n ARG 343 N -3.38 0.42 -1.65 0.00 1.74 -0.76 -4.92 116.66 108.10 3f8s n ARG 343 Ca -0.01 0.07 -0.49 0.00 -0.77 0.00 0.00 57.85 56.65 3f8s n ARG 343 Cb 0.33 -1.71 -0.05 0.00 -1.02 0.00 0.00 32.46 30.01 3f8s n ARG 343 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3f8s n GLN 344 N -2.29 1.77 -3.77 5.56 6.02 -1.10 -4.75 117.38 118.82 3f8s n GLN 344 Ca 0.01 0.64 -0.37 0.00 -0.01 0.00 0.00 57.00 57.27 3f8s n GLN 344 Cb 0.48 -2.38 -0.13 0.00 1.02 0.00 0.00 30.24 29.24 3f8s n GLN 344 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 3f8s s HIS 345 N 1.70 3.21 0.05 1.08 3.76 -1.11 -4.93 115.29 119.04 3f8s s HIS 345 Ca 0.85 -1.30 -0.22 0.00 -0.15 0.00 0.00 55.06 54.25 3f8s s HIS 345 Cb -0.80 -2.25 -0.06 0.00 1.11 0.00 0.00 32.58 30.58 3f8s s HIS 345 CO 0.46 -0.68 0.64 0.42 -0.85 0.00 0.00 174.74 174.73 3f8s s ILE 346 N 1.42 4.76 -0.03 0.60 1.01 -1.26 -1.21 121.20 126.50 3f8s s ILE 346 Ca -0.00 1.36 0.02 0.00 0.00 0.00 0.00 60.65 62.03 3f8s s ILE 346 Cb -0.19 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.31 3f8s s ILE 346 CO 0.02 0.46 -0.07 -0.70 0.00 0.00 0.00 174.94 174.65 3f8s s GLU 347 N -0.54 0.86 -0.06 2.79 2.12 -0.17 -5.01 118.70 118.69 3f8s s GLU 347 Ca 0.32 -0.23 -0.19 0.00 0.36 0.00 0.00 54.97 55.23 3f8s s GLU 347 Cb -0.20 -0.82 0.04 0.00 0.26 0.00 0.00 34.13 33.42 3f8s s GLU 347 CO 0.20 0.05 0.45 1.41 -0.54 0.00 0.00 175.26 176.83 3f8s s MET 348 N 0.38 0.74 -0.08 4.30 -2.45 -1.26 -0.58 119.30 120.35 3f8s s MET 348 Ca -0.05 0.14 0.04 0.00 -1.25 0.00 0.00 55.69 54.56 3f8s s MET 348 Cb -0.10 0.34 0.00 0.00 1.25 0.00 0.00 34.83 36.33 3f8s s MET 348 CO 0.00 -0.19 -0.20 0.45 1.05 0.00 0.00 175.02 176.13 3f8s s SER 349 N -0.89 2.65 -0.09 1.11 0.15 0.19 -4.99 113.70 111.82 3f8s s SER 349 Ca -0.09 -0.46 0.15 0.00 0.70 0.00 0.00 55.95 56.24 3f8s s SER 349 Cb -0.03 -1.11 -0.23 0.00 -1.71 0.00 0.00 66.02 62.94 3f8s s SER 349 CO 0.05 0.14 0.45 1.07 1.20 0.00 0.00 173.24 176.14 3f8s n THR 350 N 3.49 1.44 0.64 6.45 5.66 -1.26 -4.42 114.28 126.27 3f8s n THR 350 Ca -0.20 -0.80 0.07 0.00 -3.05 0.00 0.00 64.05 60.07 3f8s n THR 350 Cb 0.53 -0.76 0.01 0.00 -1.55 0.00 0.00 70.33 68.56 3f8s n THR 350 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3f8s n THR 351 N -2.89 0.00 0.00 1.09 -2.24 -1.26 -5.06 114.28 103.92 3f8s n THR 351 Ca -0.22 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 3f8s n THR 351 Cb 1.06 1.20 0.00 0.00 -2.10 0.00 0.00 70.33 70.49 3f8s n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f8s n GLY 352 N 1.04 1.89 3.86 3.38 0.00 -1.26 -4.91 105.19 109.19 3f8s n GLY 352 Ca 0.07 0.20 -0.21 0.00 0.00 0.00 0.00 46.02 46.08 3f8s n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3f8s s TRP 353 N 1.59 2.74 -0.10 1.61 -2.14 -1.26 -4.40 118.94 116.97 3f8s s TRP 353 Ca 0.00 -0.46 -0.21 0.00 2.66 0.00 0.00 56.10 58.09 3f8s s TRP 353 Cb 0.00 -2.06 -0.04 0.00 -3.10 0.00 0.00 33.47 28.27 3f8s s TRP 353 CO 0.00 -0.02 0.62 0.08 -2.66 0.00 0.00 176.95 174.97 3f8s s VAL 354 N -2.45 5.09 0.07 -0.66 1.01 -0.78 -4.79 120.40 117.89 3f8s s VAL 354 Ca 0.46 1.25 0.00 0.00 0.00 0.00 0.00 61.98 63.69 3f8s s VAL 354 Cb -0.03 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.39 3f8s s VAL 354 CO 0.27 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.23 3f8s n GLY 355 N 3.27 -1.98 0.22 4.51 0.00 -1.26 -3.17 105.19 106.77 3f8s n GLY 355 Ca -0.03 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 3f8s n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3f8s h ARG 356 N -0.22 -0.46 0.00 1.61 3.08 -1.95 -3.37 114.38 113.07 3f8s h ARG 356 Ca -0.01 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3f8s h ARG 356 Cb 0.21 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3f8s h ARG 356 CO 0.01 -0.14 0.00 1.19 -1.07 0.00 0.00 179.97 179.95 3f8s n PHE 357 N -5.16 0.00 0.00 3.04 3.72 -1.26 -4.95 117.46 112.85 3f8s n PHE 357 Ca -0.10 -0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 3f8s n PHE 357 Cb 0.28 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 3f8s n PHE 357 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 3f8s n ARG 358 N -0.08 0.00 -1.60 -1.08 1.85 -1.22 -5.01 116.66 109.52 3f8s n ARG 358 Ca 0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 57.85 56.40 3f8s n ARG 358 Cb 0.06 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.45 3f8s n ARG 358 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 3f8s n PRO 359 N -0.69 1.41 -1.55 2.89 -0.02 -1.19 -4.30 135.00 131.55 3f8s n PRO 359 Ca 0.00 0.50 -0.32 0.00 -2.02 0.00 0.00 63.50 61.66 3f8s n PRO 359 Cb 0.00 -1.94 0.06 0.00 -0.02 0.00 0.00 33.50 31.61 3f8s n PRO 359 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3f8s s SER 360 N -0.32 4.90 0.60 2.55 1.04 -1.26 -4.93 113.70 116.27 3f8s s SER 360 Ca 0.63 1.90 -0.15 0.00 0.48 0.00 0.00 55.95 58.80 3f8s s SER 360 Cb -0.73 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 62.82 3f8s s SER 360 CO 0.57 -1.77 1.05 -1.83 0.98 0.00 0.00 173.24 172.25 3f8s s GLU 361 N -4.48 3.32 -0.10 4.02 -1.05 -1.26 -4.96 118.70 114.19 3f8s s GLU 361 Ca 0.64 1.17 -0.09 0.00 -0.15 0.00 0.00 54.97 56.54 3f8s s GLU 361 Cb -0.19 -2.03 -0.04 0.00 -0.44 0.00 0.00 34.13 31.43 3f8s s GLU 361 CO 0.48 -0.81 0.21 -1.25 0.95 0.00 0.00 175.26 174.84 3f8s s PRO 362 N -4.16 3.63 -0.30 -4.83 0.04 -1.26 -4.60 135.00 123.52 3f8s s PRO 362 Ca 0.63 0.01 -0.08 0.00 0.04 0.00 0.00 61.00 61.60 3f8s s PRO 362 Cb -0.16 -3.22 0.01 0.00 0.04 0.00 0.00 34.50 31.17 3f8s s PRO 362 CO 0.38 0.71 0.11 -1.01 0.04 0.00 0.00 177.00 177.22 3f8s s HIS 363 N -0.90 3.16 -0.02 0.56 3.76 -0.14 -4.92 115.29 116.80 3f8s s HIS 363 Ca 0.17 -0.89 -0.09 0.00 -0.15 0.00 0.00 55.06 54.09 3f8s s HIS 363 Cb -0.13 -2.29 -0.05 0.00 1.11 0.00 0.00 32.58 31.22 3f8s s HIS 363 CO 0.06 -0.56 0.28 -0.06 -0.85 0.00 0.00 174.74 173.62 3f8s s PHE 364 N 1.53 3.63 0.74 1.40 0.40 -1.26 0.28 117.98 124.70 3f8s s PHE 364 Ca 0.03 0.71 -0.11 0.00 -0.60 0.00 0.00 56.93 56.95 3f8s s PHE 364 Cb -0.17 -2.08 0.04 0.00 0.51 0.00 0.00 43.02 41.32 3f8s s PHE 364 CO 0.04 0.65 1.09 0.95 0.70 0.00 0.00 175.22 178.65 3f8s s THR 365 N -1.17 3.41 0.24 0.64 -4.23 -0.69 -4.88 115.64 108.97 3f8s s THR 365 Ca 0.23 0.49 -0.06 0.00 -1.18 0.00 0.00 61.69 61.17 3f8s s THR 365 Cb -0.14 -3.01 0.22 0.00 1.34 0.00 0.00 72.50 70.91 3f8s s THR 365 CO 0.12 -0.57 1.69 0.25 -0.54 0.00 0.00 174.62 175.57 3f8s h LEU 366 N -0.89 0.02 -0.07 4.79 5.85 -1.91 0.26 115.31 123.36 3f8s h LEU 366 Ca -0.44 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3f8s h LEU 366 Cb 1.23 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.45 3f8s h LEU 366 CO 0.52 -0.02 0.00 -0.90 -0.34 0.00 0.00 178.44 177.70 3f8s n ASP 367 N -5.15 0.17 -0.66 1.25 5.68 -1.26 -4.87 116.55 111.70 3f8s n ASP 367 Ca 0.13 0.53 -0.09 0.00 -0.50 0.00 0.00 54.79 54.86 3f8s n ASP 367 Cb 0.44 -0.57 -0.04 0.00 -1.14 0.00 0.00 41.12 39.81 3f8s n ASP 367 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3f8s n GLY 368 N 0.78 1.02 0.94 6.12 0.00 0.91 -4.87 105.19 110.09 3f8s n GLY 368 Ca 0.05 -0.41 0.11 0.00 0.00 0.00 0.00 46.02 45.77 3f8s n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3f8s n ASN 369 N 0.07 2.82 -3.50 1.61 3.02 -1.26 -4.92 115.26 113.10 3f8s n ASN 369 Ca -0.09 -1.90 -0.09 0.00 -0.03 0.00 0.00 54.58 52.47 3f8s n ASN 369 Cb 0.34 -0.18 -0.02 0.00 -0.61 0.00 0.00 39.78 39.31 3f8s n ASN 369 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3f8s s SER 370 N -1.56 -0.39 0.28 6.41 1.04 -1.26 -1.12 113.70 117.10 3f8s s SER 370 Ca 0.36 0.03 -0.04 0.00 0.48 0.00 0.00 55.95 56.77 3f8s s SER 370 Cb 0.21 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.72 3f8s s SER 370 CO 0.30 -0.64 0.37 0.72 0.98 0.00 0.00 173.24 174.97 3f8s s PHE 371 N -3.07 0.95 0.10 5.02 -0.12 -0.35 -1.70 117.98 118.81 3f8s s PHE 371 Ca 0.04 -1.18 0.09 0.00 -0.05 0.00 0.00 56.93 55.83 3f8s s PHE 371 Cb -0.01 -0.18 -0.04 0.00 -0.63 0.00 0.00 43.02 42.17 3f8s s PHE 371 CO -0.09 -0.95 -0.24 0.71 -0.05 0.00 0.00 175.22 174.60 3f8s s TYR 372 N -3.64 2.10 -0.18 3.49 1.51 0.14 -1.65 117.35 119.12 3f8s s TYR 372 Ca 0.31 -0.40 -0.22 0.00 -1.01 0.00 0.00 57.07 55.76 3f8s s TYR 372 Cb 0.02 -1.17 0.06 0.00 -0.11 0.00 0.00 41.96 40.75 3f8s s TYR 372 CO 0.16 0.24 0.59 0.21 -1.11 0.00 0.00 175.55 175.63 3f8s s LYS 373 N -1.79 0.74 0.03 -0.62 2.20 -0.84 -0.96 119.74 118.50 3f8s s LYS 373 Ca 0.11 0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 56.09 3f8s s LYS 373 Cb -0.10 0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 36.54 3f8s s LYS 373 CO 0.04 -0.12 1.06 0.42 -0.36 0.00 0.00 175.35 176.39 3f8s s ILE 374 N -0.01 4.53 -0.03 5.43 1.01 -1.26 0.78 121.20 131.65 3f8s s ILE 374 Ca -0.02 1.83 -0.08 0.00 0.00 0.00 0.00 60.65 62.38 3f8s s ILE 374 Cb -0.04 -4.17 0.01 0.00 0.01 0.00 0.00 42.46 38.27 3f8s s ILE 374 CO 0.02 0.15 0.17 -0.63 0.00 0.00 0.00 174.94 174.66 3f8s s ILE 375 N 0.97 0.04 0.02 2.92 -1.09 -0.44 -4.65 121.20 118.98 3f8s s ILE 375 Ca 0.54 -0.37 -0.30 0.00 -2.23 0.00 0.00 60.65 58.29 3f8s s ILE 375 Cb -0.24 -0.38 -0.05 0.00 -1.58 0.00 0.00 42.46 40.21 3f8s s ILE 375 CO 0.29 -0.20 1.29 -0.55 -1.23 0.00 0.00 174.94 174.53 3f8s s SER 376 N -0.73 6.97 0.85 3.58 0.15 -1.26 -0.94 113.70 122.32 3f8s s SER 376 Ca -0.08 2.03 -0.07 0.00 0.70 0.00 0.00 55.95 58.53 3f8s s SER 376 Cb -0.05 -2.57 0.16 0.00 -1.71 0.00 0.00 66.02 61.86 3f8s s SER 376 CO 0.01 -0.60 1.03 -0.46 1.20 0.00 0.00 173.24 174.42 3f8s n ASN 377 N 4.69 0.65 -0.32 5.45 2.04 -0.48 -4.85 115.26 122.44 3f8s n ASN 377 Ca 0.11 -1.72 0.22 0.00 -0.44 0.00 0.00 54.58 52.75 3f8s n ASN 377 Cb 0.45 -0.73 0.43 0.00 -2.53 0.00 0.00 39.78 37.40 3f8s n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 3f8s h GLU 378 N 0.00 0.22 -0.01 -3.83 5.08 -1.96 0.04 114.58 114.11 3f8s h GLU 378 Ca -0.34 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3f8s h GLU 378 Cb 1.06 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.26 3f8s h GLU 378 CO 0.29 0.14 -0.16 0.39 -1.00 0.00 0.00 179.01 178.67 3f8s n GLU 379 N -5.16 0.94 -0.08 2.33 4.71 -1.26 -4.94 120.64 117.18 3f8s n GLU 379 Ca 0.30 -0.48 0.00 0.00 -0.01 0.00 0.00 57.16 56.96 3f8s n GLU 379 Cb 0.94 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.88 3f8s n GLU 379 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3f8s n GLY 380 N 1.28 0.51 3.82 0.62 0.00 -0.00 -4.80 105.19 106.63 3f8s n GLY 380 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 3f8s n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f8s s TYR 381 N -2.18 3.68 -0.13 1.61 1.51 -1.26 -1.39 117.35 119.20 3f8s s TYR 381 Ca 0.00 0.90 -0.29 0.00 -1.01 0.00 0.00 57.07 56.67 3f8s s TYR 381 Cb 0.00 -2.27 -0.02 0.00 -0.11 0.00 0.00 41.96 39.56 3f8s s TYR 381 CO 0.00 0.59 1.15 1.03 -1.11 0.00 0.00 175.55 177.21 3f8s s ARG 382 N -0.82 4.32 0.14 -0.62 0.52 -1.26 -1.38 118.95 119.84 3f8s s ARG 382 Ca 0.22 1.56 -0.01 0.00 -0.52 0.00 0.00 55.73 56.98 3f8s s ARG 382 Cb -0.16 -3.62 -0.04 0.00 0.52 0.00 0.00 34.95 31.65 3f8s s ARG 382 CO 0.11 -0.52 0.06 -1.01 0.02 0.00 0.00 175.30 173.96 3f8s s HIS 383 N 2.69 0.88 -0.11 -0.53 3.76 -0.12 -0.73 115.29 121.13 3f8s s HIS 383 Ca 0.52 -1.24 -0.30 0.00 -0.15 0.00 0.00 55.06 53.89 3f8s s HIS 383 Cb -0.21 -0.48 -0.02 0.00 1.11 0.00 0.00 32.58 32.98 3f8s s HIS 383 CO 0.16 -0.53 1.16 0.42 -0.85 0.00 0.00 174.74 175.11 3f8s s ILE 384 N -4.06 4.40 0.18 0.60 1.01 -1.26 -1.33 121.20 120.75 3f8s s ILE 384 Ca 0.25 1.70 0.07 0.00 0.00 0.00 0.00 60.65 62.68 3f8s s ILE 384 Cb 0.07 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 3f8s s ILE 384 CO 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 174.94 174.91 3f8s s TYR 386 N -1.79 3.10 -0.15 0.00 5.04 0.51 -1.99 117.35 122.08 3f8s s TYR 386 Ca 0.28 -1.90 -0.02 0.00 -2.44 0.00 0.00 57.07 52.99 3f8s s TYR 386 Cb -0.09 -1.98 -0.02 0.00 0.35 0.00 0.00 41.96 40.22 3f8s s TYR 386 CO 0.19 -0.81 -0.09 -0.06 -1.34 0.00 0.00 175.55 173.43 3f8s s PHE 387 N 1.22 2.89 -0.14 4.97 0.40 -0.66 -1.12 117.98 125.55 3f8s s PHE 387 Ca -0.03 -0.56 -0.07 0.00 -0.60 0.00 0.00 56.93 55.67 3f8s s PHE 387 Cb -0.17 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.41 3f8s s PHE 387 CO -0.06 -0.19 0.11 -0.65 0.70 0.00 0.00 175.22 175.13 3f8s s GLN 388 N 0.46 3.63 0.33 0.44 -0.21 -1.26 -1.21 119.66 121.84 3f8s s GLN 388 Ca -0.07 -0.21 0.02 0.00 0.02 0.00 0.00 55.36 55.12 3f8s s GLN 388 Cb -0.15 -3.20 0.59 0.00 1.00 0.00 0.00 33.01 31.24 3f8s s GLN 388 CO 0.04 0.59 1.92 0.82 -2.12 0.00 0.00 175.29 176.54 3f8s h ILE 389 N 4.28 1.18 -0.53 1.08 2.04 -1.50 -1.84 117.51 122.22 3f8s h ILE 389 Ca -0.49 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 64.79 3f8s h ILE 389 Cb 1.20 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 3f8s h ILE 389 CO 0.63 0.23 0.00 0.47 0.00 0.00 0.00 178.15 179.48 3f8s n ASP 390 N -4.35 3.68 -4.78 1.72 8.00 -1.26 -4.69 116.55 114.87 3f8s n ASP 390 Ca 0.04 -2.00 -0.28 0.00 0.71 0.00 0.00 54.79 53.26 3f8s n ASP 390 Cb 0.16 -0.35 -0.06 0.00 -0.02 0.00 0.00 41.12 40.86 3f8s n ASP 390 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3f8s s LYS 391 N -1.30 2.86 0.00 -1.24 1.02 -0.69 -5.00 119.74 115.39 3f8s s LYS 391 Ca 0.43 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.60 3f8s s LYS 391 Cb 0.24 -2.66 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 3f8s s LYS 391 CO 0.33 0.51 0.78 0.36 -0.92 0.00 0.00 175.35 176.40 3f8s n LYS 392 N -0.07 0.00 0.00 1.68 2.85 -1.26 -4.65 118.16 116.71 3f8s n LYS 392 Ca -0.09 0.31 0.00 0.00 -1.05 0.00 0.00 58.31 57.49 3f8s n LYS 392 Cb 0.54 -1.29 0.00 0.00 -0.65 0.00 0.00 35.03 33.63 3f8s n LYS 392 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3f8s n ASP 393 N -1.44 0.00 -3.48 -5.58 8.00 -1.26 -5.03 116.55 107.76 3f8s n ASP 393 Ca 0.00 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.44 3f8s n ASP 393 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3f8s n ASP 393 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3f8s s THR 395 N -3.06 1.80 -0.06 0.00 2.01 -0.27 -4.83 115.64 111.22 3f8s s THR 395 Ca 0.14 -0.83 -0.30 0.00 0.31 0.00 0.00 61.69 61.02 3f8s s THR 395 Cb -0.04 -1.61 -0.02 0.00 0.01 0.00 0.00 72.50 70.84 3f8s s THR 395 CO 0.07 0.50 1.06 -0.36 -0.69 0.00 0.00 174.62 175.20 3f8s s PHE 396 N 0.85 3.46 -0.06 4.92 0.08 -1.26 0.19 117.98 126.17 3f8s s PHE 396 Ca -0.08 1.51 -0.18 0.00 0.12 0.00 0.00 56.93 58.30 3f8s s PHE 396 Cb -0.15 -3.25 -0.31 0.00 -0.57 0.00 0.00 43.02 38.75 3f8s s PHE 396 CO -0.01 -0.51 0.77 0.82 -0.10 0.00 0.00 175.22 176.19 3f8s h ILE 397 N 4.99 1.25 -1.74 0.64 2.04 -1.26 -3.48 117.51 119.96 3f8s h ILE 397 Ca -0.34 -2.51 -0.44 0.00 1.00 0.00 0.00 64.86 62.56 3f8s h ILE 397 Cb 1.17 2.97 0.00 0.00 -0.74 0.00 0.00 36.82 40.21 3f8s h ILE 397 CO 0.84 0.74 -0.34 0.42 0.00 0.00 0.00 178.15 179.80 3f8s s THR 398 N -2.48 3.80 0.13 -0.27 -4.23 -1.24 -4.90 115.64 106.44 3f8s s THR 398 Ca -0.15 -1.05 -0.24 0.00 -1.18 0.00 0.00 61.69 59.06 3f8s s THR 398 Cb 0.03 -3.31 0.07 0.00 1.34 0.00 0.00 72.50 70.64 3f8s s THR 398 CO 0.83 -0.13 0.72 -1.59 -0.54 0.00 0.00 174.62 173.91 3f8s s LYS 399 N -4.18 1.21 0.00 3.99 -2.85 -1.26 -4.69 119.74 111.97 3f8s s LYS 399 Ca 0.46 -0.50 0.00 0.00 -1.00 0.00 0.00 55.97 54.93 3f8s s LYS 399 Cb -0.09 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.20 3f8s s LYS 399 CO 0.31 -0.54 0.00 0.41 0.10 0.00 0.00 175.35 175.63 3f8s n GLY 400 N -0.36 1.38 2.31 0.59 0.00 -1.26 -4.87 105.19 102.98 3f8s n GLY 400 Ca -0.12 -2.10 -0.23 0.00 0.00 0.00 0.00 46.02 43.57 3f8s n GLY 400 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3f8s n THR 401 N -1.49 3.39 -3.84 2.61 -1.04 -1.26 -4.80 114.28 107.84 3f8s n THR 401 Ca 0.00 -2.54 -0.07 0.00 -2.04 0.00 0.00 64.05 59.39 3f8s n THR 401 Cb 0.00 -1.82 -0.01 0.00 -1.82 0.00 0.00 70.33 66.68 3f8s n THR 401 CO 0.00 0.00 0.00 -1.66 -0.64 0.00 0.00 175.07 172.77 3f8s s TRP 402 N -0.55 -0.12 0.07 -1.42 1.48 -1.26 -5.04 118.94 112.10 3f8s s TRP 402 Ca 0.62 -0.38 0.07 0.00 -1.06 0.00 0.00 56.10 55.35 3f8s s TRP 402 Cb 0.34 0.74 -0.03 0.00 -1.16 0.00 0.00 33.47 33.35 3f8s s TRP 402 CO -0.13 -1.29 -0.19 -1.21 -4.06 0.00 0.00 176.95 170.07 3f8s s GLU 403 N -3.53 1.13 -0.15 3.25 2.02 -1.26 -4.53 118.70 115.63 3f8s s GLU 403 Ca 0.12 -1.00 -0.29 0.00 0.02 0.00 0.00 54.97 53.81 3f8s s GLU 403 Cb -0.06 -1.28 -0.01 0.00 0.10 0.00 0.00 34.13 32.89 3f8s s GLU 403 CO 0.08 0.31 1.07 0.08 0.02 0.00 0.00 175.26 176.82 3f8s s VAL 404 N -1.02 4.62 0.05 2.63 1.01 0.09 -2.98 120.40 124.80 3f8s s VAL 404 Ca 0.05 1.92 -0.05 0.00 0.00 0.00 0.00 61.98 63.90 3f8s s VAL 404 Cb -0.09 -4.24 -0.29 0.00 0.00 0.00 0.00 36.38 31.76 3f8s s VAL 404 CO 0.03 -0.08 1.05 0.40 0.00 0.00 0.00 175.10 176.49 3f8s h ILE 405 N 5.26 1.38 -1.64 2.22 2.04 -1.24 -3.45 117.51 122.07 3f8s h ILE 405 Ca -0.27 -2.95 0.10 0.00 1.00 0.00 0.00 64.86 62.74 3f8s h ILE 405 Cb 1.11 2.91 -0.22 0.00 -0.74 0.00 0.00 36.82 39.88 3f8s h ILE 405 CO 0.92 0.86 0.56 -0.83 0.00 0.00 0.00 178.15 179.66 3f8s s GLY 406 N -4.73 -0.29 -0.20 5.37 0.00 -1.16 -4.99 107.32 101.32 3f8s s GLY 406 Ca -0.06 1.90 -0.14 0.00 0.00 0.00 0.00 44.72 46.42 3f8s s GLY 406 CO 0.88 0.92 0.31 -0.42 0.00 0.00 0.00 173.10 174.79 3f8s s ILE 407 N -1.43 5.27 -0.07 0.90 1.01 -1.26 -1.12 121.20 124.50 3f8s s ILE 407 Ca -0.00 0.53 0.09 0.00 0.00 0.00 0.00 60.65 61.27 3f8s s ILE 407 Cb -0.01 -3.64 -0.14 0.00 0.01 0.00 0.00 42.46 38.69 3f8s s ILE 407 CO -0.00 0.31 0.09 -0.62 0.00 0.00 0.00 174.94 174.72 3f8s n GLU 408 N 4.20 1.77 -3.47 2.79 -0.58 0.26 -4.96 120.64 120.65 3f8s n GLU 408 Ca -0.11 -0.03 -0.14 0.00 -0.42 0.00 0.00 57.16 56.46 3f8s n GLU 408 Cb 0.51 -1.25 -0.04 0.00 -0.57 0.00 0.00 31.44 30.09 3f8s n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3f8s s ALA 409 N -2.39 -1.70 -0.02 0.62 0.00 -1.02 -4.85 121.76 112.40 3f8s s ALA 409 Ca -0.05 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.84 3f8s s ALA 409 Cb 0.04 0.41 0.02 0.00 0.00 0.00 0.00 23.12 23.59 3f8s s ALA 409 CO 0.42 -0.57 0.00 -1.17 0.00 0.00 0.00 175.76 174.43 3f8s s LEU 410 N -1.99 1.31 0.00 0.00 0.20 -1.26 -0.23 118.68 116.71 3f8s s LEU 410 Ca -0.04 -0.02 0.03 0.00 0.69 0.00 0.00 54.13 54.79 3f8s s LEU 410 Cb -0.01 -0.18 -0.01 0.00 -0.43 0.00 0.00 46.19 45.57 3f8s s LEU 410 CO -0.02 -0.08 0.10 0.35 -0.29 0.00 0.00 176.35 176.41 3f8s n THR 411 N 3.93 0.00 -0.17 3.68 -2.24 0.91 -4.93 114.28 115.46 3f8s n THR 411 Ca -0.25 -1.81 -0.07 0.00 -2.27 0.00 0.00 64.05 59.66 3f8s n THR 411 Cb 0.52 0.62 0.03 0.00 -2.10 0.00 0.00 70.33 69.39 3f8s n THR 411 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3f8s h SER 412 N 1.20 0.56 0.58 3.42 4.64 -2.01 -3.29 113.55 118.65 3f8s h SER 412 Ca -0.25 -0.01 -0.28 0.00 -0.47 0.00 0.00 61.79 60.78 3f8s h SER 412 Cb 0.93 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.86 3f8s h SER 412 CO 0.40 0.40 -1.48 0.44 -0.87 0.00 0.00 176.83 175.72 3f8s h ASP 413 N 0.67 0.19 -5.03 4.97 3.32 -1.97 -3.46 116.42 115.10 3f8s h ASP 413 Ca 0.19 -0.28 -0.15 0.00 0.02 0.00 0.00 57.03 56.82 3f8s h ASP 413 Cb -0.05 -0.06 -0.19 0.00 0.22 0.00 0.00 39.33 39.24 3f8s h ASP 413 CO -0.06 1.23 -0.59 -0.31 -1.72 0.00 0.00 179.24 177.80 3f8s s TYR 414 N -2.63 0.20 -0.07 4.55 2.02 -1.24 -2.11 117.35 118.08 3f8s s TYR 414 Ca -0.06 -0.45 0.05 0.00 -0.37 0.00 0.00 57.07 56.24 3f8s s TYR 414 Cb 0.08 -0.15 -0.01 0.00 -0.40 0.00 0.00 41.96 41.48 3f8s s TYR 414 CO 0.83 -0.28 -0.23 -1.17 -1.57 0.00 0.00 175.55 173.13 3f8s s LEU 415 N -1.73 2.03 -0.07 -1.29 0.20 -0.96 -0.06 118.68 116.79 3f8s s LEU 415 Ca -0.11 -0.49 0.03 0.00 0.69 0.00 0.00 54.13 54.25 3f8s s LEU 415 Cb -0.06 -1.30 -0.02 0.00 -0.43 0.00 0.00 46.19 44.39 3f8s s LEU 415 CO -0.02 0.20 -0.16 -0.31 -0.29 0.00 0.00 176.35 175.77 3f8s s TYR 416 N 0.04 2.66 0.06 5.38 1.51 0.67 -1.47 117.35 126.20 3f8s s TYR 416 Ca -0.08 -0.39 -0.05 0.00 -1.01 0.00 0.00 57.07 55.54 3f8s s TYR 416 Cb -0.15 -1.67 -0.02 0.00 -0.11 0.00 0.00 41.96 40.02 3f8s s TYR 416 CO 0.05 0.01 0.08 1.52 -1.11 0.00 0.00 175.55 176.10 3f8s s TYR 417 N -0.36 0.30 -0.08 2.71 1.13 -0.97 0.92 117.35 121.00 3f8s s TYR 417 Ca 0.03 -0.74 -0.10 0.00 -1.41 0.00 0.00 57.07 54.86 3f8s s TYR 417 Cb -0.12 -0.20 -0.05 0.00 -1.10 0.00 0.00 41.96 40.49 3f8s s TYR 417 CO 0.02 -0.43 0.23 0.42 -2.51 0.00 0.00 175.55 173.28 3f8s s ILE 418 N -3.51 5.34 0.09 -3.49 1.01 -0.28 -0.97 121.20 119.40 3f8s s ILE 418 Ca 0.03 0.43 -0.13 0.00 0.00 0.00 0.00 60.65 60.98 3f8s s ILE 418 Cb 0.04 -3.51 0.02 0.00 0.01 0.00 0.00 42.46 39.02 3f8s s ILE 418 CO -0.09 0.60 0.30 -0.94 0.00 0.00 0.00 174.94 174.81 3f8s s SER 419 N -1.04 -0.07 -0.21 3.58 1.04 -0.94 -0.70 113.70 115.37 3f8s s SER 419 Ca 0.18 -0.43 0.06 0.00 0.48 0.00 0.00 55.95 56.24 3f8s s SER 419 Cb -0.14 0.40 0.46 0.00 0.10 0.00 0.00 66.02 66.84 3f8s s SER 419 CO 0.07 -0.76 1.40 -0.46 0.98 0.00 0.00 173.24 174.48 3f8s n ASN 420 N -0.01 3.71 -0.16 7.02 2.04 -1.16 -2.39 115.26 124.31 3f8s n ASN 420 Ca -0.16 -2.76 -0.03 0.00 -0.44 0.00 0.00 54.58 51.18 3f8s n ASN 420 Cb 0.62 -0.66 0.06 0.00 -2.53 0.00 0.00 39.78 37.28 3f8s n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.44 0.00 0.00 177.26 176.74 3f8s h GLU 421 N 1.60 0.40 -6.07 -3.83 4.81 -1.85 -3.29 114.58 106.35 3f8s h GLU 421 Ca 0.18 -0.02 -0.69 0.00 -0.13 0.00 0.00 59.36 58.70 3f8s h GLU 421 Cb 1.75 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 31.04 3f8s h GLU 421 CO 0.48 0.26 1.22 0.98 -0.73 0.00 0.00 179.01 181.22 3f8s n TYR 422 N -4.96 1.82 -1.75 0.92 9.36 -1.26 -1.08 117.16 120.20 3f8s n TYR 422 Ca 0.05 0.34 -0.16 0.00 3.32 0.00 0.00 57.90 61.45 3f8s n TYR 422 Cb 0.18 -2.52 -0.05 0.00 -0.63 0.00 0.00 39.34 36.33 3f8s n TYR 422 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 3f8s n LYS 423 N 7.11 -1.16 -3.22 2.98 5.02 -1.26 -2.87 118.16 124.76 3f8s n LYS 423 Ca 0.35 0.96 -0.23 0.00 -2.02 0.00 0.00 58.31 57.36 3f8s n LYS 423 Cb 0.19 -5.20 0.03 0.00 -0.02 0.00 0.00 35.03 30.03 3f8s n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3f8s n GLY 424 N -1.02 -0.52 3.21 0.72 0.00 -0.24 -4.94 105.19 102.40 3f8s n GLY 424 Ca -0.17 0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 3f8s n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3f8s s MET 425 N -5.91 2.41 0.50 1.61 -1.94 -1.14 -4.96 119.30 109.88 3f8s s MET 425 Ca 0.38 -1.56 0.34 0.00 -1.71 0.00 0.00 55.69 53.15 3f8s s MET 425 Cb -0.18 -3.67 1.77 0.00 2.01 0.00 0.00 34.83 34.76 3f8s s MET 425 CO 0.47 -0.97 2.03 -1.35 -0.01 0.00 0.00 175.02 175.20 3f8s h PRO 426 N 8.27 0.00 -0.42 2.03 0.11 -1.90 -1.78 132.00 138.31 3f8s h PRO 426 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.91 3f8s h PRO 426 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3f8s h PRO 426 CO 0.72 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.92 3f8s n GLY 427 N -0.96 2.97 3.94 -0.55 0.00 -1.26 -4.84 105.19 104.48 3f8s n GLY 427 Ca -0.02 -0.61 -0.19 0.00 0.00 0.00 0.00 46.02 45.20 3f8s n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3f8s s GLY 428 N -1.16 1.85 -0.13 -0.02 0.00 -0.67 -2.32 107.32 104.87 3f8s s GLY 428 Ca 0.33 -1.65 -0.19 0.00 0.00 0.00 0.00 44.72 43.21 3f8s s GLY 428 CO 0.18 -1.52 0.49 0.50 0.00 0.00 0.00 173.10 172.75 3f8s s ARG 429 N -4.17 0.68 -0.11 2.90 0.52 -0.20 -4.01 118.95 114.56 3f8s s ARG 429 Ca 0.47 0.45 -0.27 0.00 -0.52 0.00 0.00 55.73 55.86 3f8s s ARG 429 Cb -0.07 0.32 0.06 0.00 0.52 0.00 0.00 34.95 35.78 3f8s s ARG 429 CO 0.30 -0.13 0.64 -0.80 0.02 0.00 0.00 175.30 175.32 3f8s s ASN 430 N -0.30 -0.63 -0.03 0.23 0.01 -1.00 -2.10 114.94 111.12 3f8s s ASN 430 Ca -0.05 0.86 -0.30 0.00 -0.71 0.00 0.00 52.86 52.67 3f8s s ASN 430 Cb -0.03 0.78 -0.03 0.00 0.41 0.00 0.00 41.25 42.38 3f8s s ASN 430 CO 0.03 -0.47 1.02 -0.22 -1.51 0.00 0.00 177.10 175.94 3f8s s LEU 431 N -0.71 4.33 0.18 0.60 0.20 -1.26 -2.22 118.68 119.80 3f8s s LEU 431 Ca -0.08 1.66 0.07 0.00 0.69 0.00 0.00 54.13 56.47 3f8s s LEU 431 Cb -0.02 -3.57 -0.04 0.00 -0.43 0.00 0.00 46.19 42.13 3f8s s LEU 431 CO 0.07 -0.35 -0.14 -0.31 -0.29 0.00 0.00 176.35 175.32 3f8s s TYR 432 N 1.38 1.63 -0.05 5.38 1.51 -0.14 -1.24 117.35 125.83 3f8s s TYR 432 Ca 0.52 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 56.03 3f8s s TYR 432 Cb -0.21 -0.78 0.00 0.00 -0.11 0.00 0.00 41.96 40.86 3f8s s TYR 432 CO 0.25 0.29 -0.14 -1.59 -1.11 0.00 0.00 175.55 173.25 3f8s s LYS 433 N -3.41 1.60 -0.28 -0.62 -2.85 -0.50 -2.28 119.74 111.40 3f8s s LYS 433 Ca 0.19 -0.49 -0.11 0.00 -1.00 0.00 0.00 55.97 54.56 3f8s s LYS 433 Cb -0.02 -1.38 -0.05 0.00 -2.06 0.00 0.00 37.83 34.33 3f8s s LYS 433 CO 0.06 0.15 0.20 0.42 0.10 0.00 0.00 175.35 176.28 3f8s s ILE 434 N 0.26 5.30 -0.03 3.79 1.01 -0.54 -1.76 121.20 129.22 3f8s s ILE 434 Ca -0.07 0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.48 3f8s s ILE 434 Cb -0.12 -3.54 -0.06 0.00 0.01 0.00 0.00 42.46 38.74 3f8s s ILE 434 CO 0.02 0.24 1.68 -1.58 0.00 0.00 0.00 174.94 175.30 3f8s s GLN 435 N 1.78 4.18 0.24 2.79 0.74 -0.91 -2.28 119.66 126.21 3f8s s GLN 435 Ca 0.08 2.24 0.25 0.00 0.05 0.00 0.00 55.36 57.97 3f8s s GLN 435 Cb -0.16 -3.96 0.89 0.00 1.10 0.00 0.00 33.01 30.89 3f8s s GLN 435 CO 0.11 -0.84 1.75 1.28 -0.55 0.00 0.00 175.29 177.04 3f8s n LEU 436 N 6.98 0.78 0.11 3.68 4.77 -0.90 -2.41 117.00 130.02 3f8s n LEU 436 Ca 0.17 0.62 0.05 0.00 -0.03 0.00 0.00 56.01 56.83 3f8s n LEU 436 Cb 0.42 -0.44 0.01 0.00 -2.33 0.00 0.00 43.42 41.09 3f8s n LEU 436 CO 0.63 -0.37 0.21 0.77 -1.33 0.00 0.00 177.39 177.30 3f8s h SER 437 N 0.00 0.00 -2.53 -1.43 4.64 -1.90 -3.42 113.55 108.90 3f8s h SER 437 Ca 0.00 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.87 3f8s h SER 437 Cb 0.57 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.29 3f8s h SER 437 CO 0.00 0.34 -0.72 -0.62 -0.87 0.00 0.00 176.83 174.95 3f8s s ASP 438 N -5.99 2.79 0.65 4.97 -1.08 -1.01 -5.00 116.67 112.00 3f8s s ASP 438 Ca 0.02 -1.08 0.40 0.00 -0.52 0.00 0.00 52.55 51.37 3f8s s ASP 438 Cb 0.08 -0.01 2.21 0.00 -1.46 0.00 0.00 42.92 43.74 3f8s s ASP 438 CO 0.76 -0.42 2.31 1.88 0.52 0.00 0.00 175.17 180.22 3f8s h TYR 439 N 8.35 0.00 -0.00 -5.34 0.05 -1.81 0.20 116.97 118.42 3f8s h TYR 439 Ca -0.17 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.61 3f8s h TYR 439 Cb 1.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.78 3f8s h TYR 439 CO 0.29 0.00 -0.01 0.25 -1.05 0.00 0.00 178.16 177.63 3f8s n THR 440 N -3.28 0.00 -3.20 -2.88 -2.24 -1.26 -4.35 114.28 97.07 3f8s n THR 440 Ca -0.03 -0.00 -0.46 0.00 -2.27 0.00 0.00 64.05 61.29 3f8s n THR 440 Cb 0.11 -0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 67.84 3f8s n THR 440 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3f8s s LYS 441 N -2.63 3.39 0.02 -0.78 1.02 0.70 -5.01 119.74 116.45 3f8s s LYS 441 Ca 0.26 -1.96 0.06 0.00 0.02 0.00 0.00 55.97 54.36 3f8s s LYS 441 Cb 0.20 -4.47 -0.03 0.00 -0.52 0.00 0.00 37.83 33.01 3f8s s LYS 441 CO 0.47 -1.45 -0.18 0.08 -0.92 0.00 0.00 175.35 173.36 3f8s s VAL 442 N 1.44 2.79 -0.02 3.17 1.01 -1.26 -2.14 120.40 125.39 3f8s s VAL 442 Ca 0.17 -1.10 -0.00 0.00 0.00 0.00 0.00 61.98 61.06 3f8s s VAL 442 Cb -0.15 -2.15 0.03 0.00 0.00 0.00 0.00 36.38 34.11 3f8s s VAL 442 CO -0.04 0.40 0.03 0.42 0.00 0.00 0.00 175.10 175.91 3f8s s THR 443 N -0.87 -0.02 -0.08 3.92 -4.23 -0.72 -4.97 115.64 108.67 3f8s s THR 443 Ca 0.14 0.21 -0.28 0.00 -1.18 0.00 0.00 61.69 60.58 3f8s s THR 443 Cb -0.10 -0.12 -0.02 0.00 1.34 0.00 0.00 72.50 73.59 3f8s s THR 443 CO 0.04 0.11 0.90 0.00 -0.54 0.00 0.00 174.62 175.13 3f8s n LEU 445 N 4.46 0.32 0.00 0.00 4.77 -0.37 -4.58 117.00 121.60 3f8s n LEU 445 Ca 0.05 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 3f8s n LEU 445 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3f8s n LEU 445 CO 0.50 0.08 0.10 -1.54 -1.33 0.00 0.00 177.39 175.21 3f8s n SER 446 N -1.98 0.42 -0.10 -1.43 3.41 -1.20 -4.82 113.62 107.92 3f8s n SER 446 Ca -0.01 -0.73 -0.12 0.00 -0.26 0.00 0.00 58.87 57.74 3f8s n SER 446 Cb 0.47 0.29 -0.04 0.00 -0.26 0.00 0.00 64.21 64.67 3f8s n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f8s n GLU 448 N -4.38 2.70 0.45 0.00 -0.58 -1.26 -4.35 120.64 113.22 3f8s n GLU 448 Ca -0.03 -2.32 -0.18 0.00 -0.42 0.00 0.00 57.16 54.20 3f8s n GLU 448 Cb 0.39 -1.42 -0.09 0.00 -0.57 0.00 0.00 31.44 29.75 3f8s n GLU 448 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3f8s h LEU 449 N 3.27 -1.07 -6.40 -4.62 3.38 -1.88 -3.39 115.31 104.60 3f8s h LEU 449 Ca 0.00 0.05 -0.46 0.00 0.09 0.00 0.00 57.88 57.56 3f8s h LEU 449 Cb 0.86 0.29 -0.34 0.00 0.09 0.00 0.00 40.66 41.56 3f8s h LEU 449 CO 0.00 -0.72 -0.76 0.21 0.09 0.00 0.00 178.44 177.25 3f8s s ASN 450 N -3.83 1.76 0.28 -0.43 3.84 -1.26 -5.04 114.94 110.25 3f8s s ASN 450 Ca -0.18 -1.94 -0.02 0.00 0.21 0.00 0.00 52.86 50.94 3f8s s ASN 450 Cb 0.02 0.17 0.42 0.00 -0.55 0.00 0.00 41.25 41.31 3f8s s ASN 450 CO 0.54 -0.26 1.91 -0.65 -2.79 0.00 0.00 177.10 175.84 3f8s h PRO 451 N 6.86 1.14 -0.01 0.43 0.11 -1.77 0.31 132.00 139.06 3f8s h PRO 451 Ca 0.07 -0.07 -0.11 0.00 0.11 0.00 0.00 66.00 66.00 3f8s h PRO 451 Cb 1.01 -0.26 0.01 0.00 0.11 0.00 0.00 31.00 31.88 3f8s h PRO 451 CO 0.23 0.75 -0.44 0.93 -0.21 0.00 0.00 178.00 179.26 3f8s h GLU 452 N 1.17 0.32 0.04 1.05 3.07 -1.96 -3.33 114.58 114.94 3f8s h GLU 452 Ca 0.40 -0.33 -0.24 0.00 -0.50 0.00 0.00 59.36 58.69 3f8s h GLU 452 Cb 0.08 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 3f8s h GLU 452 CO -0.14 1.01 -1.13 -0.09 -1.40 0.00 0.00 179.01 177.26 3f8s h ARG 453 N -0.25 0.09 -4.63 2.33 2.43 -1.93 -3.42 114.38 109.00 3f8s h ARG 453 Ca -0.05 -0.15 -0.62 0.00 -0.81 0.00 0.00 59.98 58.35 3f8s h ARG 453 Cb 1.16 0.06 -0.37 0.00 -0.42 0.00 0.00 29.97 30.40 3f8s h ARG 453 CO 0.09 1.04 -0.82 0.00 -1.51 0.00 0.00 179.97 178.77 3f8s n GLN 455 N 4.70 0.00 -3.75 0.00 6.02 0.94 -4.41 117.38 120.89 3f8s n GLN 455 Ca -0.16 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.54 3f8s n GLN 455 Cb 0.48 -0.36 -0.14 0.00 1.02 0.00 0.00 30.24 31.24 3f8s n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 3f8s s TYR 456 N 0.00 2.03 0.03 1.08 6.14 -0.82 -1.03 117.35 124.78 3f8s s TYR 456 Ca 0.00 -2.23 0.02 0.00 0.64 0.00 0.00 57.07 55.50 3f8s s TYR 456 Cb 0.00 -1.92 -0.04 0.00 0.42 0.00 0.00 41.96 40.43 3f8s s TYR 456 CO 0.00 -0.83 0.02 0.71 0.64 0.00 0.00 175.55 176.09 3f8s s TYR 457 N 0.85 3.11 0.36 4.97 2.02 -0.89 -1.01 117.35 126.76 3f8s s TYR 457 Ca 0.14 0.08 0.04 0.00 -0.37 0.00 0.00 57.07 56.97 3f8s s TYR 457 Cb -0.22 -1.65 -0.06 0.00 -0.40 0.00 0.00 41.96 39.63 3f8s s TYR 457 CO -0.09 0.49 0.05 -1.54 -1.57 0.00 0.00 175.55 172.88 3f8s s SER 458 N -1.83 2.82 0.04 2.29 1.04 -0.52 -4.45 113.70 113.09 3f8s s SER 458 Ca 0.22 -1.40 -0.06 0.00 0.48 0.00 0.00 55.95 55.20 3f8s s SER 458 Cb -0.12 -0.12 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 3f8s s SER 458 CO 0.14 -0.59 0.11 0.54 0.98 0.00 0.00 173.24 174.42 3f8s s VAL 459 N -3.13 0.13 -0.19 5.02 0.11 -1.26 -1.46 120.40 119.62 3f8s s VAL 459 Ca 0.35 -1.11 -0.04 0.00 -2.93 0.00 0.00 61.98 58.25 3f8s s VAL 459 Cb 0.09 -0.97 0.08 0.00 -1.53 0.00 0.00 36.38 34.05 3f8s s VAL 459 CO 0.16 -0.61 0.17 -0.55 -3.33 0.00 0.00 175.10 170.94 3f8s s SER 460 N -2.23 1.76 0.07 3.54 0.15 -0.43 -4.96 113.70 111.61 3f8s s SER 460 Ca -0.03 -0.38 -0.08 0.00 0.70 0.00 0.00 55.95 56.16 3f8s s SER 460 Cb -0.00 0.13 -0.05 0.00 -1.71 0.00 0.00 66.02 64.39 3f8s s SER 460 CO -0.05 -0.34 0.36 -0.36 1.20 0.00 0.00 173.24 174.05 3f8s s PHE 461 N 2.25 3.56 0.98 3.44 0.08 -1.26 0.81 117.98 127.84 3f8s s PHE 461 Ca 0.05 0.68 -0.11 0.00 0.12 0.00 0.00 56.93 57.68 3f8s s PHE 461 Cb -0.16 -2.08 0.18 0.00 -0.57 0.00 0.00 43.02 40.39 3f8s s PHE 461 CO -0.11 0.52 1.12 -1.54 -0.10 0.00 0.00 175.22 175.11 3f8s s SER 462 N -1.89 2.41 0.66 1.36 1.04 -0.41 -4.86 113.70 112.01 3f8s s SER 462 Ca 0.33 2.02 -0.17 0.00 0.48 0.00 0.00 55.95 58.62 3f8s s SER 462 Cb -0.13 -2.51 -0.04 0.00 0.10 0.00 0.00 66.02 63.44 3f8s s SER 462 CO 0.19 -3.40 0.70 0.29 0.98 0.00 0.00 173.24 172.00 3f8s n LYS 463 N -4.42 0.52 -0.26 4.02 5.02 -1.07 -0.71 118.16 121.26 3f8s n LYS 463 Ca 0.10 0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.60 3f8s n LYS 463 Cb 0.53 -1.94 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 3f8s n LYS 463 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3f8s n GLU 464 N -0.82 0.00 -3.44 1.97 1.02 -1.26 -3.74 120.64 114.36 3f8s n GLU 464 Ca 0.12 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 57.06 3f8s n GLU 464 Cb 0.49 -4.08 0.08 0.00 -0.02 0.00 0.00 31.44 27.90 3f8s n GLU 464 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3f8s n ALA 465 N 0.96 -1.41 0.09 0.62 0.00 0.11 -4.91 120.51 115.97 3f8s n ALA 465 Ca 0.00 0.24 -0.12 0.00 0.00 0.00 0.00 53.44 53.56 3f8s n ALA 465 Cb 0.00 -4.20 -0.12 0.00 0.00 0.00 0.00 19.45 15.13 3f8s n ALA 465 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3f8s h LYS 466 N -2.25 0.16 -4.82 0.00 6.56 -1.76 -3.43 116.57 111.03 3f8s h LYS 466 Ca -0.53 -0.26 -0.30 0.00 -1.06 0.00 0.00 60.65 58.50 3f8s h LYS 466 Cb 1.33 0.10 -0.15 0.00 -0.57 0.00 0.00 32.23 32.94 3f8s h LYS 466 CO 0.50 1.11 -0.66 0.71 -2.06 0.00 0.00 179.45 179.05 3f8s s TYR 467 N -2.72 1.25 -0.01 -1.35 2.02 -1.26 -0.47 117.35 114.80 3f8s s TYR 467 Ca -0.02 -1.03 -0.08 0.00 -0.37 0.00 0.00 57.07 55.56 3f8s s TYR 467 Cb 0.08 -0.71 0.01 0.00 -0.40 0.00 0.00 41.96 40.94 3f8s s TYR 467 CO 0.85 -0.22 0.18 1.52 -1.57 0.00 0.00 175.55 176.31 3f8s s TYR 468 N -3.66 -0.04 -0.15 2.71 1.13 -0.01 -1.28 117.35 116.05 3f8s s TYR 468 Ca 0.25 0.06 -0.20 0.00 -1.41 0.00 0.00 57.07 55.77 3f8s s TYR 468 Cb 0.06 -0.00 -0.03 0.00 -1.10 0.00 0.00 41.96 40.89 3f8s s TYR 468 CO 0.05 -0.27 0.58 -1.14 -2.51 0.00 0.00 175.55 172.26 3f8s s GLN 469 N -1.09 4.29 0.02 -3.49 0.74 0.24 -0.97 119.66 119.40 3f8s s GLN 469 Ca -0.12 0.59 -0.12 0.00 0.05 0.00 0.00 55.36 55.77 3f8s s GLN 469 Cb -0.06 -3.51 -0.05 0.00 1.10 0.00 0.00 33.01 30.49 3f8s s GLN 469 CO 0.02 -0.05 0.37 -0.51 -0.55 0.00 0.00 175.29 174.57 3f8s s LEU 470 N 1.27 4.42 -0.24 3.68 1.43 -0.15 -1.32 118.68 127.76 3f8s s LEU 470 Ca 0.29 0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 54.21 3f8s s LEU 470 Cb -0.16 -2.67 0.08 0.00 0.03 0.00 0.00 46.19 43.46 3f8s s LEU 470 CO 0.12 0.28 0.05 -0.60 0.23 0.00 0.00 176.35 176.43 3f8s s ARG 471 N -1.39 0.76 -0.17 1.70 6.06 -0.54 -2.09 118.95 123.29 3f8s s ARG 471 Ca 0.26 -0.72 -0.13 0.00 -2.50 0.00 0.00 55.73 52.64 3f8s s ARG 471 Cb -0.15 -2.08 -0.05 0.00 0.06 0.00 0.00 34.95 32.73 3f8s s ARG 471 CO 0.14 -0.78 0.25 0.00 -2.50 0.00 0.00 175.30 172.41 3f8s n SER 473 N 3.52 1.61 0.00 0.00 7.64 -0.18 -1.68 113.62 124.53 3f8s n SER 473 Ca -0.13 -1.30 0.00 0.00 1.01 0.00 0.00 58.87 58.45 3f8s n SER 473 Cb 0.52 0.44 0.00 0.00 -1.01 0.00 0.00 64.21 64.16 3f8s n SER 473 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f8s n GLY 474 N 1.10 -0.67 0.03 0.23 0.00 -1.26 -0.39 105.19 104.23 3f8s n GLY 474 Ca 0.06 -1.68 0.06 0.00 0.00 0.00 0.00 46.02 44.47 3f8s n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3f8s n PRO 475 N -1.51 0.04 -0.59 1.61 -0.04 0.65 -0.04 135.00 135.11 3f8s n PRO 475 Ca 0.00 0.35 -0.04 0.00 -0.04 0.00 0.00 63.50 63.77 3f8s n PRO 475 Cb 0.00 -1.58 0.03 0.00 -0.04 0.00 0.00 33.50 31.91 3f8s n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3f8s n GLY 476 N -0.40 -0.31 3.77 0.55 0.00 -0.00 -4.51 105.19 104.29 3f8s n GLY 476 Ca 0.02 -1.81 -0.39 0.00 0.00 0.00 0.00 46.02 43.84 3f8s n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f8s s LEU 477 N 0.00 4.17 0.49 0.99 1.43 -1.26 -4.56 118.68 119.94 3f8s s LEU 477 Ca 0.12 2.73 -0.24 0.00 -1.03 0.00 0.00 54.13 55.71 3f8s s LEU 477 Cb -0.00 -3.92 -0.07 0.00 0.03 0.00 0.00 46.19 42.22 3f8s s LEU 477 CO 0.08 -0.96 1.37 -2.65 0.23 0.00 0.00 176.35 174.42 3f8s n PRO 478 N 0.00 1.97 -4.19 1.29 -0.02 -1.26 -4.76 135.00 128.03 3f8s n PRO 478 Ca 0.04 0.71 -0.23 0.00 -2.02 0.00 0.00 63.50 62.00 3f8s n PRO 478 Cb 0.43 -2.57 -0.17 0.00 -0.02 0.00 0.00 33.50 31.18 3f8s n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3f8s s LEU 479 N -2.81 1.31 -0.21 2.45 0.20 -0.68 -4.24 118.68 114.70 3f8s s LEU 479 Ca 0.65 -0.22 -0.02 0.00 0.69 0.00 0.00 54.13 55.23 3f8s s LEU 479 Cb -0.44 -0.66 0.01 0.00 -0.43 0.00 0.00 46.19 44.66 3f8s s LEU 479 CO 0.54 -0.06 -0.09 -0.31 -0.29 0.00 0.00 176.35 176.14 3f8s s TYR 480 N 1.15 2.92 0.19 5.38 1.51 0.25 -1.11 117.35 127.64 3f8s s TYR 480 Ca -0.07 -1.26 0.07 0.00 -1.01 0.00 0.00 57.07 54.80 3f8s s TYR 480 Cb -0.14 -2.04 -0.05 0.00 -0.11 0.00 0.00 41.96 39.62 3f8s s TYR 480 CO -0.01 -0.66 -0.13 0.95 -1.11 0.00 0.00 175.55 174.59 3f8s s THR 481 N 1.39 1.58 0.04 -0.71 -4.23 -0.89 0.22 115.64 113.05 3f8s s THR 481 Ca 0.05 -2.17 0.09 0.00 -1.18 0.00 0.00 61.69 58.47 3f8s s THR 481 Cb -0.14 -2.00 -0.03 0.00 1.34 0.00 0.00 72.50 71.67 3f8s s THR 481 CO -0.06 -0.63 -0.25 -0.22 -0.54 0.00 0.00 174.62 172.92 3f8s s LEU 482 N -3.28 2.24 0.04 4.79 2.96 0.21 -0.98 118.68 124.66 3f8s s LEU 482 Ca 0.21 -0.55 -0.00 0.00 -0.22 0.00 0.00 54.13 53.57 3f8s s LEU 482 Cb 0.00 -1.34 -0.03 0.00 0.50 0.00 0.00 46.19 45.32 3f8s s LEU 482 CO 0.05 0.27 -0.03 -1.00 -1.32 0.00 0.00 176.35 174.31 3f8s s HIS 483 N -0.81 0.46 -0.06 5.38 3.76 -0.14 -0.68 115.29 123.19 3f8s s HIS 483 Ca 0.12 -0.87 0.03 0.00 -0.15 0.00 0.00 55.06 54.19 3f8s s HIS 483 Cb -0.10 -0.33 -0.02 0.00 1.11 0.00 0.00 32.58 33.23 3f8s s HIS 483 CO 0.02 -0.30 -0.15 0.45 -0.85 0.00 0.00 174.74 173.91 3f8s s SER 484 N -2.41 3.93 0.02 1.40 0.15 0.67 -0.83 113.70 116.62 3f8s s SER 484 Ca -0.01 -0.25 -0.05 0.00 0.70 0.00 0.00 55.95 56.35 3f8s s SER 484 Cb 0.02 -0.97 -0.29 0.00 -1.71 0.00 0.00 66.02 63.07 3f8s s SER 484 CO -0.07 0.30 0.93 0.28 1.20 0.00 0.00 173.24 175.89 3f8s h SER 485 N 5.65 0.44 0.00 5.45 0.02 -1.05 -1.24 113.55 122.82 3f8s h SER 485 Ca -0.41 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 59.98 3f8s h SER 485 Cb 1.16 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.56 3f8s h SER 485 CO 0.51 1.46 0.00 0.52 -1.14 0.00 0.00 176.83 178.18 3f8s n VAL 486 N -3.49 0.00 -3.73 2.27 0.31 -1.26 -2.79 118.33 109.63 3f8s n VAL 486 Ca -0.15 1.36 -0.28 0.00 -0.01 0.00 0.00 64.34 65.26 3f8s n VAL 486 Cb 1.04 -1.83 -0.10 0.00 -0.91 0.00 0.00 33.84 32.04 3f8s n VAL 486 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3f8s n ASN 487 N -2.74 3.34 0.00 4.52 5.03 -1.26 -4.97 115.26 119.19 3f8s n ASN 487 Ca 0.00 -3.29 0.00 0.00 0.87 0.00 0.00 54.58 52.16 3f8s n ASN 487 Cb 0.00 -0.74 0.00 0.00 -1.02 0.00 0.00 39.78 38.02 3f8s n ASN 487 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 3f8s n ASP 488 N 1.59 0.00 -4.79 6.41 8.00 -1.07 -4.74 116.55 121.95 3f8s n ASP 488 Ca 0.23 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.36 3f8s n ASP 488 Cb 0.37 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.41 3f8s n ASP 488 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3f8s s LYS 489 N 0.00 4.03 -0.11 -1.24 -0.14 -0.49 -4.89 119.74 116.91 3f8s s LYS 489 Ca 0.00 0.24 -0.30 0.00 -1.36 0.00 0.00 55.97 54.55 3f8s s LYS 489 Cb 0.00 -3.32 -0.02 0.00 -1.68 0.00 0.00 37.83 32.81 3f8s s LYS 489 CO 0.00 0.47 1.21 0.20 -0.76 0.00 0.00 175.35 176.47 3f8s s GLY 490 N -0.29 1.91 -0.20 -3.33 0.00 -1.26 -0.24 107.32 103.91 3f8s s GLY 490 Ca 0.20 0.52 -0.04 0.00 0.00 0.00 0.00 44.72 45.40 3f8s s GLY 490 CO 0.08 2.31 0.04 1.04 0.00 0.00 0.00 173.10 176.57 3f8s n LEU 491 N 5.81 2.70 -3.61 0.66 4.77 0.15 -4.95 117.00 122.52 3f8s n LEU 491 Ca 0.12 0.08 0.02 0.00 -0.03 0.00 0.00 56.01 56.20 3f8s n LEU 491 Cb 0.46 -1.00 -0.06 0.00 -2.33 0.00 0.00 43.42 40.49 3f8s n LEU 491 CO 0.55 0.84 0.95 -0.60 -1.33 0.00 0.00 177.39 177.80 3f8s s ARG 492 N -2.53 0.09 -0.04 3.23 3.52 -1.19 -5.03 118.95 117.00 3f8s s ARG 492 Ca -0.30 0.16 -0.29 0.00 -0.13 0.00 0.00 55.73 55.17 3f8s s ARG 492 Cb 0.08 0.03 -0.03 0.00 -1.56 0.00 0.00 34.95 33.47 3f8s s ARG 492 CO 0.66 -0.02 0.94 0.08 -0.81 0.00 0.00 175.30 176.16 3f8s s VAL 493 N 1.18 4.87 -0.25 7.11 1.01 -1.26 -0.62 120.40 132.44 3f8s s VAL 493 Ca -0.07 1.96 -0.04 0.00 0.00 0.00 0.00 61.98 63.82 3f8s s VAL 493 Cb -0.02 -4.27 -0.17 0.00 0.00 0.00 0.00 36.38 31.91 3f8s s VAL 493 CO -0.11 0.13 -0.17 0.18 0.00 0.00 0.00 175.10 175.13 3f8s n LEU 494 N 4.22 2.64 -3.69 3.92 4.77 0.13 -4.96 117.00 124.04 3f8s n LEU 494 Ca 0.06 0.04 -0.11 0.00 -0.03 0.00 0.00 56.01 55.97 3f8s n LEU 494 Cb 0.50 -0.92 -0.11 0.00 -2.33 0.00 0.00 43.42 40.56 3f8s n LEU 494 CO 0.51 0.81 -0.01 -0.70 -1.33 0.00 0.00 177.39 176.68 3f8s s GLU 495 N -2.52 0.31 0.00 3.23 2.56 -1.01 -5.00 118.70 116.27 3f8s s GLU 495 Ca -0.34 0.78 0.05 0.00 0.00 0.00 0.00 54.97 55.46 3f8s s GLU 495 Cb 0.10 0.02 0.11 0.00 2.00 0.00 0.00 34.13 36.36 3f8s s GLU 495 CO 0.59 -0.19 0.96 -0.40 -0.56 0.00 0.00 175.26 175.66 3f8s n ASP 496 N 4.60 2.09 -3.40 -1.70 5.68 -1.26 -0.58 116.55 121.97 3f8s n ASP 496 Ca -0.19 -1.71 -0.25 0.00 -0.50 0.00 0.00 54.79 52.14 3f8s n ASP 496 Cb 0.53 -0.07 0.02 0.00 -1.14 0.00 0.00 41.12 40.46 3f8s n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3f8s n ASN 497 N 0.12 -4.92 -0.18 -1.12 3.02 -1.26 -4.84 115.26 106.07 3f8s n ASN 497 Ca 0.05 -0.46 -0.05 0.00 -0.03 0.00 0.00 54.58 54.08 3f8s n ASN 497 Cb 0.26 -3.98 0.11 0.00 -0.61 0.00 0.00 39.78 35.56 3f8s n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3f8s h SER 498 N -1.48 0.91 0.09 6.41 4.64 -1.94 -1.91 113.55 120.28 3f8s h SER 498 Ca -0.51 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 60.61 3f8s h SER 498 Cb 1.34 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 3f8s h SER 498 CO 0.58 0.92 -0.20 0.00 -0.87 0.00 0.00 176.83 177.26 3f8s h ALA 499 N 1.19 -0.78 -0.94 5.18 0.00 -1.99 -1.72 119.26 120.21 3f8s h ALA 499 Ca 0.19 -0.05 0.22 0.00 0.00 0.00 0.00 54.91 55.27 3f8s h ALA 499 Cb 0.39 0.57 -0.17 0.00 0.00 0.00 0.00 17.79 18.57 3f8s h ALA 499 CO 0.01 -0.82 -0.08 1.25 0.00 0.00 0.00 179.25 179.61 3f8s h LEU 500 N -0.32 -0.62 -0.96 0.00 6.46 -1.83 0.21 115.31 118.26 3f8s h LEU 500 Ca -0.01 0.27 0.14 0.00 -0.12 0.00 0.00 57.88 58.16 3f8s h LEU 500 Cb 0.30 0.50 -0.09 0.00 -0.73 0.00 0.00 40.66 40.65 3f8s h LEU 500 CO -0.08 -0.31 0.58 -0.78 -0.62 0.00 0.00 178.44 177.22 3f8s h ASP 501 N 0.02 0.80 -0.28 1.25 3.58 -0.75 -0.43 116.42 120.62 3f8s h ASP 501 Ca 0.51 0.07 -0.14 0.00 0.42 0.00 0.00 57.03 57.90 3f8s h ASP 501 Cb 0.94 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 41.90 3f8s h ASP 501 CO -0.90 0.38 -0.36 0.11 -2.88 0.00 0.00 179.24 175.59 3f8s h LYS 502 N 0.86 0.73 -0.31 0.28 1.57 0.27 -2.72 116.57 117.25 3f8s h LYS 502 Ca 0.50 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3f8s h LYS 502 Cb 0.60 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 3f8s h LYS 502 CO -0.31 1.04 0.17 0.52 -0.57 0.00 0.00 179.45 180.30 3f8s h MET 503 N 0.47 0.44 0.00 3.15 2.86 -0.71 -3.04 114.93 118.10 3f8s h MET 503 Ca 0.03 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3f8s h MET 503 Cb 0.94 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.52 3f8s h MET 503 CO 0.08 0.37 0.00 1.28 1.06 0.00 0.00 176.91 179.70 3f8s n LEU 504 N -4.80 0.74 0.00 1.22 4.77 -0.24 -1.04 117.00 117.64 3f8s n LEU 504 Ca -0.01 0.64 0.08 0.00 -0.03 0.00 0.00 56.01 56.69 3f8s n LEU 504 Cb 0.08 -0.50 0.36 0.00 -2.33 0.00 0.00 43.42 41.03 3f8s n LEU 504 CO 0.35 -0.46 0.77 0.00 -1.33 0.00 0.00 177.39 176.72 3f8s n GLN 505 N -2.27 0.01 -0.44 3.23 6.02 -1.03 -3.09 117.38 119.80 3f8s n GLN 505 Ca 0.03 0.22 0.10 0.00 -0.01 0.00 0.00 57.00 57.33 3f8s n GLN 505 Cb 0.29 -1.51 0.31 0.00 1.02 0.00 0.00 30.24 30.35 3f8s n GLN 505 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3f8s n ASN 506 N -1.52 4.12 -3.99 1.08 3.02 -0.21 -4.96 115.26 112.80 3f8s n ASN 506 Ca 0.04 -2.24 -0.09 0.00 -0.03 0.00 0.00 54.58 52.26 3f8s n ASN 506 Cb 0.20 -0.49 -0.11 0.00 -0.61 0.00 0.00 39.78 38.78 3f8s n ASN 506 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3f8s s VAL 507 N -1.45 0.12 -1.01 2.41 0.11 -1.18 -4.23 120.40 115.18 3f8s s VAL 507 Ca 0.45 -1.02 -0.20 0.00 -2.93 0.00 0.00 61.98 58.28 3f8s s VAL 507 Cb 0.27 -0.45 -0.09 0.00 -1.53 0.00 0.00 36.38 34.57 3f8s s VAL 507 CO 0.26 -0.56 1.98 0.00 -3.33 0.00 0.00 175.10 173.44 3f8s n GLN 508 N 1.37 1.91 -2.25 1.54 6.02 -0.51 -4.95 117.38 120.51 3f8s n GLN 508 Ca -0.22 -2.19 -0.38 0.00 -0.01 0.00 0.00 57.00 54.20 3f8s n GLN 508 Cb 0.56 -3.15 -0.01 0.00 1.02 0.00 0.00 30.24 28.65 3f8s n GLN 508 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3f8s s MET 509 N 4.79 3.93 0.95 -1.09 -1.94 -1.26 -4.52 119.30 120.16 3f8s s MET 509 Ca 0.57 1.85 -0.15 0.00 -1.71 0.00 0.00 55.69 56.25 3f8s s MET 509 Cb 0.11 -2.59 0.17 0.00 2.01 0.00 0.00 34.83 34.54 3f8s s MET 509 CO 0.08 -0.43 1.22 -1.25 -0.01 0.00 0.00 175.02 174.63 3f8s s PRO 510 N -2.44 0.78 0.36 2.03 0.04 -1.26 -4.42 135.00 130.09 3f8s s PRO 510 Ca 0.59 -0.09 0.05 0.00 0.04 0.00 0.00 61.00 61.59 3f8s s PRO 510 Cb -0.31 -1.83 -0.07 0.00 0.04 0.00 0.00 34.50 32.33 3f8s s PRO 510 CO 0.38 -2.37 0.04 -1.54 0.04 0.00 0.00 177.00 173.56 3f8s s SER 511 N -4.49 2.86 -0.10 6.66 1.04 -0.71 -4.91 113.70 114.06 3f8s s SER 511 Ca 0.69 -1.39 0.02 0.00 0.48 0.00 0.00 55.95 55.75 3f8s s SER 511 Cb -0.09 -0.15 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 3f8s s SER 511 CO 0.53 -0.57 -0.17 -0.75 0.98 0.00 0.00 173.24 173.25 3f8s s LYS 512 N -3.83 3.01 -0.02 4.02 2.20 -1.26 0.19 119.74 124.05 3f8s s LYS 512 Ca 0.35 -0.75 -0.05 0.00 -0.36 0.00 0.00 55.97 55.16 3f8s s LYS 512 Cb 0.09 -2.45 -0.04 0.00 -1.51 0.00 0.00 37.83 33.91 3f8s s LYS 512 CO 0.16 0.33 0.21 0.21 -0.36 0.00 0.00 175.35 175.90 3f8s s LYS 513 N 0.03 3.50 -0.33 4.03 2.20 0.13 -4.93 119.74 124.38 3f8s s LYS 513 Ca -0.06 -0.18 -0.01 0.00 -0.36 0.00 0.00 55.97 55.35 3f8s s LYS 513 Cb -0.15 -3.10 0.12 0.00 -1.51 0.00 0.00 37.83 33.19 3f8s s LYS 513 CO 0.05 0.68 0.16 -1.17 -0.36 0.00 0.00 175.35 174.71 3f8s s LEU 514 N -1.72 1.29 0.00 5.43 2.96 -1.26 -0.97 118.68 124.41 3f8s s LEU 514 Ca 0.25 -1.79 0.00 0.00 -0.22 0.00 0.00 54.13 52.37 3f8s s LEU 514 Cb -0.13 -0.55 0.00 0.00 0.50 0.00 0.00 46.19 46.01 3f8s s LEU 514 CO 0.15 -0.38 0.00 -0.67 -1.32 0.00 0.00 176.35 174.14 3f8s n ASP 515 N 4.60 0.64 -4.07 3.68 2.03 -0.61 -4.98 116.55 117.85 3f8s n ASP 515 Ca 0.02 -0.19 -0.08 0.00 0.52 0.00 0.00 54.79 55.07 3f8s n ASP 515 Cb 0.40 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.69 3f8s n ASP 515 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 3f8s s PHE 516 N -0.61 0.48 0.37 -0.67 -0.12 -1.26 -0.88 117.98 115.28 3f8s s PHE 516 Ca 0.00 -0.96 0.04 0.00 -0.05 0.00 0.00 56.93 55.96 3f8s s PHE 516 Cb 0.00 -0.35 -0.06 0.00 -0.63 0.00 0.00 43.02 41.98 3f8s s PHE 516 CO 0.00 -0.34 0.06 0.96 -0.05 0.00 0.00 175.22 175.85 3f8s s ILE 517 N -3.41 1.25 -0.18 -4.49 -4.36 0.47 -4.92 121.20 105.56 3f8s s ILE 517 Ca 0.02 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.37 3f8s s ILE 517 Cb 0.04 -2.73 -0.03 0.00 1.25 0.00 0.00 42.46 41.00 3f8s s ILE 517 CO -0.08 0.00 -0.01 -0.63 0.24 0.00 0.00 174.94 174.46 3f8s s ILE 518 N -3.15 4.01 -0.03 8.37 -1.09 -1.26 -0.79 121.20 127.26 3f8s s ILE 518 Ca 0.32 -0.31 0.02 0.00 -2.23 0.00 0.00 60.65 58.46 3f8s s ILE 518 Cb 0.08 -2.79 0.01 0.00 -1.58 0.00 0.00 42.46 38.18 3f8s s ILE 518 CO 0.15 0.46 -0.07 -0.76 -1.23 0.00 0.00 174.94 173.49 3f8s s LEU 519 N 0.65 1.64 -1.36 2.97 1.43 -0.44 -4.84 118.68 118.72 3f8s s LEU 519 Ca -0.01 -0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 52.85 3f8s s LEU 519 Cb -0.14 -0.51 0.02 0.00 0.03 0.00 0.00 46.19 45.59 3f8s s LEU 519 CO 0.02 0.02 1.10 0.59 0.23 0.00 0.00 176.35 178.31 3f8s n ASN 520 N 3.56 -5.13 -2.15 2.29 3.02 -1.26 -0.78 115.26 114.81 3f8s n ASN 520 Ca -0.21 -0.61 -0.15 0.00 -0.03 0.00 0.00 54.58 53.59 3f8s n ASN 520 Cb 0.53 -4.82 -0.02 0.00 -0.61 0.00 0.00 39.78 34.86 3f8s n ASN 520 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3f8s n GLU 521 N -4.78 -1.87 -4.21 3.52 1.02 -1.26 -4.95 120.64 108.11 3f8s n GLU 521 Ca -0.05 0.75 -0.20 0.00 -0.02 0.00 0.00 57.16 57.64 3f8s n GLU 521 Cb 0.58 -5.27 -0.12 0.00 -0.02 0.00 0.00 31.44 26.61 3f8s n GLU 521 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3f8s s THR 522 N -2.59 1.32 -0.11 2.62 2.01 0.04 -5.12 115.64 113.81 3f8s s THR 522 Ca 0.00 -1.43 -0.22 0.00 0.31 0.00 0.00 61.69 60.35 3f8s s THR 522 Cb 0.00 -1.28 -0.03 0.00 0.01 0.00 0.00 72.50 71.20 3f8s s THR 522 CO 0.00 -0.20 0.64 -0.75 -0.69 0.00 0.00 174.62 173.62 3f8s s LYS 523 N -1.90 4.36 -0.06 4.92 2.20 -1.26 -1.33 119.74 126.66 3f8s s LYS 523 Ca 0.02 0.72 0.01 0.00 -0.36 0.00 0.00 55.97 56.37 3f8s s LYS 523 Cb -0.09 -3.48 0.02 0.00 -1.51 0.00 0.00 37.83 32.76 3f8s s LYS 523 CO 0.03 -0.00 -0.08 -0.06 -0.36 0.00 0.00 175.35 174.88 3f8s s PHE 524 N 1.08 1.11 0.08 4.03 0.08 0.03 -4.97 117.98 119.43 3f8s s PHE 524 Ca 0.33 -0.40 -0.10 0.00 0.12 0.00 0.00 56.93 56.88 3f8s s PHE 524 Cb -0.17 -0.90 -0.06 0.00 -0.57 0.00 0.00 43.02 41.33 3f8s s PHE 524 CO 0.14 -0.27 0.40 -1.58 -0.10 0.00 0.00 175.22 173.81 3f8s s TRP 525 N 0.98 3.58 0.05 0.36 0.52 -1.25 -0.40 118.94 122.78 3f8s s TRP 525 Ca -0.10 0.78 -0.02 0.00 0.02 0.00 0.00 56.10 56.78 3f8s s TRP 525 Cb -0.15 -2.15 -0.03 0.00 -1.15 0.00 0.00 33.47 29.99 3f8s s TRP 525 CO 0.00 0.52 0.01 1.52 0.02 0.00 0.00 176.95 179.02 3f8s s TYR 526 N -1.41 0.44 -0.01 -1.98 1.13 -0.06 -1.48 117.35 113.98 3f8s s TYR 526 Ca 0.33 -0.95 0.03 0.00 -1.41 0.00 0.00 57.07 55.07 3f8s s TYR 526 Cb -0.14 -0.32 -0.01 0.00 -1.10 0.00 0.00 41.96 40.39 3f8s s TYR 526 CO 0.18 -0.40 -0.11 1.14 -2.51 0.00 0.00 175.55 173.85 3f8s s GLN 527 N -3.77 0.93 -0.10 -3.49 -2.07 -0.46 -1.57 119.66 109.12 3f8s s GLN 527 Ca 0.05 -0.40 0.03 0.00 -1.82 0.00 0.00 55.36 53.23 3f8s s GLN 527 Cb 0.07 -0.89 0.01 0.00 -1.09 0.00 0.00 33.01 31.10 3f8s s GLN 527 CO -0.10 0.23 -0.19 -1.64 -1.32 0.00 0.00 175.29 172.27 3f8s s MET 528 N -0.23 2.58 -0.10 9.60 -1.94 -0.14 -0.91 119.30 128.17 3f8s s MET 528 Ca 0.04 -0.71 -0.22 0.00 -1.71 0.00 0.00 55.69 53.08 3f8s s MET 528 Cb -0.05 -2.05 -0.03 0.00 2.01 0.00 0.00 34.83 34.71 3f8s s MET 528 CO -0.00 0.06 0.67 0.42 -0.01 0.00 0.00 175.02 176.15 3f8s s ILE 529 N 0.64 5.05 -0.10 2.53 1.01 -0.09 0.21 121.20 130.45 3f8s s ILE 529 Ca -0.13 1.35 0.02 0.00 0.00 0.00 0.00 60.65 61.89 3f8s s ILE 529 Cb -0.16 -4.00 -0.01 0.00 0.01 0.00 0.00 42.46 38.29 3f8s s ILE 529 CO 0.04 0.23 -0.16 -0.76 0.00 0.00 0.00 174.94 174.29 3f8s s LEU 530 N 1.00 2.56 0.63 2.97 1.43 0.50 -2.76 118.68 125.00 3f8s s LEU 530 Ca 0.35 -0.36 -0.18 0.00 -1.03 0.00 0.00 54.13 52.92 3f8s s LEU 530 Cb -0.17 -1.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.45 3f8s s LEU 530 CO 0.16 0.21 0.74 -2.65 0.23 0.00 0.00 176.35 175.03 3f8s n PRO 531 N 3.24 0.62 -1.00 1.29 -0.02 -1.26 -1.74 135.00 136.13 3f8s n PRO 531 Ca -0.18 0.25 -0.33 0.00 -2.02 0.00 0.00 63.50 61.21 3f8s n PRO 531 Cb 0.53 -1.96 0.12 0.00 -0.02 0.00 0.00 33.50 32.17 3f8s n PRO 531 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3f8s n PRO 532 N -0.75 -0.00 -4.10 0.52 -0.04 -1.26 -3.15 135.00 126.21 3f8s n PRO 532 Ca 0.12 0.07 -0.32 0.00 -0.04 0.00 0.00 63.50 63.33 3f8s n PRO 532 Cb 0.48 -2.19 -0.04 0.00 -0.04 0.00 0.00 33.50 31.71 3f8s n PRO 532 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3f8s n HIS 533 N -3.35 -1.46 -1.83 0.54 8.25 -1.26 -4.81 115.22 111.29 3f8s n HIS 533 Ca 0.11 0.53 -0.38 0.00 -0.26 0.00 0.00 57.72 57.72 3f8s n HIS 533 Cb 0.51 -3.15 0.03 0.00 1.12 0.00 0.00 29.99 28.51 3f8s n HIS 533 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 3f8s s PHE 534 N -4.01 2.36 -0.32 4.41 5.36 -1.19 -5.00 117.98 119.60 3f8s s PHE 534 Ca 0.14 1.37 -0.01 0.00 -0.96 0.00 0.00 56.93 57.47 3f8s s PHE 534 Cb -0.07 -3.78 0.10 0.00 -0.34 0.00 0.00 43.02 38.94 3f8s s PHE 534 CO 0.95 -2.78 0.12 0.34 -1.46 0.00 0.00 175.22 172.38 3f8s s ASP 535 N -0.93 3.87 0.56 6.13 -1.08 -1.26 -4.98 116.67 118.99 3f8s s ASP 535 Ca 0.69 -1.65 0.30 0.00 -0.52 0.00 0.00 52.55 51.37 3f8s s ASP 535 Cb -0.40 -0.76 1.46 0.00 -1.46 0.00 0.00 42.92 41.77 3f8s s ASP 535 CO 0.48 -0.41 1.89 0.07 0.52 0.00 0.00 175.17 177.72 3f8s h LYS 536 N 8.03 0.00 -0.02 4.34 2.10 -1.97 0.62 116.57 129.66 3f8s h LYS 536 Ca -0.13 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 3f8s h LYS 536 Cb 1.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 3f8s h LYS 536 CO 0.46 0.00 0.00 0.45 -2.00 0.00 0.00 179.45 178.36 3f8s n SER 537 N -3.98 0.30 -4.48 7.07 2.88 -1.26 -4.46 113.62 109.68 3f8s n SER 537 Ca 0.13 -1.40 -0.24 0.00 -1.33 0.00 0.00 58.87 56.02 3f8s n SER 537 Cb 0.80 -0.02 -0.10 0.00 -0.75 0.00 0.00 64.21 64.15 3f8s n SER 537 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3f8s s LYS 538 N -1.97 1.73 -0.33 -1.46 1.02 0.21 -5.08 119.74 113.86 3f8s s LYS 538 Ca 0.32 -1.69 -0.07 0.00 0.02 0.00 0.00 55.97 54.54 3f8s s LYS 538 Cb 0.15 -1.83 0.03 0.00 -0.52 0.00 0.00 37.83 35.66 3f8s s LYS 538 CO 0.25 0.34 0.11 0.15 -0.92 0.00 0.00 175.35 175.29 3f8s s LYS 539 N -3.40 2.79 0.23 1.68 1.02 -1.26 -4.32 119.74 116.48 3f8s s LYS 539 Ca 0.29 -1.07 -0.01 0.00 0.02 0.00 0.00 55.97 55.20 3f8s s LYS 539 Cb -0.06 -3.48 -0.04 0.00 -0.52 0.00 0.00 37.83 33.74 3f8s s LYS 539 CO 0.15 -0.60 0.43 0.71 -0.92 0.00 0.00 175.35 175.11 3f8s s TYR 540 N 1.46 3.48 0.51 3.18 1.51 -0.03 -4.37 117.35 123.09 3f8s s TYR 540 Ca 0.00 0.37 -0.19 0.00 -1.01 0.00 0.00 57.07 56.25 3f8s s TYR 540 Cb -0.19 -1.88 -0.07 0.00 -0.11 0.00 0.00 41.96 39.71 3f8s s TYR 540 CO 0.03 0.32 1.03 -1.25 -1.11 0.00 0.00 175.55 174.58 3f8s s PRO 541 N -3.48 3.73 -0.08 -1.71 0.04 -1.26 -0.89 135.00 131.35 3f8s s PRO 541 Ca 0.39 1.24 -0.01 0.00 0.04 0.00 0.00 61.00 62.66 3f8s s PRO 541 Cb -0.11 -2.09 0.03 0.00 0.04 0.00 0.00 34.50 32.37 3f8s s PRO 541 CO 0.30 -0.48 -0.02 -1.17 0.04 0.00 0.00 177.00 175.67 3f8s s LEU 542 N -3.81 0.76 -0.18 -3.56 0.20 -0.45 -0.82 118.68 110.81 3f8s s LEU 542 Ca 0.65 -0.14 -0.11 0.00 0.69 0.00 0.00 54.13 55.22 3f8s s LEU 542 Cb -0.15 -0.53 -0.05 0.00 -0.43 0.00 0.00 46.19 45.03 3f8s s LEU 542 CO 0.25 -0.17 0.18 -0.22 -0.29 0.00 0.00 176.35 176.10 3f8s s LEU 543 N 1.86 4.24 -0.42 -0.68 0.20 0.94 -0.29 118.68 124.53 3f8s s LEU 543 Ca 0.04 0.33 -0.15 0.00 0.69 0.00 0.00 54.13 55.04 3f8s s LEU 543 Cb -0.12 -2.17 0.03 0.00 -0.43 0.00 0.00 46.19 43.50 3f8s s LEU 543 CO -0.06 0.18 0.32 -0.22 -0.29 0.00 0.00 176.35 176.29 3f8s s LEU 544 N 0.24 5.22 -0.32 -0.68 0.20 -0.17 -0.26 118.68 122.91 3f8s s LEU 544 Ca 0.11 -1.00 -0.29 0.00 0.69 0.00 0.00 54.13 53.64 3f8s s LEU 544 Cb -0.12 -2.16 0.01 0.00 -0.43 0.00 0.00 46.19 43.49 3f8s s LEU 544 CO 0.00 -0.49 1.12 -0.62 -0.29 0.00 0.00 176.35 176.07 3f8s s ASP 545 N 1.89 6.87 -0.05 3.68 -1.08 0.11 -1.71 116.67 126.38 3f8s s ASP 545 Ca 0.05 1.05 0.04 0.00 -0.52 0.00 0.00 52.55 53.17 3f8s s ASP 545 Cb -0.20 -2.54 -0.00 0.00 -1.46 0.00 0.00 42.92 38.71 3f8s s ASP 545 CO 0.09 -0.94 -0.18 0.54 0.52 0.00 0.00 175.17 175.21 3f8s s VAL 546 N 3.82 1.51 0.03 1.11 0.11 -0.80 -4.34 120.40 121.84 3f8s s VAL 546 Ca 0.47 -0.75 0.00 0.00 -2.93 0.00 0.00 61.98 58.78 3f8s s VAL 546 Cb -0.13 -1.31 0.00 0.00 -1.53 0.00 0.00 36.38 33.42 3f8s s VAL 546 CO 0.18 0.43 0.00 0.00 -3.33 0.00 0.00 175.10 172.38 3f8s n TYR 547 N 3.25 -0.04 -1.05 1.54 9.36 -1.26 -4.00 117.16 124.96 3f8s n TYR 547 Ca -0.19 0.01 -0.02 0.00 3.32 0.00 0.00 57.90 61.02 3f8s n TYR 547 Cb 0.53 0.03 -0.01 0.00 -0.63 0.00 0.00 39.34 39.26 3f8s n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3f8s n ALA 548 N -2.81 -0.02 -1.22 2.98 0.00 -1.26 -2.90 120.51 115.28 3f8s n ALA 548 Ca 0.00 0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 3f8s n ALA 548 Cb 0.00 -1.05 0.11 0.00 0.00 0.00 0.00 19.45 18.50 3f8s n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3f8s s GLY 549 N -2.10 1.66 0.00 0.00 0.00 -1.26 -4.87 107.32 100.75 3f8s s GLY 549 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 44.72 44.61 3f8s s GLY 549 CO 0.00 0.58 1.75 2.56 0.00 0.00 0.00 173.10 177.99 3f8s s PRO 550 N -4.90 4.17 -0.13 2.90 0.04 -1.26 -1.84 135.00 133.98 3f8s s PRO 550 Ca 0.62 2.35 0.00 0.00 0.04 0.00 0.00 61.00 64.01 3f8s s PRO 550 Cb -0.18 -3.95 0.00 0.00 0.04 0.00 0.00 34.50 30.41 3f8s s PRO 550 CO 0.56 -0.86 0.00 0.00 0.04 0.00 0.00 177.00 176.75 3f8s s SER 552 N -2.93 4.59 -0.30 0.00 1.04 -0.76 -4.19 113.70 111.14 3f8s s SER 552 Ca 0.00 -0.02 -0.05 0.00 0.48 0.00 0.00 55.95 56.37 3f8s s SER 552 Cb 0.00 -0.53 0.18 0.00 0.10 0.00 0.00 66.02 65.77 3f8s s SER 552 CO 0.00 -1.69 0.72 -1.58 0.98 0.00 0.00 173.24 171.66 3f8s s GLN 553 N -5.14 0.48 0.00 4.02 0.74 -1.26 -0.32 119.66 118.18 3f8s s GLN 553 Ca 0.63 0.88 0.17 0.00 0.05 0.00 0.00 55.36 57.09 3f8s s GLN 553 Cb -0.08 0.49 0.11 0.00 1.10 0.00 0.00 33.01 34.64 3f8s s GLN 553 CO 0.44 -0.48 1.02 1.63 -0.55 0.00 0.00 175.29 177.34 3f8s n LYS 554 N 5.43 1.44 -3.79 1.67 4.76 -1.26 -4.84 118.16 121.56 3f8s n LYS 554 Ca -0.03 -1.41 -0.37 0.00 -2.87 0.00 0.00 58.31 53.63 3f8s n LYS 554 Cb 0.52 -1.32 -0.13 0.00 -1.84 0.00 0.00 35.03 32.25 3f8s n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3f8s s ALA 555 N -1.52 3.01 0.18 7.82 0.00 -1.26 -4.74 121.76 125.24 3f8s s ALA 555 Ca 0.19 -1.47 -0.24 0.00 0.00 0.00 0.00 51.96 50.44 3f8s s ALA 555 Cb 0.14 -2.08 0.05 0.00 0.00 0.00 0.00 23.12 21.23 3f8s s ALA 555 CO 0.25 -0.93 0.87 0.16 0.00 0.00 0.00 175.76 176.11 3f8s s ASP 556 N 1.46 -0.23 0.00 0.00 1.47 -1.26 -4.52 116.67 113.59 3f8s s ASP 556 Ca 0.02 -0.41 0.10 0.00 1.18 0.00 0.00 52.55 53.44 3f8s s ASP 556 Cb -0.17 0.55 0.32 0.00 -0.34 0.00 0.00 42.92 43.28 3f8s s ASP 556 CO 0.01 -1.01 1.25 0.35 0.68 0.00 0.00 175.17 176.45 3f8s n THR 557 N -0.45 0.30 -2.89 2.11 -2.24 -0.98 -4.90 114.28 105.24 3f8s n THR 557 Ca -0.06 -0.32 -0.40 0.00 -2.27 0.00 0.00 64.05 61.00 3f8s n THR 557 Cb 0.61 0.17 -0.06 0.00 -2.10 0.00 0.00 70.33 68.95 3f8s n THR 557 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3f8s s VAL 558 N -1.70 4.38 -0.10 2.28 0.11 -1.26 -0.26 120.40 123.86 3f8s s VAL 558 Ca 0.19 1.83 -0.21 0.00 -2.93 0.00 0.00 61.98 60.86 3f8s s VAL 558 Cb 0.10 -4.20 -0.04 0.00 -1.53 0.00 0.00 36.38 30.71 3f8s s VAL 558 CO 0.13 0.46 0.62 0.12 -3.33 0.00 0.00 175.10 173.10 3f8s s PHE 559 N -0.79 3.54 0.06 1.54 5.36 0.48 -4.90 117.98 123.26 3f8s s PHE 559 Ca 0.39 1.09 0.04 0.00 -0.96 0.00 0.00 56.93 57.50 3f8s s PHE 559 Cb -0.23 -2.72 -0.03 0.00 -0.34 0.00 0.00 43.02 39.70 3f8s s PHE 559 CO 0.27 0.09 -0.12 1.03 -1.46 0.00 0.00 175.22 175.03 3f8s s ARG 560 N 0.84 0.75 -0.32 10.12 0.52 -1.26 -4.88 118.95 124.72 3f8s s ARG 560 Ca 0.33 -0.86 -0.02 0.00 -0.52 0.00 0.00 55.73 54.66 3f8s s ARG 560 Cb -0.17 -0.69 0.06 0.00 0.52 0.00 0.00 34.95 34.67 3f8s s ARG 560 CO 0.15 0.15 0.04 -0.51 0.02 0.00 0.00 175.30 175.15 3f8s s LEU 561 N -1.58 4.13 0.00 2.53 1.43 -1.26 -4.89 118.68 119.05 3f8s s LEU 561 Ca -0.04 -1.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.70 3f8s s LEU 561 Cb -0.10 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.38 3f8s s LEU 561 CO 0.02 -0.31 0.00 -0.46 0.23 0.00 0.00 176.35 175.83 3f8s n ASN 562 N 4.64 0.00 -0.19 2.29 2.04 -1.26 -5.02 115.26 117.76 3f8s n ASN 562 Ca -0.11 -0.63 -0.10 0.00 -0.44 0.00 0.00 54.58 53.30 3f8s n ASN 562 Cb 0.43 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 37.69 3f8s n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.44 0.00 0.00 177.26 176.57 3f8s h TRP 563 N 0.63 1.04 -0.84 -2.53 7.01 -1.99 -2.02 115.95 117.25 3f8s h TRP 563 Ca 0.00 -0.18 0.06 0.00 2.11 0.00 0.00 58.89 60.87 3f8s h TRP 563 Cb 0.00 -0.27 -0.05 0.00 -2.10 0.00 0.00 29.16 26.74 3f8s h TRP 563 CO 0.00 0.95 0.55 0.00 -2.79 0.00 0.00 178.44 177.15 3f8s h ALA 564 N 0.95 1.55 -0.34 2.65 0.00 -1.99 -2.00 119.26 120.08 3f8s h ALA 564 Ca 0.15 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.11 3f8s h ALA 564 Cb 0.54 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 3f8s h ALA 564 CO 0.03 0.33 -0.22 1.15 0.00 0.00 0.00 179.25 180.55 3f8s h THR 565 N 0.96 0.41 0.03 0.00 2.02 -1.71 -2.17 112.91 112.46 3f8s h THR 565 Ca 0.35 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.53 3f8s h THR 565 Cb 0.17 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 3f8s h THR 565 CO -0.12 0.00 -0.02 0.22 0.37 0.00 0.00 175.52 175.97 3f8s h TYR 566 N -0.17 -0.04 -0.19 3.16 3.20 -1.31 0.21 116.97 121.83 3f8s h TYR 566 Ca 0.17 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.07 3f8s h TYR 566 Cb 0.44 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 3f8s h TYR 566 CO -0.42 0.01 0.03 -0.07 -1.64 0.00 0.00 178.16 176.07 3f8s h LEU 567 N -0.08 0.00 -0.20 2.82 3.38 -1.20 0.21 115.31 120.25 3f8s h LEU 567 Ca -0.00 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3f8s h LEU 567 Cb 0.07 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3f8s h LEU 567 CO 0.01 0.03 0.05 0.00 0.09 0.00 0.00 178.44 178.62 3f8s h ALA 568 N 1.14 0.26 0.11 1.53 0.00 -1.36 0.18 119.26 121.11 3f8s h ALA 568 Ca 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3f8s h ALA 568 Cb 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3f8s h ALA 568 CO -0.11 -0.11 -0.05 1.03 0.00 0.00 0.00 179.25 180.01 3f8s h SER 569 N 0.14 -0.12 0.04 0.00 0.87 -0.08 -2.94 113.55 111.45 3f8s h SER 569 Ca 0.06 -0.31 -0.38 0.00 -1.23 0.00 0.00 61.79 59.94 3f8s h SER 569 Cb 0.25 0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.19 3f8s h SER 569 CO -0.00 0.26 -2.18 0.41 -0.53 0.00 0.00 176.83 174.78 3f8s n THR 570 N -4.98 1.59 1.04 2.23 -1.04 0.70 -4.42 114.28 109.39 3f8s n THR 570 Ca -0.09 -0.49 0.11 0.00 -2.04 0.00 0.00 64.05 61.55 3f8s n THR 570 Cb 0.22 -1.68 0.04 0.00 -1.82 0.00 0.00 70.33 67.09 3f8s n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3f8s n GLU 571 N -3.67 0.68 -3.28 -2.82 -0.58 -0.34 -4.99 120.64 105.65 3f8s n GLU 571 Ca -0.42 -0.53 -0.15 0.00 -0.42 0.00 0.00 57.16 55.64 3f8s n GLU 571 Cb 0.95 -1.49 0.08 0.00 -0.57 0.00 0.00 31.44 30.41 3f8s n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3f8s n ASN 572 N -0.69 -2.48 -4.29 1.62 3.02 0.48 -4.93 115.26 107.98 3f8s n ASN 572 Ca 0.08 -0.58 -0.33 0.00 -0.03 0.00 0.00 54.58 53.73 3f8s n ASN 572 Cb 0.40 -4.74 -0.15 0.00 -0.61 0.00 0.00 39.78 34.67 3f8s n ASN 572 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3f8s s ILE 573 N -3.33 2.63 -0.16 2.41 1.01 -0.97 -4.44 121.20 118.35 3f8s s ILE 573 Ca 0.04 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.60 3f8s s ILE 573 Cb -0.01 -2.08 -0.02 0.00 0.01 0.00 0.00 42.46 40.37 3f8s s ILE 573 CO 0.67 0.53 1.33 -0.63 0.00 0.00 0.00 174.94 176.84 3f8s s ILE 574 N 0.46 4.16 -0.29 2.92 1.01 -0.00 -3.24 121.20 126.21 3f8s s ILE 574 Ca -0.12 1.40 -0.08 0.00 0.00 0.00 0.00 60.65 61.84 3f8s s ILE 574 Cb -0.16 -3.93 -0.01 0.00 0.01 0.00 0.00 42.46 38.37 3f8s s ILE 574 CO 0.05 -0.15 0.12 -0.69 0.00 0.00 0.00 174.94 174.27 3f8s s VAL 575 N 3.67 4.40 -0.02 2.92 1.01 -1.11 -0.04 120.40 131.23 3f8s s VAL 575 Ca 0.58 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 62.15 3f8s s VAL 575 Cb -0.23 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.91 3f8s s VAL 575 CO 0.17 0.12 -0.09 0.00 0.00 0.00 0.00 175.10 175.31 3f8s s ALA 576 N 1.59 2.91 0.06 5.51 0.00 0.64 -0.92 121.76 131.56 3f8s s ALA 576 Ca 0.04 -1.00 0.05 0.00 0.00 0.00 0.00 51.96 51.06 3f8s s ALA 576 Cb -0.17 -1.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.84 3f8s s ALA 576 CO 0.05 0.59 -0.15 -1.12 0.00 0.00 0.00 175.76 175.13 3f8s s SER 577 N -1.15 1.73 -0.13 0.00 0.01 -0.09 0.09 113.70 114.17 3f8s s SER 577 Ca 0.15 -0.58 -0.05 0.00 1.31 0.00 0.00 55.95 56.78 3f8s s SER 577 Cb -0.11 -0.07 0.06 0.00 0.21 0.00 0.00 66.02 66.11 3f8s s SER 577 CO 0.05 -0.04 0.28 0.12 0.41 0.00 0.00 173.24 174.05 3f8s s PHE 578 N -1.15 -0.42 -0.50 2.43 5.36 -1.26 -1.36 117.98 121.08 3f8s s PHE 578 Ca -0.01 0.96 -0.14 0.00 -0.96 0.00 0.00 56.93 56.78 3f8s s PHE 578 Cb -0.09 0.04 0.11 0.00 -0.34 0.00 0.00 43.02 42.73 3f8s s PHE 578 CO 0.02 -0.32 0.42 -0.51 -1.46 0.00 0.00 175.22 173.37 3f8s s ASP 579 N 1.92 6.03 0.00 6.13 1.01 -0.55 -4.85 116.67 126.36 3f8s s ASP 579 Ca -0.04 -1.67 0.00 0.00 0.71 0.00 0.00 52.55 51.56 3f8s s ASP 579 Cb -0.11 -2.14 0.00 0.00 1.01 0.00 0.00 42.92 41.68 3f8s s ASP 579 CO -0.09 -0.74 0.00 0.61 0.21 0.00 0.00 175.17 175.16 3f8s n GLY 580 N 5.14 2.54 3.77 0.21 0.00 -1.26 -3.83 105.19 111.75 3f8s n GLY 580 Ca -0.12 -1.82 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 3f8s n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f8s s ARG 581 N 4.16 4.16 0.00 1.61 0.52 -1.26 -1.77 118.95 126.37 3f8s s ARG 581 Ca 0.00 2.24 0.00 0.00 -0.52 0.00 0.00 55.73 57.45 3f8s s ARG 581 Cb 0.00 -2.93 0.00 0.00 0.52 0.00 0.00 34.95 32.54 3f8s s ARG 581 CO 0.00 -0.36 0.00 0.41 0.02 0.00 0.00 175.30 175.37 3f8s n GLY 582 N 0.70 3.05 3.52 -3.53 0.00 0.14 -4.27 105.19 104.80 3f8s n GLY 582 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 3f8s n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3f8s s SER 583 N -0.28 1.28 0.29 1.61 1.04 -0.73 -0.32 113.70 116.59 3f8s s SER 583 Ca 0.00 1.63 0.09 0.00 0.48 0.00 0.00 55.95 58.15 3f8s s SER 583 Cb 0.00 -2.35 -0.04 0.00 0.10 0.00 0.00 66.02 63.73 3f8s s SER 583 CO 0.00 -4.03 0.05 -0.83 0.98 0.00 0.00 173.24 169.41 3f8s s GLY 584 N -2.55 1.71 0.00 7.32 0.00 0.57 -3.66 107.32 110.71 3f8s s GLY 584 Ca 0.68 -1.68 0.00 0.00 0.00 0.00 0.00 44.72 43.72 3f8s s GLY 584 CO 0.63 -1.71 0.00 -1.72 0.00 0.00 0.00 173.10 170.31 3f8s n TYR 585 N -0.99 0.00 -1.44 1.90 4.01 -1.26 -4.82 117.16 114.56 3f8s n TYR 585 Ca -0.06 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.76 3f8s n TYR 585 Cb 0.60 -0.00 0.17 0.00 -0.31 0.00 0.00 39.34 39.79 3f8s n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3f8s n GLN 586 N -2.96 1.34 0.00 -0.72 6.02 -1.26 -4.44 117.38 115.35 3f8s n GLN 586 Ca 0.00 -2.87 0.00 0.00 -0.01 0.00 0.00 57.00 54.12 3f8s n GLN 586 Cb 0.00 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 29.80 3f8s n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3f8s n GLY 587 N -1.14 -0.56 0.08 1.08 0.00 -1.26 -4.68 105.19 98.71 3f8s n GLY 587 Ca 0.17 -1.73 0.11 0.00 0.00 0.00 0.00 46.02 44.57 3f8s n GLY 587 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3f8s n ASP 588 N -1.18 0.63 -0.24 1.61 9.92 -0.48 -2.31 116.55 124.49 3f8s n ASP 588 Ca 0.00 0.15 -0.01 0.00 -0.53 0.00 0.00 54.79 54.40 3f8s n ASP 588 Cb 0.00 0.79 0.10 0.00 -0.64 0.00 0.00 41.12 41.38 3f8s n ASP 588 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 3f8s h LYS 589 N 0.00 0.70 0.08 -1.24 1.63 -1.87 -1.10 116.57 114.77 3f8s h LYS 589 Ca 0.00 -0.04 -0.23 0.00 -0.85 0.00 0.00 60.65 59.53 3f8s h LYS 589 Cb 0.93 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.40 3f8s h LYS 589 CO 0.00 0.46 -1.17 0.82 -3.45 0.00 0.00 179.45 176.11 3f8s h ILE 590 N 0.72 1.13 0.16 2.00 2.04 -1.83 -3.25 117.51 118.49 3f8s h ILE 590 Ca 0.31 -2.36 -0.01 0.00 1.00 0.00 0.00 64.86 63.80 3f8s h ILE 590 Cb 0.19 2.74 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 3f8s h ILE 590 CO -0.18 0.62 -0.08 -0.03 0.00 0.00 0.00 178.15 178.48 3f8s h MET 591 N -0.53 -0.21 0.00 2.37 4.05 -1.44 0.40 114.93 119.57 3f8s h MET 591 Ca -0.26 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.17 3f8s h MET 591 Cb 1.57 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 32.42 3f8s h MET 591 CO 0.01 -0.14 0.00 0.72 0.23 0.00 0.00 176.91 177.73 3f8s n HIS 592 N -5.18 0.00 0.33 1.39 8.25 -0.42 -3.82 115.22 115.77 3f8s n HIS 592 Ca -0.09 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.51 3f8s n HIS 592 Cb 0.11 -0.16 0.73 0.00 1.12 0.00 0.00 29.99 31.79 3f8s n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3f8s h ALA 593 N 3.55 1.38 -0.11 -1.41 0.00 -1.53 0.22 119.26 121.37 3f8s h ALA 593 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3f8s h ALA 593 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3f8s h ALA 593 CO 0.00 -0.38 0.00 -0.89 0.00 0.00 0.00 179.25 177.98 3f8s n ILE 594 N -2.82 0.15 -1.69 0.00 -0.00 -1.25 -4.92 119.36 108.83 3f8s n ILE 594 Ca -0.02 -0.57 -0.44 0.00 -0.00 0.00 0.00 62.75 61.71 3f8s n ILE 594 Cb 0.43 1.27 -0.03 0.00 -0.00 0.00 0.00 39.64 41.31 3f8s n ILE 594 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 3f8s n ASN 595 N 1.12 3.22 -2.11 4.38 5.15 0.78 -1.22 115.26 126.58 3f8s n ASN 595 Ca 0.13 1.11 -0.15 0.00 -0.60 0.00 0.00 54.58 55.07 3f8s n ASN 595 Cb 0.50 -1.47 -0.03 0.00 -0.53 0.00 0.00 39.78 38.25 3f8s n ASN 595 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3f8s n ARG 596 N 2.77 -1.81 -1.39 1.20 1.74 0.26 -4.79 116.66 114.63 3f8s n ARG 596 Ca 0.13 0.79 -0.03 0.00 -0.77 0.00 0.00 57.85 57.98 3f8s n ARG 596 Cb 0.32 -5.31 -0.02 0.00 -1.02 0.00 0.00 32.46 26.43 3f8s n ARG 596 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3f8s n ARG 597 N -2.59 0.21 -1.74 5.56 1.74 -0.36 -4.93 116.66 114.54 3f8s n ARG 597 Ca -0.17 -1.44 -0.39 0.00 -0.77 0.00 0.00 57.85 55.08 3f8s n ARG 597 Cb 0.59 0.24 0.03 0.00 -1.02 0.00 0.00 32.46 32.30 3f8s n ARG 597 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3f8s n LEU 598 N -0.03 5.11 0.00 0.55 4.77 -1.21 -2.22 117.00 123.98 3f8s n LEU 598 Ca -0.15 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.88 3f8s n LEU 598 Cb 0.85 -1.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.37 3f8s n LEU 598 CO -0.10 -0.42 0.00 0.61 -1.33 0.00 0.00 177.39 176.14 3f8s n GLY 599 N 0.69 2.30 0.00 -0.72 0.00 -1.26 -4.85 105.19 101.35 3f8s n GLY 599 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3f8s n GLY 599 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3f8s n THR 600 N -1.90 0.00 0.15 2.61 -1.04 -0.94 -4.38 114.28 108.77 3f8s n THR 600 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3f8s n THR 600 Cb 0.00 0.00 0.26 0.00 -1.82 0.00 0.00 70.33 68.77 3f8s n THR 600 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 3f8s h PHE 601 N 0.00 0.07 0.00 -1.42 0.04 -1.92 -1.39 116.94 112.32 3f8s h PHE 601 Ca 0.00 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.75 3f8s h PHE 601 Cb 0.00 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.13 3f8s h PHE 601 CO 0.00 0.52 0.00 1.05 -0.60 0.00 0.00 178.31 179.28 3f8s h GLU 602 N 0.05 0.00 0.11 1.51 9.09 -1.87 0.27 114.58 123.75 3f8s h GLU 602 Ca 0.00 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.25 3f8s h GLU 602 Cb 0.84 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.96 3f8s h GLU 602 CO 0.06 0.00 -0.74 0.28 0.05 0.00 0.00 179.01 178.67 3f8s h VAL 603 N 0.00 1.50 -0.32 -1.06 2.07 -1.52 -3.25 116.25 113.68 3f8s h VAL 603 Ca 0.00 -2.48 -0.01 0.00 0.82 0.00 0.00 66.70 65.02 3f8s h VAL 603 Cb 0.82 3.17 -0.02 0.00 -1.52 0.00 0.00 31.29 33.74 3f8s h VAL 603 CO 0.00 0.69 0.13 -0.33 0.02 0.00 0.00 177.57 178.08 3f8s h GLU 604 N -0.49 0.44 0.02 1.57 5.08 -0.93 -2.96 114.58 117.30 3f8s h GLU 604 Ca -0.14 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 57.97 3f8s h GLU 604 Cb 1.53 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.68 3f8s h GLU 604 CO 0.11 0.36 -0.96 -0.44 -1.00 0.00 0.00 179.01 177.08 3f8s h ASP 605 N 0.44 0.14 -0.60 1.42 3.32 -0.57 -2.06 116.42 118.51 3f8s h ASP 605 Ca 0.11 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 3f8s h ASP 605 Cb 0.08 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 3f8s h ASP 605 CO -0.01 1.02 0.28 1.56 -1.72 0.00 0.00 179.24 180.36 3f8s h GLN 606 N 0.04 0.87 -0.65 3.56 1.08 -1.56 -1.22 115.11 117.23 3f8s h GLN 606 Ca -0.04 -0.13 0.01 0.00 -1.45 0.00 0.00 58.65 57.03 3f8s h GLN 606 Cb 1.65 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 28.89 3f8s h GLN 606 CO 0.14 0.71 0.43 0.82 -0.95 0.00 0.00 178.83 179.98 3f8s h ILE 607 N 0.82 1.17 -0.28 2.54 2.04 -1.35 -2.28 117.51 120.16 3f8s h ILE 607 Ca 0.20 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 3f8s h ILE 607 Cb 0.13 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 3f8s h ILE 607 CO -0.02 0.16 0.13 -0.33 0.00 0.00 0.00 178.15 178.09 3f8s h GLU 608 N 0.88 0.40 -0.99 2.37 4.39 -1.21 -0.96 114.58 119.47 3f8s h GLU 608 Ca 0.24 -0.06 0.16 0.00 0.34 0.00 0.00 59.36 60.04 3f8s h GLU 608 Cb -0.10 -0.07 -0.09 0.00 -0.10 0.00 0.00 28.75 28.38 3f8s h GLU 608 CO -0.05 0.40 0.62 0.00 -1.16 0.00 0.00 179.01 178.81 3f8s h ALA 609 N 0.99 1.65 -0.24 3.43 0.00 -1.03 0.16 119.26 124.22 3f8s h ALA 609 Ca 0.10 0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.89 3f8s h ALA 609 Cb 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3f8s h ALA 609 CO -0.01 0.04 -0.47 0.00 0.00 0.00 0.00 179.25 178.82 3f8s h ALA 610 N 1.60 0.38 -0.93 0.00 0.00 -0.99 -0.27 119.26 119.05 3f8s h ALA 610 Ca 0.53 -0.48 0.16 0.00 0.00 0.00 0.00 54.91 55.12 3f8s h ALA 610 Cb 0.73 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 3f8s h ALA 610 CO -0.31 0.54 0.59 0.00 0.00 0.00 0.00 179.25 180.07 3f8s h ARG 611 N 0.47 0.70 -0.07 0.00 3.08 -0.04 -1.46 114.38 117.06 3f8s h ARG 611 Ca 0.01 -0.04 -0.23 0.00 0.07 0.00 0.00 59.98 59.79 3f8s h ARG 611 Cb 1.07 -0.16 0.02 0.00 0.08 0.00 0.00 29.97 30.98 3f8s h ARG 611 CO 0.10 0.46 -0.86 1.96 -1.07 0.00 0.00 179.97 180.57 3f8s h GLN 612 N 0.72 0.71 0.00 0.04 4.20 -0.40 -3.05 115.11 117.34 3f8s h GLN 612 Ca 0.48 -0.67 -0.01 0.00 0.06 0.00 0.00 58.65 58.51 3f8s h GLN 612 Cb 0.77 0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.71 3f8s h GLN 612 CO -0.24 1.26 -0.07 0.74 -0.67 0.00 0.00 178.83 179.85 3f8s h PHE 613 N 0.40 0.00 0.18 2.96 0.04 -0.39 -2.52 116.94 117.61 3f8s h PHE 613 Ca -0.09 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.44 3f8s h PHE 613 Cb 1.51 0.00 0.03 0.00 2.20 0.00 0.00 35.95 39.68 3f8s h PHE 613 CO 0.10 0.07 -1.09 0.66 -0.60 0.00 0.00 178.31 177.44 3f8s h SER 614 N 0.00 0.59 -0.57 2.17 4.64 -1.34 -3.31 113.55 115.74 3f8s h SER 614 Ca -0.00 -0.94 0.11 0.00 -0.47 0.00 0.00 61.79 60.49 3f8s h SER 614 Cb 0.51 -0.19 -0.11 0.00 -0.31 0.00 0.00 62.40 62.30 3f8s h SER 614 CO 0.01 1.52 -0.25 0.11 -0.87 0.00 0.00 176.83 177.35 3f8s h LYS 615 N -0.19 -0.11 -6.24 4.77 1.57 -1.37 -3.39 116.57 111.61 3f8s h LYS 615 Ca -0.20 0.01 -0.66 0.00 -1.87 0.00 0.00 60.65 57.93 3f8s h LYS 615 Cb 1.83 0.02 0.09 0.00 0.08 0.00 0.00 32.23 34.26 3f8s h LYS 615 CO 0.19 -0.07 -0.00 -1.33 -0.57 0.00 0.00 179.45 177.66 3f8s n MET 616 N -5.43 0.77 -0.65 3.15 2.81 -0.98 -4.82 117.12 111.97 3f8s n MET 616 Ca 0.05 0.27 -0.07 0.00 -1.81 0.00 0.00 57.70 56.14 3f8s n MET 616 Cb 0.34 -1.61 0.16 0.00 -0.71 0.00 0.00 33.22 31.40 3f8s n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3f8s n GLY 617 N 1.77 3.07 0.33 3.03 0.00 -1.26 -3.54 105.19 108.59 3f8s n GLY 617 Ca 0.15 -0.61 0.06 0.00 0.00 0.00 0.00 46.02 45.62 3f8s n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3f8s n PHE 618 N -0.16 0.00 -4.00 1.61 1.16 -1.26 -4.67 117.46 110.13 3f8s n PHE 618 Ca 0.28 -0.67 -0.30 0.00 -1.87 0.00 0.00 57.45 54.89 3f8s n PHE 618 Cb 1.05 -0.12 -0.16 0.00 -1.61 0.00 0.00 39.48 38.64 3f8s n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 3f8s s VAL 619 N -1.78 1.51 -0.53 1.97 1.01 -1.23 -0.85 120.40 120.50 3f8s s VAL 619 Ca 0.22 -0.62 -0.27 0.00 0.00 0.00 0.00 61.98 61.30 3f8s s VAL 619 Cb 0.20 -1.44 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 3f8s s VAL 619 CO 0.00 0.42 1.68 -0.62 0.00 0.00 0.00 175.10 176.58 3f8s s ASP 620 N 1.51 5.73 0.16 3.32 2.15 -0.07 -4.80 116.67 124.67 3f8s s ASP 620 Ca 0.05 0.52 0.17 0.00 0.43 0.00 0.00 52.55 53.72 3f8s s ASP 620 Cb -0.13 -2.53 0.77 0.00 -0.30 0.00 0.00 42.92 40.72 3f8s s ASP 620 CO -0.10 -1.98 1.52 -0.46 -0.17 0.00 0.00 175.17 173.98 3f8s n ASN 621 N 11.00 0.36 0.09 -0.34 2.04 -1.26 -1.39 115.26 125.77 3f8s n ASN 621 Ca 0.18 0.62 -0.06 0.00 -0.44 0.00 0.00 54.58 54.87 3f8s n ASN 621 Cb 0.50 -0.68 0.03 0.00 -2.53 0.00 0.00 39.78 37.09 3f8s n ASN 621 CO 0.00 0.00 0.00 0.11 -0.44 0.00 0.00 177.26 176.93 3f8s h LYS 622 N 0.00 0.10 -2.80 -3.83 1.57 -1.91 -3.38 116.57 106.32 3f8s h LYS 622 Ca 0.00 -0.11 -0.67 0.00 -1.87 0.00 0.00 60.65 58.01 3f8s h LYS 622 Cb 0.20 0.03 -0.38 0.00 0.08 0.00 0.00 32.23 32.16 3f8s h LYS 622 CO 0.00 0.85 -0.24 0.54 -0.57 0.00 0.00 179.45 180.03 3f8s n ARG 623 N -3.65 2.72 -4.03 3.15 1.74 -0.49 -4.63 116.66 111.47 3f8s n ARG 623 Ca -0.02 -4.57 -0.34 0.00 -0.77 0.00 0.00 57.85 52.16 3f8s n ARG 623 Cb 0.76 -2.35 -0.15 0.00 -1.02 0.00 0.00 32.46 29.71 3f8s n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3f8s s ILE 624 N -2.02 2.52 0.53 0.55 1.01 -1.26 -1.34 121.20 121.20 3f8s s ILE 624 Ca 0.32 -1.04 0.05 0.00 0.00 0.00 0.00 60.65 59.99 3f8s s ILE 624 Cb 0.03 -2.22 0.02 0.00 0.01 0.00 0.00 42.46 40.30 3f8s s ILE 624 CO -0.06 0.31 0.34 0.00 0.00 0.00 0.00 174.94 175.52 3f8s s ALA 625 N 1.29 4.33 -0.18 9.38 0.00 0.61 -1.63 121.76 135.56 3f8s s ALA 625 Ca 0.01 -1.21 -0.19 0.00 0.00 0.00 0.00 51.96 50.57 3f8s s ALA 625 Cb -0.16 -0.62 0.05 0.00 0.00 0.00 0.00 23.12 22.40 3f8s s ALA 625 CO -0.07 -0.37 0.53 -1.50 0.00 0.00 0.00 175.76 174.35 3f8s s ILE 626 N -2.77 0.00 0.09 0.00 2.07 -0.66 -1.00 121.20 118.93 3f8s s ILE 626 Ca 0.31 -0.03 -0.07 0.00 -1.41 0.00 0.00 60.65 59.45 3f8s s ILE 626 Cb -0.01 -0.76 -0.01 0.00 0.13 0.00 0.00 42.46 41.81 3f8s s ILE 626 CO 0.19 -0.01 0.16 -1.66 -1.91 0.00 0.00 174.94 171.70 3f8s s TRP 627 N 0.11 0.24 -0.07 3.50 1.48 -0.69 -0.39 118.94 123.11 3f8s s TRP 627 Ca -0.01 -0.68 -0.30 0.00 -1.06 0.00 0.00 56.10 54.04 3f8s s TRP 627 Cb -0.04 -0.12 0.11 0.00 -1.16 0.00 0.00 33.47 32.27 3f8s s TRP 627 CO 0.01 -0.53 0.97 0.20 -4.06 0.00 0.00 176.95 173.54 3f8s s GLY 628 N -2.88 -0.39 -0.07 3.67 0.00 -0.64 -1.91 107.32 105.10 3f8s s GLY 628 Ca 0.06 1.36 0.02 0.00 0.00 0.00 0.00 44.72 46.17 3f8s s GLY 628 CO -0.10 0.54 -0.13 0.86 0.00 0.00 0.00 173.10 174.26 3f8s s TRP 629 N -2.51 2.75 0.00 1.90 -0.11 -1.26 -1.80 118.94 117.90 3f8s s TRP 629 Ca 0.04 -0.28 0.00 0.00 1.22 0.00 0.00 56.10 57.08 3f8s s TRP 629 Cb -0.01 -1.69 0.00 0.00 -1.50 0.00 0.00 33.47 30.27 3f8s s TRP 629 CO -0.06 0.09 0.00 0.45 -4.62 0.00 0.00 176.95 172.81 3f8s n SER 630 N 2.64 0.00 -0.20 5.86 2.88 -0.08 0.23 113.62 124.94 3f8s n SER 630 Ca -0.17 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.35 3f8s n SER 630 Cb 0.52 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.08 3f8s n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 3f8s h TYR 631 N 0.00 0.53 -0.90 0.66 5.03 -1.85 -0.62 116.97 119.81 3f8s h TYR 631 Ca 0.00 0.03 0.23 0.00 2.58 0.00 0.00 58.73 61.57 3f8s h TYR 631 Cb 0.00 -0.15 -0.13 0.00 1.55 0.00 0.00 36.73 38.00 3f8s h TYR 631 CO 0.00 0.22 0.39 0.78 -1.32 0.00 0.00 178.16 178.23 3f8s h GLY 632 N 0.54 1.56 2.00 1.82 0.00 -0.08 -0.07 103.07 108.84 3f8s h GLY 632 Ca 0.28 -0.16 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 3f8s h GLY 632 CO -0.22 -0.29 -0.55 -1.33 0.00 0.00 0.00 176.54 174.14 3f8s h GLY 633 N 0.38 0.00 1.92 4.60 0.00 -1.00 0.34 103.07 109.30 3f8s h GLY 633 Ca 0.57 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.79 3f8s h GLY 633 CO -0.55 0.00 -0.51 -1.82 0.00 0.00 0.00 176.54 173.66 3f8s h TYR 634 N 0.00 0.11 0.08 5.60 3.20 -0.32 -0.91 116.97 124.73 3f8s h TYR 634 Ca -0.01 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.72 3f8s h TYR 634 Cb 1.39 -0.02 0.01 0.00 1.54 0.00 0.00 36.73 39.65 3f8s h TYR 634 CO 0.00 0.59 -0.49 0.28 -1.64 0.00 0.00 178.16 176.90 3f8s h VAL 635 N 0.07 1.61 -0.34 1.81 2.07 -0.53 -2.29 116.25 118.65 3f8s h VAL 635 Ca -0.00 -2.42 0.07 0.00 0.82 0.00 0.00 66.70 65.17 3f8s h VAL 635 Cb 0.93 3.23 -0.08 0.00 -1.52 0.00 0.00 31.29 33.85 3f8s h VAL 635 CO 0.07 0.67 -0.29 0.74 0.02 0.00 0.00 177.57 178.78 3f8s h THR 636 N -0.59 0.29 -0.06 2.57 2.02 -0.41 0.66 112.91 117.39 3f8s h THR 636 Ca -0.08 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.12 3f8s h THR 636 Cb 1.37 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 3f8s h THR 636 CO 0.09 0.00 -0.10 0.28 0.37 0.00 0.00 175.52 176.16 3f8s h SER 637 N -0.25 -0.29 -0.91 4.18 0.02 -1.22 0.11 113.55 115.18 3f8s h SER 637 Ca 0.16 0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.23 3f8s h SER 637 Cb 0.51 0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.13 3f8s h SER 637 CO -0.48 -0.14 0.60 0.24 -1.14 0.00 0.00 176.83 175.91 3f8s h MET 638 N -0.14 1.03 -0.48 3.45 2.86 -1.04 -1.85 114.93 118.75 3f8s h MET 638 Ca 0.06 -0.06 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 3f8s h MET 638 Cb 0.22 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 3f8s h MET 638 CO -0.15 0.68 -0.19 0.28 1.06 0.00 0.00 176.91 178.60 3f8s h VAL 639 N 1.06 1.27 0.00 -2.22 2.07 0.09 -2.22 116.25 116.29 3f8s h VAL 639 Ca 0.39 -1.35 -0.04 0.00 0.82 0.00 0.00 66.70 66.53 3f8s h VAL 639 Cb 0.17 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3f8s h VAL 639 CO -0.14 0.47 -0.17 -0.07 0.02 0.00 0.00 177.57 177.68 3f8s h LEU 640 N 0.83 0.00 -2.99 2.57 3.38 -0.05 -2.64 115.31 116.42 3f8s h LEU 640 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3f8s h LEU 640 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 3f8s h LEU 640 CO 0.06 0.17 0.00 0.61 0.09 0.00 0.00 178.44 179.37 3f8s n GLY 641 N -0.91 2.81 0.13 0.83 0.00 -0.80 -4.26 105.19 103.00 3f8s n GLY 641 Ca -0.02 -0.74 0.02 0.00 0.00 0.00 0.00 46.02 45.28 3f8s n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3f8s h SER 642 N 3.46 0.00 -0.20 1.61 4.64 -1.01 -3.43 113.55 118.61 3f8s h SER 642 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3f8s h SER 642 Cb 1.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3f8s h SER 642 CO 0.11 0.49 -0.04 0.61 -0.87 0.00 0.00 176.83 177.14 3f8s n GLY 643 N 1.25 0.33 0.18 -0.77 0.00 -1.26 -4.97 105.19 99.95 3f8s n GLY 643 Ca 0.00 -0.85 0.08 0.00 0.00 0.00 0.00 46.02 45.25 3f8s n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3f8s h SER 644 N 0.00 0.00 0.00 1.61 4.64 -1.91 -3.47 113.55 114.41 3f8s h SER 644 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3f8s h SER 644 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 3f8s h SER 644 CO 0.04 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.85 3f8s n GLY 645 N 1.16 0.38 0.24 -0.77 0.00 -1.26 -4.87 105.19 100.07 3f8s n GLY 645 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 3f8s n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3f8s h VAL 646 N 0.00 1.28 -2.99 1.61 2.07 -1.95 -3.45 116.25 112.82 3f8s h VAL 646 Ca 0.00 -1.54 -0.64 0.00 0.82 0.00 0.00 66.70 65.34 3f8s h VAL 646 Cb 0.25 1.49 -0.10 0.00 -1.52 0.00 0.00 31.29 31.40 3f8s h VAL 646 CO 0.00 0.51 -0.51 -0.36 0.02 0.00 0.00 177.57 177.23 3f8s s PHE 647 N -4.35 3.46 0.16 1.57 0.40 -1.26 -4.58 117.98 113.38 3f8s s PHE 647 Ca -0.12 0.38 -0.03 0.00 -0.60 0.00 0.00 56.93 56.56 3f8s s PHE 647 Cb 0.10 -2.02 0.02 0.00 0.51 0.00 0.00 43.02 41.63 3f8s s PHE 647 CO 0.86 0.49 1.41 -0.22 0.70 0.00 0.00 175.22 178.47 3f8s h LYS 648 N 5.77 0.48 -2.02 0.44 3.64 -1.56 -3.46 116.57 119.85 3f8s h LYS 648 Ca -0.48 -0.39 0.21 0.00 -1.27 0.00 0.00 60.65 58.73 3f8s h LYS 648 Cb 1.19 0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 32.98 3f8s h LYS 648 CO 0.65 1.02 0.60 0.00 -2.27 0.00 0.00 179.45 179.46 3f8s s GLY 650 N -2.82 0.22 -0.07 0.00 0.00 -0.51 -1.66 107.32 102.48 3f8s s GLY 650 Ca 0.11 -0.58 0.04 0.00 0.00 0.00 0.00 44.72 44.29 3f8s s GLY 650 CO -0.02 -0.36 -0.19 -0.42 0.00 0.00 0.00 173.10 172.11 3f8s s ILE 651 N -3.97 1.64 -0.19 0.90 1.01 0.47 -1.76 121.20 119.31 3f8s s ILE 651 Ca 0.17 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 60.02 3f8s s ILE 651 Cb -0.03 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 41.03 3f8s s ILE 651 CO 0.08 0.47 -0.18 0.00 0.00 0.00 0.00 174.94 175.31 3f8s s ALA 652 N 0.25 2.40 -0.14 9.38 0.00 -0.51 -1.61 121.76 131.52 3f8s s ALA 652 Ca -0.11 -1.22 -0.04 0.00 0.00 0.00 0.00 51.96 50.59 3f8s s ALA 652 Cb -0.15 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.68 3f8s s ALA 652 CO 0.05 -0.37 -0.02 0.08 0.00 0.00 0.00 175.76 175.50 3f8s s VAL 653 N 1.31 4.06 -1.17 0.00 1.01 -0.74 -1.69 120.40 123.19 3f8s s VAL 653 Ca 0.05 -0.30 -0.22 0.00 0.00 0.00 0.00 61.98 61.50 3f8s s VAL 653 Cb -0.13 -2.77 0.03 0.00 0.00 0.00 0.00 36.38 33.51 3f8s s VAL 653 CO -0.12 0.51 0.42 0.00 0.00 0.00 0.00 175.10 175.92 3f8s n ALA 654 N 3.27 -2.27 -1.79 5.51 0.00 0.11 -0.91 120.51 124.43 3f8s n ALA 654 Ca -0.17 -0.49 -0.32 0.00 0.00 0.00 0.00 53.44 52.45 3f8s n ALA 654 Cb 0.53 -1.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.15 3f8s n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3f8s s PRO 655 N -7.13 3.78 0.31 0.00 0.04 -1.26 -3.26 135.00 127.48 3f8s s PRO 655 Ca 0.31 1.03 -0.15 0.00 0.04 0.00 0.00 61.00 62.23 3f8s s PRO 655 Cb -0.17 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 32.17 3f8s s PRO 655 CO 0.87 -0.42 0.73 0.08 0.04 0.00 0.00 177.00 178.30 3f8s s VAL 656 N -2.57 4.68 0.00 -0.36 1.01 -1.25 -4.52 120.40 117.39 3f8s s VAL 656 Ca 0.60 0.97 0.00 0.00 0.00 0.00 0.00 61.98 63.55 3f8s s VAL 656 Cb -0.12 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3f8s s VAL 656 CO 0.33 -0.14 0.00 -1.54 0.00 0.00 0.00 175.10 173.74 3f8s n SER 657 N -0.25 1.62 -3.68 3.32 3.41 -1.26 -4.25 113.62 112.53 3f8s n SER 657 Ca 0.03 -0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.54 3f8s n SER 657 Cb 0.53 0.33 -0.10 0.00 -0.26 0.00 0.00 64.21 64.70 3f8s n SER 657 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3f8s s ARG 658 N -0.65 0.36 0.39 4.33 3.52 -1.26 -1.51 118.95 124.12 3f8s s ARG 658 Ca 0.00 0.88 0.12 0.00 -0.13 0.00 0.00 55.73 56.60 3f8s s ARG 658 Cb 0.00 0.11 0.78 0.00 -1.56 0.00 0.00 34.95 34.28 3f8s s ARG 658 CO 0.00 -0.20 1.87 -1.49 -0.81 0.00 0.00 175.30 174.67 3f8s h TRP 659 N 7.55 0.04 0.00 5.12 4.06 -1.90 -1.87 115.95 128.94 3f8s h TRP 659 Ca -0.28 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.66 3f8s h TRP 659 Cb 1.15 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 3f8s h TRP 659 CO 0.26 0.34 0.00 0.39 -3.56 0.00 0.00 178.44 175.87 3f8s n GLU 660 N -4.17 0.14 0.19 0.49 1.02 -1.26 -1.17 120.64 115.89 3f8s n GLU 660 Ca -0.02 0.51 0.12 0.00 -0.02 0.00 0.00 57.16 57.75 3f8s n GLU 660 Cb 0.36 -1.86 0.14 0.00 -0.02 0.00 0.00 31.44 30.06 3f8s n GLU 660 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3f8s h TYR 661 N 0.00 0.00 -5.21 -0.32 0.05 -1.72 -3.31 116.97 106.46 3f8s h TYR 661 Ca 0.00 0.00 -0.42 0.00 0.05 0.00 0.00 58.73 58.36 3f8s h TYR 661 Cb 0.17 0.00 0.09 0.00 1.01 0.00 0.00 36.73 38.00 3f8s h TYR 661 CO 0.00 0.00 0.13 0.98 -1.05 0.00 0.00 178.16 178.22 3f8s n TYR 662 N -2.96 -3.07 -1.68 4.88 9.36 -0.32 -4.85 117.16 118.52 3f8s n TYR 662 Ca 0.03 -1.57 -0.31 0.00 3.32 0.00 0.00 57.90 59.37 3f8s n TYR 662 Cb 0.53 -0.70 0.05 0.00 -0.63 0.00 0.00 39.34 38.59 3f8s n TYR 662 CO 0.00 0.00 0.00 0.16 0.22 0.00 0.00 176.86 177.24 3f8s s ASP 663 N -4.82 5.44 0.10 2.98 1.47 -1.26 -1.81 116.67 118.77 3f8s s ASP 663 Ca 0.62 1.45 -0.13 0.00 1.18 0.00 0.00 52.55 55.67 3f8s s ASP 663 Cb -0.03 -2.34 -0.14 0.00 -0.34 0.00 0.00 42.92 40.07 3f8s s ASP 663 CO 0.41 -1.38 1.33 0.77 0.68 0.00 0.00 175.17 176.98 3f8s h SER 664 N -0.68 0.91 -0.19 2.11 4.64 -1.45 -2.68 113.55 116.22 3f8s h SER 664 Ca -0.45 -0.60 -0.15 0.00 -0.47 0.00 0.00 61.79 60.13 3f8s h SER 664 Cb 1.22 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 3f8s h SER 664 CO 0.59 1.35 -0.47 0.58 -0.87 0.00 0.00 176.83 178.01 3f8s h VAL 665 N 0.51 1.32 0.05 0.95 2.07 -1.94 -2.01 116.25 117.20 3f8s h VAL 665 Ca -0.03 -1.71 -0.00 0.00 0.82 0.00 0.00 66.70 65.78 3f8s h VAL 665 Cb 1.28 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 3f8s h VAL 665 CO 0.14 0.53 -0.02 0.22 0.02 0.00 0.00 177.57 178.46 3f8s h TYR 666 N 0.34 -0.06 0.44 1.57 5.03 -1.94 -3.11 116.97 119.24 3f8s h TYR 666 Ca -0.01 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.29 3f8s h TYR 666 Cb 1.08 0.02 -0.01 0.00 1.55 0.00 0.00 36.73 39.38 3f8s h TYR 666 CO 0.09 0.57 -0.28 1.15 -1.32 0.00 0.00 178.16 178.37 3f8s h THR 667 N -0.81 0.42 0.00 1.81 2.02 -1.56 -2.58 112.91 112.20 3f8s h THR 667 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3f8s h THR 667 Cb 0.66 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3f8s h THR 667 CO 0.01 0.00 0.00 -0.33 0.37 0.00 0.00 175.52 175.57 3f8s h GLU 668 N -0.69 0.00 -0.34 6.66 5.08 -1.52 0.24 114.58 124.02 3f8s h GLU 668 Ca -0.05 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3f8s h GLU 668 Cb 0.57 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 3f8s h GLU 668 CO 0.04 0.00 0.22 -0.09 -1.00 0.00 0.00 179.01 178.18 3f8s h ARG 669 N 0.00 0.39 0.00 2.33 2.43 -1.38 -2.54 114.38 115.61 3f8s h ARG 669 Ca 0.00 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 3f8s h ARG 669 Cb 0.39 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 3f8s h ARG 669 CO 0.00 0.26 -1.40 0.66 -1.51 0.00 0.00 179.97 177.98 3f8s n TYR 670 N -4.49 0.00 -0.02 2.20 4.01 -0.27 -4.60 117.16 113.99 3f8s n TYR 670 Ca 0.02 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.83 3f8s n TYR 670 Cb 0.11 -0.28 -0.14 0.00 -0.31 0.00 0.00 39.34 38.72 3f8s n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3f8s n MET 671 N -2.16 0.63 0.00 -0.72 2.81 0.68 0.90 117.12 119.27 3f8s n MET 671 Ca -0.09 -0.14 0.00 0.00 -1.81 0.00 0.00 57.70 55.66 3f8s n MET 671 Cb 0.63 -1.42 0.00 0.00 -0.71 0.00 0.00 33.22 31.72 3f8s n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3f8s n GLY 672 N 1.57 -1.40 3.83 3.03 0.00 -0.96 -4.71 105.19 106.54 3f8s n GLY 672 Ca -0.06 -1.28 -0.35 0.00 0.00 0.00 0.00 46.02 44.32 3f8s n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f8s s LEU 673 N 0.00 4.31 -1.33 0.99 1.43 -1.26 -4.35 118.68 118.47 3f8s s LEU 673 Ca 0.00 1.31 -0.11 0.00 -1.03 0.00 0.00 54.13 54.29 3f8s s LEU 673 Cb 0.00 -3.56 0.13 0.00 0.03 0.00 0.00 46.19 42.79 3f8s s LEU 673 CO 0.00 0.02 1.95 -0.81 0.23 0.00 0.00 176.35 177.75 3f8s n PRO 674 N 0.62 3.37 -4.05 1.29 -0.04 -1.26 -1.07 135.00 133.85 3f8s n PRO 674 Ca -0.02 -3.26 -0.12 0.00 -0.04 0.00 0.00 63.50 60.05 3f8s n PRO 674 Cb 0.51 -3.06 -0.11 0.00 -0.04 0.00 0.00 33.50 30.81 3f8s n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3f8s s THR 675 N 1.38 0.46 0.39 0.52 -4.23 -1.26 -4.68 115.64 108.23 3f8s s THR 675 Ca 0.42 -1.12 0.17 0.00 -1.18 0.00 0.00 61.69 59.98 3f8s s THR 675 Cb 0.10 -0.63 0.38 0.00 1.34 0.00 0.00 72.50 73.69 3f8s s THR 675 CO -0.02 -0.45 1.78 -0.65 -0.54 0.00 0.00 174.62 174.74 3f8s h PRO 676 N 4.39 0.42 0.00 3.99 0.11 -1.95 0.43 132.00 139.40 3f8s h PRO 676 Ca -0.35 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.67 3f8s h PRO 676 Cb 1.20 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3f8s h PRO 676 CO 0.43 0.28 -0.33 1.05 -0.21 0.00 0.00 178.00 179.22 3f8s h GLU 677 N 0.44 0.00 0.00 1.05 9.09 -1.96 -3.43 114.58 119.77 3f8s h GLU 677 Ca 0.58 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.99 3f8s h GLU 677 Cb 1.39 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.49 3f8s h GLU 677 CO -0.29 0.33 0.00 -3.47 0.05 0.00 0.00 179.01 175.63 3f8s n ASP 678 N -3.40 0.00 -2.47 3.06 -0.08 0.14 -5.02 116.55 108.79 3f8s n ASP 678 Ca 0.00 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.29 3f8s n ASP 678 Cb 0.52 0.00 0.04 0.00 2.34 0.00 0.00 41.12 44.03 3f8s n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 3f8s n ASN 679 N 0.00 1.50 -0.23 1.67 4.05 -0.23 -4.89 115.26 117.12 3f8s n ASN 679 Ca 0.00 -2.06 -0.03 0.00 0.45 0.00 0.00 54.58 52.93 3f8s n ASN 679 Cb 0.00 -0.43 0.08 0.00 1.23 0.00 0.00 39.78 40.65 3f8s n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 3f8s h LEU 680 N 2.18 0.63 -0.78 1.20 5.85 -1.54 -2.82 115.31 120.04 3f8s h LEU 680 Ca -0.15 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.61 3f8s h LEU 680 Cb 1.43 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.29 3f8s h LEU 680 CO 0.17 0.43 0.49 0.44 -0.34 0.00 0.00 178.44 179.63 3f8s h ASP 681 N 0.76 0.80 1.54 1.25 3.32 -1.90 -1.60 116.42 120.59 3f8s h ASP 681 Ca 0.27 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 3f8s h ASP 681 Cb 0.07 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 3f8s h ASP 681 CO -0.13 0.55 -0.47 -0.74 -1.72 0.00 0.00 179.24 176.73 3f8s h HIS 682 N 0.95 0.00 -0.07 4.55 2.76 -1.92 0.25 115.15 121.67 3f8s h HIS 682 Ca 0.32 0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.53 3f8s h HIS 682 Cb 0.04 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 28.95 3f8s h HIS 682 CO -0.03 0.13 -0.25 1.88 -1.30 0.00 0.00 177.93 178.36 3f8s h TYR 683 N 0.00 -0.66 0.00 5.26 -1.99 -1.17 -2.65 116.97 115.75 3f8s h TYR 683 Ca -0.01 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.74 3f8s h TYR 683 Cb 1.11 0.30 0.00 0.00 2.00 0.00 0.00 36.73 40.15 3f8s h TYR 683 CO 0.00 -0.33 0.00 0.00 -0.00 0.00 0.00 178.16 177.83 3f8s h ARG 684 N -0.34 0.00 0.00 4.88 -0.00 -0.95 -3.12 114.38 114.85 3f8s h ARG 684 Ca 0.08 0.00 -0.11 0.00 -0.50 0.00 0.00 59.98 59.45 3f8s h ARG 684 Cb 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 30.41 3f8s h ARG 684 CO -0.27 0.00 -0.89 -0.97 0.00 0.00 0.00 179.97 177.84 3f8s h ASN 685 N 0.00 0.00 -0.47 7.04 -1.24 -0.80 -3.37 115.58 116.73 3f8s h ASN 685 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 3f8s h ASN 685 Cb 0.60 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.65 3f8s h ASN 685 CO 0.00 0.45 0.00 -1.54 -1.29 0.00 0.00 177.43 175.05 3f8s n SER 686 N -3.02 4.91 -4.87 1.15 3.41 -1.01 -4.96 113.62 109.23 3f8s n SER 686 Ca -0.03 -2.87 -0.31 0.00 -0.26 0.00 0.00 58.87 55.41 3f8s n SER 686 Cb 0.74 -0.61 0.02 0.00 -0.26 0.00 0.00 64.21 64.10 3f8s n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3f8s s THR 687 N -2.61 4.54 -0.03 6.66 -4.23 -1.26 -4.88 115.64 113.84 3f8s s THR 687 Ca 0.49 0.83 -0.16 0.00 -1.18 0.00 0.00 61.69 61.67 3f8s s THR 687 Cb 0.37 -3.80 -0.32 0.00 1.34 0.00 0.00 72.50 70.09 3f8s s THR 687 CO 0.15 -1.08 0.80 0.58 -0.54 0.00 0.00 174.62 174.53 3f8s h VAL 688 N -0.38 1.20 -0.92 2.29 2.07 -1.62 -3.35 116.25 115.53 3f8s h VAL 688 Ca -0.44 -2.55 0.20 0.00 0.82 0.00 0.00 66.70 64.73 3f8s h VAL 688 Cb 1.20 2.95 -0.07 0.00 -1.52 0.00 0.00 31.29 33.84 3f8s h VAL 688 CO 0.62 0.78 0.60 0.24 0.02 0.00 0.00 177.57 179.83 3f8s h MET 689 N -0.07 0.46 -0.38 1.57 2.86 -1.90 0.78 114.93 118.24 3f8s h MET 689 Ca -0.26 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 3f8s h MET 689 Cb 1.95 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 33.51 3f8s h MET 689 CO 0.18 0.30 0.00 -1.13 1.06 0.00 0.00 176.91 177.32 3f8s n SER 690 N -4.55 0.38 0.00 1.22 3.41 -1.26 -1.97 113.62 110.86 3f8s n SER 690 Ca 0.20 -1.69 0.00 0.00 -0.26 0.00 0.00 58.87 57.12 3f8s n SER 690 Cb 0.68 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 3f8s n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3f8s n ARG 691 N -0.24 1.15 -0.36 4.33 1.74 0.27 -4.87 116.66 118.68 3f8s n ARG 691 Ca 0.00 -0.90 0.07 0.00 -0.77 0.00 0.00 57.85 56.25 3f8s n ARG 691 Cb 0.09 -0.83 0.15 0.00 -1.02 0.00 0.00 32.46 30.85 3f8s n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3f8s h ALA 692 N 0.00 0.70 -0.90 7.54 0.00 -1.48 -0.26 119.26 124.86 3f8s h ALA 692 Ca 0.00 0.38 0.21 0.00 0.00 0.00 0.00 54.91 55.50 3f8s h ALA 692 Cb 0.51 0.74 -0.12 0.00 0.00 0.00 0.00 17.79 18.92 3f8s h ALA 692 CO 0.00 -0.40 0.43 0.93 0.00 0.00 0.00 179.25 180.21 3f8s h GLU 693 N 0.00 0.46 0.00 0.00 4.39 -1.89 -0.86 114.58 116.68 3f8s h GLU 693 Ca 0.49 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 60.10 3f8s h GLU 693 Cb 0.77 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 3f8s h GLU 693 CO -1.01 0.31 -0.30 -0.91 -1.16 0.00 0.00 179.01 175.93 3f8s h ASN 694 N 0.48 0.00 0.02 1.42 2.35 -1.30 -1.82 115.58 116.72 3f8s h ASN 694 Ca 0.55 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.30 3f8s h ASN 694 Cb 0.98 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.35 3f8s h ASN 694 CO -0.48 0.30 -0.00 -0.26 -1.65 0.00 0.00 177.43 175.34 3f8s h PHE 695 N 0.00 0.00 0.00 1.19 -1.00 -1.19 -0.51 116.94 115.43 3f8s h PHE 695 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3f8s h PHE 695 Cb 0.67 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.23 3f8s h PHE 695 CO 0.00 0.00 0.05 1.17 -1.61 0.00 0.00 178.31 177.92 3f8s n LYS 696 N -3.08 0.00 0.00 1.51 4.81 -0.68 -1.29 118.16 119.42 3f8s n LYS 696 Ca -0.03 0.44 0.09 0.00 -0.87 0.00 0.00 58.31 57.94 3f8s n LYS 696 Cb 0.07 -1.55 -0.08 0.00 0.02 0.00 0.00 35.03 33.50 3f8s n LYS 696 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3f8s n GLN 697 N -1.44 1.25 -4.29 1.64 6.02 -0.20 -5.03 117.38 115.33 3f8s n GLN 697 Ca 0.00 -0.22 -0.15 0.00 -0.01 0.00 0.00 57.00 56.61 3f8s n GLN 697 Cb 0.05 -1.34 -0.10 0.00 1.02 0.00 0.00 30.24 29.87 3f8s n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3f8s s VAL 698 N -2.53 0.53 -0.23 5.09 -7.23 -0.41 -4.99 120.40 110.62 3f8s s VAL 698 Ca 0.09 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.15 3f8s s VAL 698 Cb 0.14 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.50 3f8s s VAL 698 CO 0.66 -0.09 0.19 -1.61 -0.31 0.00 0.00 175.10 173.95 3f8s s GLU 699 N -4.02 4.10 -0.05 4.82 2.02 -0.67 -4.98 118.70 119.92 3f8s s GLU 699 Ca 0.35 -0.19 0.03 0.00 0.02 0.00 0.00 54.97 55.18 3f8s s GLU 699 Cb 0.07 -3.53 0.00 0.00 0.10 0.00 0.00 34.13 30.78 3f8s s GLU 699 CO 0.12 0.07 -0.14 -0.47 0.02 0.00 0.00 175.26 174.86 3f8s s TYR 700 N 1.01 1.54 -0.14 1.61 5.04 -1.26 -1.42 117.35 123.73 3f8s s TYR 700 Ca 0.09 -0.49 0.01 0.00 -2.44 0.00 0.00 57.07 54.24 3f8s s TYR 700 Cb -0.13 -1.07 -0.00 0.00 0.35 0.00 0.00 41.96 41.10 3f8s s TYR 700 CO 0.04 -0.21 -0.18 -1.17 -1.34 0.00 0.00 175.55 172.70 3f8s s LEU 701 N 0.31 2.38 -0.18 6.97 2.96 -0.72 -0.29 118.68 130.12 3f8s s LEU 701 Ca -0.08 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.35 3f8s s LEU 701 Cb -0.13 -1.52 0.03 0.00 0.50 0.00 0.00 46.19 45.07 3f8s s LEU 701 CO 0.03 0.11 -0.12 -0.22 -1.32 0.00 0.00 176.35 174.83 3f8s s LEU 702 N 0.65 2.03 -0.03 -0.68 2.96 0.04 -1.42 118.68 122.23 3f8s s LEU 702 Ca -0.09 -0.71 0.03 0.00 -0.22 0.00 0.00 54.13 53.14 3f8s s LEU 702 Cb -0.16 -1.22 0.00 0.00 0.50 0.00 0.00 46.19 45.31 3f8s s LEU 702 CO 0.02 -0.10 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.21 3f8s s ILE 703 N 1.43 0.90 -0.01 6.68 1.01 -0.68 -0.99 121.20 129.54 3f8s s ILE 703 Ca 0.02 -0.43 -0.16 0.00 0.00 0.00 0.00 60.65 60.07 3f8s s ILE 703 Cb -0.15 -0.79 0.03 0.00 0.01 0.00 0.00 42.46 41.57 3f8s s ILE 703 CO -0.09 0.27 0.34 -2.28 0.00 0.00 0.00 174.94 173.18 3f8s s HIS 704 N 0.11 -0.21 0.12 3.97 2.46 -1.12 0.08 115.29 120.69 3f8s s HIS 704 Ca -0.02 0.29 -0.07 0.00 0.47 0.00 0.00 55.06 55.73 3f8s s HIS 704 Cb -0.08 0.13 -0.06 0.00 -0.13 0.00 0.00 32.58 32.44 3f8s s HIS 704 CO 0.01 -0.43 0.39 0.20 -2.47 0.00 0.00 174.74 172.44 3f8s s GLY 705 N -1.44 2.28 0.44 1.59 0.00 -1.26 -2.27 107.32 106.66 3f8s s GLY 705 Ca -0.12 -0.46 0.23 0.00 0.00 0.00 0.00 44.72 44.37 3f8s s GLY 705 CO 0.03 -0.32 1.62 -0.91 0.00 0.00 0.00 173.10 173.52 3f8s h THR 706 N 2.42 0.02 -0.76 0.90 1.35 -1.09 -3.19 112.91 112.57 3f8s h THR 706 Ca -0.47 -1.02 -0.51 0.00 -0.55 0.00 0.00 66.41 63.86 3f8s h THR 706 Cb 1.18 2.00 -0.30 0.00 -1.73 0.00 0.00 68.15 69.29 3f8s h THR 706 CO 0.69 0.01 0.02 0.00 -0.25 0.00 0.00 175.52 176.00 3f8s n ALA 707 N -2.10 5.35 -2.39 6.62 0.00 -0.49 -4.72 120.51 122.78 3f8s n ALA 707 Ca 0.04 -3.49 -0.42 0.00 0.00 0.00 0.00 53.44 49.57 3f8s n ALA 707 Cb 0.53 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.97 3f8s n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3f8s s ASP 708 N -2.62 6.19 0.31 0.00 -1.08 -1.18 -3.99 116.67 114.31 3f8s s ASP 708 Ca 0.55 0.42 0.26 0.00 -0.52 0.00 0.00 52.55 53.26 3f8s s ASP 708 Cb 0.45 -2.54 0.86 0.00 -1.46 0.00 0.00 42.92 40.22 3f8s s ASP 708 CO 0.02 -1.63 1.76 -2.24 0.52 0.00 0.00 175.17 173.60 3f8s h ASP 709 N 10.92 0.00 0.00 -0.34 2.03 -1.92 -3.35 116.42 123.76 3f8s h ASP 709 Ca -0.27 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.03 3f8s h ASP 709 Cb 1.09 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 3f8s h ASP 709 CO 1.15 0.00 -0.00 -3.20 -1.03 0.00 0.00 179.24 176.16 3f8s n ASN 710 N -2.51 0.01 -4.36 4.15 4.05 -1.26 -4.77 115.26 110.57 3f8s n ASN 710 Ca 0.04 0.00 -0.45 0.00 0.45 0.00 0.00 54.58 54.62 3f8s n ASN 710 Cb 0.37 -0.26 -0.06 0.00 1.23 0.00 0.00 39.78 41.06 3f8s n ASN 710 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3f8s s VAL 711 N -1.01 5.12 0.28 3.44 1.01 -1.26 -4.84 120.40 123.14 3f8s s VAL 711 Ca -0.00 -1.19 -0.29 0.00 0.00 0.00 0.00 61.98 60.50 3f8s s VAL 711 Cb 0.00 -4.30 -0.10 0.00 0.00 0.00 0.00 36.38 31.98 3f8s s VAL 711 CO 0.00 -0.83 1.22 -1.00 0.00 0.00 0.00 175.10 174.49 3f8s s HIS 712 N 1.90 3.31 0.49 5.22 3.76 -1.26 -4.69 115.29 124.03 3f8s s HIS 712 Ca 0.06 1.50 0.32 0.00 -0.15 0.00 0.00 55.06 56.80 3f8s s HIS 712 Cb -0.26 -3.50 1.43 0.00 1.11 0.00 0.00 32.58 31.36 3f8s s HIS 712 CO 0.05 -1.29 1.74 0.35 -0.85 0.00 0.00 174.74 174.74 3f8s h PHE 713 N 3.95 0.26 -0.95 1.40 3.57 -1.79 0.94 116.94 124.32 3f8s h PHE 713 Ca -0.47 0.01 0.39 0.00 3.53 0.00 0.00 57.97 61.43 3f8s h PHE 713 Cb 1.22 -0.07 -0.16 0.00 2.79 0.00 0.00 35.95 39.72 3f8s h PHE 713 CO 0.58 -0.02 0.52 0.94 -2.23 0.00 0.00 178.31 178.11 3f8s n GLN 714 N -4.36 -0.05 -0.09 1.11 7.27 -1.26 -0.48 117.38 119.52 3f8s n GLN 714 Ca 0.29 1.27 -0.12 0.00 0.07 0.00 0.00 57.00 58.52 3f8s n GLN 714 Cb 1.26 -2.29 -0.04 0.00 2.41 0.00 0.00 30.24 31.58 3f8s n GLN 714 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 3f8s h GLN 715 N 0.00 0.51 -0.22 3.69 4.20 0.62 -1.66 115.11 122.25 3f8s h GLN 715 Ca 0.79 -0.20 -0.19 0.00 0.06 0.00 0.00 58.65 59.11 3f8s h GLN 715 Cb 2.12 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.87 3f8s h GLN 715 CO -0.69 0.73 -0.62 0.77 -0.67 0.00 0.00 178.83 178.35 3f8s h SER 716 N 0.26 0.85 -0.99 1.46 0.02 -1.50 -2.87 113.55 110.77 3f8s h SER 716 Ca 0.06 -0.49 0.30 0.00 -0.84 0.00 0.00 61.79 60.83 3f8s h SER 716 Cb 0.55 -0.25 -0.14 0.00 0.14 0.00 0.00 62.40 62.70 3f8s h SER 716 CO 0.03 1.27 0.55 0.00 -1.14 0.00 0.00 176.83 177.53 3f8s h ALA 717 N 0.74 1.87 0.07 3.77 0.00 -0.66 -1.15 119.26 123.91 3f8s h ALA 717 Ca -0.01 0.18 -0.25 0.00 0.00 0.00 0.00 54.91 54.84 3f8s h ALA 717 Cb 1.22 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 3f8s h ALA 717 CO 0.13 -0.51 -1.14 1.96 0.00 0.00 0.00 179.25 179.69 3f8s h GLN 718 N 0.36 0.15 -0.23 0.00 1.08 -1.20 -2.93 115.11 112.35 3f8s h GLN 718 Ca 0.70 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.63 3f8s h GLN 718 Cb 1.55 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 29.07 3f8s h GLN 718 CO -0.59 1.12 0.11 0.82 -0.95 0.00 0.00 178.83 179.35 3f8s h ILE 719 N 0.04 1.14 -0.54 2.54 2.04 -1.07 -2.57 117.51 119.09 3f8s h ILE 719 Ca -0.08 -0.41 -0.08 0.00 1.00 0.00 0.00 64.86 65.29 3f8s h ILE 719 Cb 1.88 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 38.94 3f8s h ILE 719 CO 0.17 0.14 0.03 0.77 0.00 0.00 0.00 178.15 179.26 3f8s h SER 720 N 0.24 0.91 -0.24 1.72 4.64 -1.30 -1.88 113.55 117.63 3f8s h SER 720 Ca 0.08 -0.29 -0.11 0.00 -0.47 0.00 0.00 61.79 60.99 3f8s h SER 720 Cb 0.12 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 3f8s h SER 720 CO -0.01 0.98 -0.23 0.50 -0.87 0.00 0.00 176.83 177.20 3f8s h LYS 721 N 0.82 0.71 -0.53 4.77 3.64 -1.48 -0.60 116.57 123.89 3f8s h LYS 721 Ca 0.16 -0.28 -0.08 0.00 -1.27 0.00 0.00 60.65 59.18 3f8s h LYS 721 Cb 0.50 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 3f8s h LYS 721 CO 0.02 0.88 0.02 0.00 -2.27 0.00 0.00 179.45 178.10 3f8s h ALA 722 N 1.13 0.71 -0.46 5.00 0.00 -1.27 -0.94 119.26 123.42 3f8s h ALA 722 Ca 0.09 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 3f8s h ALA 722 Cb 0.72 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3f8s h ALA 722 CO 0.06 0.51 0.14 -0.07 0.00 0.00 0.00 179.25 179.89 3f8s h LEU 723 N 0.80 0.62 -0.05 0.00 3.38 -0.89 -3.01 115.31 116.16 3f8s h LEU 723 Ca 0.15 -0.09 -0.26 0.00 0.09 0.00 0.00 57.88 57.78 3f8s h LEU 723 Cb 0.50 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 41.10 3f8s h LEU 723 CO 0.02 0.60 -0.99 0.58 0.09 0.00 0.00 178.44 178.74 3f8s h VAL 724 N 0.67 1.30 0.00 1.22 2.07 -0.95 -1.73 116.25 118.83 3f8s h VAL 724 Ca 0.16 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.44 3f8s h VAL 724 Cb 0.21 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 3f8s h VAL 724 CO -0.01 0.69 0.00 0.47 0.02 0.00 0.00 177.57 178.74 3f8s n ASP 725 N -3.85 0.37 0.00 0.57 8.00 -0.37 -2.62 116.55 118.65 3f8s n ASP 725 Ca -0.10 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.32 3f8s n ASP 725 Cb 0.86 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.77 3f8s n ASP 725 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 3f8s n VAL 726 N -0.00 0.00 -2.69 2.53 3.14 -1.20 -5.04 118.33 115.07 3f8s n VAL 726 Ca 0.00 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.33 3f8s n VAL 726 Cb 0.09 0.92 0.01 0.00 -1.06 0.00 0.00 33.84 33.80 3f8s n VAL 726 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3f8s n GLY 727 N 0.00 0.66 3.50 7.55 0.00 -1.08 -4.98 105.19 110.84 3f8s n GLY 727 Ca 0.00 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 3f8s n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f8s s VAL 728 N -3.04 4.64 0.16 1.61 1.01 -0.67 -5.01 120.40 119.11 3f8s s VAL 728 Ca 0.11 -0.06 -0.26 0.00 0.00 0.00 0.00 61.98 61.76 3f8s s VAL 728 Cb -0.05 -3.18 -0.08 0.00 0.00 0.00 0.00 36.38 33.08 3f8s s VAL 728 CO 0.13 0.32 0.81 -0.62 0.00 0.00 0.00 175.10 175.75 3f8s s ASP 729 N 1.57 7.42 0.16 3.32 2.15 -1.26 -4.57 116.67 125.46 3f8s s ASP 729 Ca 0.06 1.69 -0.14 0.00 0.43 0.00 0.00 52.55 54.59 3f8s s ASP 729 Cb -0.15 -2.52 0.02 0.00 -0.30 0.00 0.00 42.92 39.97 3f8s s ASP 729 CO 0.06 0.17 0.40 0.72 -0.17 0.00 0.00 175.17 176.35 3f8s s PHE 730 N -0.99 -0.01 0.01 -5.34 -0.71 -1.26 -4.82 117.98 104.87 3f8s s PHE 730 Ca 0.37 -0.34 -0.04 0.00 -1.04 0.00 0.00 56.93 55.88 3f8s s PHE 730 Cb -0.23 0.21 -0.04 0.00 -1.21 0.00 0.00 43.02 41.74 3f8s s PHE 730 CO 0.27 -0.77 0.23 -0.65 -1.34 0.00 0.00 175.22 172.97 3f8s s GLN 731 N -3.87 3.51 0.08 1.99 -1.52 0.61 -5.03 119.66 115.43 3f8s s GLN 731 Ca 0.08 -0.21 0.01 0.00 -1.95 0.00 0.00 55.36 53.29 3f8s s GLN 731 Cb 0.01 -3.07 -0.04 0.00 -0.22 0.00 0.00 33.01 29.70 3f8s s GLN 731 CO -0.06 0.64 -0.05 0.00 -0.25 0.00 0.00 175.29 175.57 3f8s s ALA 732 N -1.35 0.76 -0.28 6.09 0.00 -1.26 -0.78 121.76 124.95 3f8s s ALA 732 Ca 0.29 -1.22 -0.07 0.00 0.00 0.00 0.00 51.96 50.96 3f8s s ALA 732 Cb -0.13 0.18 0.14 0.00 0.00 0.00 0.00 23.12 23.31 3f8s s ALA 732 CO 0.19 -0.25 0.58 1.41 0.00 0.00 0.00 175.76 177.68 3f8s s MET 733 N -3.54 0.52 0.44 0.00 0.00 -0.16 -4.89 119.30 111.67 3f8s s MET 733 Ca 0.07 1.20 0.02 0.00 0.00 0.00 0.00 55.69 56.98 3f8s s MET 733 Cb 0.04 0.60 0.00 0.00 0.00 0.00 0.00 34.83 35.47 3f8s s MET 733 CO -0.06 -0.35 0.65 1.67 0.00 0.00 0.00 175.02 176.93 3f8s s TRP 734 N 2.81 3.13 -0.23 4.11 -2.14 -1.26 -2.81 118.94 122.55 3f8s s TRP 734 Ca 0.03 0.09 -0.04 0.00 2.66 0.00 0.00 56.10 58.84 3f8s s TRP 734 Cb -0.13 -2.33 0.08 0.00 -3.10 0.00 0.00 33.47 27.99 3f8s s TRP 734 CO -0.18 -0.38 0.10 0.71 -2.66 0.00 0.00 176.95 174.54 3f8s s TYR 735 N -2.51 0.43 0.03 1.66 2.02 -0.96 -4.95 117.35 113.07 3f8s s TYR 735 Ca 0.49 -0.69 -0.34 0.00 -0.37 0.00 0.00 57.07 56.16 3f8s s TYR 735 Cb -0.10 -0.88 -0.13 0.00 -0.40 0.00 0.00 41.96 40.45 3f8s s TYR 735 CO 0.37 -0.68 1.70 2.41 -1.57 0.00 0.00 175.55 177.78 3f8s n THR 736 N 5.22 0.26 -1.23 -0.71 -1.04 -1.26 -1.36 114.28 114.15 3f8s n THR 736 Ca -0.06 -0.05 -0.08 0.00 -2.04 0.00 0.00 64.05 61.82 3f8s n THR 736 Cb 0.45 -1.63 -0.03 0.00 -1.82 0.00 0.00 70.33 67.31 3f8s n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3f8s n ASP 737 N 4.80 -4.15 -4.87 8.00 8.00 -1.26 -4.86 116.55 122.21 3f8s n ASP 737 Ca 0.20 0.19 -0.34 0.00 0.71 0.00 0.00 54.79 55.56 3f8s n ASP 737 Cb 0.28 -2.34 -0.05 0.00 -0.02 0.00 0.00 41.12 38.98 3f8s n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3f8s s GLU 738 N -2.49 3.35 0.00 -1.24 0.41 -1.14 -4.76 118.70 112.83 3f8s s GLU 738 Ca 0.00 -0.34 0.00 0.00 -0.41 0.00 0.00 54.97 54.22 3f8s s GLU 738 Cb 0.00 -3.05 0.00 0.00 -1.78 0.00 0.00 34.13 29.30 3f8s s GLU 738 CO 0.00 0.68 0.00 -0.40 -0.49 0.00 0.00 175.26 175.05 3f8s n ASP 739 N 1.13 0.17 0.24 -0.19 5.68 -1.26 -1.39 116.55 120.95 3f8s n ASP 739 Ca -0.12 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.26 3f8s n ASP 739 Cb 0.53 0.00 0.62 0.00 -1.14 0.00 0.00 41.12 41.13 3f8s n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 3f8s h HIS 740 N 0.00 0.00 -0.00 2.11 -0.00 -1.91 -1.60 115.15 113.74 3f8s h HIS 740 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 3f8s h HIS 740 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 3f8s h HIS 740 CO 0.00 0.16 -0.20 0.41 -0.00 0.00 0.00 177.93 178.30 3f8s n GLY 741 N -0.78 -1.35 3.86 5.26 0.00 -1.26 -4.96 105.19 105.96 3f8s n GLY 741 Ca -0.02 -0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 3f8s n GLY 741 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3f8s n ILE 742 N -1.44 -2.01 0.12 -0.61 5.41 -0.60 -4.86 119.36 115.36 3f8s n ILE 742 Ca 0.07 -0.32 0.04 0.00 1.00 0.00 0.00 62.75 63.54 3f8s n ILE 742 Cb 0.33 -1.73 -0.06 0.00 -0.71 0.00 0.00 39.64 37.47 3f8s n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3f8s n ALA 743 N -3.47 2.54 -1.52 -1.39 0.00 -1.26 -3.92 120.51 111.49 3f8s n ALA 743 Ca -0.12 -0.20 -0.39 0.00 0.00 0.00 0.00 53.44 52.73 3f8s n ALA 743 Cb 0.43 -0.28 0.03 0.00 0.00 0.00 0.00 19.45 19.64 3f8s n ALA 743 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3f8s n SER 744 N -1.57 -0.29 0.09 0.00 3.41 -1.26 -4.66 113.62 109.34 3f8s n SER 744 Ca -0.00 0.83 -0.06 0.00 -0.26 0.00 0.00 58.87 59.38 3f8s n SER 744 Cb 0.18 -1.23 0.04 0.00 -0.26 0.00 0.00 64.21 62.94 3f8s n SER 744 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3f8s h SER 745 N 0.62 0.18 -0.12 4.04 4.64 -1.99 -1.26 113.55 119.66 3f8s h SER 745 Ca -0.45 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 60.71 3f8s h SER 745 Cb 1.38 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 3f8s h SER 745 CO 0.50 0.89 0.00 0.71 -0.87 0.00 0.00 176.83 178.06 3f8s h THR 746 N 0.09 1.14 0.00 2.95 1.35 -1.98 -2.10 112.91 114.35 3f8s h THR 746 Ca -0.02 -0.52 -0.12 0.00 -0.55 0.00 0.00 66.41 65.20 3f8s h THR 746 Cb 1.37 0.98 -0.02 0.00 -1.73 0.00 0.00 68.15 68.74 3f8s h THR 746 CO 0.11 0.18 -1.20 0.00 -0.25 0.00 0.00 175.52 174.36 3f8s h ALA 747 N 1.70 0.62 0.30 6.62 0.00 -1.82 -2.47 119.26 124.21 3f8s h ALA 747 Ca 0.07 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 3f8s h ALA 747 Cb 0.21 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3f8s h ALA 747 CO 0.00 0.63 -0.15 1.25 0.00 0.00 0.00 179.25 180.99 3f8s h HIS 748 N 0.00 -0.38 -0.45 0.00 2.76 -1.16 -2.21 115.15 113.71 3f8s h HIS 748 Ca -0.10 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.07 3f8s h HIS 748 Cb 1.40 0.12 -0.02 0.00 1.55 0.00 0.00 27.41 30.47 3f8s h HIS 748 CO 0.00 -0.05 0.30 1.96 -1.30 0.00 0.00 177.93 178.84 3f8s h GLN 749 N -0.75 0.57 0.46 5.26 4.20 -1.47 -2.98 115.11 120.39 3f8s h GLN 749 Ca -0.04 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 3f8s h GLN 749 Cb 0.50 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.16 3f8s h GLN 749 CO 0.07 0.37 -0.22 1.25 -0.67 0.00 0.00 178.83 179.63 3f8s h HIS 750 N 0.58 -0.57 -0.92 2.96 2.76 -1.38 -2.79 115.15 115.80 3f8s h HIS 750 Ca 0.17 -0.01 0.18 0.00 -2.20 0.00 0.00 60.37 58.50 3f8s h HIS 750 Cb -0.04 0.19 -0.08 0.00 1.55 0.00 0.00 27.41 29.03 3f8s h HIS 750 CO -0.00 -0.35 0.59 0.97 -1.30 0.00 0.00 177.93 177.84 3f8s h ILE 751 N -1.00 0.74 0.00 6.26 2.10 -1.39 0.13 117.51 124.34 3f8s h ILE 751 Ca -0.06 -0.20 -0.01 0.00 1.08 0.00 0.00 64.86 65.66 3f8s h ILE 751 Cb 0.47 0.11 -0.00 0.00 -1.09 0.00 0.00 36.82 36.31 3f8s h ILE 751 CO 0.10 0.11 -0.07 1.88 -1.08 0.00 0.00 178.15 179.09 3f8s h TYR 752 N 0.58 0.00 0.12 2.19 0.05 -1.52 0.93 116.97 119.32 3f8s h TYR 752 Ca 0.48 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 59.04 3f8s h TYR 752 Cb 0.95 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.72 3f8s h TYR 752 CO -0.00 0.07 -0.96 1.15 -1.05 0.00 0.00 178.16 177.37 3f8s h THR 753 N 0.00 1.41 0.27 -2.88 2.02 -0.51 -2.31 112.91 110.91 3f8s h THR 753 Ca -0.00 -2.44 -0.01 0.00 0.77 0.00 0.00 66.41 64.73 3f8s h THR 753 Cb 0.87 2.93 0.00 0.00 -1.74 0.00 0.00 68.15 70.21 3f8s h THR 753 CO 0.01 0.71 -0.13 -0.74 0.37 0.00 0.00 175.52 175.74 3f8s h HIS 754 N -0.09 -0.33 -0.40 3.16 -0.00 -0.87 -0.42 115.15 116.20 3f8s h HIS 754 Ca -0.15 -0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.25 3f8s h HIS 754 Cb 1.70 0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 29.20 3f8s h HIS 754 CO 0.16 -0.13 0.27 0.52 -0.00 0.00 0.00 177.93 178.74 3f8s h MET 755 N -0.46 0.37 -0.28 5.26 2.07 -0.94 -1.62 114.93 119.33 3f8s h MET 755 Ca -0.04 -0.02 -0.18 0.00 -2.07 0.00 0.00 59.70 57.39 3f8s h MET 755 Cb 0.35 -0.08 0.00 0.00 -1.87 0.00 0.00 31.60 30.00 3f8s h MET 755 CO 0.06 0.25 -0.54 0.77 1.07 0.00 0.00 176.91 178.51 3f8s h SER 756 N 0.38 0.97 -0.86 1.22 0.02 -0.80 -1.39 113.55 113.09 3f8s h SER 756 Ca 0.17 -0.54 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 3f8s h SER 756 Cb 0.18 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 3f8s h SER 756 CO -0.04 1.32 0.45 0.45 -1.14 0.00 0.00 176.83 177.87 3f8s h HIS 757 N 0.65 1.21 0.01 3.45 3.86 -0.34 -1.22 115.15 122.77 3f8s h HIS 757 Ca 0.01 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 3f8s h HIS 757 Cb 1.15 -0.38 0.00 0.00 1.06 0.00 0.00 27.41 29.24 3f8s h HIS 757 CO 0.08 0.86 -0.01 0.35 0.86 0.00 0.00 177.93 180.06 3f8s h PHE 758 N 1.22 -0.02 -0.35 2.45 3.57 -1.09 -2.03 116.94 120.70 3f8s h PHE 758 Ca 0.30 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.69 3f8s h PHE 758 Cb 0.07 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3f8s h PHE 758 CO 0.01 0.28 -0.20 0.97 -2.23 0.00 0.00 178.31 177.14 3f8s h ILE 759 N -0.32 1.29 -0.64 1.41 6.09 -1.25 -1.09 117.51 122.99 3f8s h ILE 759 Ca -0.00 -1.34 0.03 0.00 -1.37 0.00 0.00 64.86 62.18 3f8s h ILE 759 Cb 0.31 1.40 -0.04 0.00 0.47 0.00 0.00 36.82 38.96 3f8s h ILE 759 CO 0.00 0.44 0.43 0.11 -3.07 0.00 0.00 178.15 176.06 3f8s h LYS 760 N 0.53 0.75 0.00 2.19 1.57 -1.12 -1.26 116.57 119.24 3f8s h LYS 760 Ca 0.07 -0.05 -0.17 0.00 -1.87 0.00 0.00 60.65 58.64 3f8s h LYS 760 Cb 0.75 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 3f8s h LYS 760 CO 0.06 0.50 -1.46 0.00 -0.57 0.00 0.00 179.45 177.97 3f8s n GLN 761 N -4.46 0.62 0.20 3.15 -0.00 -0.77 0.16 117.38 116.29 3f8s n GLN 761 Ca 0.08 0.20 0.04 0.00 -0.00 0.00 0.00 57.00 57.31 3f8s n GLN 761 Cb 0.12 -1.79 0.42 0.00 -0.00 0.00 0.00 30.24 28.99 3f8s n GLN 761 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3f8s n PHE 763 N -4.15 0.00 -1.40 0.00 3.72 -0.53 -4.96 117.46 110.13 3f8s n PHE 763 Ca -0.02 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.27 3f8s n PHE 763 Cb 0.35 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.83 3f8s n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3f8s n SER 764 N 0.57 -4.27 -4.76 4.37 7.64 -0.79 -5.00 113.62 111.38 3f8s n SER 764 Ca 0.15 0.25 -0.39 0.00 1.01 0.00 0.00 58.87 59.88 3f8s n SER 764 Cb 0.48 -2.81 -0.04 0.00 -1.01 0.00 0.00 64.21 60.82 3f8s n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3f8s s LEU 765 N -2.58 4.45 0.00 -3.43 1.43 0.43 -4.97 118.68 114.01 3f8s s LEU 765 Ca 0.00 2.15 0.31 0.00 -1.03 0.00 0.00 54.13 55.56 3f8s s LEU 765 Cb 0.00 -3.79 1.68 0.00 0.03 0.00 0.00 46.19 44.12 3f8s s LEU 765 CO 0.00 -0.20 2.10 -0.81 0.23 0.00 0.00 176.35 177.68