#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jyh s PRO 29 N 0.00 0.83 -1.10 -0.67 0.04 -1.26 -5.10 135.00 127.74 3jyh s PRO 29 Ca 0.00 1.42 -0.04 0.00 0.04 0.00 0.00 61.00 62.41 3jyh s PRO 29 Cb 0.00 -1.72 0.30 0.00 0.04 0.00 0.00 34.50 33.12 3jyh s PRO 29 CO 0.00 -2.72 1.54 0.41 0.04 0.00 0.00 177.00 176.27 3jyh n GLY 30 N 0.17 5.18 3.68 0.56 0.00 -1.26 -5.00 105.19 108.53 3jyh n GLY 30 Ca 0.10 -2.61 -0.43 0.00 0.00 0.00 0.00 46.02 43.08 3jyh n GLY 30 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3jyh n PHE 31 N 1.49 2.57 -3.94 1.61 3.72 -1.26 -4.67 117.46 116.97 3jyh n PHE 31 Ca 0.28 -0.17 -0.35 0.00 -0.05 0.00 0.00 57.45 57.16 3jyh n PHE 31 Cb 0.33 -2.74 -0.11 0.00 -0.94 0.00 0.00 39.48 36.02 3jyh n PHE 31 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3jyh s GLN 32 N 3.12 3.79 -0.27 -1.08 -0.21 0.03 -4.89 119.66 120.16 3jyh s GLN 32 Ca 0.84 -0.43 -0.29 0.00 0.02 0.00 0.00 55.36 55.50 3jyh s GLN 32 Cb -0.50 -3.24 -0.01 0.00 1.00 0.00 0.00 33.01 30.27 3jyh s GLN 32 CO 0.39 0.05 1.48 -2.00 -2.12 0.00 0.00 175.29 173.10 3jyh s GLU 33 N 0.96 3.82 0.45 2.91 2.12 -1.26 -1.86 118.70 125.84 3jyh s GLU 33 Ca 0.03 1.45 0.04 0.00 0.36 0.00 0.00 54.97 56.85 3jyh s GLU 33 Cb -0.14 -3.97 -0.05 0.00 0.26 0.00 0.00 34.13 30.23 3jyh s GLU 33 CO 0.03 -1.25 0.02 1.03 -0.54 0.00 0.00 175.26 174.54 3jyh s ARG 34 N 4.51 2.04 -0.00 4.30 1.81 0.33 -5.00 118.95 126.93 3jyh s ARG 34 Ca 0.65 -2.23 0.01 0.00 -1.72 0.00 0.00 55.73 52.44 3jyh s ARG 34 Cb -0.21 -1.46 -0.00 0.00 -0.45 0.00 0.00 34.95 32.83 3jyh s ARG 34 CO 0.27 -0.23 -0.03 -0.06 -0.68 0.00 0.00 175.30 174.57 3jyh s PHE 35 N -2.86 0.27 -0.10 -0.53 0.08 -1.26 -1.37 117.98 112.21 3jyh s PHE 35 Ca 0.21 -0.05 0.03 0.00 0.12 0.00 0.00 56.93 57.24 3jyh s PHE 35 Cb 0.06 -0.17 -0.01 0.00 -0.57 0.00 0.00 43.02 42.32 3jyh s PHE 35 CO 0.11 -0.00 -0.18 0.12 -0.10 0.00 0.00 175.22 175.17 3jyh s PHE 36 N -0.07 2.67 -0.74 0.36 5.36 -0.33 -4.91 117.98 120.32 3jyh s PHE 36 Ca 0.01 -0.67 -0.26 0.00 -0.96 0.00 0.00 56.93 55.05 3jyh s PHE 36 Cb -0.01 -1.74 0.01 0.00 -0.34 0.00 0.00 43.02 40.95 3jyh s PHE 36 CO -0.00 -0.19 1.51 -0.65 -1.46 0.00 0.00 175.22 174.43 3jyh s GLN 37 N 0.08 3.03 -0.07 10.12 -1.52 -1.26 -0.46 119.66 129.58 3jyh s GLN 37 Ca -0.08 -0.09 -0.12 0.00 -1.95 0.00 0.00 55.36 53.12 3jyh s GLN 37 Cb -0.15 -4.43 -0.05 0.00 -0.22 0.00 0.00 33.01 28.16 3jyh s GLN 37 CO 0.05 -2.41 0.30 -1.14 -0.25 0.00 0.00 175.29 171.84 3jyh s GLN 38 N 6.12 3.82 0.25 2.91 2.00 0.17 -4.80 119.66 130.13 3jyh s GLN 38 Ca 0.48 0.17 -0.31 0.00 -2.00 0.00 0.00 55.36 53.70 3jyh s GLN 38 Cb -0.08 -3.25 -0.13 0.00 0.80 0.00 0.00 33.01 30.34 3jyh s GLN 38 CO 0.13 0.63 1.43 0.54 -0.50 0.00 0.00 175.29 177.52 3jyh n ARG 39 N 2.22 2.14 -0.05 1.67 1.74 -1.26 -0.28 116.66 122.83 3jyh n ARG 39 Ca -0.16 0.76 -0.10 0.00 -0.77 0.00 0.00 57.85 57.58 3jyh n ARG 39 Cb 0.53 -2.43 -0.04 0.00 -1.02 0.00 0.00 32.46 29.50 3jyh n ARG 39 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3jyh h LEU 40 N 4.26 0.24 -7.18 0.55 4.07 -1.74 -3.43 115.31 112.09 3jyh h LEU 40 Ca -0.45 -0.09 -0.55 0.00 0.08 0.00 0.00 57.88 56.87 3jyh h LEU 40 Cb 1.27 -0.06 -0.40 0.00 1.08 0.00 0.00 40.66 42.55 3jyh h LEU 40 CO 0.76 0.26 -0.76 -0.62 -1.08 0.00 0.00 178.44 177.00 3jyh s ASP 41 N -5.48 3.43 0.09 -0.43 -1.08 -1.26 -4.98 116.67 106.95 3jyh s ASP 41 Ca -0.13 -1.19 0.26 0.00 -0.52 0.00 0.00 52.55 50.96 3jyh s ASP 41 Cb 0.08 -0.68 1.00 0.00 -1.46 0.00 0.00 42.92 41.86 3jyh s ASP 41 CO 0.70 -0.36 1.81 1.41 0.52 0.00 0.00 175.17 179.24 3jyh n HIS 42 N 4.99 0.37 0.04 -5.34 8.25 -1.26 -4.23 115.22 118.04 3jyh n HIS 42 Ca -0.06 0.11 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 3jyh n HIS 42 Cb 0.44 -0.69 0.00 0.00 1.12 0.00 0.00 29.99 30.87 3jyh n HIS 42 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3jyh n PHE 43 N -1.81 0.00 -3.66 4.41 3.72 -1.26 -4.91 117.46 113.95 3jyh n PHE 43 Ca 0.06 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.26 3jyh n PHE 43 Cb 0.34 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 38.71 3jyh n PHE 43 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3jyh s ASN 44 N -0.35 1.16 0.00 4.37 3.84 -1.26 -5.05 114.94 117.65 3jyh s ASN 44 Ca 0.01 0.07 0.28 0.00 0.21 0.00 0.00 52.86 53.43 3jyh s ASN 44 Cb 0.01 -0.01 1.37 0.00 -0.55 0.00 0.00 41.25 42.07 3jyh s ASN 44 CO 0.02 -0.26 1.95 0.49 -2.79 0.00 0.00 177.10 176.50 3jyh n PHE 45 N 5.31 0.00 -0.04 0.43 3.72 -1.26 -4.46 117.46 121.15 3jyh n PHE 45 Ca -0.04 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.28 3jyh n PHE 45 Cb 0.50 -0.32 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 3jyh n PHE 45 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3jyh n GLU 46 N -1.32 0.16 0.10 -1.08 1.02 -1.26 -4.26 120.64 114.00 3jyh n GLU 46 Ca 0.12 0.07 0.10 0.00 -0.02 0.00 0.00 57.16 57.43 3jyh n GLU 46 Cb 0.24 -0.79 0.59 0.00 -0.02 0.00 0.00 31.44 31.45 3jyh n GLU 46 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3jyh h ARG 47 N -0.25 0.17 -0.42 3.49 2.43 -2.00 -1.56 114.38 116.23 3jyh h ARG 47 Ca -0.19 -0.01 -0.31 0.00 -0.81 0.00 0.00 59.98 58.66 3jyh h ARG 47 Cb 1.17 -0.04 -0.34 0.00 -0.42 0.00 0.00 29.97 30.34 3jyh h ARG 47 CO -0.11 0.11 -0.89 1.19 -1.51 0.00 0.00 179.97 178.76 3jyh n PHE 48 N -4.48 1.45 0.00 2.20 3.72 -1.26 -5.07 117.46 114.02 3jyh n PHE 48 Ca 0.03 -1.84 0.00 0.00 -0.05 0.00 0.00 57.45 55.59 3jyh n PHE 48 Cb 0.24 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 3jyh n PHE 48 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3jyh n GLY 49 N -0.58 0.06 0.42 1.37 0.00 -0.59 -1.52 105.19 104.34 3jyh n GLY 49 Ca 0.23 0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.34 3jyh n GLY 49 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3jyh n ASN 50 N 0.17 1.90 -4.69 1.61 6.94 -1.26 -4.69 115.26 115.24 3jyh n ASN 50 Ca 0.00 -1.45 -0.34 0.00 -0.02 0.00 0.00 54.58 52.76 3jyh n ASN 50 Cb 0.00 -0.01 0.11 0.00 -2.36 0.00 0.00 39.78 37.52 3jyh n ASN 50 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3jyh n LYS 51 N 0.57 0.41 -4.38 -3.83 5.02 -0.58 -4.91 118.16 110.47 3jyh n LYS 51 Ca 0.06 0.21 -0.19 0.00 -2.02 0.00 0.00 58.31 56.37 3jyh n LYS 51 Cb 0.26 -2.42 -0.10 0.00 -0.02 0.00 0.00 35.03 32.75 3jyh n LYS 51 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3jyh s THR 52 N -1.93 0.92 0.05 -0.18 -4.23 -1.26 -2.14 115.64 106.86 3jyh s THR 52 Ca 0.75 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 59.25 3jyh s THR 52 Cb -0.32 -2.67 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 3jyh s THR 52 CO 0.49 -0.05 -0.04 0.72 -0.54 0.00 0.00 174.62 175.20 3jyh s PHE 53 N -3.50 0.52 -0.30 3.99 -0.12 0.61 -4.78 117.98 114.40 3jyh s PHE 53 Ca 0.36 -0.91 -0.29 0.00 -0.05 0.00 0.00 56.93 56.04 3jyh s PHE 53 Cb 0.08 -0.36 0.01 0.00 -0.63 0.00 0.00 43.02 42.12 3jyh s PHE 53 CO 0.14 -0.30 1.09 -2.14 -0.05 0.00 0.00 175.22 173.96 3jyh s PRO 54 N -3.30 4.09 -0.33 1.99 0.02 -1.26 0.45 135.00 136.66 3jyh s PRO 54 Ca 0.02 1.15 -0.14 0.00 0.02 0.00 0.00 61.00 62.05 3jyh s PRO 54 Cb 0.03 -3.73 -0.02 0.00 0.02 0.00 0.00 34.50 30.80 3jyh s PRO 54 CO -0.07 -0.87 0.29 -1.14 -0.33 0.00 0.00 177.00 174.88 3jyh s GLN 55 N 3.62 3.58 0.27 5.54 0.74 0.40 -4.23 119.66 129.57 3jyh s GLN 55 Ca 0.46 -0.50 -0.30 0.00 0.05 0.00 0.00 55.36 55.08 3jyh s GLN 55 Cb -0.13 -3.79 -0.10 0.00 1.10 0.00 0.00 33.01 30.09 3jyh s GLN 55 CO 0.14 -0.44 1.42 0.50 -0.55 0.00 0.00 175.29 176.36 3jyh s ARG 56 N 1.85 4.28 0.05 1.67 3.52 -1.26 -1.19 118.95 127.87 3jyh s ARG 56 Ca 0.09 2.29 -0.01 0.00 -0.13 0.00 0.00 55.73 57.97 3jyh s ARG 56 Cb -0.17 -3.10 -0.04 0.00 -1.56 0.00 0.00 34.95 30.08 3jyh s ARG 56 CO 0.11 -0.38 -0.03 -0.59 -0.81 0.00 0.00 175.30 173.60 3jyh s PHE 57 N -0.23 0.50 -0.09 5.12 -0.12 -0.47 -1.51 117.98 121.17 3jyh s PHE 57 Ca 0.57 -1.02 0.02 0.00 -0.05 0.00 0.00 56.93 56.44 3jyh s PHE 57 Cb -0.42 -0.37 -0.02 0.00 -0.63 0.00 0.00 43.02 41.58 3jyh s PHE 57 CO 0.46 -0.37 -0.13 -0.51 -0.05 0.00 0.00 175.22 174.61 3jyh s LEU 58 N -2.81 2.74 0.05 -1.99 1.43 0.36 -0.51 118.68 117.94 3jyh s LEU 58 Ca 0.05 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 52.94 3jyh s LEU 58 Cb 0.07 -1.59 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 3jyh s LEU 58 CO -0.09 0.25 -0.13 0.54 0.23 0.00 0.00 176.35 177.15 3jyh s VAL 59 N -0.19 1.01 -0.24 -1.59 0.11 -0.78 -0.79 120.40 117.94 3jyh s VAL 59 Ca 0.00 -1.05 -0.03 0.00 -2.93 0.00 0.00 61.98 57.98 3jyh s VAL 59 Cb -0.13 -0.94 0.13 0.00 -1.53 0.00 0.00 36.38 33.90 3jyh s VAL 59 CO 0.03 -0.09 0.37 -0.55 -3.33 0.00 0.00 175.10 171.53 3jyh s SER 60 N -1.29 0.29 0.00 3.54 0.15 -0.75 -0.79 113.70 114.85 3jyh s SER 60 Ca -0.01 0.23 0.23 0.00 0.70 0.00 0.00 55.95 57.10 3jyh s SER 60 Cb -0.08 1.08 0.60 0.00 -1.71 0.00 0.00 66.02 65.90 3jyh s SER 60 CO 0.01 -0.30 1.48 -0.90 1.20 0.00 0.00 173.24 174.73 3jyh n ASP 61 N 5.36 2.44 -0.25 5.45 5.68 -1.26 -1.95 116.55 132.02 3jyh n ASP 61 Ca -0.04 -1.83 0.25 0.00 -0.50 0.00 0.00 54.79 52.68 3jyh n ASP 61 Cb 0.50 -0.14 0.46 0.00 -1.14 0.00 0.00 41.12 40.81 3jyh n ASP 61 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3jyh n ARG 62 N 0.84 -0.05 -0.04 0.11 1.74 -1.26 -0.00 116.66 118.01 3jyh n ARG 62 Ca 0.17 1.08 0.05 0.00 -0.77 0.00 0.00 57.85 58.38 3jyh n ARG 62 Cb 0.46 -1.94 0.06 0.00 -1.02 0.00 0.00 32.46 30.03 3jyh n ARG 62 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3jyh n PHE 63 N -4.76 0.09 -2.89 -1.55 3.72 -1.26 -5.02 117.46 105.80 3jyh n PHE 63 Ca 0.30 -0.11 -0.42 0.00 -0.05 0.00 0.00 57.45 57.17 3jyh n PHE 63 Cb 1.01 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 39.50 3jyh n PHE 63 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 3jyh s TRP 64 N -0.89 3.23 -0.83 1.38 -0.00 1.00 -3.93 118.94 118.89 3jyh s TRP 64 Ca 0.14 0.96 -0.25 0.00 -0.00 0.00 0.00 56.10 56.95 3jyh s TRP 64 Cb 0.09 -3.23 -0.02 0.00 -0.00 0.00 0.00 33.47 30.32 3jyh s TRP 64 CO 0.13 -0.54 1.77 0.08 -0.00 0.00 0.00 176.95 178.39 3jyh s VAL 65 N 3.01 3.53 -0.76 5.86 1.01 -1.00 -4.86 120.40 127.20 3jyh s VAL 65 Ca 0.35 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.11 3jyh s VAL 65 Cb -0.14 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.97 3jyh s VAL 65 CO 0.11 -1.20 0.26 -2.11 0.00 0.00 0.00 175.10 172.16 3jyh n ARG 66 N 9.00 0.00 0.00 2.72 0.00 -1.26 -0.03 116.66 127.09 3jyh n ARG 66 Ca 0.30 0.02 0.00 0.00 -0.00 0.00 0.00 57.85 58.17 3jyh n ARG 66 Cb 0.49 -1.53 0.00 0.00 -0.00 0.00 0.00 32.46 31.42 3jyh n ARG 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3jyh n GLY 67 N -0.76 0.68 0.00 2.89 0.00 -1.26 -4.88 105.19 101.85 3jyh n GLY 67 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3jyh n GLY 67 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3jyh n GLU 68 N -0.04 3.89 -3.12 1.61 -0.00 0.95 -5.00 120.64 118.93 3jyh n GLU 68 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.16 56.81 3jyh n GLU 68 Cb 0.16 -0.51 -0.06 0.00 -0.00 0.00 0.00 31.44 31.03 3jyh n GLU 68 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 3jyh s GLY 69 N -0.43 2.56 1.06 -1.84 0.00 -0.65 -4.99 107.32 103.02 3jyh s GLY 69 Ca 0.00 0.12 -0.16 0.00 0.00 0.00 0.00 44.72 44.69 3jyh s GLY 69 CO 0.00 0.45 1.15 2.56 0.00 0.00 0.00 173.10 177.26 3jyh s PRO 70 N -2.13 -0.05 -0.17 2.90 0.04 -1.26 -4.75 135.00 129.59 3jyh s PRO 70 Ca 0.44 0.06 -0.05 0.00 0.04 0.00 0.00 61.00 61.48 3jyh s PRO 70 Cb -0.16 -1.72 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 3jyh s PRO 70 CO 0.20 -2.96 0.01 0.42 0.04 0.00 0.00 177.00 174.72 3jyh s ILE 71 N -3.22 4.32 -0.34 0.56 1.01 -0.05 -0.86 121.20 122.63 3jyh s ILE 71 Ca 0.69 -0.20 -0.08 0.00 0.00 0.00 0.00 60.65 61.06 3jyh s ILE 71 Cb -0.11 -2.92 0.03 0.00 0.01 0.00 0.00 42.46 39.47 3jyh s ILE 71 CO 0.55 0.48 0.12 -0.36 0.00 0.00 0.00 174.94 175.74 3jyh s PHE 72 N 0.33 3.22 -0.29 3.97 0.40 0.25 -1.28 117.98 124.58 3jyh s PHE 72 Ca -0.00 -1.19 0.01 0.00 -0.60 0.00 0.00 56.93 55.14 3jyh s PHE 72 Cb -0.13 -2.31 0.06 0.00 0.51 0.00 0.00 43.02 41.15 3jyh s PHE 72 CO 0.02 -0.67 -0.03 0.12 0.70 0.00 0.00 175.22 175.36 3jyh s PHE 73 N 1.47 3.33 -0.32 0.36 5.36 -0.62 0.07 117.98 127.63 3jyh s PHE 73 Ca 0.00 -2.18 -0.27 0.00 -0.96 0.00 0.00 56.93 53.52 3jyh s PHE 73 Cb -0.19 -2.17 0.01 0.00 -0.34 0.00 0.00 43.02 40.33 3jyh s PHE 73 CO 0.04 -0.86 0.96 -0.47 -1.46 0.00 0.00 175.22 173.43 3jyh s TYR 74 N 1.16 3.17 -0.96 10.12 5.04 0.98 -0.81 117.35 136.05 3jyh s TYR 74 Ca -0.05 1.04 -0.24 0.00 -2.44 0.00 0.00 57.07 55.38 3jyh s TYR 74 Cb -0.20 -3.51 0.03 0.00 0.35 0.00 0.00 41.96 38.63 3jyh s TYR 74 CO -0.03 -0.70 1.52 0.95 -1.34 0.00 0.00 175.55 175.95 3jyh s THR 75 N 3.39 3.81 0.52 4.34 -4.23 -0.56 -1.41 115.64 121.50 3jyh s THR 75 Ca 0.40 -0.54 -0.22 0.00 -1.18 0.00 0.00 61.69 60.15 3jyh s THR 75 Cb -0.13 -4.85 -0.06 0.00 1.34 0.00 0.00 72.50 68.80 3jyh s THR 75 CO 0.14 -1.75 1.25 0.61 -0.54 0.00 0.00 174.62 174.34 3jyh n GLY 76 N 6.68 0.48 0.00 3.99 0.00 -0.46 -4.51 105.19 111.36 3jyh n GLY 76 Ca 0.30 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3jyh n GLY 76 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3jyh n ASN 77 N -0.59 0.00 -2.01 1.61 6.94 -1.26 -4.08 115.26 115.87 3jyh n ASN 77 Ca 0.10 0.00 -0.05 0.00 -0.02 0.00 0.00 54.58 54.60 3jyh n ASN 77 Cb 0.44 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.78 3jyh n ASN 77 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 3jyh n GLU 78 N 0.00 1.13 -1.88 -3.83 0.00 -1.26 -4.53 120.64 110.26 3jyh n GLU 78 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 57.16 56.70 3jyh n GLU 78 Cb 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 31.44 29.82 3jyh n GLU 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3jyh n GLY 79 N 2.35 0.75 3.68 -1.84 0.00 -1.26 -4.84 105.19 104.03 3jyh n GLY 79 Ca 0.20 -0.86 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 3jyh n GLY 79 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3jyh n ASP 80 N -0.29 4.04 0.32 1.61 -0.08 -1.26 -4.43 116.55 116.46 3jyh n ASP 80 Ca 0.00 0.96 0.20 0.00 -1.51 0.00 0.00 54.79 54.45 3jyh n ASP 80 Cb 0.03 -1.53 1.08 0.00 2.34 0.00 0.00 41.12 43.05 3jyh n ASP 80 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 3jyh h VAL 81 N 4.98 0.13 0.00 5.18 3.04 -1.92 -0.51 116.25 127.15 3jyh h VAL 81 Ca -0.48 -0.09 -0.09 0.00 -1.01 0.00 0.00 66.70 65.04 3jyh h VAL 81 Cb 1.23 1.08 -0.01 0.00 -2.01 0.00 0.00 31.29 31.58 3jyh h VAL 81 CO 0.94 0.01 -0.42 -0.50 -1.01 0.00 0.00 177.57 176.59 3jyh h TRP 82 N 0.00 0.00 -0.79 3.17 4.06 -1.97 -1.78 115.95 118.64 3jyh h TRP 82 Ca -0.00 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.91 3jyh h TRP 82 Cb 0.08 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.20 3jyh h TRP 82 CO 0.00 0.42 0.35 0.00 -3.56 0.00 0.00 178.44 175.65 3jyh h ALA 83 N 1.58 1.13 0.05 1.49 0.00 -1.46 -0.24 119.26 121.81 3jyh h ALA 83 Ca -0.00 -0.17 -0.23 0.00 0.00 0.00 0.00 54.91 54.50 3jyh h ALA 83 Cb 0.76 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3jyh h ALA 83 CO 0.05 0.64 -1.03 0.74 0.00 0.00 0.00 179.25 179.66 3jyh h PHE 84 N 1.13 0.45 -0.44 0.00 0.04 -1.58 -2.44 116.94 114.10 3jyh h PHE 84 Ca 0.27 -0.28 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 3jyh h PHE 84 Cb 0.15 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 3jyh h PHE 84 CO 0.02 1.14 0.15 0.00 -0.60 0.00 0.00 178.31 179.01 3jyh h ALA 85 N 0.76 0.58 -0.36 2.45 0.00 -1.22 -2.12 119.26 119.35 3jyh h ALA 85 Ca -0.08 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 3jyh h ALA 85 Cb 1.70 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 3jyh h ALA 85 CO 0.17 0.22 -0.06 -0.91 0.00 0.00 0.00 179.25 178.66 3jyh h ASN 86 N 0.58 0.57 -0.01 0.00 2.35 -1.04 -3.30 115.58 114.74 3jyh h ASN 86 Ca 0.14 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3jyh h ASN 86 Cb 0.25 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.47 3jyh h ASN 86 CO -0.01 0.69 -0.59 0.59 -1.65 0.00 0.00 177.43 176.45 3jyh n ASN 87 N -4.22 1.56 -2.84 5.81 3.02 -0.92 -4.51 115.26 113.16 3jyh n ASN 87 Ca 0.01 -1.28 -0.32 0.00 -0.03 0.00 0.00 54.58 52.96 3jyh n ASN 87 Cb 0.30 0.66 0.01 0.00 -0.61 0.00 0.00 39.78 40.13 3jyh n ASN 87 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3jyh n SER 88 N -0.53 5.77 0.25 6.41 7.64 -0.80 -3.92 113.62 128.44 3jyh n SER 88 Ca 0.07 -3.74 0.18 0.00 1.01 0.00 0.00 58.87 56.39 3jyh n SER 88 Cb 0.38 -0.74 0.90 0.00 -1.01 0.00 0.00 64.21 63.74 3jyh n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3jyh h ALA 89 N 2.99 1.58 0.00 -0.43 0.00 -1.66 -2.59 119.26 119.14 3jyh h ALA 89 Ca 0.37 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 3jyh h ALA 89 Cb 0.52 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3jyh h ALA 89 CO 1.04 -0.26 -0.21 0.35 0.00 0.00 0.00 179.25 180.18 3jyh h PHE 90 N 0.00 0.00 -0.04 0.00 3.57 -1.01 -1.47 116.94 117.99 3jyh h PHE 90 Ca 0.06 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 3jyh h PHE 90 Cb 0.45 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.19 3jyh h PHE 90 CO 0.00 0.21 -0.08 0.28 -2.23 0.00 0.00 178.31 176.48 3jyh h VAL 91 N 0.00 1.44 -0.62 1.41 2.07 -1.66 -1.02 116.25 117.87 3jyh h VAL 91 Ca -0.00 -1.42 0.09 0.00 0.82 0.00 0.00 66.70 66.19 3jyh h VAL 91 Cb 0.44 2.29 -0.07 0.00 -1.52 0.00 0.00 31.29 32.42 3jyh h VAL 91 CO 0.03 0.38 0.26 0.00 0.02 0.00 0.00 177.57 178.26 3jyh h ALA 92 N 0.45 0.82 -0.63 1.67 0.00 -1.67 0.14 119.26 120.04 3jyh h ALA 92 Ca 0.00 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3jyh h ALA 92 Cb 0.67 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 3jyh h ALA 92 CO 0.02 -0.15 0.13 0.93 0.00 0.00 0.00 179.25 180.18 3jyh h GLU 93 N 0.45 1.01 -0.02 0.00 5.08 -1.23 -1.11 114.58 118.77 3jyh h GLU 93 Ca 0.31 -0.24 -0.15 0.00 -1.00 0.00 0.00 59.36 58.28 3jyh h GLU 93 Cb 0.36 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3jyh h GLU 93 CO -0.29 0.91 -0.69 1.25 -1.00 0.00 0.00 179.01 179.19 3jyh h LEU 94 N 0.96 0.10 -0.76 1.33 5.85 -0.86 -2.84 115.31 119.08 3jyh h LEU 94 Ca 0.20 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 3jyh h LEU 94 Cb 0.37 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 3jyh h LEU 94 CO 0.00 0.75 0.20 0.00 -0.34 0.00 0.00 178.44 179.05 3jyh h ALA 95 N 1.25 0.99 -0.37 1.25 0.00 -0.19 -0.59 119.26 121.59 3jyh h ALA 95 Ca -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3jyh h ALA 95 Cb 1.22 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3jyh h ALA 95 CO 0.10 0.66 0.13 0.00 0.00 0.00 0.00 179.25 180.14 3jyh h ALA 96 N 1.13 0.49 -0.19 0.00 0.00 -1.19 -0.61 119.26 118.89 3jyh h ALA 96 Ca 0.23 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 3jyh h ALA 96 Cb 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3jyh h ALA 96 CO -0.00 0.12 -0.30 1.05 0.00 0.00 0.00 179.25 180.11 3jyh h GLU 97 N 0.46 0.37 -0.01 0.00 4.11 -1.32 -3.35 114.58 114.84 3jyh h GLU 97 Ca 0.12 -0.15 0.00 0.00 0.07 0.00 0.00 59.36 59.41 3jyh h GLU 97 Cb 0.23 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3jyh h GLU 97 CO -0.01 0.64 -0.65 0.54 0.07 0.00 0.00 179.01 179.60 3jyh n ARG 98 N -4.10 1.12 -0.84 1.06 5.12 -0.24 -4.96 116.66 113.80 3jyh n ARG 98 Ca -0.01 -0.46 0.00 0.00 -1.93 0.00 0.00 57.85 55.45 3jyh n ARG 98 Cb 0.42 -1.39 0.00 0.00 -1.16 0.00 0.00 32.46 30.33 3jyh n ARG 98 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3jyh n GLY 99 N 1.38 0.49 3.82 -0.13 0.00 -0.60 -4.64 105.19 105.50 3jyh n GLY 99 Ca 0.06 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.89 3jyh n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyh s ALA 100 N -2.00 3.38 0.39 4.61 0.00 -0.34 -2.37 121.76 125.42 3jyh s ALA 100 Ca 0.00 0.18 -0.20 0.00 0.00 0.00 0.00 51.96 51.94 3jyh s ALA 100 Cb 0.00 -2.85 -0.10 0.00 0.00 0.00 0.00 23.12 20.17 3jyh s ALA 100 CO 0.00 0.31 0.88 -1.17 0.00 0.00 0.00 175.76 175.79 3jyh s LEU 101 N -2.15 4.01 -0.36 0.00 2.96 -0.04 -3.88 118.68 119.23 3jyh s LEU 101 Ca 0.45 1.58 0.03 0.00 -0.22 0.00 0.00 54.13 55.98 3jyh s LEU 101 Cb -0.16 -4.35 0.10 0.00 0.50 0.00 0.00 46.19 42.29 3jyh s LEU 101 CO 0.21 -0.29 0.09 -0.22 -1.32 0.00 0.00 176.35 174.82 3jyh s LEU 102 N -3.01 4.14 -0.21 -0.68 2.96 -0.82 0.86 118.68 121.91 3jyh s LEU 102 Ca 0.58 -2.17 -0.04 0.00 -0.22 0.00 0.00 54.13 52.29 3jyh s LEU 102 Cb -0.10 -1.46 -0.01 0.00 0.50 0.00 0.00 46.19 45.12 3jyh s LEU 102 CO 0.15 -0.37 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.09 3jyh s VAL 103 N 0.89 3.46 -0.40 1.68 1.01 0.11 -1.81 120.40 125.35 3jyh s VAL 103 Ca 0.12 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.54 3jyh s VAL 103 Cb -0.20 -2.57 0.06 0.00 0.00 0.00 0.00 36.38 33.67 3jyh s VAL 103 CO -0.10 0.43 0.22 -0.36 0.00 0.00 0.00 175.10 175.28 3jyh s PHE 104 N 1.37 3.30 -0.20 5.22 0.08 0.03 -0.01 117.98 127.78 3jyh s PHE 104 Ca 0.04 -1.37 -0.14 0.00 0.12 0.00 0.00 56.93 55.59 3jyh s PHE 104 Cb -0.14 -2.72 -0.04 0.00 -0.57 0.00 0.00 43.02 39.55 3jyh s PHE 104 CO -0.02 -0.78 0.31 0.00 -0.10 0.00 0.00 175.22 174.63 3jyh s ALA 105 N 1.45 3.58 0.35 5.36 0.00 -0.50 -0.49 121.76 131.52 3jyh s ALA 105 Ca 0.02 -0.61 -0.26 0.00 0.00 0.00 0.00 51.96 51.11 3jyh s ALA 105 Cb -0.21 -2.49 -0.09 0.00 0.00 0.00 0.00 23.12 20.33 3jyh s ALA 105 CO 0.03 -0.17 1.06 -2.00 0.00 0.00 0.00 175.76 174.68 3jyh s GLU 106 N 1.03 4.35 -0.01 0.00 2.12 -0.57 -1.36 118.70 124.25 3jyh s GLU 106 Ca 0.15 1.60 -0.29 0.00 0.36 0.00 0.00 54.97 56.79 3jyh s GLU 106 Cb -0.14 -2.78 -0.03 0.00 0.26 0.00 0.00 34.13 31.44 3jyh s GLU 106 CO 0.06 0.00 0.94 -1.58 -0.54 0.00 0.00 175.26 174.14 3jyh s HIS 107 N -1.48 3.65 0.34 5.30 5.65 -1.26 -4.78 115.29 122.70 3jyh s HIS 107 Ca 0.53 1.63 -0.25 0.00 0.25 0.00 0.00 55.06 57.21 3jyh s HIS 107 Cb -0.25 -3.07 -0.14 0.00 -1.18 0.00 0.00 32.58 27.94 3jyh s HIS 107 CO 0.32 0.00 0.74 2.89 -0.65 0.00 0.00 174.74 178.04 3jyh n ARG 108 N 3.89 0.81 -0.60 2.88 1.85 -1.26 -0.95 116.66 123.29 3jyh n ARG 108 Ca 0.05 0.29 0.00 0.00 -1.00 0.00 0.00 57.85 57.19 3jyh n ARG 108 Cb 0.51 -1.58 0.00 0.00 -1.05 0.00 0.00 32.46 30.34 3jyh n ARG 108 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3jyh n TYR 109 N -0.30 0.00 -4.19 2.89 4.01 0.14 -5.00 117.16 114.71 3jyh n TYR 109 Ca 0.12 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.57 3jyh n TYR 109 Cb 0.34 -0.36 -0.09 0.00 -0.31 0.00 0.00 39.34 38.92 3jyh n TYR 109 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 3jyh s TYR 110 N -2.97 2.84 0.00 -0.72 2.02 -0.12 -4.80 117.35 113.60 3jyh s TYR 110 Ca 0.00 -0.12 0.00 0.00 -0.37 0.00 0.00 57.07 56.58 3jyh s TYR 110 Cb 0.00 -1.44 0.00 0.00 -0.40 0.00 0.00 41.96 40.12 3jyh s TYR 110 CO 0.00 0.47 0.00 0.41 -1.57 0.00 0.00 175.55 174.86 3jyh n GLY 111 N 0.39 1.32 0.46 0.71 0.00 -1.26 -1.41 105.19 105.40 3jyh n GLY 111 Ca -0.11 0.49 0.05 0.00 0.00 0.00 0.00 46.02 46.45 3jyh n GLY 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3jyh n LYS 112 N 0.00 1.04 -3.07 1.61 4.01 -1.26 -4.80 118.16 115.69 3jyh n LYS 112 Ca 0.00 -1.34 -0.44 0.00 -0.51 0.00 0.00 58.31 56.02 3jyh n LYS 112 Cb 0.00 -1.21 0.00 0.00 -0.51 0.00 0.00 35.03 33.31 3jyh n LYS 112 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 3jyh n SER 113 N 0.55 5.72 -4.18 4.39 7.64 -0.50 -4.71 113.62 122.52 3jyh n SER 113 Ca 0.07 -3.15 -0.34 0.00 1.01 0.00 0.00 58.87 56.45 3jyh n SER 113 Cb 0.30 -1.39 -0.14 0.00 -1.01 0.00 0.00 64.21 61.97 3jyh n SER 113 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3jyh s LEU 114 N -1.20 3.45 0.52 -3.43 1.43 -1.26 0.28 118.68 118.46 3jyh s LEU 114 Ca 0.34 -1.04 0.17 0.00 -1.03 0.00 0.00 54.13 52.57 3jyh s LEU 114 Cb -0.02 -1.68 1.27 0.00 0.03 0.00 0.00 46.19 45.79 3jyh s LEU 114 CO -0.00 -0.18 2.12 -0.65 0.23 0.00 0.00 176.35 177.87 3jyh h PRO 115 N 8.00 0.03 -0.01 1.29 0.11 -1.93 -2.92 132.00 136.56 3jyh h PRO 115 Ca -0.28 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.78 3jyh h PRO 115 Cb 1.09 -0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.09 3jyh h PRO 115 CO 0.55 0.02 -0.64 1.19 -0.21 0.00 0.00 178.00 178.92 3jyh n PHE 116 N -4.51 0.05 -4.88 0.65 3.72 -1.26 -4.86 117.46 106.37 3jyh n PHE 116 Ca -0.01 -1.28 0.00 0.00 -0.05 0.00 0.00 57.45 56.12 3jyh n PHE 116 Cb 0.17 -0.23 0.00 0.00 -0.94 0.00 0.00 39.48 38.48 3jyh n PHE 116 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3jyh n GLY 117 N -0.73 1.02 0.37 1.37 0.00 -1.11 -3.54 105.19 102.57 3jyh n GLY 117 Ca 0.16 -0.64 0.12 0.00 0.00 0.00 0.00 46.02 45.66 3jyh n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyh h ALA 118 N -0.88 1.89 0.00 4.61 0.00 -1.99 -1.65 119.26 121.23 3jyh h ALA 118 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3jyh h ALA 118 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3jyh h ALA 118 CO 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.15 3jyh n GLN 119 N -4.53 0.65 -0.31 0.00 10.64 -1.23 -4.00 117.38 118.60 3jyh n GLN 119 Ca 0.16 0.01 0.12 0.00 -1.83 0.00 0.00 57.00 55.45 3jyh n GLN 119 Cb 0.45 -1.50 0.29 0.00 -0.86 0.00 0.00 30.24 28.62 3jyh n GLN 119 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.06 176.00 3jyh h SER 120 N 0.00 0.44 -0.53 2.61 0.02 -1.40 -1.10 113.55 113.58 3jyh h SER 120 Ca 0.00 0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 60.97 3jyh h SER 120 Cb 0.14 0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.69 3jyh h SER 120 CO 0.00 0.08 0.15 0.35 -1.14 0.00 0.00 176.83 176.27 3jyh n THR 121 N -4.97 2.26 -4.06 -2.27 -2.24 -1.26 -3.83 114.28 97.92 3jyh n THR 121 Ca 0.21 -1.17 -0.29 0.00 -2.27 0.00 0.00 64.05 60.53 3jyh n THR 121 Cb 0.60 -0.41 -0.06 0.00 -2.10 0.00 0.00 70.33 68.35 3jyh n THR 121 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3jyh s GLN 122 N -2.38 2.90 0.11 -0.78 -1.52 -0.42 -4.80 119.66 112.77 3jyh s GLN 122 Ca 0.42 -0.75 -0.34 0.00 -1.95 0.00 0.00 55.36 52.74 3jyh s GLN 122 Cb 0.33 -2.70 -0.13 0.00 -0.22 0.00 0.00 33.01 30.28 3jyh s GLN 122 CO 0.11 0.54 1.68 -2.13 -0.25 0.00 0.00 175.29 175.23 3jyh n ARG 123 N 0.15 2.25 -0.07 2.91 0.63 -1.26 -1.86 116.66 119.39 3jyh n ARG 123 Ca -0.08 0.81 0.00 0.00 -0.92 0.00 0.00 57.85 57.66 3jyh n ARG 123 Cb 0.53 -2.62 0.00 0.00 0.45 0.00 0.00 32.46 30.82 3jyh n ARG 123 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3jyh n GLY 124 N 3.73 0.73 0.00 5.14 0.00 -1.26 -4.91 105.19 108.62 3jyh n GLY 124 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3jyh n GLY 124 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3jyh n HIS 125 N -2.03 0.00 0.97 1.61 8.25 -0.78 -4.81 115.22 118.42 3jyh n HIS 125 Ca 0.00 -0.05 0.13 0.00 -0.26 0.00 0.00 57.72 57.54 3jyh n HIS 125 Cb 0.00 -0.00 0.40 0.00 1.12 0.00 0.00 29.99 31.50 3jyh n HIS 125 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3jyh n THR 126 N -0.05 0.04 0.08 1.59 -2.24 -1.25 -4.51 114.28 107.94 3jyh n THR 126 Ca 0.00 -0.02 0.20 0.00 -2.27 0.00 0.00 64.05 61.96 3jyh n THR 126 Cb 0.14 -0.09 0.64 0.00 -2.10 0.00 0.00 70.33 68.92 3jyh n THR 126 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3jyh h GLU 127 N 0.00 0.00 -0.67 -0.78 4.11 -1.92 0.14 114.58 115.46 3jyh h GLU 127 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3jyh h GLU 127 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3jyh h GLU 127 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.36 3jyh n LEU 128 N -3.37 3.78 -4.42 3.06 4.77 -1.26 -4.83 117.00 114.72 3jyh n LEU 128 Ca 0.09 -1.86 -0.44 0.00 -0.03 0.00 0.00 56.01 53.77 3jyh n LEU 128 Cb 0.81 -0.45 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 3jyh n LEU 128 CO 0.22 0.93 0.62 -0.22 -1.33 0.00 0.00 177.39 177.61 3jyh s LEU 129 N -1.07 4.80 0.15 2.23 2.96 0.50 -4.83 118.68 123.42 3jyh s LEU 129 Ca 0.47 -1.18 -0.09 0.00 -0.22 0.00 0.00 54.13 53.11 3jyh s LEU 129 Cb 0.25 -2.37 -0.01 0.00 0.50 0.00 0.00 46.19 44.56 3jyh s LEU 129 CO 0.32 -1.31 0.26 0.42 -1.32 0.00 0.00 176.35 174.73 3jyh s THR 130 N 3.50 0.08 0.18 3.68 -4.23 -1.26 -4.85 115.64 112.74 3jyh s THR 130 Ca 0.18 -1.33 -0.13 0.00 -1.18 0.00 0.00 61.69 59.23 3jyh s THR 130 Cb -0.20 -1.71 0.08 0.00 1.34 0.00 0.00 72.50 72.00 3jyh s THR 130 CO 0.08 -0.38 1.83 0.58 -0.54 0.00 0.00 174.62 176.19 3jyh h VAL 131 N 2.59 1.09 -0.82 2.29 2.07 -1.99 -2.02 116.25 119.46 3jyh h VAL 131 Ca -0.32 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 3jyh h VAL 131 Cb 1.22 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 3jyh h VAL 131 CO 0.50 0.12 0.44 -0.33 0.02 0.00 0.00 177.57 178.32 3jyh h GLU 132 N 0.68 1.15 -0.22 1.57 3.07 -1.98 -0.49 114.58 118.36 3jyh h GLU 132 Ca 0.21 -0.14 -0.02 0.00 -0.50 0.00 0.00 59.36 58.91 3jyh h GLU 132 Cb -0.02 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 27.66 3jyh h GLU 132 CO -0.07 0.85 0.05 1.96 -1.40 0.00 0.00 179.01 180.40 3jyh h GLN 133 N 1.14 0.35 -0.71 2.33 1.08 -1.84 -1.71 115.11 115.76 3jyh h GLN 133 Ca 0.29 -0.09 0.06 0.00 -1.45 0.00 0.00 58.65 57.46 3jyh h GLN 133 Cb 0.05 -0.05 -0.06 0.00 -0.05 0.00 0.00 27.48 27.37 3jyh h GLN 133 CO -0.04 0.47 0.40 0.00 -0.95 0.00 0.00 178.83 178.71 3jyh h ALA 134 N 0.86 0.96 -0.38 3.87 0.00 -1.09 -0.26 119.26 123.22 3jyh h ALA 134 Ca 0.07 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3jyh h ALA 134 Cb 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3jyh h ALA 134 CO 0.00 0.08 -0.29 -0.07 0.00 0.00 0.00 179.25 178.97 3jyh h LEU 135 N 0.73 0.84 -1.01 0.00 3.38 -0.98 -2.01 115.31 116.26 3jyh h LEU 135 Ca 0.32 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 3jyh h LEU 135 Cb 0.21 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3jyh h LEU 135 CO -0.19 1.07 -0.18 0.00 0.09 0.00 0.00 178.44 179.23 3jyh h ALA 136 N 0.98 1.16 0.16 1.53 0.00 -1.08 -0.19 119.26 121.83 3jyh h ALA 136 Ca 0.08 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.70 3jyh h ALA 136 Cb 0.83 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 3jyh h ALA 136 CO 0.07 0.53 -0.37 -0.44 0.00 0.00 0.00 179.25 179.04 3jyh h ASP 137 N 0.46 -1.06 -0.71 0.00 3.32 -0.66 -1.34 116.42 116.43 3jyh h ASP 137 Ca 0.08 0.12 0.03 0.00 0.02 0.00 0.00 57.03 57.28 3jyh h ASP 137 Cb 0.58 0.39 -0.05 0.00 0.22 0.00 0.00 39.33 40.47 3jyh h ASP 137 CO 0.04 -0.46 0.44 -0.26 -1.72 0.00 0.00 179.24 177.28 3jyh h PHE 138 N -0.63 0.83 -0.84 4.55 0.04 -1.10 -0.26 116.94 119.53 3jyh h PHE 138 Ca 0.02 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.78 3jyh h PHE 138 Cb 0.64 -0.27 -0.04 0.00 2.20 0.00 0.00 35.95 38.48 3jyh h PHE 138 CO -0.30 0.47 0.40 0.00 -0.60 0.00 0.00 178.31 178.27 3jyh h ALA 139 N 1.31 1.08 -0.06 2.45 0.00 -0.87 -1.07 119.26 122.10 3jyh h ALA 139 Ca 0.29 -0.16 -0.23 0.00 0.00 0.00 0.00 54.91 54.80 3jyh h ALA 139 Cb 0.04 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.51 3jyh h ALA 139 CO -0.12 0.65 -0.90 0.93 0.00 0.00 0.00 179.25 179.81 3jyh h GLU 140 N 1.20 0.63 -0.29 0.00 5.08 -0.62 -2.47 114.58 118.11 3jyh h GLU 140 Ca 0.29 -0.60 0.06 0.00 -1.00 0.00 0.00 59.36 58.11 3jyh h GLU 140 Cb 0.12 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 3jyh h GLU 140 CO -0.04 1.21 -0.10 1.25 -1.00 0.00 0.00 179.01 180.34 3jyh h LEU 141 N 0.39 -0.36 -0.86 1.33 5.85 -1.01 -1.91 115.31 118.76 3jyh h LEU 141 Ca -0.08 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.79 3jyh h LEU 141 Cb 1.53 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 42.72 3jyh h LEU 141 CO 0.17 -0.13 0.54 -0.07 -0.34 0.00 0.00 178.44 178.61 3jyh h LEU 142 N -0.04 0.87 -0.41 2.25 3.38 -1.17 0.10 115.31 120.29 3jyh h LEU 142 Ca 0.15 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3jyh h LEU 142 Cb 0.26 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3jyh h LEU 142 CO -0.32 0.57 0.16 0.03 0.09 0.00 0.00 178.44 178.97 3jyh h ARG 143 N 1.01 0.61 -0.24 1.13 3.08 -1.23 -1.27 114.38 117.47 3jyh h ARG 143 Ca 0.36 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 60.23 3jyh h ARG 143 Cb 0.10 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3jyh h ARG 143 CO -0.15 0.57 -0.11 0.00 -1.07 0.00 0.00 179.97 179.22 3jyh h ALA 144 N 1.01 0.33 -0.42 0.04 0.00 -1.06 -1.86 119.26 117.30 3jyh h ALA 144 Ca 0.14 -0.30 0.08 0.00 0.00 0.00 0.00 54.91 54.83 3jyh h ALA 144 Cb 0.19 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 3jyh h ALA 144 CO -0.01 0.18 -0.11 -0.07 0.00 0.00 0.00 179.25 179.24 3jyh h LEU 145 N 0.21 -0.42 -0.07 0.00 3.38 -0.74 0.20 115.31 117.87 3jyh h LEU 145 Ca 0.05 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 3jyh h LEU 145 Cb 0.60 0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 3jyh h LEU 145 CO 0.03 -0.15 0.04 0.03 0.09 0.00 0.00 178.44 178.49 3jyh h ARG 146 N -0.01 0.10 0.25 1.13 3.08 -1.12 -2.54 114.38 115.27 3jyh h ARG 146 Ca 0.20 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3jyh h ARG 146 Cb 0.32 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 3jyh h ARG 146 CO -0.44 0.13 -0.28 0.00 -1.07 0.00 0.00 179.97 178.32 3jyh h ARG 147 N 0.04 -0.55 0.00 0.04 3.08 -0.81 0.14 114.38 116.32 3jyh h ARG 147 Ca 0.03 0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 3jyh h ARG 147 Cb 0.06 0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 3jyh h ARG 147 CO -0.00 -0.36 -0.06 -0.44 -1.07 0.00 0.00 179.97 178.03 3jyh h ASP 148 N -0.57 0.00 -0.12 7.04 3.32 -0.63 -2.54 116.42 122.92 3jyh h ASP 148 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3jyh h ASP 148 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3jyh h ASP 148 CO -0.08 0.06 0.00 0.18 -1.72 0.00 0.00 179.24 177.68 3jyh n LEU 149 N -3.92 2.43 -3.00 1.55 4.32 -0.96 -4.97 117.00 112.45 3jyh n LEU 149 Ca -0.03 -1.24 -0.22 0.00 -0.02 0.00 0.00 56.01 54.50 3jyh n LEU 149 Cb 0.15 -0.07 0.03 0.00 -1.62 0.00 0.00 43.42 41.90 3jyh n LEU 149 CO 0.30 0.49 -0.03 0.61 -1.22 0.00 0.00 177.39 177.54 3jyh n GLY 150 N 0.80 -0.52 2.06 -0.72 0.00 -0.69 -4.90 105.19 101.22 3jyh n GLY 150 Ca 0.10 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 3jyh n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyh n ALA 151 N -3.41 5.48 -0.20 4.61 0.00 0.41 -4.76 120.51 122.63 3jyh n ALA 151 Ca -0.11 -3.02 0.24 0.00 0.00 0.00 0.00 53.44 50.55 3jyh n ALA 151 Cb 0.62 -1.35 0.63 0.00 0.00 0.00 0.00 19.45 19.35 3jyh n ALA 151 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3jyh h GLN 152 N 1.13 0.17 -0.13 0.00 7.50 -1.91 0.28 115.11 122.15 3jyh h GLN 152 Ca 0.56 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.70 3jyh h GLN 152 Cb 2.42 -0.04 0.00 0.00 0.05 0.00 0.00 27.48 29.91 3jyh h GLN 152 CO 1.04 0.11 0.00 -0.40 -1.50 0.00 0.00 178.83 178.08 3jyh n ASP 153 N -4.38 2.82 -4.64 1.46 5.68 -1.26 -4.92 116.55 111.31 3jyh n ASP 153 Ca 0.19 -1.91 -0.43 0.00 -0.50 0.00 0.00 54.79 52.14 3jyh n ASP 153 Cb 0.84 -0.07 -0.02 0.00 -1.14 0.00 0.00 41.12 40.73 3jyh n ASP 153 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3jyh s ALA 154 N -1.86 3.55 0.42 2.12 0.00 0.09 -4.97 121.76 121.11 3jyh s ALA 154 Ca 0.32 -0.01 -0.25 0.00 0.00 0.00 0.00 51.96 52.03 3jyh s ALA 154 Cb 0.21 -3.62 -0.08 0.00 0.00 0.00 0.00 23.12 19.62 3jyh s ALA 154 CO 0.31 -1.35 1.25 -2.14 0.00 0.00 0.00 175.76 173.82 3jyh s PRO 155 N 3.49 3.92 0.15 0.00 0.02 -1.26 -4.72 135.00 136.60 3jyh s PRO 155 Ca 0.44 2.01 0.08 0.00 0.02 0.00 0.00 61.00 63.56 3jyh s PRO 155 Cb -0.13 -2.66 -0.04 0.00 0.02 0.00 0.00 34.50 31.69 3jyh s PRO 155 CO 0.13 -0.48 -0.09 0.00 -0.33 0.00 0.00 177.00 176.23 3jyh s ALA 156 N -1.34 2.97 -0.06 -1.55 0.00 -1.26 -0.87 121.76 119.65 3jyh s ALA 156 Ca 0.58 -1.37 0.02 0.00 0.00 0.00 0.00 51.96 51.20 3jyh s ALA 156 Cb -0.35 -0.83 0.02 0.00 0.00 0.00 0.00 23.12 21.96 3jyh s ALA 156 CO 0.44 0.54 -0.09 0.42 0.00 0.00 0.00 175.76 177.07 3jyh s ILE 157 N -1.50 0.86 0.09 0.00 -1.09 -0.40 0.45 121.20 119.60 3jyh s ILE 157 Ca 0.24 -0.31 -0.16 0.00 -2.23 0.00 0.00 60.65 58.18 3jyh s ILE 157 Cb -0.10 -0.82 -0.07 0.00 -1.58 0.00 0.00 42.46 39.90 3jyh s ILE 157 CO 0.15 0.29 0.53 0.00 -1.23 0.00 0.00 174.94 174.68 3jyh s ALA 158 N 0.79 3.61 -0.01 9.38 0.00 -0.44 -1.58 121.76 133.50 3jyh s ALA 158 Ca -0.13 -0.09 0.04 0.00 0.00 0.00 0.00 51.96 51.78 3jyh s ALA 158 Cb -0.15 -2.53 -0.01 0.00 0.00 0.00 0.00 23.12 20.43 3jyh s ALA 158 CO 0.02 0.44 -0.13 -0.06 0.00 0.00 0.00 175.76 176.04 3jyh s PHE 159 N -1.26 1.14 -0.16 0.00 0.08 0.01 -1.47 117.98 116.32 3jyh s PHE 159 Ca 0.32 -0.21 -0.30 0.00 0.12 0.00 0.00 56.93 56.85 3jyh s PHE 159 Cb -0.17 -0.73 0.13 0.00 -0.57 0.00 0.00 43.02 41.68 3jyh s PHE 159 CO 0.18 -0.02 0.99 0.20 -0.10 0.00 0.00 175.22 176.47 3jyh s GLY 160 N -0.30 -0.27 0.02 4.36 0.00 -1.08 -1.49 107.32 108.56 3jyh s GLY 160 Ca 0.05 2.02 0.08 0.00 0.00 0.00 0.00 44.72 46.87 3jyh s GLY 160 CO -0.00 1.03 -0.23 -0.32 0.00 0.00 0.00 173.10 173.57 3jyh s GLY 161 N -1.11 1.42 0.00 0.20 0.00 -1.26 -1.05 107.32 105.52 3jyh s GLY 161 Ca -0.02 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.51 3jyh s GLY 161 CO 0.02 -1.05 0.00 -1.26 0.00 0.00 0.00 173.10 170.80 3jyh n SER 162 N 1.92 0.00 -0.20 1.64 2.88 -0.12 -0.87 113.62 118.88 3jyh n SER 162 Ca -0.17 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.56 3jyh n SER 162 Cb 0.52 0.00 0.54 0.00 -0.75 0.00 0.00 64.21 64.52 3jyh n SER 162 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 3jyh h TYR 163 N 0.00 0.44 -0.29 0.66 3.20 -1.91 -0.40 116.97 118.67 3jyh h TYR 163 Ca 0.00 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 3jyh h TYR 163 Cb 0.00 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 3jyh h TYR 163 CO 0.00 0.13 0.03 0.78 -1.64 0.00 0.00 178.16 177.46 3jyh h GLY 164 N 0.35 0.46 1.28 1.82 0.00 -1.23 -1.38 103.07 104.36 3jyh h GLY 164 Ca 0.42 -0.24 -0.09 0.00 0.00 0.00 0.00 47.33 47.41 3jyh h GLY 164 CO -0.13 0.23 -0.07 -1.33 0.00 0.00 0.00 176.54 175.25 3jyh h GLY 165 N 0.71 0.93 0.74 4.60 0.00 -0.89 -0.78 103.07 108.38 3jyh h GLY 165 Ca 0.10 -0.69 0.02 0.00 0.00 0.00 0.00 47.33 46.76 3jyh h GLY 165 CO 0.00 0.63 -0.07 -0.33 0.00 0.00 0.00 176.54 176.77 3jyh h MET 166 N 0.78 -0.10 -0.54 4.80 2.07 -1.02 -1.78 114.93 119.15 3jyh h MET 166 Ca 0.14 0.01 0.07 0.00 -2.07 0.00 0.00 59.70 57.84 3jyh h MET 166 Cb 0.56 0.02 -0.06 0.00 -1.87 0.00 0.00 31.60 30.26 3jyh h MET 166 CO 0.03 -0.06 0.23 -0.07 1.07 0.00 0.00 176.91 178.11 3jyh h LEU 167 N -0.10 0.28 -0.62 1.22 3.38 -1.09 0.18 115.31 118.56 3jyh h LEU 167 Ca 0.05 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3jyh h LEU 167 Cb 0.17 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3jyh h LEU 167 CO -0.12 0.18 0.39 0.28 0.09 0.00 0.00 178.44 179.27 3jyh h SER 168 N 0.43 0.74 -0.24 -0.43 0.02 -0.96 0.33 113.55 113.44 3jyh h SER 168 Ca 0.26 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.13 3jyh h SER 168 Cb 0.25 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 3jyh h SER 168 CO -0.23 0.56 0.01 0.00 -1.14 0.00 0.00 176.83 176.03 3jyh h ALA 169 N 1.21 0.32 -0.77 3.77 0.00 -0.84 -2.39 119.26 120.56 3jyh h ALA 169 Ca 0.23 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3jyh h ALA 169 Cb -0.05 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 3jyh h ALA 169 CO -0.05 0.05 0.38 1.88 0.00 0.00 0.00 179.25 181.51 3jyh h TYR 170 N 0.20 1.09 -0.59 0.00 0.05 -0.26 0.18 116.97 117.64 3jyh h TYR 170 Ca 0.07 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3jyh h TYR 170 Cb 0.40 -0.34 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 3jyh h TYR 170 CO 0.03 0.79 0.33 1.25 -1.05 0.00 0.00 178.16 179.51 3jyh h LEU 171 N 1.09 0.74 -0.53 3.88 5.85 -0.29 0.53 115.31 126.58 3jyh h LEU 171 Ca 0.27 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.79 3jyh h LEU 171 Cb 0.10 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 3jyh h LEU 171 CO -0.04 0.62 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.51 3jyh h ARG 172 N 0.80 0.99 -0.25 1.25 9.65 -1.09 0.23 114.38 125.97 3jyh h ARG 172 Ca 0.21 -0.36 -0.03 0.00 -1.10 0.00 0.00 59.98 58.70 3jyh h ARG 172 Cb 0.04 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 3jyh h ARG 172 CO -0.03 1.03 0.03 0.52 2.80 0.00 0.00 179.97 184.32 3jyh h MET 173 N 0.86 0.42 0.00 0.20 2.86 -0.14 -3.10 114.93 116.04 3jyh h MET 173 Ca 0.14 -0.12 -0.23 0.00 -2.06 0.00 0.00 59.70 57.43 3jyh h MET 173 Cb 0.64 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.21 3jyh h MET 173 CO 0.04 0.56 -1.45 0.87 1.06 0.00 0.00 176.91 178.00 3jyh h LYS 174 N 0.22 0.00 -2.04 1.72 1.79 0.06 -3.40 116.57 114.92 3jyh h LYS 174 Ca 0.08 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 58.03 3jyh h LYS 174 Cb 0.35 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.59 3jyh h LYS 174 CO 0.01 0.48 -0.99 0.66 -1.08 0.00 0.00 179.45 178.53 3jyh n TYR 175 N -3.04 1.70 0.40 -1.35 4.01 0.81 -4.91 117.16 114.78 3jyh n TYR 175 Ca -0.11 -3.81 0.10 0.00 -0.16 0.00 0.00 57.90 53.92 3jyh n TYR 175 Cb 0.95 -0.43 0.44 0.00 -0.31 0.00 0.00 39.34 39.98 3jyh n TYR 175 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3jyh n PRO 176 N 0.05 0.13 0.14 -0.72 -0.04 -1.17 -1.59 135.00 131.80 3jyh n PRO 176 Ca 0.27 0.39 0.13 0.00 -0.04 0.00 0.00 63.50 64.25 3jyh n PRO 176 Cb 0.57 -1.77 0.32 0.00 -0.04 0.00 0.00 33.50 32.58 3jyh n PRO 176 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 3jyh h HIS 177 N 0.00 0.00 0.00 0.54 2.07 -1.91 -3.36 115.15 112.50 3jyh h HIS 177 Ca 0.00 0.00 -0.24 0.00 -2.85 0.00 0.00 60.37 57.28 3jyh h HIS 177 Cb 0.30 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.23 3jyh h HIS 177 CO 0.00 0.00 -1.94 1.28 -3.07 0.00 0.00 177.93 174.20 3jyh n LEU 178 N -2.51 0.00 -4.09 6.12 4.77 -0.62 -4.96 117.00 115.71 3jyh n LEU 178 Ca 0.05 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.78 3jyh n LEU 178 Cb 0.46 0.33 -0.16 0.00 -2.33 0.00 0.00 43.42 41.72 3jyh n LEU 178 CO 0.32 0.33 -0.49 0.68 -1.33 0.00 0.00 177.39 176.90 3jyh s VAL 179 N -2.36 1.28 -0.34 4.08 -7.23 -0.91 -4.41 120.40 110.51 3jyh s VAL 179 Ca -0.07 -0.61 0.21 0.00 -1.81 0.00 0.00 61.98 59.71 3jyh s VAL 179 Cb 0.04 -1.12 0.21 0.00 0.56 0.00 0.00 36.38 36.07 3jyh s VAL 179 CO 0.57 0.38 1.45 0.00 -0.31 0.00 0.00 175.10 177.19 3jyh h ALA 180 N 6.51 0.84 -2.20 1.32 0.00 -0.24 -3.40 119.26 122.09 3jyh h ALA 180 Ca -0.31 -0.12 0.21 0.00 0.00 0.00 0.00 54.91 54.69 3jyh h ALA 180 Cb 1.18 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 3jyh h ALA 180 CO 0.48 0.15 0.59 0.20 0.00 0.00 0.00 179.25 180.67 3jyh s GLY 181 N -4.31 -0.17 -0.11 0.00 0.00 -1.22 -4.81 107.32 96.70 3jyh s GLY 181 Ca 0.05 0.11 -0.07 0.00 0.00 0.00 0.00 44.72 44.81 3jyh s GLY 181 CO 0.71 0.83 0.27 0.00 0.00 0.00 0.00 173.10 174.90 3jyh s ALA 182 N -2.78 -0.64 -0.36 3.20 0.00 -0.17 -1.33 121.76 119.68 3jyh s ALA 182 Ca 0.16 0.94 -0.12 0.00 0.00 0.00 0.00 51.96 52.93 3jyh s ALA 182 Cb -0.00 -0.58 0.01 0.00 0.00 0.00 0.00 23.12 22.55 3jyh s ALA 182 CO 0.02 -0.17 0.23 -1.17 0.00 0.00 0.00 175.76 174.67 3jyh s LEU 183 N 0.82 4.65 -0.44 0.00 2.96 -0.54 -0.67 118.68 125.46 3jyh s LEU 183 Ca -0.06 -0.72 -0.07 0.00 -0.22 0.00 0.00 54.13 53.06 3jyh s LEU 183 Cb -0.07 -2.09 0.11 0.00 0.50 0.00 0.00 46.19 44.64 3jyh s LEU 183 CO -0.05 -0.33 0.28 0.00 -1.32 0.00 0.00 176.35 174.93 3jyh s ALA 184 N 1.65 3.29 -0.18 5.97 0.00 0.13 -2.63 121.76 129.98 3jyh s ALA 184 Ca 0.04 -2.48 -0.12 0.00 0.00 0.00 0.00 51.96 49.41 3jyh s ALA 184 Cb -0.18 -2.64 -0.05 0.00 0.00 0.00 0.00 23.12 20.25 3jyh s ALA 184 CO 0.09 -1.83 0.20 0.00 0.00 0.00 0.00 175.76 174.22 3jyh s ALA 185 N 1.29 3.64 -1.37 0.00 0.00 -0.22 -2.27 121.76 122.83 3jyh s ALA 185 Ca 0.06 -0.59 -0.08 0.00 0.00 0.00 0.00 51.96 51.36 3jyh s ALA 185 Cb -0.25 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.61 3jyh s ALA 185 CO -0.02 0.12 0.42 0.43 0.00 0.00 0.00 175.76 176.71 3jyh n SER 186 N 3.57 -1.26 -4.29 0.00 7.64 0.37 -0.95 113.62 118.69 3jyh n SER 186 Ca -0.14 -1.10 -0.42 0.00 1.01 0.00 0.00 58.87 58.21 3jyh n SER 186 Cb 0.52 -2.62 -0.08 0.00 -1.01 0.00 0.00 64.21 61.02 3jyh n SER 186 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3jyh s ALA 187 N -3.93 3.44 -1.53 -0.43 0.00 -1.26 -2.86 121.76 115.20 3jyh s ALA 187 Ca 0.13 -2.29 -0.12 0.00 0.00 0.00 0.00 51.96 49.69 3jyh s ALA 187 Cb -0.06 -2.90 -0.02 0.00 0.00 0.00 0.00 23.12 20.14 3jyh s ALA 187 CO 0.92 -1.79 2.59 -0.35 0.00 0.00 0.00 175.76 177.13 3jyh n PRO 188 N 5.04 3.37 0.27 0.00 -0.04 -1.26 -4.47 135.00 137.91 3jyh n PRO 188 Ca -0.11 -2.47 0.13 0.00 -0.04 0.00 0.00 63.50 61.02 3jyh n PRO 188 Cb 0.42 -3.01 0.75 0.00 -0.04 0.00 0.00 33.50 31.62 3jyh n PRO 188 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3jyh h VAL 189 N 3.45 0.51 0.03 0.52 -1.51 -1.89 -2.85 116.25 114.51 3jyh h VAL 189 Ca 0.72 -0.50 -0.00 0.00 -1.23 0.00 0.00 66.70 65.69 3jyh h VAL 189 Cb 0.45 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 30.95 3jyh h VAL 189 CO 1.82 0.10 -0.01 -0.07 -1.23 0.00 0.00 177.57 178.18 3jyh h LEU 190 N 0.00 -0.03 -0.38 4.19 3.38 -1.44 -3.24 115.31 117.80 3jyh h LEU 190 Ca -0.00 -0.51 0.03 0.00 0.09 0.00 0.00 57.88 57.49 3jyh h LEU 190 Cb 0.33 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 3jyh h LEU 190 CO 0.01 0.70 0.17 0.00 0.09 0.00 0.00 178.44 179.42 3jyh h ALA 191 N -0.43 0.46 0.00 1.53 0.00 -1.31 -2.00 119.26 117.51 3jyh h ALA 191 Ca -0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3jyh h ALA 191 Cb 0.55 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3jyh h ALA 191 CO 0.01 -0.21 -0.14 -0.39 0.00 0.00 0.00 179.25 178.52 3jyh h VAL 192 N 0.35 0.68 -0.00 0.00 -1.51 -1.62 0.34 116.25 114.48 3jyh h VAL 192 Ca 0.17 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 3jyh h VAL 192 Cb 0.10 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 3jyh h VAL 192 CO -0.14 0.13 -0.00 0.00 -1.23 0.00 0.00 177.57 176.33 3jyh n ALA 193 N -2.32 2.66 -0.79 5.19 0.00 -0.86 -1.76 120.51 122.63 3jyh n ALA 193 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3jyh n ALA 193 Cb 0.24 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.23 3jyh n ALA 193 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jyh n GLY 194 N 1.06 0.52 3.90 0.00 0.00 0.11 -4.46 105.19 106.31 3jyh n GLY 194 Ca 0.22 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 3jyh n GLY 194 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jyh s LEU 195 N 0.00 4.20 0.00 0.99 1.43 -0.81 -4.97 118.68 119.52 3jyh s LEU 195 Ca 0.00 0.64 0.00 0.00 -1.03 0.00 0.00 54.13 53.74 3jyh s LEU 195 Cb 0.00 -3.40 0.00 0.00 0.03 0.00 0.00 46.19 42.82 3jyh s LEU 195 CO 0.00 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.15 3jyh n GLY 196 N -0.30 -1.95 3.63 -3.19 0.00 -1.26 -3.97 105.19 98.15 3jyh n GLY 196 Ca -0.02 -1.47 -0.36 0.00 0.00 0.00 0.00 46.02 44.17 3jyh n GLY 196 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3jyh s ASP 197 N -4.00 5.83 0.19 1.61 -1.08 -1.26 -4.96 116.67 113.00 3jyh s ASP 197 Ca 0.00 0.07 0.14 0.00 -0.52 0.00 0.00 52.55 52.24 3jyh s ASP 197 Cb 0.00 -2.03 0.73 0.00 -1.46 0.00 0.00 42.92 40.16 3jyh s ASP 197 CO 0.00 0.10 1.43 -1.54 0.52 0.00 0.00 175.17 175.67 3jyh n SER 198 N 4.07 0.35 0.01 -0.34 3.41 -1.26 -1.05 113.62 118.81 3jyh n SER 198 Ca -0.16 0.65 0.12 0.00 -0.26 0.00 0.00 58.87 59.22 3jyh n SER 198 Cb 0.52 -0.70 0.20 0.00 -0.26 0.00 0.00 64.21 63.97 3jyh n SER 198 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3jyh n ASN 199 N -1.96 0.56 0.13 4.04 3.02 -1.26 -1.69 115.26 118.10 3jyh n ASN 199 Ca -0.00 -0.24 -0.13 0.00 -0.03 0.00 0.00 54.58 54.18 3jyh n ASN 199 Cb 0.04 0.32 -0.07 0.00 -0.61 0.00 0.00 39.78 39.47 3jyh n ASN 199 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 3jyh h GLN 200 N 0.00 -0.33 -0.03 3.52 -0.00 -1.41 -2.48 115.11 114.39 3jyh h GLN 200 Ca 0.00 0.02 0.03 0.00 -0.00 0.00 0.00 58.65 58.71 3jyh h GLN 200 Cb 0.55 0.07 -0.06 0.00 0.00 0.00 0.00 27.48 28.05 3jyh h GLN 200 CO 0.00 -0.22 -0.40 0.35 0.00 0.00 0.00 178.83 178.56 3jyh h PHE 201 N -0.34 -1.14 0.00 3.99 3.57 -1.80 0.60 116.94 121.83 3jyh h PHE 201 Ca -0.00 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.44 3jyh h PHE 201 Cb 0.31 0.50 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 3jyh h PHE 201 CO -0.12 -0.48 -0.46 0.74 -2.23 0.00 0.00 178.31 175.76 3jyh h PHE 202 N -0.54 0.00 -0.45 0.41 0.04 -1.80 -1.11 116.94 113.50 3jyh h PHE 202 Ca 0.06 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.87 3jyh h PHE 202 Cb 0.63 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.74 3jyh h PHE 202 CO -0.43 0.46 0.22 -0.09 -0.60 0.00 0.00 178.31 177.87 3jyh h ARG 203 N 0.00 0.42 -0.26 1.51 2.43 -1.17 -1.52 114.38 115.80 3jyh h ARG 203 Ca -0.00 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.01 3jyh h ARG 203 Cb 1.13 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 3jyh h ARG 203 CO 0.06 0.28 -0.38 -0.44 -1.51 0.00 0.00 179.97 177.98 3jyh h ASP 204 N 0.43 0.62 0.01 -3.80 3.32 -0.16 -0.64 116.42 116.21 3jyh h ASP 204 Ca 0.20 -0.27 0.01 0.00 0.02 0.00 0.00 57.03 56.98 3jyh h ASP 204 Cb 0.12 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 3jyh h ASP 204 CO -0.15 0.94 -0.04 0.58 -1.72 0.00 0.00 179.24 178.86 3jyh h VAL 205 N 0.49 0.91 -0.27 -1.35 2.07 -1.17 -1.86 116.25 115.07 3jyh h VAL 205 Ca 0.05 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.63 3jyh h VAL 205 Cb 0.88 0.91 -0.07 0.00 -1.52 0.00 0.00 31.29 31.49 3jyh h VAL 205 CO 0.08 0.00 -0.18 0.74 0.02 0.00 0.00 177.57 178.22 3jyh h THR 206 N -0.07 0.49 -1.01 2.57 2.02 -1.13 -1.75 112.91 114.03 3jyh h THR 206 Ca 0.01 0.00 0.24 0.00 0.77 0.00 0.00 66.41 67.43 3jyh h THR 206 Cb 0.08 0.49 -0.09 0.00 -1.74 0.00 0.00 68.15 66.89 3jyh h THR 206 CO -0.03 0.00 0.64 0.00 0.37 0.00 0.00 175.52 176.50 3jyh h ALA 207 N 0.99 2.09 -0.46 6.16 0.00 -0.86 -0.28 119.26 126.89 3jyh h ALA 207 Ca 0.14 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3jyh h ALA 207 Cb 0.39 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3jyh h ALA 207 CO -0.37 -0.48 0.14 -0.44 0.00 0.00 0.00 179.25 178.11 3jyh h ASP 208 N 0.48 0.68 0.78 0.00 3.32 -0.47 -0.47 116.42 120.73 3jyh h ASP 208 Ca 0.58 -0.21 -0.18 0.00 0.02 0.00 0.00 57.03 57.25 3jyh h ASP 208 Cb 1.33 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 3jyh h ASP 208 CO -0.31 0.70 -0.83 -0.26 -1.72 0.00 0.00 179.24 176.82 3jyh h PHE 209 N 0.61 0.05 -0.23 4.55 0.04 -1.12 -2.66 116.94 118.17 3jyh h PHE 209 Ca 0.15 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.87 3jyh h PHE 209 Cb 0.27 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.41 3jyh h PHE 209 CO 0.01 0.84 0.04 1.49 -0.60 0.00 0.00 178.31 180.10 3jyh h GLU 210 N 0.02 0.38 0.00 1.51 4.57 -0.96 -1.30 114.58 118.80 3jyh h GLU 210 Ca -0.01 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 3jyh h GLU 210 Cb 1.46 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 30.00 3jyh h GLU 210 CO 0.11 0.51 -0.09 0.78 -1.18 0.00 0.00 179.01 179.14 3jyh h GLY 211 N 0.19 0.00 0.38 1.92 0.00 -1.06 -2.74 103.07 101.77 3jyh h GLY 211 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 3jyh h GLY 211 CO 0.00 0.00 -0.18 -1.61 0.00 0.00 0.00 176.54 174.75 3jyh h GLN 212 N 0.00 -0.50 -2.25 4.80 5.75 -1.33 -3.47 115.11 118.11 3jyh h GLN 212 Ca -0.00 0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 3jyh h GLN 212 Cb 0.16 0.11 -0.23 0.00 1.07 0.00 0.00 27.48 28.59 3jyh h GLN 212 CO 0.01 -0.33 -0.22 0.45 -2.65 0.00 0.00 178.83 176.09 3jyh s SER 213 N -4.31 -0.73 0.61 -0.69 0.15 -0.50 -5.02 113.70 103.20 3jyh s SER 213 Ca -0.08 1.29 0.37 0.00 0.70 0.00 0.00 55.95 58.24 3jyh s SER 213 Cb 0.01 1.73 1.96 0.00 -1.71 0.00 0.00 66.02 68.01 3jyh s SER 213 CO 0.23 -0.22 2.23 -0.65 1.20 0.00 0.00 173.24 176.02 3jyh h PRO 214 N 7.91 0.00 -0.33 5.44 0.11 -1.75 -1.78 132.00 141.60 3jyh h PRO 214 Ca -0.20 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.78 3jyh h PRO 214 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3jyh h PRO 214 CO 0.13 0.03 -0.35 0.87 -0.21 0.00 0.00 178.00 178.46 3jyh h LYS 215 N 0.00 0.75 0.36 1.05 1.57 -1.92 -2.62 116.57 115.76 3jyh h LYS 215 Ca -0.00 -0.36 -0.02 0.00 -1.87 0.00 0.00 60.65 58.40 3jyh h LYS 215 Cb 0.15 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3jyh h LYS 215 CO 0.00 0.98 -0.18 0.00 -0.57 0.00 0.00 179.45 179.69 3jyh h THR 217 N -0.49 1.22 -0.61 0.00 1.35 -1.54 0.27 112.91 113.11 3jyh h THR 217 Ca -0.05 -0.52 -0.00 0.00 -0.55 0.00 0.00 66.41 65.29 3jyh h THR 217 Cb 0.38 0.20 -0.03 0.00 -1.73 0.00 0.00 68.15 66.97 3jyh h THR 217 CO 0.07 0.24 0.38 1.56 -0.25 0.00 0.00 175.52 177.52 3jyh h GLN 218 N 1.03 0.82 -0.47 4.72 4.20 -1.36 -0.30 115.11 123.76 3jyh h GLN 218 Ca 0.26 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.91 3jyh h GLN 218 Cb 0.01 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 3jyh h GLN 218 CO -0.04 0.57 0.28 0.78 -0.67 0.00 0.00 178.83 179.75 3jyh h GLY 219 N 0.83 0.68 0.65 3.46 0.00 0.14 -1.41 103.07 107.41 3jyh h GLY 219 Ca 0.22 -0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.29 3jyh h GLY 219 CO -0.04 0.27 -0.17 -2.08 0.00 0.00 0.00 176.54 174.52 3jyh h VAL 220 N 0.62 0.60 -0.65 4.60 2.07 -0.41 -1.27 116.25 121.81 3jyh h VAL 220 Ca 0.17 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.76 3jyh h VAL 220 Cb -0.01 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 3jyh h VAL 220 CO -0.03 0.00 0.32 0.03 0.02 0.00 0.00 177.57 177.91 3jyh h ARG 221 N -0.31 0.56 -0.71 1.57 3.08 -0.86 -1.71 114.38 116.00 3jyh h ARG 221 Ca 0.04 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 3jyh h ARG 221 Cb 0.35 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 3jyh h ARG 221 CO -0.13 0.37 0.17 0.93 -1.07 0.00 0.00 179.97 180.25 3jyh h GLU 222 N 0.58 1.14 0.19 0.04 5.08 -1.10 -1.91 114.58 118.61 3jyh h GLU 222 Ca 0.31 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3jyh h GLU 222 Cb 0.28 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 3jyh h GLU 222 CO -0.23 1.00 -0.10 0.00 -1.00 0.00 0.00 179.01 178.68 3jyh h ALA 223 N 1.09 -0.27 -0.80 3.43 0.00 -0.63 0.23 119.26 122.30 3jyh h ALA 223 Ca 0.22 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3jyh h ALA 223 Cb 0.38 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 3jyh h ALA 223 CO 0.00 -0.65 0.38 0.74 0.00 0.00 0.00 179.25 179.71 3jyh h PHE 224 N -0.28 1.16 -0.24 0.00 0.04 -1.26 -1.64 116.94 114.74 3jyh h PHE 224 Ca -0.02 -0.06 0.01 0.00 2.80 0.00 0.00 57.97 60.70 3jyh h PHE 224 Cb 0.22 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 37.99 3jyh h PHE 224 CO -0.07 0.85 0.12 -0.09 -0.60 0.00 0.00 178.31 178.52 3jyh h ARG 225 N 1.14 0.25 -0.39 1.51 2.43 -1.25 -1.63 114.38 116.44 3jyh h ARG 225 Ca 0.27 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.49 3jyh h ARG 225 Cb 0.13 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.57 3jyh h ARG 225 CO -0.03 0.17 0.06 1.96 -1.51 0.00 0.00 179.97 180.62 3jyh h GLN 226 N 0.26 0.18 -0.35 0.20 4.20 -0.47 0.20 115.11 119.32 3jyh h GLN 226 Ca 0.09 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 3jyh h GLN 226 Cb 0.02 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 3jyh h GLN 226 CO -0.06 0.12 0.20 0.82 -0.67 0.00 0.00 178.83 179.24 3jyh h ILE 227 N 0.18 1.13 -0.50 2.54 2.04 -1.18 -1.22 117.51 120.49 3jyh h ILE 227 Ca 0.19 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.74 3jyh h ILE 227 Cb 0.24 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 3jyh h ILE 227 CO -0.26 0.13 0.32 0.50 0.00 0.00 0.00 178.15 178.84 3jyh h LYS 228 N 0.45 0.62 -0.51 2.37 3.64 -0.92 -1.44 116.57 120.78 3jyh h LYS 228 Ca 0.13 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3jyh h LYS 228 Cb 0.04 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 3jyh h LYS 228 CO -0.02 0.41 0.32 -0.44 -2.27 0.00 0.00 179.45 177.45 3jyh h ASP 229 N 0.64 0.61 -0.56 4.20 3.32 -0.71 -0.11 116.42 123.81 3jyh h ASP 229 Ca 0.19 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 3jyh h ASP 229 Cb -0.03 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 3jyh h ASP 229 CO -0.06 0.47 0.32 -0.07 -1.72 0.00 0.00 179.24 178.18 3jyh h LEU 230 N 0.69 0.68 -0.45 1.55 3.38 -1.02 -0.39 115.31 119.74 3jyh h LEU 230 Ca 0.19 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3jyh h LEU 230 Cb -0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3jyh h LEU 230 CO -0.04 0.55 0.22 0.15 0.09 0.00 0.00 178.44 179.42 3jyh h PHE 231 N 0.75 0.64 -0.68 1.13 3.04 -1.05 0.17 116.94 120.95 3jyh h PHE 231 Ca 0.20 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.12 3jyh h PHE 231 Cb 0.01 -0.20 -0.03 0.00 2.56 0.00 0.00 35.95 38.29 3jyh h PHE 231 CO -0.02 0.51 0.43 -0.07 -2.02 0.00 0.00 178.31 177.14 3jyh h LEU 232 N 0.59 0.80 0.00 0.59 -0.00 -0.71 -1.30 115.31 115.27 3jyh h LEU 232 Ca 0.16 -0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.99 3jyh h LEU 232 Cb 0.10 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.56 3jyh h LEU 232 CO -0.02 0.60 0.00 0.00 -0.00 0.00 0.00 178.44 179.02 3jyh n GLN 233 N -4.58 0.12 -1.29 1.13 6.02 -0.18 -4.88 117.38 113.72 3jyh n GLN 233 Ca 0.06 0.21 -0.04 0.00 -0.01 0.00 0.00 57.00 57.22 3jyh n GLN 233 Cb 0.04 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.78 3jyh n GLN 233 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3jyh n GLY 234 N -0.36 0.60 2.58 1.08 0.00 -0.49 -4.96 105.19 103.64 3jyh n GLY 234 Ca 0.05 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.84 3jyh n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyh n ALA 235 N 0.66 6.51 -0.31 4.61 0.00 0.54 -4.75 120.51 127.77 3jyh n ALA 235 Ca -0.04 -3.94 -0.02 0.00 0.00 0.00 0.00 53.44 49.45 3jyh n ALA 235 Cb 0.20 -2.36 0.10 0.00 0.00 0.00 0.00 19.45 17.40 3jyh n ALA 235 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3jyh h TYR 236 N 3.85 1.02 -0.58 0.00 0.05 -1.86 -2.64 116.97 116.81 3jyh h TYR 236 Ca 0.56 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 59.34 3jyh h TYR 236 Cb 0.37 -0.34 -0.03 0.00 1.01 0.00 0.00 36.73 37.75 3jyh h TYR 236 CO 1.44 0.59 0.25 -0.44 -1.05 0.00 0.00 178.16 178.96 3jyh h ASP 237 N 1.06 0.75 -0.65 3.88 3.32 -1.85 -0.61 116.42 122.33 3jyh h ASP 237 Ca 0.33 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 3jyh h ASP 237 Cb -0.00 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 3jyh h ASP 237 CO -0.11 0.66 0.20 0.74 -1.72 0.00 0.00 179.24 179.01 3jyh h THR 238 N 0.82 1.25 -0.03 0.35 2.02 -1.87 0.44 112.91 115.88 3jyh h THR 238 Ca 0.20 -0.86 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 3jyh h THR 238 Cb 0.13 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 3jyh h THR 238 CO -0.02 0.33 -0.02 0.58 0.37 0.00 0.00 175.52 176.76 3jyh h VAL 239 N 0.99 1.34 -0.24 3.16 2.07 -1.16 0.18 116.25 122.59 3jyh h VAL 239 Ca 0.22 -1.04 0.05 0.00 0.82 0.00 0.00 66.70 66.74 3jyh h VAL 239 Cb 0.29 1.98 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 3jyh h VAL 239 CO -0.01 0.28 -0.03 -0.09 0.02 0.00 0.00 177.57 177.75 3jyh h ARG 240 N -0.34 0.04 0.17 1.57 2.43 -1.06 0.85 114.38 118.04 3jyh h ARG 240 Ca 0.01 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 3jyh h ARG 240 Cb 0.46 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 3jyh h ARG 240 CO 0.01 0.03 -0.08 2.35 -1.51 0.00 0.00 179.97 180.76 3jyh h TRP 241 N 0.04 -0.21 -0.19 2.20 2.91 -0.87 -0.43 115.95 119.40 3jyh h TRP 241 Ca 0.12 -0.00 -0.11 0.00 1.13 0.00 0.00 58.89 60.02 3jyh h TRP 241 Cb 0.16 0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 28.88 3jyh h TRP 241 CO -0.22 0.07 -0.32 0.93 -1.03 0.00 0.00 178.44 177.87 3jyh h GLU 242 N -0.48 0.55 0.00 2.65 4.39 -0.58 -3.24 114.58 117.87 3jyh h GLU 242 Ca -0.02 -0.34 -0.12 0.00 0.34 0.00 0.00 59.36 59.21 3jyh h GLU 242 Cb 0.37 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.04 3jyh h GLU 242 CO 0.04 0.95 -0.59 0.35 -1.16 0.00 0.00 179.01 178.59 3jyh h PHE 243 N 0.21 0.00 -0.99 4.33 3.57 -0.94 -3.41 116.94 119.73 3jyh h PHE 243 Ca 0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3jyh h PHE 243 Cb 0.91 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.65 3jyh h PHE 243 CO 0.09 0.59 0.00 0.41 -2.23 0.00 0.00 178.31 177.17 3jyh n GLY 244 N 0.87 0.56 3.88 2.40 0.00 -0.26 -4.77 105.19 107.87 3jyh n GLY 244 Ca 0.01 -0.28 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 3jyh n GLY 244 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3jyh s THR 245 N -2.00 5.45 0.11 2.61 -4.23 -0.68 0.66 115.64 117.56 3jyh s THR 245 Ca 0.00 0.07 -0.15 0.00 -1.18 0.00 0.00 61.69 60.43 3jyh s THR 245 Cb 0.00 -3.44 -0.06 0.00 1.34 0.00 0.00 72.50 70.35 3jyh s THR 245 CO 0.00 0.51 1.48 0.00 -0.54 0.00 0.00 174.62 176.08 3jyh s GLN 247 N -4.65 4.09 0.60 0.00 1.11 -1.26 -5.06 119.66 114.48 3jyh s GLN 247 Ca -0.13 1.52 -0.17 0.00 0.01 0.00 0.00 55.36 56.59 3jyh s GLN 247 Cb 0.09 -2.48 -0.03 0.00 -1.01 0.00 0.00 33.01 29.58 3jyh s GLN 247 CO 0.81 -0.21 1.11 -1.25 0.01 0.00 0.00 175.29 175.76 3jyh s PRO 248 N -2.59 3.13 -0.06 2.91 0.04 -1.26 -4.92 135.00 132.24 3jyh s PRO 248 Ca 0.59 1.48 0.05 0.00 0.04 0.00 0.00 61.00 63.16 3jyh s PRO 248 Cb -0.22 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 3jyh s PRO 248 CO 0.27 -1.01 -0.22 -0.51 0.04 0.00 0.00 177.00 175.57 3jyh s LEU 249 N -4.30 2.02 0.00 -3.56 1.43 -1.26 -5.03 118.68 107.98 3jyh s LEU 249 Ca 0.69 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 3jyh s LEU 249 Cb -0.22 -1.27 0.00 0.00 0.03 0.00 0.00 46.19 44.74 3jyh s LEU 249 CO 0.34 0.20 0.00 -1.54 0.23 0.00 0.00 176.35 175.57 3jyh n SER 250 N 3.16 1.45 -3.15 2.29 3.41 -1.26 -4.74 113.62 114.78 3jyh n SER 250 Ca -0.18 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.26 3jyh n SER 250 Cb 0.52 0.25 -0.05 0.00 -0.26 0.00 0.00 64.21 64.68 3jyh n SER 250 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 3jyh s ASP 251 N -0.83 1.21 0.39 4.04 1.47 -1.26 -5.04 116.67 116.65 3jyh s ASP 251 Ca 0.00 -1.60 0.08 0.00 1.18 0.00 0.00 52.55 52.22 3jyh s ASP 251 Cb 0.00 0.66 0.81 0.00 -0.34 0.00 0.00 42.92 44.05 3jyh s ASP 251 CO 0.00 -1.29 1.96 1.05 0.68 0.00 0.00 175.17 177.58 3jyh h GLU 252 N 2.07 0.35 -0.95 2.11 -0.00 -2.00 -0.82 114.58 115.35 3jyh h GLU 252 Ca -0.27 -0.06 0.08 0.00 -0.00 0.00 0.00 59.36 59.11 3jyh h GLU 252 Cb 1.24 -0.06 -0.07 0.00 -0.00 0.00 0.00 28.75 29.86 3jyh h GLU 252 CO 0.38 0.37 0.61 1.57 -0.00 0.00 0.00 179.01 181.94 3jyh h LYS 253 N 0.34 1.02 -0.26 1.06 5.09 -1.99 0.04 116.57 121.88 3jyh h LYS 253 Ca 0.08 -0.06 -0.14 0.00 0.09 0.00 0.00 60.65 60.62 3jyh h LYS 253 Cb 0.22 -0.23 -0.00 0.00 0.10 0.00 0.00 32.23 32.32 3jyh h LYS 253 CO 0.00 0.68 -0.38 -0.44 -2.09 0.00 0.00 179.45 177.22 3jyh h ASP 254 N 1.05 0.78 -0.52 7.07 3.32 -1.58 -1.77 116.42 124.77 3jyh h ASP 254 Ca 0.42 -0.51 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 3jyh h ASP 254 Cb 0.26 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3jyh h ASP 254 CO -0.17 1.14 0.29 0.25 -1.72 0.00 0.00 179.24 179.02 3jyh h LEU 255 N 0.44 0.64 -0.06 1.55 5.85 -1.13 -1.25 115.31 121.36 3jyh h LEU 255 Ca 0.03 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.67 3jyh h LEU 255 Cb 0.97 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 3jyh h LEU 255 CO 0.09 0.55 -0.04 0.74 -0.34 0.00 0.00 178.44 179.43 3jyh h THR 256 N 0.69 0.87 -0.04 1.05 2.02 -0.95 -1.18 112.91 115.37 3jyh h THR 256 Ca 0.18 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.40 3jyh h THR 256 Cb 0.04 0.87 -0.05 0.00 -1.74 0.00 0.00 68.15 67.27 3jyh h THR 256 CO -0.03 0.00 -0.29 -0.61 0.37 0.00 0.00 175.52 174.96 3jyh h GLN 257 N -0.05 -0.40 -0.43 6.66 5.75 -1.14 0.18 115.11 125.69 3jyh h GLN 257 Ca 0.04 0.03 0.08 0.00 -0.15 0.00 0.00 58.65 58.65 3jyh h GLN 257 Cb 0.11 0.09 -0.08 0.00 1.07 0.00 0.00 27.48 28.67 3jyh h GLN 257 CO -0.09 -0.26 -0.09 1.25 -2.65 0.00 0.00 178.83 176.99 3jyh h LEU 258 N -0.41 -0.36 -0.49 -2.39 6.46 -1.13 0.31 115.31 117.30 3jyh h LEU 258 Ca 0.07 0.12 -0.01 0.00 -0.12 0.00 0.00 57.88 57.95 3jyh h LEU 258 Cb 0.52 0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.67 3jyh h LEU 258 CO -0.27 -0.13 0.27 -0.26 -0.62 0.00 0.00 178.44 177.43 3jyh h PHE 259 N 0.02 0.67 -0.59 1.25 0.04 -0.94 0.17 116.94 117.56 3jyh h PHE 259 Ca 0.21 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.94 3jyh h PHE 259 Cb 0.31 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.22 3jyh h PHE 259 CO -0.36 0.50 0.28 0.52 -0.60 0.00 0.00 178.31 178.66 3jyh h MET 260 N 0.65 0.85 -0.16 1.51 2.86 -0.14 0.10 114.93 120.61 3jyh h MET 260 Ca 0.17 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 3jyh h MET 260 Cb 0.06 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 3jyh h MET 260 CO -0.03 0.69 0.10 0.35 1.06 0.00 0.00 176.91 179.08 3jyh h PHE 261 N 0.80 0.18 -0.36 -0.22 3.57 -0.11 -2.49 116.94 118.32 3jyh h PHE 261 Ca 0.20 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.66 3jyh h PHE 261 Cb 0.12 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3jyh h PHE 261 CO -0.00 0.11 0.03 0.00 -2.23 0.00 0.00 178.31 176.22 3jyh h ALA 262 N 1.06 0.48 -0.81 2.41 0.00 -0.47 -3.06 119.26 118.88 3jyh h ALA 262 Ca 0.06 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.81 3jyh h ALA 262 Cb -0.01 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.58 3jyh h ALA 262 CO -0.02 0.22 0.48 -0.09 0.00 0.00 0.00 179.25 179.84 3jyh h ARG 263 N 0.44 0.84 -0.53 0.00 2.43 -0.75 -2.79 114.38 114.03 3jyh h ARG 263 Ca 0.11 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3jyh h ARG 263 Cb 0.41 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 3jyh h ARG 263 CO 0.01 0.56 0.35 -0.97 -1.51 0.00 0.00 179.97 178.41 3jyh h ASN 264 N 0.87 0.61 -0.80 -3.80 -1.24 -1.34 -1.44 115.58 108.44 3jyh h ASN 264 Ca 0.36 -0.02 0.17 0.00 0.71 0.00 0.00 56.30 57.52 3jyh h ASN 264 Cb 0.21 -0.15 -0.11 0.00 0.73 0.00 0.00 38.32 39.00 3jyh h ASN 264 CO -0.19 0.45 0.29 0.00 -1.29 0.00 0.00 177.43 176.69 3jyh h ALA 265 N 1.66 1.14 -0.30 1.57 0.00 -1.49 -0.98 119.26 120.86 3jyh h ALA 265 Ca 0.19 0.14 -0.10 0.00 0.00 0.00 0.00 54.91 55.15 3jyh h ALA 265 Cb -0.07 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3jyh h ALA 265 CO -0.04 -0.28 -0.19 0.74 0.00 0.00 0.00 179.25 179.48 3jyh h PHE 266 N 0.39 0.77 -0.22 0.00 0.04 -1.36 -1.34 116.94 115.22 3jyh h PHE 266 Ca 0.46 -0.20 0.06 0.00 2.80 0.00 0.00 57.97 61.08 3jyh h PHE 266 Cb 0.78 -0.17 -0.07 0.00 2.20 0.00 0.00 35.95 38.69 3jyh h PHE 266 CO -0.19 0.91 -0.23 1.15 -0.60 0.00 0.00 178.31 179.35 3jyh h THR 267 N 0.41 0.42 0.40 -1.55 2.02 -1.11 0.41 112.91 113.90 3jyh h THR 267 Ca 0.06 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.22 3jyh h THR 267 Cb 0.73 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 3jyh h THR 267 CO 0.05 0.00 -0.19 0.58 0.37 0.00 0.00 175.52 176.33 3jyh h VAL 268 N -0.25 0.61 -0.55 3.16 2.07 -1.12 -0.23 116.25 119.94 3jyh h VAL 268 Ca 0.13 -0.22 0.11 0.00 0.82 0.00 0.00 66.70 67.54 3jyh h VAL 268 Cb 0.44 0.72 -0.09 0.00 -1.52 0.00 0.00 31.29 30.85 3jyh h VAL 268 CO -0.36 0.04 0.05 -0.07 0.02 0.00 0.00 177.57 177.25 3jyh h LEU 269 N -0.66 -0.13 0.18 2.57 3.38 -1.22 0.40 115.31 119.84 3jyh h LEU 269 Ca -0.05 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3jyh h LEU 269 Cb 0.48 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 3jyh h LEU 269 CO 0.09 -0.04 -0.19 0.00 0.09 0.00 0.00 178.44 178.39 3jyh h ALA 270 N 1.47 -0.38 -0.75 1.53 0.00 -0.80 -2.74 119.26 117.59 3jyh h ALA 270 Ca 0.29 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3jyh h ALA 270 Cb 0.43 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3jyh h ALA 270 CO -0.42 -0.74 0.23 0.52 0.00 0.00 0.00 179.25 178.84 3jyh h MET 271 N -0.41 1.17 -1.20 0.00 2.86 -0.59 -2.95 114.93 113.81 3jyh h MET 271 Ca 0.00 -0.25 -0.41 0.00 -2.06 0.00 0.00 59.70 56.98 3jyh h MET 271 Cb 0.38 -0.17 -0.20 0.00 0.06 0.00 0.00 31.60 31.68 3jyh h MET 271 CO -0.05 0.99 0.53 -1.33 1.06 0.00 0.00 176.91 178.11 3jyh n MET 272 N -4.25 2.01 -1.73 1.72 2.81 0.09 -1.38 117.12 116.40 3jyh n MET 272 Ca 0.06 -2.13 -0.42 0.00 -1.81 0.00 0.00 57.70 53.40 3jyh n MET 272 Cb 0.23 -1.84 -0.00 0.00 -0.71 0.00 0.00 33.22 30.90 3jyh n MET 272 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3jyh n ASP 273 N -0.32 4.70 -4.90 7.83 2.03 -1.04 -4.63 116.55 120.23 3jyh n ASP 273 Ca 0.41 -2.83 -0.32 0.00 0.52 0.00 0.00 54.79 52.58 3jyh n ASP 273 Cb 0.88 -1.63 -0.05 0.00 -0.72 0.00 0.00 41.12 39.61 3jyh n ASP 273 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 3jyh s TYR 274 N 2.76 3.49 -2.00 -0.67 2.02 -1.26 -4.19 117.35 117.49 3jyh s TYR 274 Ca 0.50 0.50 0.10 0.00 -0.37 0.00 0.00 57.07 57.80 3jyh s TYR 274 Cb 0.14 -1.96 0.60 0.00 -0.40 0.00 0.00 41.96 40.34 3jyh s TYR 274 CO -0.08 0.47 1.05 -0.35 -1.57 0.00 0.00 175.55 175.08 3jyh n PRO 275 N 0.19 0.53 -3.90 -1.71 -0.04 -1.26 0.07 135.00 128.88 3jyh n PRO 275 Ca -0.03 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.33 3jyh n PRO 275 Cb 0.52 -1.30 -0.07 0.00 -0.04 0.00 0.00 33.50 32.61 3jyh n PRO 275 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3jyh s TYR 276 N -2.00 0.25 0.53 0.54 -0.85 -1.26 -4.53 117.35 110.04 3jyh s TYR 276 Ca 0.15 -0.65 -0.21 0.00 -0.52 0.00 0.00 57.07 55.85 3jyh s TYR 276 Cb 0.07 -0.04 -0.05 0.00 0.38 0.00 0.00 41.96 42.31 3jyh s TYR 276 CO 0.12 -0.64 1.21 -2.14 -1.52 0.00 0.00 175.55 172.58 3jyh s PRO 277 N -3.91 3.32 0.24 -3.49 0.02 -1.26 -4.15 135.00 125.76 3jyh s PRO 277 Ca 0.11 1.86 -0.03 0.00 0.02 0.00 0.00 61.00 62.97 3jyh s PRO 277 Cb 0.04 -2.16 -0.03 0.00 0.02 0.00 0.00 34.50 32.37 3jyh s PRO 277 CO -0.06 -0.94 0.25 0.95 -0.33 0.00 0.00 177.00 176.87 3jyh s THR 278 N -1.54 0.00 -0.41 0.99 -4.23 -0.66 -4.90 115.64 104.88 3jyh s THR 278 Ca 0.71 -1.84 0.09 0.00 -1.18 0.00 0.00 61.69 59.47 3jyh s THR 278 Cb -0.31 -2.45 0.33 0.00 1.34 0.00 0.00 72.50 71.41 3jyh s THR 278 CO 0.36 0.00 0.87 -0.67 -0.54 0.00 0.00 174.62 174.63 3jyh n ASP 279 N -0.54 -0.61 -0.03 3.99 -0.08 -1.26 -0.84 116.55 117.19 3jyh n ASP 279 Ca 0.02 -3.26 -0.02 0.00 -1.51 0.00 0.00 54.79 50.01 3jyh n ASP 279 Cb 0.64 0.47 -0.01 0.00 2.34 0.00 0.00 41.12 44.56 3jyh n ASP 279 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 3jyh n PHE 280 N 0.47 0.25 0.94 -0.67 -0.00 -1.26 -4.51 117.46 112.69 3jyh n PHE 280 Ca 0.17 0.11 0.12 0.00 -0.00 0.00 0.00 57.45 57.85 3jyh n PHE 280 Cb 0.66 -0.37 0.27 0.00 -0.00 0.00 0.00 39.48 40.05 3jyh n PHE 280 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 3jyh n LEU 281 N -3.15 0.48 0.00 -2.13 4.77 -1.26 -5.00 117.00 110.71 3jyh n LEU 281 Ca -0.03 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3jyh n LEU 281 Cb 0.12 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 3jyh n LEU 281 CO 0.05 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 3jyh n GLY 282 N 1.48 2.81 3.68 -0.72 0.00 -1.26 -5.13 105.19 106.04 3jyh n GLY 282 Ca 0.05 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 3jyh n GLY 282 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3jyh s PRO 283 N -2.00 4.27 0.04 1.61 0.04 -1.26 -4.01 135.00 133.70 3jyh s PRO 283 Ca 0.00 1.84 0.02 0.00 0.04 0.00 0.00 61.00 62.90 3jyh s PRO 283 Cb 0.00 -3.68 -0.03 0.00 0.04 0.00 0.00 34.50 30.84 3jyh s PRO 283 CO 0.00 -0.62 -0.06 -0.51 0.04 0.00 0.00 177.00 175.85 3jyh s LEU 284 N 2.87 2.29 1.03 -3.56 1.43 -0.02 -4.88 118.68 117.85 3jyh s LEU 284 Ca 0.61 -0.60 -0.15 0.00 -1.03 0.00 0.00 54.13 52.95 3jyh s LEU 284 Cb -0.27 -0.08 0.21 0.00 0.03 0.00 0.00 46.19 46.07 3jyh s LEU 284 CO 0.23 -0.27 1.16 -2.16 0.23 0.00 0.00 176.35 175.53 3jyh s PRO 285 N -1.86 0.13 0.52 1.29 0.04 -1.26 -1.66 135.00 132.20 3jyh s PRO 285 Ca -0.09 0.07 -0.22 0.00 0.04 0.00 0.00 61.00 60.80 3jyh s PRO 285 Cb -0.08 -1.74 -0.05 0.00 0.04 0.00 0.00 34.50 32.67 3jyh s PRO 285 CO -0.01 -2.84 1.31 0.00 0.04 0.00 0.00 177.00 175.50 3jyh s ALA 286 N -3.25 2.86 -1.20 8.56 0.00 -1.26 -3.92 121.76 123.55 3jyh s ALA 286 Ca 0.68 1.24 -0.15 0.00 0.00 0.00 0.00 51.96 53.73 3jyh s ALA 286 Cb -0.12 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 3jyh s ALA 286 CO 0.55 -1.20 0.72 0.09 0.00 0.00 0.00 175.76 175.92 3jyh n ASN 287 N -0.90 -4.12 0.26 0.00 3.02 0.11 -4.77 115.26 108.87 3jyh n ASN 287 Ca 0.10 -0.99 0.15 0.00 -0.03 0.00 0.00 54.58 53.80 3jyh n ASN 287 Cb 0.46 -3.42 0.65 0.00 -0.61 0.00 0.00 39.78 36.85 3jyh n ASN 287 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3jyh h PRO 288 N -1.87 0.00 0.26 3.52 0.13 -1.77 -2.30 132.00 129.97 3jyh h PRO 288 Ca -0.65 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.46 3jyh h PRO 288 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 3jyh h PRO 288 CO 0.51 0.09 -0.13 0.28 -0.23 0.00 0.00 178.00 178.52 3jyh h VAL 289 N 0.00 0.78 -0.44 1.56 2.07 -1.89 -0.90 116.25 117.43 3jyh h VAL 289 Ca -0.00 -0.31 0.09 0.00 0.82 0.00 0.00 66.70 67.29 3jyh h VAL 289 Cb 0.54 0.96 -0.09 0.00 -1.52 0.00 0.00 31.29 31.18 3jyh h VAL 289 CO 0.01 0.07 -0.13 0.50 0.02 0.00 0.00 177.57 178.04 3jyh h LYS 290 N -0.52 -0.03 -0.90 1.57 3.64 -1.85 -1.31 116.57 117.18 3jyh h LYS 290 Ca -0.04 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3jyh h LYS 290 Cb 0.38 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.16 3jyh h LYS 290 CO 0.06 -0.02 0.59 0.28 -2.27 0.00 0.00 179.45 178.09 3jyh h VAL 291 N -0.03 1.20 -0.36 2.00 2.07 -1.36 -0.20 116.25 119.58 3jyh h VAL 291 Ca 0.21 -0.41 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 3jyh h VAL 291 Cb 0.35 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 3jyh h VAL 291 CO -0.47 0.22 -0.03 1.23 0.02 0.00 0.00 177.57 178.54 3jyh h GLY 292 N 1.18 0.71 0.89 2.17 0.00 -0.77 -1.82 103.07 105.43 3jyh h GLY 292 Ca 0.34 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 3jyh h GLY 292 CO -0.08 0.50 -0.26 0.00 0.00 0.00 0.00 176.54 176.69 3jyh h ASP 294 N -0.66 -0.30 -0.43 0.00 3.32 -1.05 0.29 116.42 117.59 3jyh h ASP 294 Ca -0.05 0.15 0.03 0.00 0.02 0.00 0.00 57.03 57.19 3jyh h ASP 294 Cb 0.54 0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 3jyh h ASP 294 CO 0.05 -0.12 0.23 0.03 -1.72 0.00 0.00 179.24 177.71 3jyh h ARG 295 N 0.10 0.44 -0.18 3.56 3.08 -1.23 -0.43 114.38 119.73 3jyh h ARG 295 Ca 0.32 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.33 3jyh h ARG 295 Cb 0.51 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 3jyh h ARG 295 CO -0.53 0.29 0.06 1.25 -1.07 0.00 0.00 179.97 179.97 3jyh h LEU 296 N 0.46 0.26 -1.17 3.04 6.46 0.10 -3.17 115.31 121.28 3jyh h LEU 296 Ca 0.18 -0.19 -0.08 0.00 -0.12 0.00 0.00 57.88 57.68 3jyh h LEU 296 Cb 0.06 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 3jyh h LEU 296 CO -0.11 0.37 -0.37 -0.07 -0.62 0.00 0.00 178.44 177.64 3jyh h LEU 297 N 0.12 0.00 -0.57 2.25 3.38 -0.31 -2.90 115.31 117.28 3jyh h LEU 297 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3jyh h LEU 297 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3jyh h LEU 297 CO -0.00 0.37 0.00 -1.54 0.09 0.00 0.00 178.44 177.35 3jyh n SER 298 N -3.78 0.87 -4.85 -0.43 3.41 -0.19 -4.75 113.62 103.91 3jyh n SER 298 Ca -0.01 -1.41 -0.34 0.00 -0.26 0.00 0.00 58.87 56.84 3jyh n SER 298 Cb 0.45 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.31 3jyh n SER 298 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3jyh s GLU 299 N -1.95 3.93 -0.01 4.33 0.41 -1.10 -5.01 118.70 119.32 3jyh s GLU 299 Ca 0.37 0.44 -0.12 0.00 -0.41 0.00 0.00 54.97 55.24 3jyh s GLU 299 Cb 0.19 -2.85 -0.33 0.00 -1.78 0.00 0.00 34.13 29.36 3jyh s GLU 299 CO 0.30 0.43 0.85 0.00 -0.49 0.00 0.00 175.26 176.35 3jyh h ALA 300 N 3.27 0.02 -2.83 5.21 0.00 -1.87 -3.45 119.26 119.61 3jyh h ALA 300 Ca -0.48 -1.01 -0.59 0.00 0.00 0.00 0.00 54.91 52.84 3jyh h ALA 300 Cb 1.19 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 19.21 3jyh h ALA 300 CO 0.67 0.89 -0.16 -0.65 0.00 0.00 0.00 179.25 180.00 3jyh s GLN 301 N -2.59 4.19 0.21 0.00 -0.21 -1.26 -5.00 119.66 115.00 3jyh s GLN 301 Ca -0.12 0.45 -0.07 0.00 0.02 0.00 0.00 55.36 55.64 3jyh s GLN 301 Cb 0.05 -3.35 0.16 0.00 1.00 0.00 0.00 33.01 30.87 3jyh s GLN 301 CO 0.90 0.38 1.72 0.00 -2.12 0.00 0.00 175.29 176.17 3jyh h ARG 302 N 5.87 1.08 -0.76 2.91 2.47 -1.93 -1.86 114.38 122.16 3jyh h ARG 302 Ca -0.45 -0.27 -0.03 0.00 -1.26 0.00 0.00 59.98 57.97 3jyh h ARG 302 Cb 1.19 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 29.34 3jyh h ARG 302 CO 0.70 0.97 0.35 0.82 0.56 0.00 0.00 179.97 183.37 3jyh h ILE 303 N 1.02 1.25 -0.46 2.04 2.04 -1.93 0.07 117.51 121.53 3jyh h ILE 303 Ca 0.21 -0.73 -0.07 0.00 1.00 0.00 0.00 64.86 65.27 3jyh h ILE 303 Cb 0.40 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 3jyh h ILE 303 CO 0.01 0.30 0.01 0.74 0.00 0.00 0.00 178.15 179.21 3jyh h THR 304 N 1.08 1.23 -0.38 -0.27 2.02 -1.75 0.17 112.91 115.01 3jyh h THR 304 Ca 0.26 -0.96 -0.02 0.00 0.77 0.00 0.00 66.41 66.46 3jyh h THR 304 Cb 0.15 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 3jyh h THR 304 CO -0.03 0.34 0.15 1.23 0.37 0.00 0.00 175.52 177.57 3jyh h GLY 305 N 0.95 0.61 0.91 2.16 0.00 -0.61 0.11 103.07 107.21 3jyh h GLY 305 Ca 0.14 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 3jyh h GLY 305 CO 0.02 0.32 0.08 -2.00 0.00 0.00 0.00 176.54 174.95 3jyh h LEU 306 N 0.47 0.21 -0.83 3.11 5.85 -0.53 -1.81 115.31 121.77 3jyh h LEU 306 Ca 0.13 -0.12 0.10 0.00 0.84 0.00 0.00 57.88 58.83 3jyh h LEU 306 Cb 0.20 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.10 3jyh h LEU 306 CO -0.01 0.27 0.47 -0.09 -0.34 0.00 0.00 178.44 178.74 3jyh h ARG 307 N 0.13 0.74 -0.19 1.25 2.43 -0.48 -1.27 114.38 116.99 3jyh h ARG 307 Ca 0.06 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 3jyh h ARG 307 Cb 0.11 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 3jyh h ARG 307 CO -0.01 0.49 0.04 0.00 -1.51 0.00 0.00 179.97 178.99 3jyh h ALA 308 N 1.48 0.26 -0.40 2.80 0.00 -0.60 -1.97 119.26 120.82 3jyh h ALA 308 Ca 0.41 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3jyh h ALA 308 Cb 0.42 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3jyh h ALA 308 CO -0.27 -0.09 0.22 1.25 0.00 0.00 0.00 179.25 180.36 3jyh h LEU 309 N 0.12 0.50 -1.82 0.00 6.46 -0.90 -1.89 115.31 117.78 3jyh h LEU 309 Ca 0.06 -0.08 0.10 0.00 -0.12 0.00 0.00 57.88 57.84 3jyh h LEU 309 Cb 0.28 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.06 3jyh h LEU 309 CO 0.00 0.44 0.32 0.00 -0.62 0.00 0.00 178.44 178.58 3jyh h ALA 310 N 1.08 2.17 -0.05 1.25 0.00 -1.15 -2.22 119.26 120.34 3jyh h ALA 310 Ca 0.14 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3jyh h ALA 310 Cb 0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3jyh h ALA 310 CO -0.02 -0.29 0.07 0.78 0.00 0.00 0.00 179.25 179.79 3jyh h GLY 311 N 0.20 0.00 2.00 0.00 0.00 -0.54 0.14 103.07 104.88 3jyh h GLY 311 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.52 3jyh h GLY 311 CO -0.04 0.00 -0.16 1.41 0.00 0.00 0.00 176.54 177.75 3jyh h LEU 312 N 0.00 0.00 0.00 3.11 3.38 -1.45 -0.37 115.31 119.98 3jyh h LEU 312 Ca 0.03 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.64 3jyh h LEU 312 Cb 0.16 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 3jyh h LEU 312 CO -0.00 0.16 -2.36 0.52 0.09 0.00 0.00 178.44 176.85 3jyh n VAL 313 N -4.05 1.37 0.56 1.22 0.31 0.34 -4.42 118.33 113.67 3jyh n VAL 313 Ca -0.02 -0.58 0.07 0.00 -0.01 0.00 0.00 64.34 63.79 3jyh n VAL 313 Cb 0.24 -1.19 0.05 0.00 -0.91 0.00 0.00 33.84 32.03 3jyh n VAL 313 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3jyh n TYR 314 N -3.11 0.00 -2.70 3.52 4.01 -0.25 -4.68 117.16 113.95 3jyh n TYR 314 Ca -0.40 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.27 3jyh n TYR 314 Cb 0.99 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 40.10 3jyh n TYR 314 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3jyh n ASN 315 N 0.59 -0.38 -0.08 7.72 5.15 -0.17 -4.88 115.26 123.21 3jyh n ASN 315 Ca 0.07 -2.46 -0.06 0.00 -0.60 0.00 0.00 54.58 51.54 3jyh n ASN 315 Cb 0.33 0.31 0.12 0.00 -0.53 0.00 0.00 39.78 40.01 3jyh n ASN 315 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3jyh h ALA 316 N 2.24 0.98 0.00 5.20 0.00 -1.71 -2.50 119.26 123.47 3jyh h ALA 316 Ca -0.23 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3jyh h ALA 316 Cb 1.26 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3jyh h ALA 316 CO 0.12 0.60 -0.28 -1.13 0.00 0.00 0.00 179.25 178.57 3jyh n SER 317 N -4.15 0.29 -0.01 0.00 3.41 -1.26 -4.95 113.62 106.96 3jyh n SER 317 Ca 0.01 0.09 -0.00 0.00 -0.26 0.00 0.00 58.87 58.71 3jyh n SER 317 Cb 0.38 -0.09 -0.00 0.00 -0.26 0.00 0.00 64.21 64.24 3jyh n SER 317 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jyh n GLY 318 N 1.49 0.45 0.02 5.00 0.00 -0.94 -4.94 105.19 106.28 3jyh n GLY 318 Ca 0.06 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.67 3jyh n GLY 318 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3jyh n SER 319 N 0.94 0.44 -4.68 1.61 3.41 -1.26 -4.85 113.62 109.22 3jyh n SER 319 Ca -0.00 -0.24 -0.43 0.00 -0.26 0.00 0.00 58.87 57.95 3jyh n SER 319 Cb 0.01 1.35 -0.02 0.00 -0.26 0.00 0.00 64.21 65.28 3jyh n SER 319 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3jyh s GLU 320 N -3.32 4.35 0.20 4.33 0.41 -1.26 -4.92 118.70 118.50 3jyh s GLU 320 Ca -0.01 1.39 0.11 0.00 -0.41 0.00 0.00 54.97 56.05 3jyh s GLU 320 Cb 0.14 -3.59 -0.07 0.00 -1.78 0.00 0.00 34.13 28.84 3jyh s GLU 320 CO 0.86 -0.45 1.35 0.45 -0.49 0.00 0.00 175.26 176.98 3jyh h HIS 321 N 7.26 0.00 -3.79 1.61 3.86 -1.98 -3.47 115.15 118.64 3jyh h HIS 321 Ca -0.26 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.86 3jyh h HIS 321 Cb 1.11 0.00 -0.13 0.00 1.06 0.00 0.00 27.41 29.45 3jyh h HIS 321 CO 0.73 0.74 -0.28 0.00 0.86 0.00 0.00 177.93 179.97 3jyh s TYR 323 N -3.93 3.13 -0.88 0.00 2.02 0.21 -4.78 117.35 113.12 3jyh s TYR 323 Ca 0.13 -0.02 -0.23 0.00 -0.37 0.00 0.00 57.07 56.59 3jyh s TYR 323 Cb 0.03 -3.11 0.06 0.00 -0.40 0.00 0.00 41.96 38.54 3jyh s TYR 323 CO -0.03 -0.71 1.29 0.34 -1.57 0.00 0.00 175.55 174.87 3jyh s ASP 324 N 1.87 6.38 0.43 2.29 -1.08 -1.26 -0.76 116.67 124.54 3jyh s ASP 324 Ca 0.19 -1.19 0.22 0.00 -0.52 0.00 0.00 52.55 51.25 3jyh s ASP 324 Cb -0.15 -2.52 0.92 0.00 -1.46 0.00 0.00 42.92 39.70 3jyh s ASP 324 CO 0.16 -1.53 1.83 0.16 0.52 0.00 0.00 175.17 176.31 3jyh h ILE 325 N 6.32 0.70 0.05 4.11 3.07 -1.95 -0.96 117.51 128.86 3jyh h ILE 325 Ca -0.01 -1.17 -0.25 0.00 1.55 0.00 0.00 64.86 64.98 3jyh h ILE 325 Cb 1.03 1.75 -0.02 0.00 -0.27 0.00 0.00 36.82 39.31 3jyh h ILE 325 CO 1.31 0.26 -1.27 1.88 -1.05 0.00 0.00 178.15 179.27 3jyh h TYR 326 N 0.00 0.18 0.00 0.16 0.05 -1.89 -3.04 116.97 112.43 3jyh h TYR 326 Ca -0.00 -0.13 -0.15 0.00 0.05 0.00 0.00 58.73 58.50 3jyh h TYR 326 Cb 0.73 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.43 3jyh h TYR 326 CO 0.00 1.13 -1.04 0.00 -1.05 0.00 0.00 178.16 177.20 3jyh h ARG 327 N 0.03 0.00 0.00 4.88 2.47 -1.91 -3.36 114.38 116.48 3jyh h ARG 327 Ca -0.13 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.43 3jyh h ARG 327 Cb 1.90 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 30.19 3jyh h ARG 327 CO 0.14 0.43 -1.12 -0.07 0.56 0.00 0.00 179.97 179.91 3jyh h LEU 328 N 0.00 0.00 -7.52 3.04 3.38 -1.31 -3.44 115.31 109.45 3jyh h LEU 328 Ca -0.09 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.42 3jyh h LEU 328 Cb 1.54 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 41.91 3jyh h LEU 328 CO 0.06 0.61 -0.77 -0.47 0.09 0.00 0.00 178.44 177.95 3jyh s TYR 329 N -2.90 0.86 -0.40 1.13 5.04 -1.15 -4.97 117.35 114.97 3jyh s TYR 329 Ca -0.01 -0.32 -0.11 0.00 -2.44 0.00 0.00 57.07 54.20 3jyh s TYR 329 Cb 0.08 -0.91 0.05 0.00 0.35 0.00 0.00 41.96 41.53 3jyh s TYR 329 CO 0.79 -0.38 0.25 -1.01 -1.34 0.00 0.00 175.55 173.86 3jyh s HIS 330 N 1.91 3.27 -0.14 4.97 3.76 -1.26 -4.50 115.29 123.29 3jyh s HIS 330 Ca 0.05 -1.08 -0.29 0.00 -0.15 0.00 0.00 55.06 53.58 3jyh s HIS 330 Cb -0.12 -2.66 -0.04 0.00 1.11 0.00 0.00 32.58 30.87 3jyh s HIS 330 CO -0.06 -0.71 1.59 0.45 -0.85 0.00 0.00 174.74 175.16 3jyh s SER 331 N 1.82 6.56 0.05 1.40 0.15 -1.26 -4.52 113.70 117.90 3jyh s SER 331 Ca 0.03 1.89 0.01 0.00 0.70 0.00 0.00 55.95 58.57 3jyh s SER 331 Cb -0.21 -2.53 -0.00 0.00 -1.71 0.00 0.00 66.02 61.57 3jyh s SER 331 CO 0.06 -1.06 0.02 0.00 1.20 0.00 0.00 173.24 173.46 3jyh n ALA 333 N -2.74 2.21 -3.61 0.00 0.00 -1.26 -4.17 120.51 110.93 3jyh n ALA 333 Ca -0.02 -0.12 -0.40 0.00 0.00 0.00 0.00 53.44 52.91 3jyh n ALA 333 Cb 0.08 -1.36 -0.09 0.00 0.00 0.00 0.00 19.45 18.08 3jyh n ALA 333 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3jyh s ASP 334 N -2.36 5.60 0.41 0.00 -1.08 -1.26 -4.66 116.67 113.31 3jyh s ASP 334 Ca 0.25 -2.10 0.28 0.00 -0.52 0.00 0.00 52.55 50.46 3jyh s ASP 334 Cb 0.15 -1.96 1.49 0.00 -1.46 0.00 0.00 42.92 41.14 3jyh s ASP 334 CO 0.31 -0.61 1.86 1.55 0.52 0.00 0.00 175.17 178.80 3jyh h PRO 335 N 8.14 0.00 0.00 4.34 0.13 -1.75 0.20 132.00 143.07 3jyh h PRO 335 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 3jyh h PRO 335 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 3jyh h PRO 335 CO 0.80 0.00 -0.13 0.25 -0.23 0.00 0.00 178.00 178.69 3jyh n THR 336 N -2.50 0.17 0.00 1.56 -2.24 -1.26 -4.98 114.28 105.03 3jyh n THR 336 Ca -0.01 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 3jyh n THR 336 Cb 0.07 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 3jyh n THR 336 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jyh n GLY 337 N 1.44 3.31 0.03 3.38 0.00 0.72 -4.95 105.19 109.13 3jyh n GLY 337 Ca 0.06 -1.47 0.11 0.00 0.00 0.00 0.00 46.02 44.72 3jyh n GLY 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyh n GLY 339 N 1.25 -0.74 3.22 0.00 0.00 -1.26 -4.23 105.19 103.43 3jyh n GLY 339 Ca -0.03 -1.41 -0.13 0.00 0.00 0.00 0.00 46.02 44.46 3jyh n GLY 339 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3jyh s THR 340 N 0.00 0.47 0.00 2.61 -4.23 -1.26 -4.49 115.64 108.74 3jyh s THR 340 Ca 0.00 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 3jyh s THR 340 Cb 0.00 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.66 3jyh s THR 340 CO 0.00 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.30 3jyh n GLY 341 N -0.23 -0.26 0.37 3.99 0.00 -1.26 -4.08 105.19 103.71 3jyh n GLY 341 Ca -0.05 -1.84 0.15 0.00 0.00 0.00 0.00 46.02 44.28 3jyh n GLY 341 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3jyh h PRO 342 N 0.00 0.66 0.00 1.61 0.13 -1.98 -1.81 132.00 130.60 3jyh h PRO 342 Ca 0.00 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 65.04 3jyh h PRO 342 Cb 0.00 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 30.97 3jyh h PRO 342 CO 0.00 0.44 -0.24 -0.44 -0.23 0.00 0.00 178.00 177.53 3jyh h ASP 343 N 0.68 0.00 0.01 1.44 3.32 -1.87 -1.94 116.42 118.05 3jyh h ASP 343 Ca 0.56 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.45 3jyh h ASP 343 Cb 0.99 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 3jyh h ASP 343 CO -0.34 0.24 -0.55 0.00 -1.72 0.00 0.00 179.24 176.87 3jyh h ALA 344 N 1.76 0.68 -0.23 3.45 0.00 -1.48 -2.34 119.26 121.10 3jyh h ALA 344 Ca -0.00 -0.51 -0.19 0.00 0.00 0.00 0.00 54.91 54.20 3jyh h ALA 344 Cb 0.44 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3jyh h ALA 344 CO 0.03 0.69 -0.61 0.00 0.00 0.00 0.00 179.25 179.36 3jyh h ARG 345 N 0.44 0.78 -0.37 0.00 3.08 -1.29 -0.43 114.38 116.59 3jyh h ARG 345 Ca 0.01 -0.53 -0.02 0.00 0.07 0.00 0.00 59.98 59.50 3jyh h ARG 345 Cb 1.10 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.21 3jyh h ARG 345 CO 0.11 1.16 0.14 0.00 -1.07 0.00 0.00 179.97 180.30 3jyh h ALA 346 N 0.72 0.48 -0.50 0.04 0.00 -1.39 -0.82 119.26 117.80 3jyh h ALA 346 Ca -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3jyh h ALA 346 Cb 1.21 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 3jyh h ALA 346 CO 0.13 0.09 0.21 2.35 0.00 0.00 0.00 179.25 182.04 3jyh h TRP 347 N 0.45 0.76 -0.84 0.00 2.91 -1.39 -2.02 115.95 115.83 3jyh h TRP 347 Ca 0.12 -0.05 0.13 0.00 1.13 0.00 0.00 58.89 60.22 3jyh h TRP 347 Cb 0.20 -0.23 -0.09 0.00 -0.51 0.00 0.00 29.16 28.54 3jyh h TRP 347 CO 0.00 0.62 0.44 0.22 -1.03 0.00 0.00 178.44 178.69 3jyh h ASP 348 N 0.67 0.56 -0.58 2.65 3.58 -0.86 -0.12 116.42 122.32 3jyh h ASP 348 Ca 0.17 0.08 -0.06 0.00 0.42 0.00 0.00 57.03 57.63 3jyh h ASP 348 Cb 0.18 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 3jyh h ASP 348 CO -0.02 0.26 0.11 0.22 -2.88 0.00 0.00 179.24 176.94 3jyh h TYR 349 N 0.66 1.01 -0.45 0.28 3.20 -0.74 -1.58 116.97 119.35 3jyh h TYR 349 Ca 0.44 -0.13 0.04 0.00 3.14 0.00 0.00 58.73 62.22 3jyh h TYR 349 Cb 0.57 -0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.51 3jyh h TYR 349 CO -0.09 0.87 0.21 1.96 -1.64 0.00 0.00 178.16 179.48 3jyh h GLN 350 N 0.86 0.42 0.00 1.82 4.20 -0.62 -2.68 115.11 119.10 3jyh h GLN 350 Ca 0.18 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3jyh h GLN 350 Cb 0.39 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.08 3jyh h GLN 350 CO 0.01 0.27 0.00 0.00 -0.67 0.00 0.00 178.83 178.44 3jyh h ALA 351 N 1.25 1.00 -0.02 3.87 0.00 -0.70 -1.13 119.26 123.53 3jyh h ALA 351 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3jyh h ALA 351 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3jyh h ALA 351 CO -0.15 0.00 -0.27 0.00 0.00 0.00 0.00 179.25 178.83 3jyh n THR 353 N 0.19 0.18 -0.09 0.00 -2.24 -0.94 -3.21 114.28 108.17 3jyh n THR 353 Ca 0.12 0.06 -0.12 0.00 -2.27 0.00 0.00 64.05 61.84 3jyh n THR 353 Cb 0.46 -0.67 -0.09 0.00 -2.10 0.00 0.00 70.33 67.93 3jyh n THR 353 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3jyh n GLU 354 N -2.78 0.70 -2.98 -0.78 1.02 -0.79 -1.78 120.64 113.25 3jyh n GLU 354 Ca 0.00 0.09 -0.43 0.00 -0.02 0.00 0.00 57.16 56.80 3jyh n GLU 354 Cb 0.00 -1.38 -0.06 0.00 -0.02 0.00 0.00 31.44 29.99 3jyh n GLU 354 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3jyh s ILE 355 N -2.37 4.68 -0.47 -3.67 -1.09 -0.50 -4.47 121.20 113.31 3jyh s ILE 355 Ca -0.22 0.45 -0.21 0.00 -2.23 0.00 0.00 60.65 58.44 3jyh s ILE 355 Cb 0.06 -4.29 0.03 0.00 -1.58 0.00 0.00 42.46 36.69 3jyh s ILE 355 CO 0.47 -0.66 0.71 0.20 -1.23 0.00 0.00 174.94 174.42 3jyh s ASN 356 N 2.08 6.32 -0.51 3.58 0.01 -0.72 -4.28 114.94 121.42 3jyh s ASN 356 Ca 0.29 -0.43 0.07 0.00 -0.71 0.00 0.00 52.86 52.08 3jyh s ASN 356 Cb -0.12 -2.34 0.34 0.00 0.41 0.00 0.00 41.25 39.54 3jyh s ASN 356 CO 0.21 -0.89 0.88 0.18 -1.51 0.00 0.00 177.10 175.97 3jyh n LEU 357 N 6.49 3.26 -3.22 0.60 4.77 -1.26 -3.90 117.00 123.73 3jyh n LEU 357 Ca -0.02 -5.46 -0.37 0.00 -0.03 0.00 0.00 56.01 50.14 3jyh n LEU 357 Cb 0.47 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.41 3jyh n LEU 357 CO 0.56 2.33 2.71 0.35 -1.33 0.00 0.00 177.39 182.01 3jyh n THR 358 N -0.07 4.56 -3.20 -5.08 -2.24 -1.26 -4.29 114.28 102.69 3jyh n THR 358 Ca 0.29 -3.29 -0.39 0.00 -2.27 0.00 0.00 64.05 58.39 3jyh n THR 358 Cb 0.48 -2.26 -0.06 0.00 -2.10 0.00 0.00 70.33 66.40 3jyh n THR 358 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3jyh s PHE 359 N 0.35 3.67 0.14 4.78 0.08 -1.26 -4.74 117.98 120.99 3jyh s PHE 359 Ca 0.62 1.19 0.09 0.00 0.12 0.00 0.00 56.93 58.95 3jyh s PHE 359 Cb 0.21 -2.62 -0.04 0.00 -0.57 0.00 0.00 43.02 40.00 3jyh s PHE 359 CO -0.08 0.33 -0.16 0.00 -0.10 0.00 0.00 175.22 175.21 3jyh s ALA 360 N -0.11 2.75 0.07 5.36 0.00 -0.68 -4.18 121.76 124.97 3jyh s ALA 360 Ca 0.31 -1.40 0.05 0.00 0.00 0.00 0.00 51.96 50.92 3jyh s ALA 360 Cb -0.18 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 3jyh s ALA 360 CO 0.17 0.55 -0.04 -1.54 0.00 0.00 0.00 175.76 174.90 3jyh s SER 361 N -2.35 4.79 0.00 0.00 1.04 -1.14 -4.54 113.70 111.50 3jyh s SER 361 Ca 0.20 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.41 3jyh s SER 361 Cb -0.10 -1.09 0.00 0.00 0.10 0.00 0.00 66.02 64.93 3jyh s SER 361 CO 0.11 0.20 0.05 -0.46 0.98 0.00 0.00 173.24 174.13 3jyh n ASN 362 N 0.84 0.10 -0.30 7.02 0.23 -1.25 -0.16 115.26 121.75 3jyh n ASN 362 Ca -0.13 -0.61 -0.04 0.00 -0.53 0.00 0.00 54.58 53.28 3jyh n ASN 362 Cb 0.52 0.08 -0.02 0.00 -2.08 0.00 0.00 39.78 38.28 3jyh n ASN 362 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3jyh n ASN 363 N -0.08 -4.60 0.02 0.53 5.15 -0.52 -4.46 115.26 111.29 3jyh n ASN 363 Ca 0.00 0.10 0.00 0.00 -0.60 0.00 0.00 54.58 54.08 3jyh n ASN 363 Cb 0.12 -2.45 0.00 0.00 -0.53 0.00 0.00 39.78 36.92 3jyh n ASN 363 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 3jyh n VAL 364 N -2.51 0.36 1.23 3.44 0.31 -1.26 -4.74 118.33 115.17 3jyh n VAL 364 Ca -0.04 0.12 0.13 0.00 -0.01 0.00 0.00 64.34 64.54 3jyh n VAL 364 Cb 0.32 -1.49 0.36 0.00 -0.91 0.00 0.00 33.84 32.12 3jyh n VAL 364 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3jyh n THR 365 N -3.14 0.07 -4.08 2.52 -2.24 -1.26 -4.93 114.28 101.22 3jyh n THR 365 Ca 0.00 -0.37 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 3jyh n THR 365 Cb 0.34 0.79 -0.08 0.00 -2.10 0.00 0.00 70.33 69.28 3jyh n THR 365 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3jyh s ASP 366 N -1.89 0.06 0.00 3.42 1.47 -1.26 -4.32 116.67 114.15 3jyh s ASP 366 Ca 0.34 -1.11 0.19 0.00 1.18 0.00 0.00 52.55 53.16 3jyh s ASP 366 Cb 0.20 0.45 0.94 0.00 -0.34 0.00 0.00 42.92 44.17 3jyh s ASP 366 CO 0.31 -0.94 1.63 1.15 0.68 0.00 0.00 175.17 178.00 3jyh n MET 367 N -0.28 1.31 -3.74 2.11 0.00 -1.26 -3.92 117.12 111.34 3jyh n MET 367 Ca -0.02 -0.47 -0.20 0.00 0.00 0.00 0.00 57.70 57.01 3jyh n MET 367 Cb 0.64 -1.33 -0.01 0.00 0.00 0.00 0.00 33.22 32.51 3jyh n MET 367 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 3jyh s PHE 368 N -1.91 3.27 0.99 3.17 0.08 -1.26 -4.39 117.98 117.93 3jyh s PHE 368 Ca 0.29 -0.12 -0.11 0.00 0.12 0.00 0.00 56.93 57.11 3jyh s PHE 368 Cb 0.15 -1.77 0.17 0.00 -0.57 0.00 0.00 43.02 41.00 3jyh s PHE 368 CO 0.23 0.23 1.01 -2.30 -0.10 0.00 0.00 175.22 174.29 3jyh n PRO 369 N -1.51 -0.97 -2.15 0.24 -0.02 -1.26 -1.44 135.00 127.89 3jyh n PRO 369 Ca -0.05 -0.23 -0.41 0.00 -2.02 0.00 0.00 63.50 60.80 3jyh n PRO 369 Cb 0.58 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.77 3jyh n PRO 369 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3jyh s ASP 370 N -2.50 5.72 -0.49 2.55 2.15 -1.26 -3.79 116.67 119.05 3jyh s ASP 370 Ca 0.66 0.56 0.03 0.00 0.43 0.00 0.00 52.55 54.23 3jyh s ASP 370 Cb -0.23 -2.53 0.15 0.00 -0.30 0.00 0.00 42.92 40.01 3jyh s ASP 370 CO 0.61 -1.98 0.33 -0.76 -0.17 0.00 0.00 175.17 173.20 3jyh s LEU 371 N 7.48 2.72 0.50 -1.34 1.43 0.77 -4.96 118.68 125.29 3jyh s LEU 371 Ca 0.65 -3.03 -0.22 0.00 -1.03 0.00 0.00 54.13 50.51 3jyh s LEU 371 Cb -0.14 -0.96 -0.06 0.00 0.03 0.00 0.00 46.19 45.05 3jyh s LEU 371 CO 0.25 -0.20 1.18 -2.16 0.23 0.00 0.00 176.35 175.66 3jyh s PRO 372 N -0.13 3.53 -0.32 1.29 0.04 -1.26 -2.91 135.00 135.25 3jyh s PRO 372 Ca 0.24 1.80 -0.02 0.00 0.04 0.00 0.00 61.00 63.06 3jyh s PRO 372 Cb -0.11 -2.26 0.12 0.00 0.04 0.00 0.00 34.50 32.29 3jyh s PRO 372 CO -0.10 -0.74 0.18 0.12 0.04 0.00 0.00 177.00 176.50 3jyh s PHE 373 N -1.57 0.43 0.41 0.56 5.36 -1.26 -4.98 117.98 116.94 3jyh s PHE 373 Ca 0.68 -1.17 0.08 0.00 -0.96 0.00 0.00 56.93 55.56 3jyh s PHE 373 Cb -0.29 -0.87 0.00 0.00 -0.34 0.00 0.00 43.02 41.53 3jyh s PHE 373 CO 0.34 -0.84 0.53 0.95 -1.46 0.00 0.00 175.22 174.75 3jyh s THR 374 N 1.64 3.00 0.38 0.12 -4.23 -1.26 -4.19 115.64 111.11 3jyh s THR 374 Ca 0.13 -1.06 0.05 0.00 -1.18 0.00 0.00 61.69 59.63 3jyh s THR 374 Cb -0.19 -3.02 0.25 0.00 1.34 0.00 0.00 72.50 70.88 3jyh s THR 374 CO -0.19 -0.01 2.02 0.44 -0.54 0.00 0.00 174.62 176.34 3jyh h ASP 375 N 0.72 0.56 -0.17 3.99 3.32 -1.98 0.13 116.42 123.00 3jyh h ASP 375 Ca -0.41 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.61 3jyh h ASP 375 Cb 1.28 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 3jyh h ASP 375 CO 0.48 0.43 0.08 -0.33 -1.72 0.00 0.00 179.24 178.17 3jyh h GLU 376 N 0.65 0.25 -0.60 3.56 3.07 -1.99 0.17 114.58 119.69 3jyh h GLU 376 Ca 0.17 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 3jyh h GLU 376 Cb -0.04 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 27.80 3jyh h GLU 376 CO -0.03 0.30 0.38 -0.07 -1.40 0.00 0.00 179.01 178.19 3jyh h LEU 377 N 0.14 0.71 -0.10 1.33 3.38 -1.83 -1.80 115.31 117.13 3jyh h LEU 377 Ca 0.06 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3jyh h LEU 377 Cb 0.14 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3jyh h LEU 377 CO -0.01 0.54 0.06 -0.09 0.09 0.00 0.00 178.44 179.03 3jyh h ARG 378 N 0.81 0.11 -0.38 1.13 2.43 -0.51 0.36 114.38 118.34 3jyh h ARG 378 Ca 0.22 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.43 3jyh h ARG 378 Cb -0.05 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.43 3jyh h ARG 378 CO -0.04 0.08 0.12 1.96 -1.51 0.00 0.00 179.97 180.58 3jyh h GLN 379 N 0.12 0.27 -0.22 0.20 4.20 -0.56 0.32 115.11 119.44 3jyh h GLN 379 Ca 0.04 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 3jyh h GLN 379 Cb -0.00 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 3jyh h GLN 379 CO -0.02 0.18 0.10 0.00 -0.67 0.00 0.00 178.83 178.42 3jyh h ARG 380 N 0.28 0.32 -0.21 1.46 3.08 -1.13 -1.33 114.38 116.84 3jyh h ARG 380 Ca 0.18 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 3jyh h ARG 380 Cb 0.17 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 3jyh h ARG 380 CO -0.19 0.34 0.11 -0.92 -1.07 0.00 0.00 179.97 178.24 3jyh h TYR 381 N 0.22 0.30 -0.37 3.04 3.20 -0.67 -2.91 116.97 119.78 3jyh h TYR 381 Ca 0.07 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.81 3jyh h TYR 381 Cb 0.13 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 3jyh h TYR 381 CO -0.02 0.28 -0.28 0.00 -1.64 0.00 0.00 178.16 176.50 3jyh h LEU 383 N 0.66 0.92 -0.73 0.00 3.38 -1.18 0.47 115.31 118.83 3jyh h LEU 383 Ca 0.08 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.64 3jyh h LEU 383 Cb 0.80 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3jyh h LEU 383 CO 0.07 1.00 -0.53 0.44 0.09 0.00 0.00 178.44 179.51 3jyh h ASP 384 N 0.81 0.00 0.02 -0.43 5.19 -1.43 -2.54 116.42 118.05 3jyh h ASP 384 Ca 0.15 0.00 -0.39 0.00 -0.62 0.00 0.00 57.03 56.17 3jyh h ASP 384 Cb 0.52 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.98 3jyh h ASP 384 CO 0.03 0.53 -2.24 0.41 -3.12 0.00 0.00 179.24 174.84 3jyh n THR 385 N -3.60 1.56 0.11 0.35 -1.04 -0.83 -4.71 114.28 106.11 3jyh n THR 385 Ca -0.00 -0.45 0.01 0.00 -2.04 0.00 0.00 64.05 61.57 3jyh n THR 385 Cb 0.60 -1.71 -0.01 0.00 -1.82 0.00 0.00 70.33 67.39 3jyh n THR 385 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 3jyh n TRP 386 N -3.78 0.00 -2.83 -1.42 7.02 0.12 -4.82 117.44 111.73 3jyh n TRP 386 Ca -0.44 0.00 -0.16 0.00 -1.02 0.00 0.00 57.50 55.87 3jyh n TRP 386 Cb 0.92 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.84 3jyh n TRP 386 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3jyh n GLY 387 N 0.96 -0.19 3.17 6.99 0.00 -0.95 -4.70 105.19 110.46 3jyh n GLY 387 Ca 0.01 -0.11 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 3jyh n GLY 387 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3jyh s VAL 388 N -3.01 1.00 -0.29 1.61 -7.23 -1.22 -4.97 120.40 106.29 3jyh s VAL 388 Ca 0.23 -1.45 -0.10 0.00 -1.81 0.00 0.00 61.98 58.86 3jyh s VAL 388 Cb -0.10 -1.17 -0.03 0.00 0.56 0.00 0.00 36.38 35.65 3jyh s VAL 388 CO 0.29 -0.39 0.16 0.86 -0.31 0.00 0.00 175.10 175.70 3jyh s TRP 389 N -1.82 3.17 0.55 2.82 -0.11 -1.26 -3.12 118.94 119.18 3jyh s TRP 389 Ca 0.01 -0.30 -0.21 0.00 1.22 0.00 0.00 56.10 56.82 3jyh s TRP 389 Cb -0.07 -2.35 -0.05 0.00 -1.50 0.00 0.00 33.47 29.50 3jyh s TRP 389 CO 0.01 -0.34 1.21 -2.30 -4.62 0.00 0.00 176.95 170.91 3jyh n PRO 390 N 5.01 1.40 -3.86 5.86 -0.02 -1.20 -4.89 135.00 137.30 3jyh n PRO 390 Ca -0.14 0.52 -0.31 0.00 -2.02 0.00 0.00 63.50 61.55 3jyh n PRO 390 Cb 0.50 -2.40 -0.12 0.00 -0.02 0.00 0.00 33.50 31.47 3jyh n PRO 390 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3jyh s ARG 391 N -2.78 2.45 0.12 -0.52 0.52 -0.73 -4.97 118.95 113.04 3jyh s ARG 391 Ca 0.72 -3.06 0.17 0.00 -0.52 0.00 0.00 55.73 53.04 3jyh s ARG 391 Cb -0.43 -3.50 0.73 0.00 0.52 0.00 0.00 34.95 32.27 3jyh s ARG 391 CO 0.49 -1.22 1.52 -2.30 0.02 0.00 0.00 175.30 173.80 3jyh n PRO 392 N 2.48 0.08 0.06 3.54 -0.02 -1.26 -1.78 135.00 138.10 3jyh n PRO 392 Ca 0.15 0.37 0.11 0.00 -2.02 0.00 0.00 63.50 62.12 3jyh n PRO 392 Cb 0.35 -1.67 0.01 0.00 -0.02 0.00 0.00 33.50 32.16 3jyh n PRO 392 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3jyh n ASP 393 N -1.83 0.64 -0.09 2.55 3.85 -1.26 -4.57 116.55 115.83 3jyh n ASP 393 Ca 0.02 0.07 -0.10 0.00 -0.71 0.00 0.00 54.79 54.07 3jyh n ASP 393 Cb 0.16 0.72 -0.03 0.00 -1.35 0.00 0.00 41.12 40.62 3jyh n ASP 393 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.20 175.94 3jyh h TRP 394 N 0.00 0.49 -0.53 2.11 2.91 -1.70 -2.66 115.95 116.57 3jyh h TRP 394 Ca 0.00 -0.06 -0.03 0.00 1.13 0.00 0.00 58.89 59.92 3jyh h TRP 394 Cb 0.87 -0.14 -0.03 0.00 -0.51 0.00 0.00 29.16 29.36 3jyh h TRP 394 CO 0.00 0.55 0.20 1.25 -1.03 0.00 0.00 178.44 179.41 3jyh h LEU 395 N 0.30 0.70 -0.37 0.65 5.85 -1.78 0.44 115.31 121.09 3jyh h LEU 395 Ca 0.09 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 3jyh h LEU 395 Cb 0.31 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3jyh h LEU 395 CO 0.00 0.64 0.03 0.25 -0.34 0.00 0.00 178.44 179.03 3jyh h LEU 396 N 0.76 0.61 -0.00 2.25 5.85 -1.77 0.35 115.31 123.36 3jyh h LEU 396 Ca 0.18 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.63 3jyh h LEU 396 Cb 0.17 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3jyh h LEU 396 CO -0.01 0.74 -0.10 0.74 -0.34 0.00 0.00 178.44 179.47 3jyh h THR 397 N 0.46 0.75 -0.14 1.05 2.02 -0.92 -2.43 112.91 113.70 3jyh h THR 397 Ca 0.11 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.18 3jyh h THR 397 Cb 0.41 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 3jyh h THR 397 CO 0.01 0.00 -0.35 -1.28 0.37 0.00 0.00 175.52 174.28 3jyh h SER 398 N -0.17 0.55 0.00 4.18 0.87 -0.10 -3.38 113.55 115.50 3jyh h SER 398 Ca 0.04 -0.58 0.00 0.00 -1.23 0.00 0.00 61.79 60.02 3jyh h SER 398 Cb 0.22 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 3jyh h SER 398 CO -0.10 1.03 -0.00 0.49 -0.53 0.00 0.00 176.83 177.71 3jyh n PHE 399 N -4.35 0.00 -0.07 2.24 3.72 0.12 -5.01 117.46 114.12 3jyh n PHE 399 Ca -0.07 -0.78 0.00 0.00 -0.05 0.00 0.00 57.45 56.55 3jyh n PHE 399 Cb 0.50 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.94 3jyh n PHE 399 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62 3jyh n TRP 400 N -1.02 0.00 0.00 1.38 8.01 -0.91 -4.89 117.44 120.00 3jyh n TRP 400 Ca 0.09 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.28 3jyh n TRP 400 Cb 0.47 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.77 3jyh n TRP 400 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3jyh n GLY 401 N -2.00 2.48 0.08 6.99 0.00 -1.26 -2.07 105.19 109.41 3jyh n GLY 401 Ca 0.00 0.35 0.11 0.00 0.00 0.00 0.00 46.02 46.48 3jyh n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jyh n GLY 402 N 0.00 -0.92 3.45 -0.02 0.00 -1.26 -4.74 105.19 101.71 3jyh n GLY 402 Ca 0.00 -0.52 -0.44 0.00 0.00 0.00 0.00 46.02 45.06 3jyh n GLY 402 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3jyh n ASP 403 N -1.26 5.22 -1.91 1.61 2.03 -0.88 -4.73 116.55 116.64 3jyh n ASP 403 Ca 0.06 -2.98 -0.10 0.00 0.52 0.00 0.00 54.79 52.29 3jyh n ASP 403 Cb 0.35 -1.57 0.26 0.00 -0.72 0.00 0.00 41.12 39.43 3jyh n ASP 403 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3jyh n LEU 404 N 5.64 5.93 -0.01 -2.67 4.77 -1.26 -4.60 117.00 124.80 3jyh n LEU 404 Ca 0.37 -3.39 0.05 0.00 -0.03 0.00 0.00 56.01 53.01 3jyh n LEU 404 Cb 0.43 -0.75 0.44 0.00 -2.33 0.00 0.00 43.42 41.21 3jyh n LEU 404 CO 0.63 0.93 1.16 0.03 -1.33 0.00 0.00 177.39 178.81 3jyh h ARG 405 N 1.94 0.51 -0.01 3.23 3.08 -1.87 -2.35 114.38 118.92 3jyh h ARG 405 Ca 0.35 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.37 3jyh h ARG 405 Cb 2.37 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 32.30 3jyh h ARG 405 CO 0.78 0.33 -0.25 0.00 -1.07 0.00 0.00 179.97 179.76 3jyh n ALA 406 N -2.48 3.06 -1.95 0.04 0.00 -1.26 -4.89 120.51 113.02 3jyh n ALA 406 Ca 0.04 -0.36 -0.28 0.00 0.00 0.00 0.00 53.44 52.84 3jyh n ALA 406 Cb 0.11 -1.18 0.05 0.00 0.00 0.00 0.00 19.45 18.43 3jyh n ALA 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3jyh s ALA 407 N -2.58 3.02 0.02 0.00 0.00 -0.89 -5.10 121.76 116.24 3jyh s ALA 407 Ca 0.23 -0.60 -0.22 0.00 0.00 0.00 0.00 51.96 51.37 3jyh s ALA 407 Cb 0.19 -2.82 0.05 0.00 0.00 0.00 0.00 23.12 20.55 3jyh s ALA 407 CO 0.54 -1.15 0.51 -1.54 0.00 0.00 0.00 175.76 174.11 3jyh s SER 408 N -4.41 -0.43 -1.16 0.00 1.04 -1.26 -4.79 113.70 102.70 3jyh s SER 408 Ca 0.58 0.24 -0.04 0.00 0.48 0.00 0.00 55.95 57.21 3jyh s SER 408 Cb -0.11 0.47 -0.03 0.00 0.10 0.00 0.00 66.02 66.45 3jyh s SER 408 CO 0.48 -0.66 0.91 0.59 0.98 0.00 0.00 173.24 175.54 3jyh n ASN 409 N 0.62 -3.79 -4.02 7.02 4.13 -1.10 -4.87 115.26 113.26 3jyh n ASN 409 Ca -0.19 -0.71 -0.23 0.00 1.68 0.00 0.00 54.58 55.13 3jyh n ASN 409 Cb 0.59 -4.86 -0.16 0.00 -1.54 0.00 0.00 39.78 33.81 3jyh n ASN 409 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3jyh s ILE 410 N -3.43 0.97 -0.25 2.41 1.01 -0.96 -0.99 121.20 119.95 3jyh s ILE 410 Ca 0.20 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 3jyh s ILE 410 Cb -0.03 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.53 3jyh s ILE 410 CO 0.76 0.31 0.07 -0.63 0.00 0.00 0.00 174.94 175.44 3jyh s ILE 411 N 0.41 4.32 -0.41 2.92 1.01 0.15 -1.17 121.20 128.44 3jyh s ILE 411 Ca -0.08 -0.18 -0.13 0.00 0.00 0.00 0.00 60.65 60.25 3jyh s ILE 411 Cb -0.12 -3.03 0.03 0.00 0.01 0.00 0.00 42.46 39.35 3jyh s ILE 411 CO 0.02 0.33 0.28 -0.36 0.00 0.00 0.00 174.94 175.21 3jyh s PHE 412 N 1.61 3.25 0.09 3.97 0.08 0.46 0.23 117.98 127.66 3jyh s PHE 412 Ca 0.06 -0.81 0.03 0.00 0.12 0.00 0.00 56.93 56.33 3jyh s PHE 412 Cb -0.15 -2.63 -0.04 0.00 -0.57 0.00 0.00 43.02 39.63 3jyh s PHE 412 CO 0.04 -0.65 0.11 -1.54 -0.10 0.00 0.00 175.22 173.08 3jyh s SER 413 N 1.77 5.66 -0.02 1.36 1.04 -0.96 -0.67 113.70 121.89 3jyh s SER 413 Ca 0.04 0.02 -0.16 0.00 0.48 0.00 0.00 55.95 56.33 3jyh s SER 413 Cb -0.20 -1.56 0.03 0.00 0.10 0.00 0.00 66.02 64.39 3jyh s SER 413 CO 0.08 0.16 0.33 0.20 0.98 0.00 0.00 173.24 174.99 3jyh s ASN 414 N -2.51 -0.21 -0.12 7.02 0.01 0.15 -0.48 114.94 118.80 3jyh s ASN 414 Ca 0.30 0.12 -0.10 0.00 -0.71 0.00 0.00 52.86 52.47 3jyh s ASN 414 Cb -0.12 0.32 -0.05 0.00 0.41 0.00 0.00 41.25 41.82 3jyh s ASN 414 CO 0.23 -0.46 0.22 -0.83 -1.51 0.00 0.00 177.10 174.76 3jyh s GLY 415 N -1.33 2.22 0.59 0.66 0.00 -1.24 -0.57 107.32 107.65 3jyh s GLY 415 Ca -0.13 -0.52 0.35 0.00 0.00 0.00 0.00 44.72 44.42 3jyh s GLY 415 CO 0.05 -0.03 2.20 3.45 0.00 0.00 0.00 173.10 178.77 3jyh h ASN 416 N 5.53 0.00 0.50 1.64 -1.07 -1.19 -1.23 115.58 119.76 3jyh h ASN 416 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.88 3jyh h ASN 416 Cb 1.20 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.45 3jyh h ASN 416 CO 0.65 0.04 -0.01 0.18 0.07 0.00 0.00 177.43 178.35 3jyh n LEU 417 N -3.38 0.06 -4.63 6.14 4.77 -0.64 -4.87 117.00 114.45 3jyh n LEU 417 Ca -0.02 0.23 -0.41 0.00 -0.03 0.00 0.00 56.01 55.78 3jyh n LEU 417 Cb 0.16 -0.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.94 3jyh n LEU 417 CO 0.25 0.01 0.50 -0.62 -1.33 0.00 0.00 177.39 176.20 3jyh s ASP 418 N -2.52 6.67 0.60 -1.43 2.15 -0.47 -4.76 116.67 116.91 3jyh s ASP 418 Ca 0.30 0.82 0.32 0.00 0.43 0.00 0.00 52.55 54.41 3jyh s ASP 418 Cb 0.20 -2.38 1.91 0.00 -0.30 0.00 0.00 42.92 42.35 3jyh s ASP 418 CO 0.46 -0.44 2.27 1.55 -0.17 0.00 0.00 175.17 178.84 3jyh h PRO 419 N 7.83 0.00 0.00 4.34 0.13 -1.86 -1.07 132.00 141.37 3jyh h PRO 419 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3jyh h PRO 419 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3jyh h PRO 419 CO 0.82 0.00 0.00 -1.49 -0.23 0.00 0.00 178.00 177.10 3jyh h TRP 420 N 0.00 0.00 -0.88 1.56 4.06 -1.91 -3.30 115.95 115.48 3jyh h TRP 420 Ca -0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 3jyh h TRP 420 Cb 0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.13 3jyh h TRP 420 CO 0.00 0.00 0.50 0.00 -3.56 0.00 0.00 178.44 175.38 3jyh h ALA 421 N 2.24 1.23 0.00 1.49 0.00 -1.47 -1.84 119.26 120.92 3jyh h ALA 421 Ca 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3jyh h ALA 421 Cb 0.50 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3jyh h ALA 421 CO 0.00 0.64 -0.01 0.78 0.00 0.00 0.00 179.25 180.66 3jyh h GLY 422 N 1.23 0.00 -0.63 0.00 0.00 -1.76 -1.37 103.07 100.55 3jyh h GLY 422 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.64 3jyh h GLY 422 CO -0.05 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.10 3jyh n GLY 423 N -0.82 0.10 0.00 4.60 0.00 -0.69 -4.89 105.19 103.49 3jyh n GLY 423 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3jyh n GLY 423 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jyh n GLY 424 N 1.07 4.41 3.66 -0.02 0.00 -0.52 -1.21 105.19 112.58 3jyh n GLY 424 Ca 0.15 -2.16 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 3jyh n GLY 424 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jyh s ILE 425 N -0.22 5.00 -0.60 -0.61 -1.09 -1.26 -4.80 121.20 117.63 3jyh s ILE 425 Ca 0.00 1.27 0.06 0.00 -2.23 0.00 0.00 60.65 59.75 3jyh s ILE 425 Cb 0.00 -3.98 0.01 0.00 -1.58 0.00 0.00 42.46 36.91 3jyh s ILE 425 CO 0.00 0.10 0.53 0.54 -1.23 0.00 0.00 174.94 174.88 3jyh n ARG 426 N 5.03 1.87 -4.04 2.79 5.12 -1.26 -4.80 116.66 121.37 3jyh n ARG 426 Ca -0.00 -0.55 -0.11 0.00 -1.93 0.00 0.00 57.85 55.26 3jyh n ARG 426 Cb 0.50 -0.99 -0.11 0.00 -1.16 0.00 0.00 32.46 30.70 3jyh n ARG 426 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 3jyh s ARG 427 N -0.91 0.48 0.31 5.56 1.70 -1.26 -4.88 118.95 119.94 3jyh s ARG 427 Ca 0.05 -0.80 -0.29 0.00 -0.47 0.00 0.00 55.73 54.22 3jyh s ARG 427 Cb 0.05 -0.07 -0.12 0.00 -0.57 0.00 0.00 34.95 34.24 3jyh s ARG 427 CO 0.14 -0.01 1.42 0.09 -1.08 0.00 0.00 175.30 175.85 3jyh n ASN 428 N 1.24 3.15 -0.02 -2.89 4.13 -1.26 -4.34 115.26 115.27 3jyh n ASN 428 Ca -0.21 1.18 0.05 0.00 1.68 0.00 0.00 54.58 57.27 3jyh n ASN 428 Cb 0.56 -1.51 -0.11 0.00 -1.54 0.00 0.00 39.78 37.18 3jyh n ASN 428 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3jyh n LEU 429 N 1.45 0.00 -3.85 3.41 4.77 -0.36 -4.96 117.00 117.47 3jyh n LEU 429 Ca 0.07 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.95 3jyh n LEU 429 Cb 0.35 0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.52 3jyh n LEU 429 CO 0.63 0.06 0.48 -0.94 -1.33 0.00 0.00 177.39 176.29 3jyh s SER 430 N -3.85 0.16 0.44 -1.43 1.04 -1.09 -4.80 113.70 104.18 3jyh s SER 430 Ca -0.06 -1.22 0.17 0.00 0.48 0.00 0.00 55.95 55.32 3jyh s SER 430 Cb 0.08 0.83 1.10 0.00 0.10 0.00 0.00 66.02 68.13 3jyh s SER 430 CO 0.59 -1.65 1.93 0.00 0.98 0.00 0.00 173.24 175.09 3jyh h ALA 431 N 2.01 2.17 -0.00 5.32 0.00 -1.97 -3.16 119.26 123.64 3jyh h ALA 431 Ca -0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3jyh h ALA 431 Cb 1.25 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3jyh h ALA 431 CO 0.41 -0.37 -0.02 -1.13 0.00 0.00 0.00 179.25 178.14 3jyh n SER 432 N -4.46 0.86 -4.37 0.00 3.41 -1.26 -4.90 113.62 102.89 3jyh n SER 432 Ca 0.14 -0.93 -0.41 0.00 -0.26 0.00 0.00 58.87 57.42 3jyh n SER 432 Cb 0.55 0.26 -0.11 0.00 -0.26 0.00 0.00 64.21 64.65 3jyh n SER 432 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3jyh s VAL 433 N -0.39 4.57 -0.03 -3.33 1.01 -1.19 -2.28 120.40 118.75 3jyh s VAL 433 Ca 0.02 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.16 3jyh s VAL 433 Cb 0.01 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.81 3jyh s VAL 433 CO 0.03 -0.26 -0.21 -0.63 0.00 0.00 0.00 175.10 174.03 3jyh s ILE 434 N 1.55 1.67 -0.06 2.22 -1.09 -0.32 -1.22 121.20 123.96 3jyh s ILE 434 Ca 0.02 -0.88 -0.04 0.00 -2.23 0.00 0.00 60.65 57.52 3jyh s ILE 434 Cb -0.19 -1.41 -0.04 0.00 -1.58 0.00 0.00 42.46 39.24 3jyh s ILE 434 CO 0.07 0.47 0.11 0.00 -1.23 0.00 0.00 174.94 174.36 3jyh s ALA 435 N -0.27 3.73 -0.05 9.38 0.00 -1.26 -0.41 121.76 132.88 3jyh s ALA 435 Ca 0.02 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.23 3jyh s ALA 435 Cb -0.10 -1.77 0.02 0.00 0.00 0.00 0.00 23.12 21.27 3jyh s ALA 435 CO 0.01 0.66 -0.02 0.08 0.00 0.00 0.00 175.76 176.48 3jyh s VAL 436 N -1.11 0.44 -0.12 0.00 1.01 0.16 -4.78 120.40 116.01 3jyh s VAL 436 Ca 0.19 -0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.13 3jyh s VAL 436 Cb -0.12 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 3jyh s VAL 436 CO 0.09 0.23 -0.01 -0.89 0.00 0.00 0.00 175.10 174.52 3jyh s THR 437 N 1.28 4.19 -0.37 3.92 2.01 -1.26 -0.68 115.64 124.74 3jyh s THR 437 Ca -0.05 -0.28 -0.06 0.00 0.31 0.00 0.00 61.69 61.61 3jyh s THR 437 Cb -0.14 -2.79 0.07 0.00 0.01 0.00 0.00 72.50 69.65 3jyh s THR 437 CO -0.02 0.56 0.14 -0.63 -0.69 0.00 0.00 174.62 173.98 3jyh s ILE 438 N -0.37 3.66 -0.02 1.82 1.01 0.27 -4.95 121.20 122.61 3jyh s ILE 438 Ca 0.07 -1.43 -0.30 0.00 0.00 0.00 0.00 60.65 58.99 3jyh s ILE 438 Cb -0.12 -3.20 -0.06 0.00 0.01 0.00 0.00 42.46 39.08 3jyh s ILE 438 CO 0.02 -0.35 1.68 -1.10 0.00 0.00 0.00 174.94 175.19 3jyh s GLN 439 N 1.33 4.18 -0.15 2.79 -1.52 -1.26 -1.47 119.66 123.56 3jyh s GLN 439 Ca 0.01 2.25 0.00 0.00 -1.95 0.00 0.00 55.36 55.67 3jyh s GLN 439 Cb -0.21 -3.93 0.00 0.00 -0.22 0.00 0.00 33.01 28.64 3jyh s GLN 439 CO 0.01 -0.83 0.00 0.41 -0.25 0.00 0.00 175.29 174.62 3jyh n GLY 440 N 4.14 0.51 3.72 3.09 0.00 -1.26 -4.69 105.19 110.71 3jyh n GLY 440 Ca 0.17 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 3jyh n GLY 440 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3jyh s GLY 441 N -2.62 2.16 0.00 -0.02 0.00 -0.54 -4.89 107.32 101.41 3jyh s GLY 441 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 44.72 44.21 3jyh s GLY 441 CO 0.00 0.41 0.00 0.00 0.00 0.00 0.00 173.10 173.51 3jyh n ALA 442 N 3.66 0.00 -2.26 3.20 0.00 -1.26 -1.62 120.51 122.23 3jyh n ALA 442 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.89 3jyh n ALA 442 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 3jyh n ALA 442 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3jyh s HIS 443 N 0.11 2.48 -0.13 0.00 2.46 -0.48 -3.70 115.29 116.03 3jyh s HIS 443 Ca 0.00 0.69 -0.01 0.00 0.47 0.00 0.00 55.06 56.21 3jyh s HIS 443 Cb 0.00 -3.71 0.00 0.00 -0.13 0.00 0.00 32.58 28.74 3jyh s HIS 443 CO 0.00 -2.52 0.09 -2.39 -2.47 0.00 0.00 174.74 167.45 3jyh n HIS 444 N 7.03 -0.28 0.01 3.88 1.44 -1.26 -4.85 115.22 121.19 3jyh n HIS 444 Ca 0.16 0.10 -0.04 0.00 -2.01 0.00 0.00 57.72 55.92 3jyh n HIS 444 Cb 0.44 -0.40 0.17 0.00 0.12 0.00 0.00 29.99 30.33 3jyh n HIS 444 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 3jyh h LEU 445 N 1.06 0.51 -2.73 2.39 5.85 -1.93 -3.18 115.31 117.27 3jyh h LEU 445 Ca -0.10 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 3jyh h LEU 445 Cb 0.21 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 3jyh h LEU 445 CO 0.06 0.78 -0.01 -2.24 -0.34 0.00 0.00 178.44 176.70 3jyh h ASP 446 N 0.43 0.00 1.73 1.25 2.03 -1.93 -1.80 116.42 118.13 3jyh h ASP 446 Ca 0.06 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.36 3jyh h ASP 446 Cb 0.74 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.24 3jyh h ASP 446 CO 0.06 0.01 -0.25 -0.07 -1.03 0.00 0.00 179.24 177.96 3jyh h LEU 447 N 0.00 0.00-10.26 0.15 3.38 -1.91 -3.44 115.31 103.23 3jyh h LEU 447 Ca -0.00 -0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 3jyh h LEU 447 Cb 0.04 0.00 0.13 0.00 0.09 0.00 0.00 40.66 40.92 3jyh h LEU 447 CO 0.00 0.00 0.33 -0.13 0.09 0.00 0.00 178.44 178.74 3jyh s ARG 448 N -3.24 2.30 0.68 1.13 0.52 -0.68 -0.87 118.95 118.78 3jyh s ARG 448 Ca 0.05 1.35 -0.17 0.00 -0.52 0.00 0.00 55.73 56.44 3jyh s ARG 448 Cb 0.06 -1.89 0.01 0.00 0.52 0.00 0.00 34.95 33.65 3jyh s ARG 448 CO 0.70 -1.64 1.24 0.00 0.02 0.00 0.00 175.30 175.62 3jyh n ALA 449 N -3.14 0.78 -1.53 2.13 0.00 -1.26 -3.37 120.51 114.13 3jyh n ALA 449 Ca 0.10 -0.07 -0.43 0.00 0.00 0.00 0.00 53.44 53.04 3jyh n ALA 449 Cb 0.52 -2.29 -0.00 0.00 0.00 0.00 0.00 19.45 17.68 3jyh n ALA 449 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3jyh n SER 450 N -2.08 0.29 -3.79 0.00 7.64 -1.26 -4.91 113.62 109.51 3jyh n SER 450 Ca 0.15 1.05 -0.13 0.00 1.01 0.00 0.00 58.87 60.95 3jyh n SER 450 Cb 0.49 -1.21 -0.12 0.00 -1.01 0.00 0.00 64.21 62.36 3jyh n SER 450 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3jyh s HIS 451 N -1.24 -0.27 0.55 1.43 5.04 -1.26 -5.04 115.29 114.50 3jyh s HIS 451 Ca 0.62 0.65 0.22 0.00 -1.54 0.00 0.00 55.06 55.01 3jyh s HIS 451 Cb -0.66 0.09 1.45 0.00 0.04 0.00 0.00 32.58 33.50 3jyh s HIS 451 CO 0.58 -0.13 2.13 -1.00 -2.34 0.00 0.00 174.74 173.98 3jyh h PRO 452 N 5.83 0.00 -0.02 2.88 0.13 -2.03 -1.83 132.00 136.97 3jyh h PRO 452 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3jyh h PRO 452 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3jyh h PRO 452 CO 0.36 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.52 3jyh n GLU 453 N -4.27 1.09 -1.87 0.86 -0.58 -1.26 -4.91 120.64 109.69 3jyh n GLU 453 Ca 0.00 -0.13 -0.40 0.00 -0.42 0.00 0.00 57.16 56.22 3jyh n GLU 453 Cb 0.23 -1.35 0.01 0.00 -0.57 0.00 0.00 31.44 29.76 3jyh n GLU 453 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3jyh s ASP 454 N -1.68 5.93 0.31 1.62 1.01 -0.69 -4.79 116.67 118.37 3jyh s ASP 454 Ca 0.33 2.83 -0.29 0.00 0.71 0.00 0.00 52.55 56.13 3jyh s ASP 454 Cb 0.15 -2.65 -0.10 0.00 1.01 0.00 0.00 42.92 41.34 3jyh s ASP 454 CO 0.26 -1.13 1.17 -2.16 0.21 0.00 0.00 175.17 173.51 3jyh s PRO 455 N -2.45 4.49 0.33 8.23 0.04 -1.26 -4.94 135.00 139.43 3jyh s PRO 455 Ca 0.61 1.92 0.16 0.00 0.04 0.00 0.00 61.00 63.73 3jyh s PRO 455 Cb -0.42 -3.08 1.13 0.00 0.04 0.00 0.00 34.50 32.16 3jyh s PRO 455 CO 0.53 0.03 1.44 0.00 0.04 0.00 0.00 177.00 179.04 3jyh n ALA 456 N 0.93 0.84 -0.13 8.56 0.00 -1.26 -0.99 120.51 128.47 3jyh n ALA 456 Ca -0.00 0.94 -0.01 0.00 0.00 0.00 0.00 53.44 54.37 3jyh n ALA 456 Cb 0.44 -0.89 0.24 0.00 0.00 0.00 0.00 19.45 19.25 3jyh n ALA 456 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3jyh h SER 457 N 0.00 0.73 -0.10 0.00 0.87 -1.92 -0.34 113.55 112.80 3jyh h SER 457 Ca 0.73 -0.09 -0.19 0.00 -1.23 0.00 0.00 61.79 61.02 3jyh h SER 457 Cb 1.87 -0.19 0.01 0.00 -0.44 0.00 0.00 62.40 63.65 3jyh h SER 457 CO -0.73 0.65 -0.68 1.62 -0.53 0.00 0.00 176.83 177.16 3jyh h VAL 458 N 0.80 1.33 -0.38 2.23 3.04 -1.34 -0.55 116.25 121.38 3jyh h VAL 458 Ca 0.19 -1.96 0.08 0.00 -1.01 0.00 0.00 66.70 64.01 3jyh h VAL 458 Cb 0.14 2.19 -0.08 0.00 -2.01 0.00 0.00 31.29 31.54 3jyh h VAL 458 CO -0.02 0.60 -0.13 0.58 -1.01 0.00 0.00 177.57 177.59 3jyh h VAL 459 N 0.27 0.55 -0.15 1.51 2.07 -1.36 0.46 116.25 119.59 3jyh h VAL 459 Ca -0.06 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.37 3jyh h VAL 459 Cb 1.33 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 3jyh h VAL 459 CO 0.14 0.00 -0.31 -0.33 0.02 0.00 0.00 177.57 177.09 3jyh h GLU 460 N -0.05 0.30 -0.27 1.57 4.39 -1.03 -2.59 114.58 116.91 3jyh h GLU 460 Ca 0.19 -0.12 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 3jyh h GLU 460 Cb 0.33 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 3jyh h GLU 460 CO -0.42 0.59 0.05 0.00 -1.16 0.00 0.00 179.01 178.08 3jyh h ALA 461 N 1.41 0.35 -0.98 3.43 0.00 -0.12 -2.27 119.26 121.08 3jyh h ALA 461 Ca 0.04 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.80 3jyh h ALA 461 Cb 0.69 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 3jyh h ALA 461 CO 0.05 0.02 0.65 0.00 0.00 0.00 0.00 179.25 179.97 3jyh h ARG 462 N 0.25 1.23 -0.33 0.00 3.08 -0.86 -1.20 114.38 116.55 3jyh h ARG 462 Ca 0.08 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3jyh h ARG 462 Cb 0.31 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 3jyh h ARG 462 CO 0.00 0.81 0.13 0.87 -1.07 0.00 0.00 179.97 180.72 3jyh h LYS 463 N 1.27 0.50 -0.48 0.04 1.57 -1.29 0.30 116.57 118.47 3jyh h LYS 463 Ca 0.38 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 59.07 3jyh h LYS 463 Cb -0.03 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 3jyh h LYS 463 CO -0.11 0.50 0.29 1.25 -0.57 0.00 0.00 179.45 180.81 3jyh h LEU 464 N 0.39 0.58 0.27 2.94 5.85 -1.20 0.21 115.31 124.36 3jyh h LEU 464 Ca 0.11 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3jyh h LEU 464 Cb 0.18 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.07 3jyh h LEU 464 CO -0.01 0.46 -0.13 -0.33 -0.34 0.00 0.00 178.44 178.10 3jyh h GLU 465 N 0.65 -0.35 -0.67 1.25 5.08 -0.99 0.40 114.58 119.94 3jyh h GLU 465 Ca 0.17 0.02 0.14 0.00 -1.00 0.00 0.00 59.36 58.69 3jyh h GLU 465 Cb -0.01 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 29.22 3jyh h GLU 465 CO -0.03 -0.21 0.15 0.00 -1.00 0.00 0.00 179.01 177.92 3jyh h ALA 466 N 0.35 0.84 -0.51 3.43 0.00 -0.22 0.31 119.26 123.45 3jyh h ALA 466 Ca -0.04 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3jyh h ALA 466 Cb 0.29 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3jyh h ALA 466 CO 0.06 -0.32 0.03 1.15 0.00 0.00 0.00 179.25 180.17 3jyh h THR 467 N 0.27 1.26 -0.14 0.00 2.02 -0.61 -0.99 112.91 114.72 3jyh h THR 467 Ca 0.37 -1.04 -0.04 0.00 0.77 0.00 0.00 66.41 66.47 3jyh h THR 467 Cb 0.59 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 3jyh h THR 467 CO -0.46 0.37 -0.08 0.40 0.37 0.00 0.00 175.52 176.11 3jyh h ILE 468 N 0.75 1.32 -0.73 3.11 2.04 -0.02 -2.22 117.51 121.76 3jyh h ILE 468 Ca 0.15 -1.15 0.02 0.00 1.00 0.00 0.00 64.86 64.88 3jyh h ILE 468 Cb 0.48 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 3jyh h ILE 468 CO 0.02 0.34 0.47 0.40 0.00 0.00 0.00 178.15 179.38 3jyh h ILE 469 N -0.05 1.13 -0.57 -0.67 2.04 -0.38 -1.42 117.51 117.60 3jyh h ILE 469 Ca 0.03 -0.32 0.09 0.00 1.00 0.00 0.00 64.86 65.66 3jyh h ILE 469 Cb 0.57 0.12 -0.07 0.00 -0.74 0.00 0.00 36.82 36.69 3jyh h ILE 469 CO 0.02 0.17 0.17 1.23 0.00 0.00 0.00 178.15 179.75 3jyh h GLY 470 N 0.93 0.76 2.00 5.37 0.00 -1.17 -1.66 103.07 109.30 3jyh h GLY 470 Ca 0.29 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 3jyh h GLY 470 CO -0.09 -0.05 -0.07 1.05 0.00 0.00 0.00 176.54 177.38 3jyh h GLU 471 N 0.33 0.00 0.08 4.80 9.09 -0.68 -1.67 114.58 126.53 3jyh h GLU 471 Ca 0.29 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.58 3jyh h GLU 471 Cb 0.37 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.49 3jyh h GLU 471 CO -0.32 0.07 -0.50 -1.49 0.05 0.00 0.00 179.01 176.82 3jyh h TRP 472 N 0.00 0.35 0.04 2.06 6.55 -0.42 -2.39 115.95 122.13 3jyh h TRP 472 Ca -0.00 -0.25 0.02 0.00 0.95 0.00 0.00 58.89 59.61 3jyh h TRP 472 Cb 0.41 -0.02 -0.02 0.00 -0.86 0.00 0.00 29.16 28.66 3jyh h TRP 472 CO 0.00 1.18 -0.14 0.28 -1.05 0.00 0.00 178.44 178.71 3jyh h VAL 473 N -0.58 0.67 -0.88 1.49 2.07 -1.30 -1.02 116.25 116.69 3jyh h VAL 473 Ca -0.08 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.53 3jyh h VAL 473 Cb 1.37 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 3jyh h VAL 473 CO 0.09 0.00 0.53 0.50 0.02 0.00 0.00 177.57 178.71 3jyh h LYS 474 N -0.25 0.87 -0.02 1.57 3.64 -1.41 -2.60 116.57 118.37 3jyh h LYS 474 Ca 0.04 -0.05 -0.18 0.00 -1.27 0.00 0.00 60.65 59.18 3jyh h LYS 474 Cb 0.29 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3jyh h LYS 474 CO -0.11 0.57 -0.79 0.00 -2.27 0.00 0.00 179.45 176.85 3jyh h ALA 475 N 1.46 0.62 -0.56 5.00 0.00 -1.23 -3.22 119.26 121.33 3jyh h ALA 475 Ca 0.42 -0.67 0.09 0.00 0.00 0.00 0.00 54.91 54.75 3jyh h ALA 475 Cb 0.34 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3jyh h ALA 475 CO -0.23 0.86 0.38 0.00 0.00 0.00 0.00 179.25 180.26 3jyh h ALA 476 N 1.04 2.03 -0.02 0.00 0.00 -0.78 -3.51 119.26 118.03 3jyh h ALA 476 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3jyh h ALA 476 Cb 1.38 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3jyh h ALA 476 CO 0.12 -0.16 0.00 2.89 0.00 0.00 0.00 179.25 182.10