#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yr6 n MET 498 N 0.00 0.00 0.11 1.61 -0.00 -1.22 -3.64 117.12 113.98 1yr6 n MET 498 Ca 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 57.70 57.90 1yr6 n MET 498 Cb 0.00 0.00 0.76 0.00 -0.00 0.00 0.00 33.22 33.98 1yr6 n MET 498 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1yr6 h ALA 499 N 0.00 2.09 -6.13 3.17 0.00 -1.77 -3.46 119.26 113.15 1yr6 h ALA 499 Ca 0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 54.91 54.51 1yr6 h ALA 499 Cb 0.22 0.03 0.08 0.00 0.00 0.00 0.00 17.79 18.13 1yr6 h ALA 499 CO 0.00 -0.57 -0.87 0.43 0.00 0.00 0.00 179.25 178.24 1yr6 n SER 500 N -3.83 -5.61 -4.65 0.00 7.64 -0.80 -4.97 113.62 101.41 1yr6 n SER 500 Ca 0.06 -0.92 -0.34 0.00 1.01 0.00 0.00 58.87 58.69 1yr6 n SER 500 Cb 0.55 -3.55 -0.10 0.00 -1.01 0.00 0.00 64.21 60.10 1yr6 n SER 500 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1yr6 s MET 1 N -5.56 2.81 -0.13 1.43 1.00 0.13 -5.01 119.30 113.98 1yr6 s MET 1 Ca 0.41 -0.54 0.02 0.00 0.00 0.00 0.00 55.69 55.58 1yr6 s MET 1 Cb -0.14 -2.67 -0.00 0.00 0.00 0.00 0.00 34.83 32.02 1yr6 s MET 1 CO 0.85 0.66 -0.20 0.42 0.00 0.00 0.00 175.02 176.74 1yr6 s ILE 2 N -0.94 2.34 -0.14 2.53 1.01 -1.26 0.35 121.20 125.09 1yr6 s ILE 2 Ca 0.15 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.92 1yr6 s ILE 2 Cb -0.11 -1.94 0.01 0.00 0.01 0.00 0.00 42.46 40.43 1yr6 s ILE 2 CO 0.05 0.54 -0.21 -0.69 0.00 0.00 0.00 174.94 174.64 1yr6 s VAL 3 N 0.56 2.00 -0.28 2.92 1.01 0.16 -2.30 120.40 124.47 1yr6 s VAL 3 Ca -0.12 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 1yr6 s VAL 3 Cb -0.16 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 1yr6 s VAL 3 CO 0.04 0.54 0.12 -0.69 0.00 0.00 0.00 175.10 175.10 1yr6 s VAL 4 N 0.93 4.55 -0.24 2.92 1.01 0.73 -0.10 120.40 130.20 1yr6 s VAL 4 Ca -0.05 -0.23 -0.14 0.00 0.00 0.00 0.00 61.98 61.57 1yr6 s VAL 4 Cb -0.15 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1yr6 s VAL 4 CO -0.04 0.22 0.32 -0.36 0.00 0.00 0.00 175.10 175.24 1yr6 s PHE 5 N 1.63 3.30 -0.04 5.22 0.08 0.63 -0.05 117.98 128.75 1yr6 s PHE 5 Ca 0.06 0.42 0.06 0.00 0.12 0.00 0.00 56.93 57.58 1yr6 s PHE 5 Cb -0.16 -2.48 -0.01 0.00 -0.57 0.00 0.00 43.02 39.80 1yr6 s PHE 5 CO 0.06 -0.09 -0.21 0.08 -0.10 0.00 0.00 175.22 174.95 1yr6 s VAL 6 N 1.60 1.74 0.00 -0.44 1.01 -0.08 -2.94 120.40 121.28 1yr6 s VAL 6 Ca 0.14 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1yr6 s VAL 6 Cb -0.15 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.76 1yr6 s VAL 6 CO 0.08 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.28 1yr6 n GLY 7 N 2.85 1.59 3.82 4.51 0.00 -1.26 0.20 105.19 116.90 1yr6 n GLY 7 Ca -0.17 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 44.99 1yr6 n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yr6 s THR 8 N -2.00 4.38 -0.08 2.61 -4.23 -1.26 -4.47 115.64 110.59 1yr6 s THR 8 Ca 0.00 1.42 -0.33 0.00 -1.18 0.00 0.00 61.69 61.59 1yr6 s THR 8 Cb 0.00 -3.61 -0.11 0.00 1.34 0.00 0.00 72.50 70.12 1yr6 s THR 8 CO 0.00 -0.38 1.93 0.00 -0.54 0.00 0.00 174.62 175.62 1yr6 n ALA 9 N -0.84 1.05 0.00 3.99 0.00 0.95 -1.20 120.51 124.46 1yr6 n ALA 9 Ca 0.07 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1yr6 n ALA 9 Cb 0.54 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.43 1yr6 n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yr6 n GLY 10 N 4.57 0.55 0.00 0.00 0.00 -1.26 -4.99 105.19 104.06 1yr6 n GLY 10 Ca 0.23 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.34 1yr6 n GLY 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1yr6 n SER 11 N 0.00 0.00 -0.57 1.61 3.41 -0.34 -4.87 113.62 112.87 1yr6 n SER 11 Ca 0.00 0.02 -0.06 0.00 -0.26 0.00 0.00 58.87 58.57 1yr6 n SER 11 Cb 0.00 -0.29 -0.02 0.00 -0.26 0.00 0.00 64.21 63.64 1yr6 n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yr6 n GLY 12 N 0.32 0.58 0.37 5.00 0.00 -1.26 -4.76 105.19 105.43 1yr6 n GLY 12 Ca 0.09 -0.72 0.02 0.00 0.00 0.00 0.00 46.02 45.41 1yr6 n GLY 12 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1yr6 h LYS 13 N 0.00 1.14 -0.32 1.61 3.64 -1.89 -2.29 116.57 118.47 1yr6 h LYS 13 Ca -0.14 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.01 1yr6 h LYS 13 Cb 0.67 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1yr6 h LYS 13 CO 0.18 0.76 -0.44 1.15 -2.27 0.00 0.00 179.45 178.83 1yr6 h THR 14 N 1.18 1.28 -0.71 1.00 2.02 -1.96 -1.86 112.91 113.85 1yr6 h THR 14 Ca 0.41 -1.62 -0.07 0.00 0.77 0.00 0.00 66.41 65.90 1yr6 h THR 14 Cb 0.11 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 68.05 1yr6 h THR 14 CO -0.15 0.53 0.18 0.74 0.37 0.00 0.00 175.52 177.19 1yr6 h THR 15 N 0.64 1.26 -0.64 3.16 2.02 -1.96 -2.83 112.91 114.57 1yr6 h THR 15 Ca 0.03 -0.96 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 1yr6 h THR 15 Cb 1.04 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 1yr6 h THR 15 CO 0.10 0.37 0.37 0.25 0.37 0.00 0.00 175.52 176.99 1yr6 h LEU 16 N 1.07 0.78 0.09 2.58 5.85 -1.37 -1.74 115.31 122.57 1yr6 h LEU 16 Ca 0.22 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.88 1yr6 h LEU 16 Cb 0.36 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1yr6 h LEU 16 CO 0.00 0.62 -0.10 0.74 -0.34 0.00 0.00 178.44 179.36 1yr6 h THR 17 N 0.87 0.76 0.09 1.05 2.02 -1.26 0.23 112.91 116.67 1yr6 h THR 17 Ca 0.23 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.43 1yr6 h THR 17 Cb -0.00 0.76 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1yr6 h THR 17 CO -0.04 0.00 -0.35 1.23 0.37 0.00 0.00 175.52 176.73 1yr6 h GLY 18 N -0.22 -0.66 1.34 2.16 0.00 -1.42 -1.19 103.07 103.08 1yr6 h GLY 18 Ca 0.01 0.42 -0.11 0.00 0.00 0.00 0.00 47.33 47.65 1yr6 h GLY 18 CO -0.04 -0.25 -0.20 -2.09 0.00 0.00 0.00 176.54 173.96 1yr6 h GLU 19 N -0.56 0.76 -0.69 4.80 4.57 -1.20 -1.27 114.58 121.01 1yr6 h GLU 19 Ca 0.04 -0.30 -0.03 0.00 -1.18 0.00 0.00 59.36 57.89 1yr6 h GLU 19 Cb 0.60 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.12 1yr6 h GLU 19 CO -0.23 0.91 0.33 0.35 -1.18 0.00 0.00 179.01 179.18 1yr6 h PHE 20 N 0.67 1.00 -0.22 0.92 3.57 -0.44 -1.57 116.94 120.87 1yr6 h PHE 20 Ca 0.10 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.58 1yr6 h PHE 20 Cb 0.71 -0.31 -0.07 0.00 2.79 0.00 0.00 35.95 39.07 1yr6 h PHE 20 CO 0.04 0.75 -0.53 0.78 -2.23 0.00 0.00 178.31 177.12 1yr6 h GLY 21 N 0.96 -1.09 0.20 2.40 0.00 -0.62 -2.09 103.07 102.83 1yr6 h GLY 21 Ca 0.24 0.70 0.08 0.00 0.00 0.00 0.00 47.33 48.35 1yr6 h GLY 21 CO -0.03 -0.19 -0.10 3.21 0.00 0.00 0.00 176.54 179.43 1yr6 h ARG 22 N -0.49 -0.01 -1.03 4.80 3.08 -0.97 0.27 114.38 120.02 1yr6 h ARG 22 Ca 0.04 0.00 0.27 0.00 0.07 0.00 0.00 59.98 60.36 1yr6 h ARG 22 Cb 0.62 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.56 1yr6 h ARG 22 CO -0.47 -0.00 0.63 -0.92 -1.07 0.00 0.00 179.97 178.14 1yr6 h TYR 23 N -0.01 0.85 0.00 3.04 3.20 -1.09 -1.58 116.97 121.38 1yr6 h TYR 23 Ca 0.19 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.94 1yr6 h TYR 23 Cb 0.30 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 1yr6 h TYR 23 CO -0.36 0.03 -0.76 -0.07 -1.64 0.00 0.00 178.16 175.37 1yr6 h LEU 24 N 0.47 0.00 0.00 2.82 3.38 0.13 -3.33 115.31 118.78 1yr6 h LEU 24 Ca 0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.61 1yr6 h LEU 24 Cb 1.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.19 1yr6 h LEU 24 CO -0.41 0.73 0.00 -0.62 0.09 0.00 0.00 178.44 178.23 1yr6 n GLU 25 N -3.27 0.23 -0.02 1.13 1.02 0.07 -0.68 120.64 119.11 1yr6 n GLU 25 Ca 0.01 0.12 -0.15 0.00 -0.02 0.00 0.00 57.16 57.12 1yr6 n GLU 25 Cb 0.83 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.65 1yr6 n GLU 25 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1yr6 h ASP 26 N 0.00 0.40 -0.01 1.62 3.32 -1.67 -3.38 116.42 116.71 1yr6 h ASP 26 Ca 0.00 -0.69 0.00 0.00 0.02 0.00 0.00 57.03 56.36 1yr6 h ASP 26 Cb 0.08 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1yr6 h ASP 26 CO 0.00 1.03 -0.31 0.59 -1.72 0.00 0.00 179.24 178.82 1yr6 n ASN 27 N -4.40 1.03 -4.09 6.45 3.02 -0.75 -5.05 115.26 111.48 1yr6 n ASN 27 Ca -0.09 -1.01 -0.08 0.00 -0.03 0.00 0.00 54.58 53.37 1yr6 n ASN 27 Cb 0.53 0.64 -0.10 0.00 -0.61 0.00 0.00 39.78 40.25 1yr6 n ASN 27 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1yr6 s TYR 28 N -1.62 0.60 -0.11 3.10 2.02 0.14 -5.14 117.35 116.34 1yr6 s TYR 28 Ca 0.07 -1.08 -0.18 0.00 -0.37 0.00 0.00 57.07 55.51 1yr6 s TYR 28 Cb 0.09 -0.39 -0.04 0.00 -0.40 0.00 0.00 41.96 41.21 1yr6 s TYR 28 CO 0.33 -0.44 0.48 0.21 -1.57 0.00 0.00 175.55 174.55 1yr6 s LYS 29 N -3.96 4.33 -0.02 -0.62 2.47 -1.26 -4.25 119.74 116.42 1yr6 s LYS 29 Ca 0.13 0.45 0.01 0.00 -1.56 0.00 0.00 55.97 55.00 1yr6 s LYS 29 Cb 0.07 -3.43 0.01 0.00 -1.46 0.00 0.00 37.83 33.03 1yr6 s LYS 29 CO -0.06 0.18 -0.04 0.08 0.16 0.00 0.00 175.35 175.67 1yr6 s VAL 30 N 0.54 0.45 0.04 4.02 1.01 -1.26 -1.05 120.40 124.15 1yr6 s VAL 30 Ca 0.26 -0.15 0.09 0.00 0.00 0.00 0.00 61.98 62.18 1yr6 s VAL 30 Cb -0.15 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1yr6 s VAL 30 CO 0.10 0.17 -0.26 0.00 0.00 0.00 0.00 175.10 175.11 1yr6 s ALA 31 N 0.42 2.19 -0.06 5.51 0.00 0.22 -4.98 121.76 125.05 1yr6 s ALA 31 Ca -0.05 -1.23 0.03 0.00 0.00 0.00 0.00 51.96 50.71 1yr6 s ALA 31 Cb -0.09 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 1yr6 s ALA 31 CO -0.00 0.52 -0.15 0.71 0.00 0.00 0.00 175.76 176.84 1yr6 s TYR 32 N -0.78 2.70 -0.16 0.00 2.02 -1.26 -1.08 117.35 118.79 1yr6 s TYR 32 Ca 0.11 -0.26 0.01 0.00 -0.37 0.00 0.00 57.07 56.56 1yr6 s TYR 32 Cb -0.10 -1.66 0.02 0.00 -0.40 0.00 0.00 41.96 39.82 1yr6 s TYR 32 CO 0.02 0.10 -0.19 0.08 -1.57 0.00 0.00 175.55 173.99 1yr6 s VAL 33 N -0.54 1.90 -0.33 0.71 1.01 0.20 -0.64 120.40 122.71 1yr6 s VAL 33 Ca 0.07 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 1yr6 s VAL 33 Cb -0.12 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 1yr6 s VAL 33 CO 0.01 0.51 0.21 0.21 0.00 0.00 0.00 175.10 176.05 1yr6 s ASN 34 N 1.18 5.90 -0.02 3.32 3.04 -0.32 0.21 114.94 128.25 1yr6 s ASN 34 Ca 0.01 -0.46 0.19 0.00 0.04 0.00 0.00 52.86 52.64 1yr6 s ASN 34 Cb -0.14 -2.10 0.56 0.00 -1.54 0.00 0.00 41.25 38.04 1yr6 s ASN 34 CO -0.08 -0.22 1.47 0.18 -3.04 0.00 0.00 177.10 175.40 1yr6 n LEU 35 N 5.07 3.78 -4.55 3.21 4.77 0.11 -2.02 117.00 127.37 1yr6 n LEU 35 Ca -0.13 -2.08 -0.41 0.00 -0.03 0.00 0.00 56.01 53.36 1yr6 n LEU 35 Cb 0.49 -0.43 -0.09 0.00 -2.33 0.00 0.00 43.42 41.06 1yr6 n LEU 35 CO 0.36 0.89 0.10 -0.62 -1.33 0.00 0.00 177.39 176.79 1yr6 s ASP 36 N -1.01 6.23 0.00 -1.43 -1.08 -1.26 -4.27 116.67 113.85 1yr6 s ASP 36 Ca 0.42 -0.14 0.30 0.00 -0.52 0.00 0.00 52.55 52.61 1yr6 s ASP 36 Cb 0.23 -2.22 1.56 0.00 -1.46 0.00 0.00 42.92 41.03 1yr6 s ASP 36 CO 0.27 -0.38 2.05 0.35 0.52 0.00 0.00 175.17 177.97 1yr6 n THR 37 N 5.30 0.00 -0.84 1.71 -2.24 -1.26 -3.97 114.28 112.98 1yr6 n THR 37 Ca -0.08 -0.05 0.01 0.00 -2.27 0.00 0.00 64.05 61.67 1yr6 n THR 37 Cb 0.49 -0.27 0.02 0.00 -2.10 0.00 0.00 70.33 68.47 1yr6 n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yr6 n GLY 38 N 1.14 0.60 3.75 3.38 0.00 -1.26 -0.28 105.19 112.52 1yr6 n GLY 38 Ca 0.19 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1yr6 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yr6 s VAL 39 N -0.72 4.06 -0.08 1.61 0.11 -1.25 -5.00 120.40 119.13 1yr6 s VAL 39 Ca 0.04 1.97 -0.27 0.00 -2.93 0.00 0.00 61.98 60.79 1yr6 s VAL 39 Cb 0.04 -4.25 -0.23 0.00 -1.53 0.00 0.00 36.38 30.40 1yr6 s VAL 39 CO 0.00 0.43 1.02 0.50 -3.33 0.00 0.00 175.10 173.72 1yr6 h LYS 40 N 4.47 0.03 -3.87 1.54 3.11 -1.96 -3.48 116.57 116.41 1yr6 h LYS 40 Ca -0.45 -0.03 -0.18 0.00 -2.81 0.00 0.00 60.65 57.19 1yr6 h LYS 40 Cb 1.20 0.01 -0.22 0.00 -1.00 0.00 0.00 32.23 32.22 1yr6 h LYS 40 CO 0.69 0.77 -0.68 -2.00 -2.81 0.00 0.00 179.45 175.42 1yr6 s GLU 41 N -3.23 0.27 -0.14 1.90 2.12 -1.26 -5.16 118.70 113.21 1yr6 s GLU 41 Ca -0.17 -0.46 -0.01 0.00 0.36 0.00 0.00 54.97 54.68 1yr6 s GLU 41 Cb -0.00 0.10 -0.02 0.00 0.26 0.00 0.00 34.13 34.47 1yr6 s GLU 41 CO 0.69 -0.05 -0.10 -0.51 -0.54 0.00 0.00 175.26 174.75 1yr6 s LEU 42 N -1.16 2.86 -0.00 2.70 1.43 -1.26 -4.99 118.68 118.25 1yr6 s LEU 42 Ca -0.13 -0.28 0.07 0.00 -1.03 0.00 0.00 54.13 52.77 1yr6 s LEU 42 Cb -0.08 -1.66 0.22 0.00 0.03 0.00 0.00 46.19 44.70 1yr6 s LEU 42 CO -0.01 0.16 1.17 -0.81 0.23 0.00 0.00 176.35 177.10 1yr6 n PRO 43 N 3.54 1.60 -4.38 1.29 -0.04 -1.26 -4.82 135.00 130.93 1yr6 n PRO 43 Ca -0.18 -0.89 -0.20 0.00 -0.04 0.00 0.00 63.50 62.19 1yr6 n PRO 43 Cb 0.53 -1.22 -0.10 0.00 -0.04 0.00 0.00 33.50 32.67 1yr6 n PRO 43 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1yr6 s TYR 44 N -1.67 1.70 -0.40 0.54 -0.85 -1.26 -4.91 117.35 110.50 1yr6 s TYR 44 Ca 0.17 -1.18 -0.13 0.00 -0.52 0.00 0.00 57.07 55.40 1yr6 s TYR 44 Cb 0.09 -1.03 0.03 0.00 0.38 0.00 0.00 41.96 41.43 1yr6 s TYR 44 CO 0.11 -0.29 0.27 -2.00 -1.52 0.00 0.00 175.55 172.12 1yr6 s GLU 45 N -3.90 2.90 0.16 -3.49 2.12 -1.26 -5.06 118.70 110.16 1yr6 s GLU 45 Ca 0.35 -1.07 -0.24 0.00 0.36 0.00 0.00 54.97 54.37 1yr6 s GLU 45 Cb 0.07 -3.88 -0.08 0.00 0.26 0.00 0.00 34.13 30.49 1yr6 s GLU 45 CO 0.15 -0.75 0.75 -1.25 -0.54 0.00 0.00 175.26 173.63 1yr6 s PRO 46 N 1.62 4.51 -0.02 4.30 0.04 -1.26 -4.48 135.00 139.70 1yr6 s PRO 46 Ca 0.04 1.10 -0.25 0.00 0.04 0.00 0.00 61.00 61.93 1yr6 s PRO 46 Cb -0.19 -3.22 -0.20 0.00 0.04 0.00 0.00 34.50 30.93 1yr6 s PRO 46 CO 0.08 0.56 1.23 0.77 0.04 0.00 0.00 177.00 179.68 1yr6 h SER 47 N 4.25 0.11 -3.95 6.66 0.02 -1.26 -3.45 113.55 115.94 1yr6 h SER 47 Ca -0.47 -0.55 -0.69 0.00 -0.84 0.00 0.00 61.79 59.24 1yr6 h SER 47 Cb 1.21 -0.03 -0.27 0.00 0.14 0.00 0.00 62.40 63.44 1yr6 h SER 47 CO 0.66 0.64 -0.82 -0.63 -1.14 0.00 0.00 176.83 175.54 1yr6 s ILE 48 N -4.01 2.60 -0.32 3.27 1.01 -1.20 -5.07 121.20 117.49 1yr6 s ILE 48 Ca -0.16 -0.87 -0.00 0.00 0.00 0.00 0.00 60.65 59.62 1yr6 s ILE 48 Cb 0.02 -2.00 0.13 0.00 0.01 0.00 0.00 42.46 40.62 1yr6 s ILE 48 CO 0.70 0.57 0.26 -0.62 0.00 0.00 0.00 174.94 175.85 1yr6 s ASP 49 N -0.32 2.21 0.01 3.58 -1.08 -1.26 -1.17 116.67 118.64 1yr6 s ASP 49 Ca 0.02 -1.36 0.01 0.00 -0.52 0.00 0.00 52.55 50.70 1yr6 s ASP 49 Cb -0.13 0.16 0.04 0.00 -1.46 0.00 0.00 42.92 41.53 1yr6 s ASP 49 CO 0.02 -0.35 0.97 1.33 0.52 0.00 0.00 175.17 177.66 1yr6 n VAL 50 N 4.79 1.76 0.22 1.11 0.24 -0.85 -0.23 118.33 125.37 1yr6 n VAL 50 Ca 0.03 0.51 0.10 0.00 -2.04 0.00 0.00 64.34 62.94 1yr6 n VAL 50 Cb 0.43 -1.51 0.48 0.00 -1.47 0.00 0.00 33.84 31.77 1yr6 n VAL 50 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1yr6 h ARG 51 N 0.00 0.00 -1.06 7.34 3.08 -1.82 -2.14 114.38 119.78 1yr6 h ARG 51 Ca 0.00 0.00 0.30 0.00 0.07 0.00 0.00 59.98 60.35 1yr6 h ARG 51 Cb 0.10 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.04 1yr6 h ARG 51 CO 0.00 0.22 0.65 1.05 -1.07 0.00 0.00 179.97 180.83 1yr6 h GLU 52 N 0.00 0.37 0.00 0.04 4.11 -1.03 -3.15 114.58 114.91 1yr6 h GLU 52 Ca -0.00 -0.02 -0.32 0.00 0.07 0.00 0.00 59.36 59.09 1yr6 h GLU 52 Cb 0.71 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.82 1yr6 h GLU 52 CO 0.03 0.24 -2.20 0.34 0.07 0.00 0.00 179.01 177.49 1yr6 n PHE 53 N -4.80 0.00 -3.64 2.06 7.35 -0.89 -5.03 117.46 112.52 1yr6 n PHE 53 Ca 0.29 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.89 1yr6 n PHE 53 Cb 0.95 -0.86 -0.07 0.00 0.35 0.00 0.00 39.48 39.85 1yr6 n PHE 53 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1yr6 s VAL 54 N -2.42 0.00 0.08 -2.13 0.11 -0.86 -5.07 120.40 110.11 1yr6 s VAL 54 Ca -0.10 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.01 1yr6 s VAL 54 Cb 0.05 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.87 1yr6 s VAL 54 CO 0.71 0.00 -0.15 0.42 -3.33 0.00 0.00 175.10 172.75 1yr6 s THR 55 N 0.22 1.23 0.19 5.04 -4.23 -1.26 -3.83 115.64 113.00 1yr6 s THR 55 Ca 0.03 -1.38 -0.12 0.00 -1.18 0.00 0.00 61.69 59.04 1yr6 s THR 55 Cb -0.05 -1.19 0.10 0.00 1.34 0.00 0.00 72.50 72.71 1yr6 s THR 55 CO -0.07 -0.21 1.85 0.58 -0.54 0.00 0.00 174.62 176.23 1yr6 h VAL 56 N 4.20 1.17 -0.20 2.29 2.07 -0.95 -3.05 116.25 121.78 1yr6 h VAL 56 Ca -0.42 -0.32 0.05 0.00 0.82 0.00 0.00 66.70 66.83 1yr6 h VAL 56 Cb 1.19 0.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.16 1yr6 h VAL 56 CO 0.41 0.16 -0.12 -0.33 0.02 0.00 0.00 177.57 177.71 1yr6 h GLU 57 N 0.85 -0.11 -0.77 1.57 3.07 -1.95 -2.07 114.58 115.18 1yr6 h GLU 57 Ca 0.23 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1yr6 h GLU 57 Cb -0.08 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 27.81 1yr6 h GLU 57 CO -0.05 -0.07 0.49 1.05 -1.40 0.00 0.00 179.01 179.03 1yr6 h GLU 58 N -0.11 1.04 0.00 2.33 4.11 -1.95 -2.41 114.58 117.59 1yr6 h GLU 58 Ca 0.11 -0.08 0.00 0.00 0.07 0.00 0.00 59.36 59.46 1yr6 h GLU 58 Cb 0.28 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1yr6 h GLU 58 CO -0.26 0.71 0.00 0.44 0.07 0.00 0.00 179.01 179.97 1yr6 n ILE 59 N -4.51 0.59 0.22 -1.06 -5.35 -1.03 -1.89 119.36 106.33 1yr6 n ILE 59 Ca 0.07 -0.06 0.09 0.00 -0.27 0.00 0.00 62.75 62.58 1yr6 n ILE 59 Cb 0.04 -0.75 0.51 0.00 -1.74 0.00 0.00 39.64 37.70 1yr6 n ILE 59 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 1yr6 h MET 60 N 0.00 0.00 -0.14 6.28 2.86 -0.85 -2.96 114.93 120.12 1yr6 h MET 60 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1yr6 h MET 60 Cb 0.56 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 1yr6 h MET 60 CO 0.00 0.24 0.07 0.00 1.06 0.00 0.00 176.91 178.28 1yr6 h ARG 61 N 0.00 0.19 0.00 1.72 3.08 -1.38 -1.42 114.38 116.57 1yr6 h ARG 61 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1yr6 h ARG 61 Cb 0.63 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1yr6 h ARG 61 CO 0.03 0.23 0.20 0.39 -1.07 0.00 0.00 179.97 179.75 1yr6 n GLU 62 N -4.93 0.00 0.00 0.04 1.02 -1.12 -4.73 120.64 110.92 1yr6 n GLU 62 Ca -0.05 0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1yr6 n GLU 62 Cb 0.08 -1.70 0.00 0.00 -0.02 0.00 0.00 31.44 29.80 1yr6 n GLU 62 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yr6 n GLY 63 N -1.20 0.99 3.81 0.62 0.00 -0.54 -5.10 105.19 103.77 1yr6 n GLY 63 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1yr6 n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yr6 s TYR 64 N -2.00 3.17 1.16 1.61 2.02 -1.23 -5.06 117.35 117.02 1yr6 s TYR 64 Ca 0.00 1.60 -0.19 0.00 -0.37 0.00 0.00 57.07 58.10 1yr6 s TYR 64 Cb 0.00 -2.95 0.28 0.00 -0.40 0.00 0.00 41.96 38.89 1yr6 s TYR 64 CO 0.00 -0.44 1.19 0.20 -1.57 0.00 0.00 175.55 174.93 1yr6 s GLY 65 N -2.08 1.67 0.11 0.71 0.00 -1.26 -4.56 107.32 101.90 1yr6 s GLY 65 Ca 0.64 -1.16 -0.08 0.00 0.00 0.00 0.00 44.72 44.12 1yr6 s GLY 65 CO 0.16 -0.25 1.28 -0.56 0.00 0.00 0.00 173.10 173.73 1yr6 h PRO 66 N -2.41 0.56 -0.15 2.90 0.13 -1.97 0.16 132.00 131.22 1yr6 h PRO 66 Ca -0.43 -0.56 0.04 0.00 -0.87 0.00 0.00 66.00 64.18 1yr6 h PRO 66 Cb 1.26 0.15 -0.07 0.00 0.13 0.00 0.00 31.00 32.47 1yr6 h PRO 66 CO 0.30 1.19 -0.46 -0.91 -0.23 0.00 0.00 178.00 177.89 1yr6 h ASN 67 N 0.34 -1.44 -0.53 1.44 2.35 -2.00 -0.14 115.58 115.60 1yr6 h ASN 67 Ca -0.09 0.19 -0.04 0.00 -0.55 0.00 0.00 56.30 55.81 1yr6 h ASN 67 Cb 1.56 0.58 -0.03 0.00 0.05 0.00 0.00 38.32 40.48 1yr6 h ASN 67 CO 0.17 -0.44 0.19 1.23 -1.65 0.00 0.00 177.43 176.94 1yr6 h GLY 68 N -0.51 0.92 1.60 2.83 0.00 -1.91 -2.65 103.07 103.35 1yr6 h GLY 68 Ca 0.07 -0.49 -0.13 0.00 0.00 0.00 0.00 47.33 46.78 1yr6 h GLY 68 CO -0.42 0.46 -0.44 0.00 0.00 0.00 0.00 176.54 176.15 1yr6 h ALA 69 N 1.38 0.91 0.06 3.60 0.00 -0.24 0.12 119.26 125.08 1yr6 h ALA 69 Ca 0.19 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1yr6 h ALA 69 Cb 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1yr6 h ALA 69 CO -0.01 0.64 -0.03 0.82 0.00 0.00 0.00 179.25 180.67 1yr6 h ILE 70 N 0.36 1.15 -0.42 0.00 2.04 -0.84 -0.59 117.51 119.22 1yr6 h ILE 70 Ca 0.03 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1yr6 h ILE 70 Cb 0.91 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 1yr6 h ILE 70 CO 0.08 0.18 0.27 0.58 0.00 0.00 0.00 178.15 179.26 1yr6 h VAL 71 N -0.40 1.12 -0.67 1.67 2.07 -1.38 -2.91 116.25 115.75 1yr6 h VAL 71 Ca -0.01 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 1yr6 h VAL 71 Cb 0.36 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1yr6 h VAL 71 CO 0.01 0.11 0.33 -0.08 0.02 0.00 0.00 177.57 177.97 1yr6 h GLU 72 N 0.57 0.95 -0.25 1.57 4.57 -0.74 -1.98 114.58 119.26 1yr6 h GLU 72 Ca 0.15 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1yr6 h GLU 72 Cb -0.05 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.35 1yr6 h GLU 72 CO -0.03 0.73 0.13 0.66 -1.18 0.00 0.00 179.01 179.32 1yr6 h SER 73 N 0.95 0.30 0.96 1.04 4.64 -0.90 -2.16 113.55 118.37 1yr6 h SER 73 Ca 0.23 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1yr6 h SER 73 Cb 0.09 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1yr6 h SER 73 CO -0.03 0.25 -0.55 1.88 -0.87 0.00 0.00 176.83 177.51 1yr6 h TYR 74 N 0.34 0.00 -0.02 4.77 0.05 -1.30 -2.73 116.97 118.09 1yr6 h TYR 74 Ca 0.09 0.00 -0.22 0.00 0.05 0.00 0.00 58.73 58.65 1yr6 h TYR 74 Cb 0.02 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.77 1yr6 h TYR 74 CO 0.00 0.00 -0.90 -0.44 -1.05 0.00 0.00 178.16 175.77 1yr6 h ASP 75 N 0.00 0.53 0.38 3.88 3.32 -0.90 -3.08 116.42 120.55 1yr6 h ASP 75 Ca 0.00 -0.41 -0.17 0.00 0.02 0.00 0.00 57.03 56.48 1yr6 h ASP 75 Cb 0.76 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1yr6 h ASP 75 CO 0.00 1.20 -0.69 0.03 -1.72 0.00 0.00 179.24 178.06 1yr6 h ARG 76 N 0.24 0.27 -0.59 3.56 3.08 -1.41 -3.20 114.38 116.33 1yr6 h ARG 76 Ca -0.07 -0.21 -0.05 0.00 0.07 0.00 0.00 59.98 59.72 1yr6 h ARG 76 Cb 1.53 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.59 1yr6 h ARG 76 CO 0.16 0.85 0.17 -0.07 -1.07 0.00 0.00 179.97 180.01 1yr6 h LEU 77 N 0.19 0.84 -2.16 3.04 4.07 -1.53 -2.36 115.31 117.39 1yr6 h LEU 77 Ca -0.02 -0.14 0.07 0.00 0.08 0.00 0.00 57.88 57.87 1yr6 h LEU 77 Cb 1.23 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.75 1yr6 h LEU 77 CO 0.11 0.80 0.25 0.24 -1.08 0.00 0.00 178.44 178.76 1yr6 h MET 78 N 0.87 0.00 0.00 1.13 2.86 -1.53 0.42 114.93 118.68 1yr6 h MET 78 Ca 0.19 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1yr6 h MET 78 Cb 0.27 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 1yr6 h MET 78 CO -0.01 0.00 -0.01 0.93 1.06 0.00 0.00 176.91 178.88 1yr6 h GLU 79 N 0.00 0.00 -0.10 1.72 5.08 -1.52 -2.51 114.58 117.25 1yr6 h GLU 79 Ca 0.11 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1yr6 h GLU 79 Cb 0.61 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1yr6 h GLU 79 CO -0.00 0.01 -0.16 1.63 -1.00 0.00 0.00 179.01 179.49 1yr6 n LYS 80 N -3.30 1.73 0.17 2.33 4.76 0.15 -4.89 118.16 119.10 1yr6 n LYS 80 Ca -0.03 -2.94 -0.15 0.00 -2.87 0.00 0.00 58.31 52.33 1yr6 n LYS 80 Cb 0.11 -1.64 -0.07 0.00 -1.84 0.00 0.00 35.03 31.58 1yr6 n LYS 80 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1yr6 h PHE 81 N 0.75 -0.96 -0.67 2.13 3.57 -1.21 -0.37 116.94 120.18 1yr6 h PHE 81 Ca 0.04 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 1yr6 h PHE 81 Cb 1.19 0.39 -0.03 0.00 2.79 0.00 0.00 35.95 40.28 1yr6 h PHE 81 CO 0.48 -0.48 0.37 -0.97 -2.23 0.00 0.00 178.31 175.48 1yr6 h ASN 82 N -0.66 0.84 -0.34 0.41 -0.73 -1.90 -0.02 115.58 113.18 1yr6 h ASN 82 Ca 0.00 -0.09 0.04 0.00 1.87 0.00 0.00 56.30 58.12 1yr6 h ASN 82 Cb 0.64 -0.21 -0.04 0.00 0.27 0.00 0.00 38.32 38.97 1yr6 h ASN 82 CO -0.13 0.69 0.09 -0.08 -0.37 0.00 0.00 177.43 177.63 1yr6 h GLU 83 N 0.92 0.21 -0.64 6.67 4.81 -1.85 0.02 114.58 124.72 1yr6 h GLU 83 Ca 0.24 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.37 1yr6 h GLU 83 Cb 0.04 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1yr6 h GLU 83 CO -0.04 0.14 0.08 1.88 -0.73 0.00 0.00 179.01 180.34 1yr6 h TYR 84 N 0.22 1.13 0.31 0.92 0.05 -0.69 -1.18 116.97 117.73 1yr6 h TYR 84 Ca 0.16 -0.16 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 1yr6 h TYR 84 Cb 0.16 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.59 1yr6 h TYR 84 CO -0.17 0.96 -0.17 1.25 -1.05 0.00 0.00 178.16 178.98 1yr6 h LEU 85 N 0.99 -0.43 -0.91 3.88 5.85 -0.69 -1.34 115.31 122.66 1yr6 h LEU 85 Ca 0.19 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 1yr6 h LEU 85 Cb 0.45 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 1yr6 h LEU 85 CO 0.02 -0.29 0.53 0.78 -0.34 0.00 0.00 178.44 179.14 1yr6 h ASN 86 N -0.46 1.10 -0.97 1.25 2.35 -0.96 -0.15 115.58 117.75 1yr6 h ASN 86 Ca -0.04 -0.08 0.19 0.00 -0.55 0.00 0.00 56.30 55.83 1yr6 h ASN 86 Cb 0.37 -0.28 -0.09 0.00 0.05 0.00 0.00 38.32 38.37 1yr6 h ASN 86 CO 0.05 0.86 0.61 0.11 -1.65 0.00 0.00 177.43 177.41 1yr6 h LYS 87 N 1.25 0.62 0.22 0.81 1.57 -1.05 -1.03 116.57 118.97 1yr6 h LYS 87 Ca 0.32 -0.04 -0.34 0.00 -1.87 0.00 0.00 60.65 58.72 1yr6 h LYS 87 Cb -0.03 -0.14 0.03 0.00 0.08 0.00 0.00 32.23 32.17 1yr6 h LYS 87 CO -0.06 0.41 -1.61 0.82 -0.57 0.00 0.00 179.45 178.44 1yr6 h ILE 88 N 0.64 1.12 -0.71 1.86 2.04 -0.43 -2.59 117.51 119.43 1yr6 h ILE 88 Ca 0.53 -2.61 0.06 0.00 1.00 0.00 0.00 64.86 63.85 1yr6 h ILE 88 Cb 0.99 2.92 -0.04 0.00 -0.74 0.00 0.00 36.82 39.94 1yr6 h ILE 88 CO -0.29 0.83 0.47 -0.07 0.00 0.00 0.00 178.15 179.09 1yr6 h LEU 89 N 0.12 0.65 -0.09 1.44 3.38 -0.81 -1.37 115.31 118.63 1yr6 h LEU 89 Ca -0.30 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.46 1yr6 h LEU 89 Cb 2.14 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 42.76 1yr6 h LEU 89 CO 0.23 0.43 -0.76 -0.09 0.09 0.00 0.00 178.44 178.33 1yr6 h ARG 90 N 0.75 0.68 -0.98 1.13 2.43 -1.24 -2.91 114.38 114.23 1yr6 h ARG 90 Ca 0.30 -0.61 0.10 0.00 -0.81 0.00 0.00 59.98 58.97 1yr6 h ARG 90 Cb 0.24 0.14 -0.08 0.00 -0.42 0.00 0.00 29.97 29.85 1yr6 h ARG 90 CO -0.10 1.22 0.62 -0.07 -1.51 0.00 0.00 179.97 180.13 1yr6 h LEU 91 N 0.35 0.93 -1.45 3.80 3.38 -1.04 -0.60 115.31 120.68 1yr6 h LEU 91 Ca -0.07 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1yr6 h LEU 91 Cb 1.41 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 42.01 1yr6 h LEU 91 CO 0.15 0.53 -0.05 -0.08 0.09 0.00 0.00 178.44 179.08 1yr6 h GLU 92 N 1.02 0.00 0.11 1.13 4.81 -1.20 -2.17 114.58 118.28 1yr6 h GLU 92 Ca 0.47 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 59.43 1yr6 h GLU 92 Cb 0.39 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 1yr6 h GLU 92 CO -0.24 0.05 -1.23 0.87 -0.73 0.00 0.00 179.01 177.74 1yr6 h LYS 93 N 0.00 0.23 -0.64 1.92 1.79 -0.94 -3.33 116.57 115.60 1yr6 h LYS 93 Ca -0.00 -0.38 0.00 0.00 -2.18 0.00 0.00 60.65 58.08 1yr6 h LYS 93 Cb 0.54 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1yr6 h LYS 93 CO 0.01 1.17 0.00 -0.85 -1.08 0.00 0.00 179.45 178.70 1yr6 n GLU 94 N -3.49 3.32 -3.95 3.15 0.28 -0.76 -4.65 120.64 114.54 1yr6 n GLU 94 Ca -0.08 -2.44 -0.09 0.00 -0.16 0.00 0.00 57.16 54.40 1yr6 n GLU 94 Cb 1.01 -1.80 -0.09 0.00 1.43 0.00 0.00 31.44 31.99 1yr6 n GLU 94 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1yr6 s ASN 95 N -0.84 0.24 0.03 -1.84 0.01 -0.85 -3.11 114.94 108.59 1yr6 s ASN 95 Ca 0.44 -0.67 -0.16 0.00 -0.71 0.00 0.00 52.86 51.75 1yr6 s ASN 95 Cb 0.28 0.25 -0.31 0.00 0.41 0.00 0.00 41.25 41.88 1yr6 s ASN 95 CO 0.21 -0.58 1.05 0.44 -1.51 0.00 0.00 177.10 176.71 1yr6 h ASP 96 N 3.33 0.82 -3.49 -1.22 3.32 -1.33 -2.11 116.42 115.75 1yr6 h ASP 96 Ca -0.33 -0.86 -0.44 0.00 0.02 0.00 0.00 57.03 55.42 1yr6 h ASP 96 Cb 1.18 -0.26 -0.33 0.00 0.22 0.00 0.00 39.33 40.13 1yr6 h ASP 96 CO 0.55 1.60 -0.79 -0.31 -1.72 0.00 0.00 179.24 178.58 1yr6 s TYR 97 N -2.84 0.99 -0.31 4.55 1.51 -0.50 -0.70 117.35 120.07 1yr6 s TYR 97 Ca -0.10 -0.31 -0.05 0.00 -1.01 0.00 0.00 57.07 55.60 1yr6 s TYR 97 Cb 0.04 -0.79 0.03 0.00 -0.11 0.00 0.00 41.96 41.14 1yr6 s TYR 97 CO 0.92 -0.21 0.06 0.08 -1.11 0.00 0.00 175.55 175.30 1yr6 s VAL 98 N 0.74 3.58 -0.27 0.71 1.01 0.15 -0.61 120.40 125.71 1yr6 s VAL 98 Ca -0.12 -1.05 -0.11 0.00 0.00 0.00 0.00 61.98 60.70 1yr6 s VAL 98 Cb -0.14 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 1yr6 s VAL 98 CO 0.01 -0.05 0.20 -0.76 0.00 0.00 0.00 175.10 174.50 1yr6 s LEU 99 N 1.39 4.05 -0.22 3.92 1.43 -0.24 -0.67 118.68 128.35 1yr6 s LEU 99 Ca -0.01 0.05 -0.05 0.00 -1.03 0.00 0.00 54.13 53.09 1yr6 s LEU 99 Cb -0.19 -2.14 -0.02 0.00 0.03 0.00 0.00 46.19 43.87 1yr6 s LEU 99 CO 0.01 -0.03 0.00 -0.63 0.23 0.00 0.00 176.35 175.94 1yr6 s ILE 100 N 1.59 3.88 -0.25 -0.59 1.01 0.85 -0.63 121.20 127.06 1yr6 s ILE 100 Ca 0.08 -0.33 -0.14 0.00 0.00 0.00 0.00 60.65 60.26 1yr6 s ILE 100 Cb -0.15 -2.77 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 1yr6 s ILE 100 CO 0.09 0.41 0.35 -0.62 0.00 0.00 0.00 174.94 175.17 1yr6 s ASP 101 N 1.25 6.28 0.43 3.58 2.15 0.13 -0.27 116.67 130.21 1yr6 s ASP 101 Ca 0.04 0.32 0.08 0.00 0.43 0.00 0.00 52.55 53.41 1yr6 s ASP 101 Cb -0.15 -2.20 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 1yr6 s ASP 101 CO 0.01 -0.12 0.51 0.42 -0.17 0.00 0.00 175.17 175.81 1yr6 s THR 102 N 1.74 2.81 0.13 1.71 -4.23 -1.15 -0.71 115.64 115.93 1yr6 s THR 102 Ca 0.15 -1.14 -0.35 0.00 -1.18 0.00 0.00 61.69 59.18 1yr6 s THR 102 Cb -0.15 -2.95 -0.15 0.00 1.34 0.00 0.00 72.50 70.59 1yr6 s THR 102 CO 0.09 0.00 1.52 -2.65 -0.54 0.00 0.00 174.62 173.04 1yr6 n PRO 103 N -1.75 1.86 0.28 3.99 -0.02 -1.26 -4.59 135.00 133.50 1yr6 n PRO 103 Ca 0.07 0.67 0.11 0.00 -2.02 0.00 0.00 63.50 62.32 1yr6 n PRO 103 Cb 0.60 -2.41 0.57 0.00 -0.02 0.00 0.00 33.50 32.25 1yr6 n PRO 103 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1yr6 h GLY 104 N 5.63 0.00 -7.75 -1.23 0.00 -1.94 -3.14 103.07 94.63 1yr6 h GLY 104 Ca -0.46 0.00 -0.77 0.00 0.00 0.00 0.00 47.33 46.11 1yr6 h GLY 104 CO 0.86 0.00 -0.01 1.20 0.00 0.00 0.00 176.54 178.59 1yr6 s GLN 105 N -3.81 3.36 0.66 4.80 -1.52 -1.26 -0.04 119.66 121.85 1yr6 s GLN 105 Ca -0.02 -2.50 0.42 0.00 -1.95 0.00 0.00 55.36 51.30 1yr6 s GLN 105 Cb 0.06 -4.25 2.29 0.00 -0.22 0.00 0.00 33.01 30.89 1yr6 s GLN 105 CO 0.19 -1.26 2.29 0.00 -0.25 0.00 0.00 175.29 176.26 1yr6 h MET 106 N 7.55 0.00 0.00 2.91 -0.00 -1.77 0.37 114.93 123.99 1yr6 h MET 106 Ca 0.08 0.00 -0.12 0.00 -0.00 0.00 0.00 59.70 59.66 1yr6 h MET 106 Cb 1.01 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.60 1yr6 h MET 106 CO 0.74 0.00 -0.56 1.05 -0.00 0.00 0.00 176.91 178.14 1yr6 h GLU 107 N 0.00 0.00 0.00 -0.10 4.11 -1.92 0.72 114.58 117.38 1yr6 h GLU 107 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1yr6 h GLU 107 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1yr6 h GLU 107 CO 0.00 0.56 0.00 1.15 0.07 0.00 0.00 179.01 180.79 1yr6 h THR 108 N 0.00 0.00 0.00 -1.06 2.02 -0.62 0.51 112.91 113.76 1yr6 h THR 108 Ca -0.01 -0.06 -0.36 0.00 0.77 0.00 0.00 66.41 66.76 1yr6 h THR 108 Cb 1.09 0.72 -0.07 0.00 -1.74 0.00 0.00 68.15 68.15 1yr6 h THR 108 CO 0.07 0.00 -2.36 0.33 0.37 0.00 0.00 175.52 173.93 1yr6 n PHE 109 N -2.49 0.00 0.08 3.16 7.35 -0.14 -4.16 117.46 121.27 1yr6 n PHE 109 Ca -0.01 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.59 1yr6 n PHE 109 Cb 0.08 -0.95 -0.06 0.00 0.35 0.00 0.00 39.48 38.91 1yr6 n PHE 109 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1yr6 h LEU 110 N 0.00 0.20 0.00 -2.13 3.38 0.81 -3.30 115.31 114.27 1yr6 h LEU 110 Ca -0.53 -0.18 -0.36 0.00 0.09 0.00 0.00 57.88 56.89 1yr6 h LEU 110 Cb 2.02 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 42.65 1yr6 h LEU 110 CO -0.03 1.06 -2.21 0.49 0.09 0.00 0.00 178.44 177.84 1yr6 n PHE 111 N -3.55 0.00 -1.96 1.13 3.72 0.17 -4.84 117.46 112.14 1yr6 n PHE 111 Ca -0.03 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.98 1yr6 n PHE 111 Cb 0.88 -0.78 0.01 0.00 -0.94 0.00 0.00 39.48 38.66 1yr6 n PHE 111 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1yr6 s HIS 112 N -2.40 2.57 0.22 1.38 2.46 -1.23 -4.86 115.29 113.43 1yr6 s HIS 112 Ca -0.30 1.40 -0.17 0.00 0.47 0.00 0.00 55.06 56.45 1yr6 s HIS 112 Cb 0.11 -3.69 0.22 0.00 -0.13 0.00 0.00 32.58 29.09 1yr6 s HIS 112 CO 0.39 -2.40 1.57 0.93 -2.47 0.00 0.00 174.74 172.76 1yr6 h GLU 113 N 2.02 -0.06 -0.61 2.88 5.08 -1.93 -2.96 114.58 119.00 1yr6 h GLU 113 Ca -0.50 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 57.99 1yr6 h GLU 113 Cb 1.27 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 30.43 1yr6 h GLU 113 CO 0.60 -0.04 0.05 0.35 -1.00 0.00 0.00 179.01 178.97 1yr6 h PHE 114 N -0.06 0.05 -0.05 4.33 3.57 -1.91 0.27 116.94 123.14 1yr6 h PHE 114 Ca 0.32 0.04 -0.19 0.00 3.53 0.00 0.00 57.97 61.67 1yr6 h PHE 114 Cb 0.59 0.07 0.01 0.00 2.79 0.00 0.00 35.95 39.41 1yr6 h PHE 114 CO -0.76 -0.12 -0.73 0.78 -2.23 0.00 0.00 178.31 175.25 1yr6 h GLY 115 N 0.16 0.65 1.45 2.40 0.00 -1.74 -2.45 103.07 103.53 1yr6 h GLY 115 Ca 0.32 -1.04 -0.15 0.00 0.00 0.00 0.00 47.33 46.47 1yr6 h GLY 115 CO -0.49 0.92 -0.47 -2.08 0.00 0.00 0.00 176.54 174.42 1yr6 h VAL 116 N 0.20 1.31 0.07 4.60 2.07 -1.43 -2.80 116.25 120.26 1yr6 h VAL 116 Ca -0.08 -1.68 -0.25 0.00 0.82 0.00 0.00 66.70 65.52 1yr6 h VAL 116 Cb 1.39 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1yr6 h VAL 116 CO 0.15 0.53 -1.09 0.03 0.02 0.00 0.00 177.57 177.20 1yr6 h ARG 117 N 0.48 0.33 -0.72 1.57 3.08 -0.99 -2.13 114.38 116.00 1yr6 h ARG 117 Ca 0.03 -0.45 0.04 0.00 0.07 0.00 0.00 59.98 59.66 1yr6 h ARG 117 Cb 1.00 0.15 -0.05 0.00 0.08 0.00 0.00 29.97 31.16 1yr6 h ARG 117 CO 0.09 1.16 0.45 1.25 -1.07 0.00 0.00 179.97 181.85 1yr6 h LEU 118 N 0.15 0.73 -0.56 3.04 5.85 -1.48 -2.73 115.31 120.31 1yr6 h LEU 118 Ca -0.11 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.46 1yr6 h LEU 118 Cb 1.77 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.64 1yr6 h LEU 118 CO 0.18 0.50 -0.63 0.24 -0.34 0.00 0.00 178.44 178.39 1yr6 h MET 119 N 0.87 0.35 0.00 1.25 2.86 -1.39 -1.98 114.93 116.88 1yr6 h MET 119 Ca 0.30 -0.25 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1yr6 h MET 119 Cb 0.05 0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1yr6 h MET 119 CO -0.12 0.86 0.00 0.39 1.06 0.00 0.00 176.91 179.10 1yr6 n GLU 120 N -3.88 0.19 0.00 1.72 1.02 -0.81 -3.35 120.64 115.53 1yr6 n GLU 120 Ca -0.03 0.48 0.06 0.00 -0.02 0.00 0.00 57.16 57.65 1yr6 n GLU 120 Cb 0.64 -1.91 0.02 0.00 -0.02 0.00 0.00 31.44 30.17 1yr6 n GLU 120 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1yr6 n ASN 121 N -2.27 1.60 -4.88 1.62 4.13 -0.78 -4.97 115.26 109.72 1yr6 n ASN 121 Ca 0.01 -1.30 -0.32 0.00 1.68 0.00 0.00 54.58 54.65 1yr6 n ASN 121 Cb 0.18 0.31 -0.05 0.00 -1.54 0.00 0.00 39.78 38.68 1yr6 n ASN 121 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1yr6 s LEU 122 N -1.52 4.23 -0.62 3.41 1.43 -0.99 -5.03 118.68 119.59 1yr6 s LEU 122 Ca 0.12 0.84 -0.27 0.00 -1.03 0.00 0.00 54.13 53.78 1yr6 s LEU 122 Cb 0.10 -3.47 -0.00 0.00 0.03 0.00 0.00 46.19 42.85 1yr6 s LEU 122 CO 0.25 0.00 1.62 -2.84 0.23 0.00 0.00 176.35 175.62 1yr6 s PRO 123 N -2.59 2.94 -1.55 1.29 0.02 -1.26 -4.46 135.00 129.39 1yr6 s PRO 123 Ca 0.43 0.40 -0.14 0.00 0.02 0.00 0.00 61.00 61.71 1yr6 s PRO 123 Cb -0.12 -4.27 0.09 0.00 0.02 0.00 0.00 34.50 30.22 1yr6 s PRO 123 CO 0.21 -2.38 0.96 0.66 -0.33 0.00 0.00 177.00 176.13 1yr6 n TYR 124 N 11.12 -2.25 -1.96 6.54 4.01 -1.26 -4.87 117.16 128.49 1yr6 n TYR 124 Ca 0.14 0.89 -0.34 0.00 -0.16 0.00 0.00 57.90 58.43 1yr6 n TYR 124 Cb 0.50 -3.87 0.03 0.00 -0.31 0.00 0.00 39.34 35.69 1yr6 n TYR 124 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1yr6 s PRO 125 N -6.64 3.00 -0.12 -0.72 0.04 -1.26 -4.92 135.00 124.38 1yr6 s PRO 125 Ca 0.67 1.53 -0.06 0.00 0.04 0.00 0.00 61.00 63.18 1yr6 s PRO 125 Cb -0.34 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 1yr6 s PRO 125 CO 0.83 -1.12 0.12 -1.17 0.04 0.00 0.00 177.00 175.70 1yr6 s LEU 126 N -4.39 4.27 -0.12 -3.56 2.96 -0.97 -4.26 118.68 112.60 1yr6 s LEU 126 Ca 0.71 0.41 -0.02 0.00 -0.22 0.00 0.00 54.13 55.01 1yr6 s LEU 126 Cb -0.23 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.40 1yr6 s LEU 126 CO 0.35 0.39 -0.07 -0.69 -1.32 0.00 0.00 176.35 175.02 1yr6 s VAL 127 N -0.94 3.63 -0.24 1.68 1.01 -0.00 -0.20 120.40 125.34 1yr6 s VAL 127 Ca 0.14 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 61.61 1yr6 s VAL 127 Cb -0.12 -2.54 -0.00 0.00 0.00 0.00 0.00 36.38 33.71 1yr6 s VAL 127 CO 0.03 0.53 -0.01 -0.69 0.00 0.00 0.00 175.10 174.97 1yr6 s VAL 128 N 0.02 3.53 -0.41 2.92 1.01 0.93 -0.11 120.40 128.28 1yr6 s VAL 128 Ca -0.01 -0.57 -0.17 0.00 0.00 0.00 0.00 61.98 61.23 1yr6 s VAL 128 Cb -0.14 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.58 1yr6 s VAL 128 CO 0.03 0.31 0.40 -0.47 0.00 0.00 0.00 175.10 175.38 1yr6 s TYR 129 N 1.48 3.19 -0.01 5.22 5.04 0.52 -0.90 117.35 131.88 1yr6 s TYR 129 Ca 0.04 -0.39 -0.22 0.00 -2.44 0.00 0.00 57.07 54.07 1yr6 s TYR 129 Cb -0.15 -2.81 -0.05 0.00 0.35 0.00 0.00 41.96 39.29 1yr6 s TYR 129 CO -0.02 -0.66 0.64 0.42 -1.34 0.00 0.00 175.55 174.60 1yr6 s ILE 130 N 2.03 4.91 -0.01 3.14 -1.09 0.13 -0.78 121.20 129.54 1yr6 s ILE 130 Ca 0.11 1.34 0.06 0.00 -2.23 0.00 0.00 60.65 59.93 1yr6 s ILE 130 Cb -0.17 -3.98 -0.02 0.00 -1.58 0.00 0.00 42.46 36.71 1yr6 s ILE 130 CO 0.13 0.37 -0.20 -0.44 -1.23 0.00 0.00 174.94 173.57 1yr6 s SER 131 N 0.05 2.32 0.20 3.58 0.01 -0.03 -4.44 113.70 115.39 1yr6 s SER 131 Ca 0.33 -0.37 -0.30 0.00 1.31 0.00 0.00 55.95 56.92 1yr6 s SER 131 Cb -0.18 -0.25 -0.09 0.00 0.21 0.00 0.00 66.02 65.70 1yr6 s SER 131 CO 0.18 0.23 1.39 -0.62 0.41 0.00 0.00 173.24 174.83 1yr6 s ASP 132 N -0.54 6.77 0.38 2.44 -1.08 -1.26 -2.12 116.67 121.25 1yr6 s ASP 132 Ca 0.07 2.50 0.07 0.00 -0.52 0.00 0.00 52.55 54.68 1yr6 s ASP 132 Cb -0.08 -2.61 0.80 0.00 -1.46 0.00 0.00 42.92 39.57 1yr6 s ASP 132 CO -0.00 -0.64 1.97 -0.65 0.52 0.00 0.00 175.17 176.37 1yr6 h PRO 133 N 5.60 0.66 0.00 4.34 0.11 -1.93 -2.77 132.00 138.02 1yr6 h PRO 133 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1yr6 h PRO 133 Cb 1.21 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1yr6 h PRO 133 CO 0.80 0.44 0.00 1.49 -0.21 0.00 0.00 178.00 180.52 1yr6 h GLU 134 N 0.68 0.00 0.00 1.05 4.22 -1.95 0.19 114.58 118.77 1yr6 h GLU 134 Ca 0.30 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.74 1yr6 h GLU 134 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1yr6 h GLU 134 CO -0.10 0.00 0.00 0.44 -2.18 0.00 0.00 179.01 177.17 1yr6 n ILE 135 N -3.07 0.79 -3.29 2.32 -6.64 -1.04 -4.57 119.36 103.85 1yr6 n ILE 135 Ca -0.03 0.15 -0.46 0.00 -1.77 0.00 0.00 62.75 60.64 1yr6 n ILE 135 Cb 0.09 -1.00 -0.03 0.00 -1.44 0.00 0.00 39.64 37.25 1yr6 n ILE 135 CO 0.00 0.00 0.00 -0.76 -1.77 0.00 0.00 176.55 174.02 1yr6 s LEU 136 N -4.01 6.35 0.00 7.28 1.43 0.65 -4.77 118.68 125.61 1yr6 s LEU 136 Ca 0.06 -2.20 0.00 0.00 -1.03 0.00 0.00 54.13 50.97 1yr6 s LEU 136 Cb 0.10 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 44.10 1yr6 s LEU 136 CO 0.40 -0.75 0.00 0.29 0.23 0.00 0.00 176.35 176.51 1yr6 n LYS 137 N 4.79 3.34 -3.55 1.70 5.02 -1.26 -5.07 118.16 123.13 1yr6 n LYS 137 Ca 0.01 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.13 1yr6 n LYS 137 Cb 0.44 -0.37 -0.06 0.00 -0.02 0.00 0.00 35.03 35.02 1yr6 n LYS 137 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1yr6 s LYS 138 N -0.61 0.99 0.43 1.97 -2.85 -1.26 -5.05 119.74 113.36 1yr6 s LYS 138 Ca 0.00 0.42 0.23 0.00 -1.00 0.00 0.00 55.97 55.62 1yr6 s LYS 138 Cb 0.00 0.47 1.25 0.00 -2.06 0.00 0.00 37.83 37.49 1yr6 s LYS 138 CO 0.00 -0.27 1.67 -1.35 0.10 0.00 0.00 175.35 175.50 1yr6 h PRO 139 N 3.51 0.00 -0.15 1.78 0.11 -1.98 0.69 132.00 135.96 1yr6 h PRO 139 Ca -0.28 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.80 1yr6 h PRO 139 Cb 1.15 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1yr6 h PRO 139 CO 0.31 0.00 -0.05 -0.91 -0.21 0.00 0.00 178.00 177.14 1yr6 h ASN 140 N 0.00 0.31 -1.00 -2.05 2.35 -1.97 -3.13 115.58 110.09 1yr6 h ASN 140 Ca 0.00 -0.39 0.26 0.00 -0.55 0.00 0.00 56.30 55.61 1yr6 h ASN 140 Cb 0.35 -0.08 -0.07 0.00 0.05 0.00 0.00 38.32 38.56 1yr6 h ASN 140 CO 0.00 0.63 0.67 0.44 -1.65 0.00 0.00 177.43 177.52 1yr6 h ASP 141 N -0.02 0.34 -0.09 5.81 3.32 0.08 -1.14 116.42 124.72 1yr6 h ASP 141 Ca 0.04 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 1yr6 h ASP 141 Cb 0.50 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1yr6 h ASP 141 CO 0.02 0.09 -0.18 1.88 -1.72 0.00 0.00 179.24 179.32 1yr6 h TYR 142 N 0.31 0.36 -0.12 4.55 0.05 -1.61 -1.30 116.97 119.20 1yr6 h TYR 142 Ca 0.54 -0.13 -0.15 0.00 0.05 0.00 0.00 58.73 59.03 1yr6 h TYR 142 Cb 1.52 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 39.18 1yr6 h TYR 142 CO -0.00 0.79 -0.58 0.00 -1.05 0.00 0.00 178.16 177.32 1yr6 h PHE 144 N 0.30 -0.18 -0.78 0.00 3.57 -1.16 0.89 116.94 119.57 1yr6 h PHE 144 Ca -0.00 0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.68 1yr6 h PHE 144 Cb 1.10 0.08 -0.14 0.00 2.79 0.00 0.00 35.95 39.77 1yr6 h PHE 144 CO 0.03 -0.08 -0.01 0.28 -2.23 0.00 0.00 178.31 176.30 1yr6 h VAL 145 N -0.10 0.29 -0.72 1.41 2.07 -1.33 0.12 116.25 117.99 1yr6 h VAL 145 Ca -0.00 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 1yr6 h VAL 145 Cb 0.10 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.04 1yr6 h VAL 145 CO -0.03 0.02 0.28 0.03 0.02 0.00 0.00 177.57 177.90 1yr6 h ARG 146 N 0.08 1.07 -0.32 1.57 3.08 -1.16 -2.73 114.38 115.97 1yr6 h ARG 146 Ca 0.43 -0.18 -0.16 0.00 0.07 0.00 0.00 59.98 60.13 1yr6 h ARG 146 Cb 0.76 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 1yr6 h ARG 146 CO -0.71 0.87 -0.42 0.35 -1.07 0.00 0.00 179.97 178.99 1yr6 h PHE 147 N 1.04 1.05 -0.50 3.04 3.57 0.25 -3.08 116.94 122.30 1yr6 h PHE 147 Ca 0.24 -0.34 0.07 0.00 3.53 0.00 0.00 57.97 61.47 1yr6 h PHE 147 Cb 0.20 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 38.67 1yr6 h PHE 147 CO 0.02 1.15 0.18 0.35 -2.23 0.00 0.00 178.31 177.78 1yr6 h PHE 148 N 0.64 0.32 -0.97 0.41 3.57 -0.71 0.18 116.94 120.38 1yr6 h PHE 148 Ca 0.04 0.03 0.17 0.00 3.53 0.00 0.00 57.97 61.74 1yr6 h PHE 148 Cb 1.02 -0.07 -0.09 0.00 2.79 0.00 0.00 35.95 39.60 1yr6 h PHE 148 CO 0.07 0.10 0.61 0.00 -2.23 0.00 0.00 178.31 176.87 1yr6 h ALA 149 N 1.33 1.75 -0.68 2.41 0.00 -1.51 0.12 119.26 122.69 1yr6 h ALA 149 Ca 0.24 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1yr6 h ALA 149 Cb 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1yr6 h ALA 149 CO -0.24 -0.07 0.26 1.25 0.00 0.00 0.00 179.25 180.45 1yr6 h LEU 150 N 0.75 0.93 -0.42 0.00 5.85 -0.91 -2.71 115.31 118.80 1yr6 h LEU 150 Ca 0.53 -0.14 -0.10 0.00 0.84 0.00 0.00 57.88 59.01 1yr6 h LEU 150 Cb 0.83 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1yr6 h LEU 150 CO -0.30 0.84 -0.13 0.25 -0.34 0.00 0.00 178.44 178.77 1yr6 h LEU 151 N 0.99 0.84 -1.02 2.25 6.46 0.22 -2.41 115.31 122.65 1yr6 h LEU 151 Ca 0.23 -0.38 0.04 0.00 -0.12 0.00 0.00 57.88 57.66 1yr6 h LEU 151 Cb 0.21 -0.23 -0.06 0.00 -0.73 0.00 0.00 40.66 39.85 1yr6 h LEU 151 CO -0.02 1.02 0.65 0.40 -0.62 0.00 0.00 178.44 179.88 1yr6 h ILE 152 N 0.65 1.15 -0.26 4.05 2.04 -1.27 -1.27 117.51 122.60 1yr6 h ILE 152 Ca 0.10 -0.43 0.04 0.00 1.00 0.00 0.00 64.86 65.58 1yr6 h ILE 152 Cb 0.67 -0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 36.51 1yr6 h ILE 152 CO 0.05 0.23 -0.00 -0.78 0.00 0.00 0.00 178.15 177.64 1yr6 h ASP 153 N 1.24 -0.10 0.39 1.72 1.82 -1.10 -0.97 116.42 119.41 1yr6 h ASP 153 Ca 0.41 0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 57.09 1yr6 h ASP 153 Cb 0.04 0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.15 1yr6 h ASP 153 CO -0.14 -0.02 -0.29 -0.07 -1.61 0.00 0.00 179.24 177.11 1yr6 h LEU 154 N 0.08 -0.77 -1.28 2.28 4.07 -1.14 1.04 115.31 119.59 1yr6 h LEU 154 Ca 0.12 0.05 0.19 0.00 0.08 0.00 0.00 57.88 58.32 1yr6 h LEU 154 Cb 0.16 0.24 -0.08 0.00 1.08 0.00 0.00 40.66 42.05 1yr6 h LEU 154 CO -0.21 -0.42 0.60 -0.09 -1.08 0.00 0.00 178.44 177.25 1yr6 h ARG 155 N -0.66 0.58 0.00 1.13 9.65 -0.91 0.28 114.38 124.46 1yr6 h ARG 155 Ca -0.05 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1yr6 h ARG 155 Cb 0.55 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 1yr6 h ARG 155 CO 0.02 0.38 -1.47 1.28 2.80 0.00 0.00 179.97 182.98 1yr6 n LEU 156 N -4.61 0.38 -3.30 3.80 4.77 -0.40 -4.92 117.00 112.72 1yr6 n LEU 156 Ca 0.21 -0.21 -0.14 0.00 -0.03 0.00 0.00 56.01 55.83 1yr6 n LEU 156 Cb 0.61 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.74 1yr6 n LEU 156 CO 0.27 0.09 0.09 0.61 -1.33 0.00 0.00 177.39 177.12 1yr6 n GLY 157 N 1.42 -1.17 3.58 -0.72 0.00 0.36 -4.42 105.19 104.24 1yr6 n GLY 157 Ca -0.01 0.53 -0.15 0.00 0.00 0.00 0.00 46.02 46.39 1yr6 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yr6 s ALA 158 N -3.27 -1.74 0.29 4.61 0.00 -1.00 -4.95 121.76 115.70 1yr6 s ALA 158 Ca 0.31 1.76 -0.30 0.00 0.00 0.00 0.00 51.96 53.73 1yr6 s ALA 158 Cb -0.06 -0.78 -0.11 0.00 0.00 0.00 0.00 23.12 22.16 1yr6 s ALA 158 CO 0.77 -0.34 1.60 0.95 0.00 0.00 0.00 175.76 178.74 1yr6 s THR 159 N -0.13 2.07 -0.14 0.00 -4.23 -1.26 -4.41 115.64 107.54 1yr6 s THR 159 Ca -0.04 0.06 -0.00 0.00 -1.18 0.00 0.00 61.69 60.54 1yr6 s THR 159 Cb -0.03 -3.04 0.03 0.00 1.34 0.00 0.00 72.50 70.80 1yr6 s THR 159 CO 0.04 0.01 -0.10 -0.89 -0.54 0.00 0.00 174.62 173.14 1yr6 s THR 160 N 0.09 1.30 -0.30 3.99 2.01 -1.26 -0.82 115.64 120.64 1yr6 s THR 160 Ca 0.64 -0.55 -0.12 0.00 0.31 0.00 0.00 61.69 61.98 1yr6 s THR 160 Cb -0.48 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1yr6 s THR 160 CO 0.47 0.34 0.22 -0.63 -0.69 0.00 0.00 174.62 174.33 1yr6 s ILE 161 N 1.58 5.29 0.18 1.82 -1.09 0.84 -4.89 121.20 124.93 1yr6 s ILE 161 Ca 0.04 0.06 -0.30 0.00 -2.23 0.00 0.00 60.65 58.22 1yr6 s ILE 161 Cb -0.13 -3.61 -0.08 0.00 -1.58 0.00 0.00 42.46 37.05 1yr6 s ILE 161 CO -0.09 0.15 1.31 -2.16 -1.23 0.00 0.00 174.94 172.93 1yr6 s PRO 162 N 1.77 4.38 0.03 2.79 0.04 -1.26 -0.36 135.00 142.40 1yr6 s PRO 162 Ca 0.07 2.04 -0.00 0.00 0.04 0.00 0.00 61.00 63.15 1yr6 s PRO 162 Cb -0.16 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 1yr6 s PRO 162 CO 0.11 -0.28 -0.03 0.00 0.04 0.00 0.00 177.00 176.83 1yr6 s ALA 163 N 0.34 0.30 -0.16 8.56 0.00 0.04 -1.41 121.76 129.43 1yr6 s ALA 163 Ca 0.58 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.67 1yr6 s ALA 163 Cb -0.36 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 1yr6 s ALA 163 CO 0.36 -0.22 -0.03 -0.51 0.00 0.00 0.00 175.76 175.35 1yr6 s LEU 164 N -2.00 3.27 0.67 0.00 1.43 -0.23 -0.85 118.68 120.97 1yr6 s LEU 164 Ca -0.07 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 1yr6 s LEU 164 Cb -0.04 -1.79 0.11 0.00 0.03 0.00 0.00 46.19 44.50 1yr6 s LEU 164 CO -0.04 0.17 0.92 0.21 0.23 0.00 0.00 176.35 177.84 1yr6 s ASN 165 N 0.36 4.61 -1.03 2.29 3.04 -0.90 -0.59 114.94 122.72 1yr6 s ASN 165 Ca -0.04 -0.46 0.00 0.00 0.04 0.00 0.00 52.86 52.40 1yr6 s ASN 165 Cb -0.14 -0.01 0.00 0.00 -1.54 0.00 0.00 41.25 39.56 1yr6 s ASN 165 CO 0.03 -1.67 0.00 0.29 -3.04 0.00 0.00 177.10 172.71 1yr6 n LYS 166 N -2.64 -2.17 0.33 0.43 5.02 -0.93 -4.33 118.16 113.87 1yr6 n LYS 166 Ca 0.15 0.58 0.20 0.00 -2.02 0.00 0.00 58.31 57.21 1yr6 n LYS 166 Cb 0.61 -5.14 1.06 0.00 -0.02 0.00 0.00 35.03 31.53 1yr6 n LYS 166 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1yr6 h VAL 167 N 0.00 0.00 0.00 -0.18 -1.51 -1.74 -1.56 116.25 111.26 1yr6 h VAL 167 Ca -0.28 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.19 1yr6 h VAL 167 Cb 1.17 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.18 1yr6 h VAL 167 CO 0.33 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 175.77 1yr6 n ASP 168 N -2.96 0.00 -1.16 4.19 5.75 -1.26 -1.87 116.55 119.24 1yr6 n ASP 168 Ca -0.03 0.24 0.12 0.00 -0.01 0.00 0.00 54.79 55.11 1yr6 n ASP 168 Cb 0.17 -0.34 0.22 0.00 -1.03 0.00 0.00 41.12 40.14 1yr6 n ASP 168 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1yr6 n LEU 169 N -1.34 3.48 -4.83 -2.12 4.77 -0.59 -4.93 117.00 111.45 1yr6 n LEU 169 Ca 0.04 -1.53 -0.37 0.00 -0.03 0.00 0.00 56.01 54.11 1yr6 n LEU 169 Cb 0.08 -0.26 -0.06 0.00 -2.33 0.00 0.00 43.42 40.85 1yr6 n LEU 169 CO 0.07 0.76 0.16 -0.76 -1.33 0.00 0.00 177.39 176.29 1yr6 s LEU 170 N -1.45 4.45 0.00 2.23 1.43 -0.78 -4.98 118.68 119.58 1yr6 s LEU 170 Ca 0.39 1.04 0.29 0.00 -1.03 0.00 0.00 54.13 54.82 1yr6 s LEU 170 Cb 0.23 -2.82 1.26 0.00 0.03 0.00 0.00 46.19 44.88 1yr6 s LEU 170 CO 0.31 0.26 1.93 -1.54 0.23 0.00 0.00 176.35 177.54 1yr6 n SER 171 N 1.52 0.03 0.00 2.29 3.41 -1.26 -4.81 113.62 114.80 1yr6 n SER 171 Ca -0.11 0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 1yr6 n SER 171 Cb 0.52 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1yr6 n SER 171 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1yr6 n GLU 172 N -1.46 0.00 0.20 4.33 4.07 -1.26 -4.68 120.64 121.84 1yr6 n GLU 172 Ca 0.08 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 57.03 1yr6 n GLU 172 Cb 0.32 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.63 1yr6 n GLU 172 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1yr6 h GLU 173 N 0.00 -0.68 -0.50 5.31 5.08 -1.99 0.74 114.58 122.54 1yr6 h GLU 173 Ca 0.00 0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.48 1yr6 h GLU 173 Cb 0.00 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 1yr6 h GLU 173 CO 0.00 -0.46 0.16 0.93 -1.00 0.00 0.00 179.01 178.64 1yr6 h GLU 174 N -0.71 0.31 -0.36 2.33 5.08 -1.92 -0.33 114.58 118.98 1yr6 h GLU 174 Ca -0.01 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 1yr6 h GLU 174 Cb 0.66 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.79 1yr6 h GLU 174 CO -0.10 0.21 0.05 0.87 -1.00 0.00 0.00 179.01 179.03 1yr6 h LYS 175 N 0.32 0.16 -0.37 2.33 1.57 -1.85 -1.78 116.57 116.95 1yr6 h LYS 175 Ca 0.24 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1yr6 h LYS 175 Cb 0.28 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1yr6 h LYS 175 CO -0.27 0.10 0.23 0.93 -0.57 0.00 0.00 179.45 179.87 1yr6 h GLU 176 N 0.16 0.51 -0.92 3.15 5.08 -0.02 -2.45 114.58 120.08 1yr6 h GLU 176 Ca 0.17 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1yr6 h GLU 176 Cb 0.21 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 1yr6 h GLU 176 CO -0.25 0.38 0.54 -0.09 -1.00 0.00 0.00 179.01 178.59 1yr6 h ARG 177 N 0.49 1.26 -0.22 2.33 2.43 -0.74 -2.35 114.38 117.59 1yr6 h ARG 177 Ca 0.13 -0.12 -0.18 0.00 -0.81 0.00 0.00 59.98 59.00 1yr6 h ARG 177 Cb -0.00 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 29.29 1yr6 h ARG 177 CO -0.03 0.89 -0.59 0.45 -1.51 0.00 0.00 179.97 179.18 1yr6 h HIS 178 N 1.28 0.92 -0.94 2.20 3.86 -1.19 -3.11 115.15 118.17 1yr6 h HIS 178 Ca 0.33 -0.34 0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1yr6 h HIS 178 Cb -0.04 -0.17 -0.05 0.00 1.06 0.00 0.00 27.41 28.22 1yr6 h HIS 178 CO 0.01 1.14 0.62 0.07 0.86 0.00 0.00 177.93 180.62 1yr6 h ARG 179 N 0.54 1.22 0.04 2.45 0.11 -1.26 -2.96 114.38 114.53 1yr6 h ARG 179 Ca -0.00 -0.07 0.01 0.00 0.10 0.00 0.00 59.98 60.01 1yr6 h ARG 179 Cb 1.18 -0.28 -0.03 0.00 1.11 0.00 0.00 29.97 31.96 1yr6 h ARG 179 CO 0.12 0.81 -0.30 0.87 0.10 0.00 0.00 179.97 181.57 1yr6 h LYS 180 N 1.26 -0.40 -0.61 0.08 6.56 -1.35 -2.40 116.57 119.72 1yr6 h LYS 180 Ca 0.35 0.03 0.05 0.00 -1.06 0.00 0.00 60.65 60.02 1yr6 h LYS 180 Cb -0.13 0.09 -0.05 0.00 -0.57 0.00 0.00 32.23 31.57 1yr6 h LYS 180 CO -0.08 -0.26 0.33 1.88 -2.06 0.00 0.00 179.45 179.25 1yr6 h TYR 181 N -0.41 0.60 0.64 -1.35 0.05 -1.62 -2.91 116.97 111.96 1yr6 h TYR 181 Ca 0.00 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.77 1yr6 h TYR 181 Cb 0.42 -0.18 0.01 0.00 1.01 0.00 0.00 36.73 37.99 1yr6 h TYR 181 CO -0.41 0.29 -0.31 0.74 -1.05 0.00 0.00 178.16 177.42 1yr6 h PHE 182 N 0.62 -0.79 -0.15 4.88 0.04 -1.36 -3.36 116.94 116.82 1yr6 h PHE 182 Ca 0.27 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 61.00 1yr6 h PHE 182 Cb 0.17 0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 1yr6 h PHE 182 CO -0.09 -0.49 -0.00 0.93 -0.60 0.00 0.00 178.31 178.05 1yr6 h GLU 183 N -1.09 0.27 -6.19 1.51 5.08 -1.52 -3.42 114.58 109.22 1yr6 h GLU 183 Ca -0.09 -0.09 -0.54 0.00 -1.00 0.00 0.00 59.36 57.65 1yr6 h GLU 183 Cb 0.65 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.84 1yr6 h GLU 183 CO 0.14 0.50 1.27 0.34 -1.00 0.00 0.00 179.01 180.26 1yr6 s ASP 184 N -5.78 5.71 0.13 1.42 -1.08 -1.10 -4.98 116.67 110.99 1yr6 s ASP 184 Ca -0.14 0.73 -0.31 0.00 -0.52 0.00 0.00 52.55 52.32 1yr6 s ASP 184 Cb 0.06 -2.53 -0.07 0.00 -1.46 0.00 0.00 42.92 38.91 1yr6 s ASP 184 CO 0.72 -1.96 1.29 -0.51 0.52 0.00 0.00 175.17 175.23 1yr6 s ILE 185 N 7.54 3.52 0.32 4.11 1.10 -1.26 -3.82 121.20 132.71 1yr6 s ILE 185 Ca 0.69 1.15 0.00 0.00 -0.51 0.00 0.00 60.65 61.98 1yr6 s ILE 185 Cb -0.16 -3.74 0.00 0.00 0.15 0.00 0.00 42.46 38.71 1yr6 s ILE 185 CO 0.27 0.12 0.00 0.47 -2.11 0.00 0.00 174.94 173.69 1yr6 n ASP 186 N 3.46 -4.04 0.00 4.50 8.00 -1.26 -4.86 116.55 122.36 1yr6 n ASP 186 Ca 0.09 0.77 0.00 0.00 0.71 0.00 0.00 54.79 56.35 1yr6 n ASP 186 Cb 0.44 -2.54 0.00 0.00 -0.02 0.00 0.00 41.12 39.00 1yr6 n ASP 186 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yr6 n TYR 187 N -3.15 0.00 0.25 1.24 4.19 -1.26 -4.60 117.16 113.83 1yr6 n TYR 187 Ca -0.05 0.00 -0.15 0.00 3.31 0.00 0.00 57.90 61.02 1yr6 n TYR 187 Cb 0.35 0.00 -0.08 0.00 0.49 0.00 0.00 39.34 40.10 1yr6 n TYR 187 CO 0.00 0.00 0.00 1.37 0.91 0.00 0.00 176.86 179.14 1yr6 h LEU 188 N 0.00 -0.54 -1.17 2.98 8.10 -1.81 -0.07 115.31 122.80 1yr6 h LEU 188 Ca 0.00 -0.07 -0.05 0.00 0.11 0.00 0.00 57.88 57.87 1yr6 h LEU 188 Cb 0.00 0.14 -0.02 0.00 -0.44 0.00 0.00 40.66 40.34 1yr6 h LEU 188 CO 0.00 -0.22 0.06 0.71 -4.11 0.00 0.00 178.44 174.88 1yr6 h THR 189 N -0.88 1.20 -0.16 0.15 1.35 -1.89 -0.67 112.91 112.01 1yr6 h THR 189 Ca -0.07 -0.77 0.03 0.00 -0.55 0.00 0.00 66.41 65.05 1yr6 h THR 189 Cb 0.58 0.83 -0.03 0.00 -1.73 0.00 0.00 68.15 67.80 1yr6 h THR 189 CO 0.11 0.28 -0.01 0.00 -0.25 0.00 0.00 175.52 175.64 1yr6 h ALA 190 N 1.45 0.13 0.00 6.62 0.00 -1.86 -0.12 119.26 125.49 1yr6 h ALA 190 Ca 0.14 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1yr6 h ALA 190 Cb 0.30 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1yr6 h ALA 190 CO 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 179.25 178.80 1yr6 h ARG 191 N 0.04 0.00 -2.64 0.00 2.47 -0.77 -3.04 114.38 110.44 1yr6 h ARG 191 Ca 0.08 0.00 -0.76 0.00 -1.26 0.00 0.00 59.98 58.04 1yr6 h ARG 191 Cb 0.10 0.00 -0.15 0.00 -1.65 0.00 0.00 29.97 28.27 1yr6 h ARG 191 CO -0.14 0.00 2.11 1.28 0.56 0.00 0.00 179.97 183.78 1yr6 n LEU 192 N -2.83 7.78 0.00 3.04 4.77 -0.06 -3.91 117.00 125.79 1yr6 n LEU 192 Ca 0.01 -4.96 0.00 0.00 -0.03 0.00 0.00 56.01 51.03 1yr6 n LEU 192 Cb 0.28 -1.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 1yr6 n LEU 192 CO 0.25 1.99 0.00 1.17 -1.33 0.00 0.00 177.39 179.47 1yr6 n LYS 193 N 1.59 1.83 0.00 3.23 4.81 -1.15 -4.78 118.16 123.69 1yr6 n LYS 193 Ca 0.57 0.00 0.14 0.00 -0.87 0.00 0.00 58.31 58.15 1yr6 n LYS 193 Cb 0.26 -0.26 0.60 0.00 0.02 0.00 0.00 35.03 35.65 1yr6 n LYS 193 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1yr6 n LEU 194 N -0.21 0.22 -4.61 3.14 7.99 -1.25 -4.75 117.00 117.53 1yr6 n LEU 194 Ca 0.00 0.22 -0.42 0.00 -0.01 0.00 0.00 56.01 55.80 1yr6 n LEU 194 Cb 0.00 -0.31 -0.05 0.00 -0.11 0.00 0.00 43.42 42.95 1yr6 n LEU 194 CO 0.00 0.05 0.54 -1.81 -1.51 0.00 0.00 177.39 174.66 1yr6 s ASP 195 N -2.72 6.63 -0.34 -1.43 -0.00 -1.26 -4.95 116.67 112.60 1yr6 s ASP 195 Ca 0.22 0.64 -0.03 0.00 -0.00 0.00 0.00 52.55 53.38 1yr6 s ASP 195 Cb 0.19 -2.39 0.07 0.00 -0.00 0.00 0.00 42.92 40.80 1yr6 s ASP 195 CO 0.52 -0.57 2.58 -0.81 -0.00 0.00 0.00 175.17 176.89 1yr6 n PRO 196 N 6.10 2.10 -4.43 8.23 -0.04 -1.26 -4.31 135.00 141.39 1yr6 n PRO 196 Ca 0.03 -1.84 -0.22 0.00 -0.04 0.00 0.00 63.50 61.43 1yr6 n PRO 196 Cb 0.48 -1.90 -0.16 0.00 -0.04 0.00 0.00 33.50 31.88 1yr6 n PRO 196 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1yr6 s SER 197 N 0.54 1.41 0.14 3.54 1.04 -1.26 -4.98 113.70 114.13 1yr6 s SER 197 Ca 0.48 -0.22 -0.26 0.00 0.48 0.00 0.00 55.95 56.43 1yr6 s SER 197 Cb 0.31 -0.58 -0.02 0.00 0.10 0.00 0.00 66.02 65.83 1yr6 s SER 197 CO -0.11 0.02 1.61 0.24 0.98 0.00 0.00 173.24 175.98 1yr6 h MET 198 N 6.85 -0.37 0.00 4.02 2.86 -1.95 11.99 114.93 138.33 1yr6 h MET 198 Ca -0.34 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1yr6 h MET 198 Cb 1.17 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.92 1yr6 h MET 198 CO 0.48 -0.25 0.00 1.04 1.06 0.00 0.00 176.91 179.24 1yr6 n GLN 199 N -5.41 0.08 -0.09 1.72 1.13 -1.26 0.73 117.38 114.28 1yr6 n GLN 199 Ca -0.03 0.56 -0.22 0.00 -1.94 0.00 0.00 57.00 55.37 1yr6 n GLN 199 Cb 0.32 -1.76 -0.12 0.00 0.11 0.00 0.00 30.24 28.79 1yr6 n GLN 199 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yr6 n GLY 200 N -1.30 -0.51 0.19 1.08 0.00 0.85 -2.70 105.19 102.80 1yr6 n GLY 200 Ca -0.01 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 45.93 1yr6 n GLY 200 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1yr6 h LEU 201 N -0.36 0.00 -0.53 0.99 3.38 2.67 -1.18 115.31 120.29 1yr6 h LEU 201 Ca -0.53 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.42 1yr6 h LEU 201 Cb 1.78 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.51 1yr6 h LEU 201 CO -0.13 0.35 0.23 -0.03 0.09 0.00 0.00 178.44 178.95 1yr6 h MET 202 N 0.00 0.78 0.00 1.13 4.05 2.53 -1.87 114.93 121.54 1yr6 h MET 202 Ca -0.00 -0.13 -0.05 0.00 -0.28 0.00 0.00 59.70 59.24 1yr6 h MET 202 Cb 0.86 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 1yr6 h MET 202 CO 0.05 0.67 -0.24 0.00 0.23 0.00 0.00 176.91 177.61 1yr6 h ALA 203 N 1.07 1.20 -0.16 0.39 0.00 -1.18 -2.54 119.26 118.04 1yr6 h ALA 203 Ca 0.18 -0.22 -0.20 0.00 0.00 0.00 0.00 54.91 54.67 1yr6 h ALA 203 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1yr6 h ALA 203 CO -0.02 0.30 -0.71 -0.92 0.00 0.00 0.00 179.25 177.91 1yr6 h TYR 204 N 0.00 0.89 -0.57 0.00 -0.00 -0.91 -3.18 116.97 113.20 1yr6 h TYR 204 Ca -0.00 -0.37 0.05 0.00 -0.00 0.00 0.00 58.73 58.40 1yr6 h TYR 204 Cb 0.59 -0.14 -0.05 0.00 -0.00 0.00 0.00 36.73 37.13 1yr6 h TYR 204 CO 0.00 1.17 0.30 -0.22 -0.00 0.00 0.00 178.16 179.41 1yr6 h LYS 205 N 0.47 0.56 -0.26 1.82 3.64 -0.93 -2.76 116.57 119.12 1yr6 h LYS 205 Ca -0.03 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1yr6 h LYS 205 Cb 1.31 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1yr6 h LYS 205 CO 0.14 0.37 0.18 0.52 -2.27 0.00 0.00 179.45 178.39 1yr6 h MET 206 N 0.58 0.31 -5.10 1.90 2.86 -1.49 -3.32 114.93 110.66 1yr6 h MET 206 Ca 0.25 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 1yr6 h MET 206 Cb 0.14 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.72 1yr6 h MET 206 CO -0.16 0.21 0.21 0.00 1.06 0.00 0.00 176.91 178.23 1yr6 n SER 208 N 17.16 0.83 -1.89 0.00 7.64 -1.25 -5.02 113.62 131.09 1yr6 n SER 208 Ca 0.36 0.12 -0.27 0.00 1.01 0.00 0.00 58.87 60.10 1yr6 n SER 208 Cb 0.46 -0.34 -0.05 0.00 -1.01 0.00 0.00 64.21 63.27 1yr6 n SER 208 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1yr6 n MET 209 N -3.28 0.00 0.00 1.43 0.00 -1.26 -4.90 117.12 109.10 1yr6 n MET 209 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.67 1yr6 n MET 209 Cb 0.10 -0.64 0.00 0.00 0.00 0.00 0.00 33.22 32.67 1yr6 n MET 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1yr6 n MET 210 N 2.78 2.77 -4.07 3.17 0.00 -1.26 -4.96 117.12 115.54 1yr6 n MET 210 Ca 0.21 0.00 -0.27 0.00 0.00 0.00 0.00 57.70 57.64 1yr6 n MET 210 Cb -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.15 1yr6 n MET 210 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 1yr6 s THR 211 N 3.99 4.52 0.00 3.17 2.01 -1.26 -4.46 115.64 123.61 1yr6 s THR 211 Ca 0.00 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 60.98 1yr6 s THR 211 Cb 0.00 -3.29 0.00 0.00 0.01 0.00 0.00 72.50 69.22 1yr6 s THR 211 CO 0.00 -0.07 0.00 -0.62 -0.69 0.00 0.00 174.62 173.24 1yr6 n GLU 212 N -0.22 0.00 0.00 4.92 4.71 -1.26 -3.95 120.64 124.84 1yr6 n GLU 212 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.07 1yr6 n GLU 212 Cb 0.54 -0.32 0.00 0.00 -1.01 0.00 0.00 31.44 30.66 1yr6 n GLU 212 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1yr6 n VAL 213 N -1.62 0.00 -3.82 2.62 0.31 -1.26 -4.39 118.33 110.16 1yr6 n VAL 213 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.05 1yr6 n VAL 213 Cb 0.13 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 32.95 1yr6 n VAL 213 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1yr6 n LEU 214 N 0.00 3.00 -4.58 7.52 7.94 -1.25 -5.09 117.00 124.55 1yr6 n LEU 214 Ca 0.00 -5.22 -0.42 0.00 -1.11 0.00 0.00 56.01 49.26 1yr6 n LEU 214 Cb 0.00 -0.70 -0.05 0.00 0.53 0.00 0.00 43.42 43.20 1yr6 n LEU 214 CO 0.00 1.80 0.59 -2.16 -1.11 0.00 0.00 177.39 176.52 1yr6 s PRO 215 N -1.56 3.66 0.75 1.96 0.04 -1.26 -4.29 135.00 134.30 1yr6 s PRO 215 Ca 0.27 0.22 -0.15 0.00 0.04 0.00 0.00 61.00 61.38 1yr6 s PRO 215 Cb -0.01 -3.85 0.02 0.00 0.04 0.00 0.00 34.50 30.70 1yr6 s PRO 215 CO -0.15 -0.94 1.00 -2.30 0.04 0.00 0.00 177.00 174.65 1yr6 n PRO 216 N 6.56 0.43 -3.99 0.56 -0.02 -1.26 -5.00 135.00 132.27 1yr6 n PRO 216 Ca 0.03 0.21 -0.22 0.00 -2.02 0.00 0.00 63.50 61.49 1yr6 n PRO 216 Cb 0.48 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.65 1yr6 n PRO 216 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1yr6 s VAL 217 N -1.89 3.14 -0.17 -1.45 0.11 -1.26 -5.10 120.40 113.78 1yr6 s VAL 217 Ca 0.73 -1.58 -0.20 0.00 -2.93 0.00 0.00 61.98 57.99 1yr6 s VAL 217 Cb -0.33 -3.04 -0.03 0.00 -1.53 0.00 0.00 36.38 31.45 1yr6 s VAL 217 CO 0.51 -0.17 0.60 -0.60 -3.33 0.00 0.00 175.10 172.11 1yr6 s ARG 218 N -3.90 4.25 0.12 1.54 3.52 -1.26 -5.05 118.95 118.17 1yr6 s ARG 218 Ca 0.39 0.60 -0.28 0.00 -0.13 0.00 0.00 55.73 56.31 1yr6 s ARG 218 Cb -0.03 -3.54 -0.06 0.00 -1.56 0.00 0.00 34.95 29.75 1yr6 s ARG 218 CO 0.24 -0.14 0.87 0.08 -0.81 0.00 0.00 175.30 175.54 1yr6 s VAL 219 N 1.56 4.49 0.10 7.11 1.01 -1.26 -4.63 120.40 128.78 1yr6 s VAL 219 Ca 0.29 1.88 -0.09 0.00 0.00 0.00 0.00 61.98 64.06 1yr6 s VAL 219 Cb -0.16 -4.23 -0.06 0.00 0.00 0.00 0.00 36.38 31.93 1yr6 s VAL 219 CO 0.11 0.39 0.42 -0.76 0.00 0.00 0.00 175.10 175.25 1yr6 s LEU 220 N -0.34 4.32 -0.22 3.92 1.43 -0.50 -5.00 118.68 122.29 1yr6 s LEU 220 Ca 0.42 0.79 -0.02 0.00 -1.03 0.00 0.00 54.13 54.29 1yr6 s LEU 220 Cb -0.23 -3.09 0.01 0.00 0.03 0.00 0.00 46.19 42.91 1yr6 s LEU 220 CO 0.27 0.13 -0.08 -0.31 0.23 0.00 0.00 176.35 176.60 1yr6 s TYR 221 N -1.47 2.97 0.08 0.29 2.02 -1.26 -1.07 117.35 118.91 1yr6 s TYR 221 Ca 0.35 -1.34 0.09 0.00 -0.37 0.00 0.00 57.07 55.80 1yr6 s TYR 221 Cb -0.14 -2.05 -0.03 0.00 -0.40 0.00 0.00 41.96 39.34 1yr6 s TYR 221 CO 0.19 -0.68 -0.24 -0.51 -1.57 0.00 0.00 175.55 172.74 1yr6 s LEU 222 N 1.38 2.23 -0.13 -1.29 1.43 0.24 -3.62 118.68 118.92 1yr6 s LEU 222 Ca 0.03 -0.63 -0.04 0.00 -1.03 0.00 0.00 54.13 52.46 1yr6 s LEU 222 Cb -0.15 -1.13 0.06 0.00 0.03 0.00 0.00 46.19 45.00 1yr6 s LEU 222 CO -0.06 0.18 0.15 -0.55 0.23 0.00 0.00 176.35 176.30 1yr6 s SER 223 N -1.56 1.35 0.41 2.29 0.15 -0.90 -2.20 113.70 113.24 1yr6 s SER 223 Ca 0.11 -0.07 0.13 0.00 0.70 0.00 0.00 55.95 56.82 1yr6 s SER 223 Cb -0.10 0.13 0.98 0.00 -1.71 0.00 0.00 66.02 65.33 1yr6 s SER 223 CO 0.03 -0.29 1.93 0.00 1.20 0.00 0.00 173.24 176.11 1yr6 h ALA 224 N 8.37 2.01 -0.07 5.45 0.00 -1.92 0.79 119.26 133.89 1yr6 h ALA 224 Ca -0.14 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1yr6 h ALA 224 Cb 1.13 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1yr6 h ALA 224 CO 0.22 -0.20 -0.01 -0.22 0.00 0.00 0.00 179.25 179.04 1yr6 h LYS 225 N 0.49 0.13 -0.03 0.00 3.64 -1.97 -3.32 116.57 115.51 1yr6 h LYS 225 Ca 0.36 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1yr6 h LYS 225 Cb 0.72 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1yr6 h LYS 225 CO -0.12 0.44 0.00 0.25 -2.27 0.00 0.00 179.45 177.74 1yr6 n THR 226 N -4.83 0.02 -1.94 1.00 -2.24 -1.18 -4.96 114.28 100.15 1yr6 n THR 226 Ca -0.07 -0.51 -0.19 0.00 -2.27 0.00 0.00 64.05 61.01 1yr6 n THR 226 Cb 0.21 1.34 -0.05 0.00 -2.10 0.00 0.00 70.33 69.73 1yr6 n THR 226 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1yr6 n ARG 227 N 0.97 -1.59 -1.75 -0.78 1.74 0.26 -4.97 116.66 110.55 1yr6 n ARG 227 Ca 0.10 1.04 -0.42 0.00 -0.77 0.00 0.00 57.85 57.81 1yr6 n ARG 227 Cb 0.43 -5.53 -0.01 0.00 -1.02 0.00 0.00 32.46 26.33 1yr6 n ARG 227 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1yr6 n GLU 228 N -2.58 2.69 -0.93 5.56 2.13 -1.17 -3.17 120.64 123.17 1yr6 n GLU 228 Ca -0.21 0.95 0.00 0.00 0.66 0.00 0.00 57.16 58.57 1yr6 n GLU 228 Cb 0.65 -2.72 0.00 0.00 0.27 0.00 0.00 31.44 29.64 1yr6 n GLU 228 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1yr6 n GLY 229 N 1.77 0.81 0.27 8.31 0.00 -1.24 -2.11 105.19 113.01 1yr6 n GLY 229 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 1yr6 n GLY 229 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1yr6 h PHE 230 N 0.00 1.03 -0.58 1.61 -1.00 -1.84 -2.36 116.94 113.80 1yr6 h PHE 230 Ca 0.00 -0.20 -0.06 0.00 2.81 0.00 0.00 57.97 60.53 1yr6 h PHE 230 Cb 0.01 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 39.29 1yr6 h PHE 230 CO 0.01 0.96 0.13 0.93 -1.61 0.00 0.00 178.31 178.73 1yr6 h GLU 231 N 0.80 0.93 -0.61 1.51 3.07 -1.90 -0.70 114.58 117.68 1yr6 h GLU 231 Ca 0.14 -0.23 0.10 0.00 -0.50 0.00 0.00 59.36 58.86 1yr6 h GLU 231 Cb 0.59 -0.12 -0.07 0.00 -0.84 0.00 0.00 28.75 28.30 1yr6 h GLU 231 CO 0.04 0.87 0.22 -0.44 -1.40 0.00 0.00 179.01 178.30 1yr6 h ASP 232 N 0.84 0.21 -0.29 1.42 3.32 -1.93 -0.61 116.42 119.37 1yr6 h ASP 232 Ca 0.18 0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.21 1yr6 h ASP 232 Cb 0.37 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1yr6 h ASP 232 CO 0.00 0.13 -0.20 0.25 -1.72 0.00 0.00 179.24 177.70 1yr6 h LEU 233 N 0.40 0.69 -0.44 1.55 5.85 -1.06 0.17 115.31 122.47 1yr6 h LEU 233 Ca 0.31 -0.44 0.05 0.00 0.84 0.00 0.00 57.88 58.64 1yr6 h LEU 233 Cb 0.39 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 1yr6 h LEU 233 CO -0.31 0.98 0.17 -0.08 -0.34 0.00 0.00 178.44 178.85 1yr6 h GLU 234 N 0.40 0.34 -0.10 1.25 4.81 -0.94 0.13 114.58 120.47 1yr6 h GLU 234 Ca 0.06 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1yr6 h GLU 234 Cb 0.75 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 1yr6 h GLU 234 CO 0.06 0.22 -0.01 1.15 -0.73 0.00 0.00 179.01 179.70 1yr6 h THR 235 N 0.35 0.92 -0.91 0.32 2.02 -0.84 -1.91 112.91 112.85 1yr6 h THR 235 Ca 0.20 -0.01 0.13 0.00 0.77 0.00 0.00 66.41 67.51 1yr6 h THR 235 Cb 0.18 0.90 -0.07 0.00 -1.74 0.00 0.00 68.15 67.41 1yr6 h THR 235 CO -0.19 0.00 0.58 -0.07 0.37 0.00 0.00 175.52 176.21 1yr6 h LEU 236 N 0.02 0.73 -1.40 2.58 3.38 -0.14 0.14 115.31 120.62 1yr6 h LEU 236 Ca 0.05 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1yr6 h LEU 236 Cb 0.06 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1yr6 h LEU 236 CO -0.09 0.38 -0.24 0.00 0.09 0.00 0.00 178.44 178.58 1yr6 h ALA 237 N 1.58 1.17 0.04 1.53 0.00 -0.03 -1.73 119.26 121.82 1yr6 h ALA 237 Ca 0.45 -0.22 -0.20 0.00 0.00 0.00 0.00 54.91 54.94 1yr6 h ALA 237 Cb 0.63 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1yr6 h ALA 237 CO -0.21 0.30 -1.05 -0.92 0.00 0.00 0.00 179.25 177.37 1yr6 h TYR 238 N 0.00 0.16 -0.10 0.00 5.03 -0.42 -3.11 116.97 118.53 1yr6 h TYR 238 Ca -0.00 -0.12 0.03 0.00 2.58 0.00 0.00 58.73 61.22 1yr6 h TYR 238 Cb 0.61 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 38.88 1yr6 h TYR 238 CO 0.00 1.41 0.12 0.93 -1.32 0.00 0.00 178.16 179.30 1yr6 h GLU 239 N -0.74 0.00 0.00 1.82 5.08 -0.75 -2.52 114.58 117.47 1yr6 h GLU 239 Ca -0.26 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.02 1yr6 h GLU 239 Cb 1.41 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 1yr6 h GLU 239 CO -0.07 0.00 -0.46 1.25 -1.00 0.00 0.00 179.01 178.73 1yr6 h HIS 240 N 0.00 0.00 0.00 4.33 2.76 -1.43 -3.04 115.15 117.77 1yr6 h HIS 240 Ca 0.05 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 1yr6 h HIS 240 Cb 0.29 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.25 1yr6 h HIS 240 CO 0.00 1.15 0.00 0.66 -1.30 0.00 0.00 177.93 178.44 1yr6 n TYR 241 N -4.55 0.00 0.00 5.26 4.01 -1.13 -2.17 117.16 118.59 1yr6 n TYR 241 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 1yr6 n TYR 241 Cb 0.54 -0.39 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 1yr6 n TYR 241 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1yr6 h THR 243 N 0.00 0.00 0.00 0.00 1.35 -1.63 -3.52 112.91 109.11 1yr6 h THR 243 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1yr6 h THR 243 Cb 0.00 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.42 1yr6 h THR 243 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27