#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ri1 n LYS 42 N 0.00 2.52 -0.08 -1.46 4.76 -1.26 -4.17 118.16 118.46 1ri1 n LYS 42 Ca 0.00 -2.33 0.03 0.00 -2.87 0.00 0.00 58.31 53.14 1ri1 n LYS 42 Cb 0.00 -1.50 0.08 0.00 -1.84 0.00 0.00 35.03 31.77 1ri1 n LYS 42 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1ri1 n THR 43 N 1.43 0.80 -0.17 -0.18 -2.24 -1.26 -4.74 114.28 107.93 1ri1 n THR 43 Ca 0.20 -0.90 -0.02 0.00 -2.27 0.00 0.00 64.05 61.06 1ri1 n THR 43 Cb 0.59 0.63 0.06 0.00 -2.10 0.00 0.00 70.33 69.51 1ri1 n THR 43 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1ri1 h ILE 44 N 1.23 0.57 -0.78 2.28 2.10 -2.00 -0.09 117.51 120.82 1ri1 h ILE 44 Ca 0.00 -0.03 0.08 0.00 1.08 0.00 0.00 64.86 65.98 1ri1 h ILE 44 Cb 0.57 0.47 -0.06 0.00 -1.09 0.00 0.00 36.82 36.70 1ri1 h ILE 44 CO 0.00 0.02 0.45 0.78 -1.08 0.00 0.00 178.15 178.31 1ri1 h ASN 45 N 0.10 0.66 -0.16 2.19 2.35 -1.92 0.88 115.58 119.67 1ri1 h ASN 45 Ca 0.26 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 56.01 1ri1 h ASN 45 Cb 0.40 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 1ri1 h ASN 45 CO -0.45 0.40 -0.01 0.40 -1.65 0.00 0.00 177.43 176.12 1ri1 h ILE 46 N 0.79 1.17 -0.12 2.81 2.04 -1.42 0.22 117.51 123.00 1ri1 h ILE 46 Ca 0.36 -0.67 -0.13 0.00 1.00 0.00 0.00 64.86 65.41 1ri1 h ILE 46 Cb 0.27 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1ri1 h ILE 46 CO -0.21 0.23 -0.45 0.03 0.00 0.00 0.00 178.15 177.74 1ri1 h ARG 47 N 0.40 0.52 -0.42 2.37 3.08 0.21 -2.08 114.38 118.45 1ri1 h ARG 47 Ca 0.09 -0.40 0.03 0.00 0.07 0.00 0.00 59.98 59.77 1ri1 h ARG 47 Cb 0.28 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 1ri1 h ARG 47 CO 0.01 1.02 0.22 -0.91 -1.07 0.00 0.00 179.97 179.24 1ri1 h ASN 48 N 0.12 0.33 0.50 7.04 2.35 -0.47 0.64 115.58 126.09 1ri1 h ASN 48 Ca -0.02 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1ri1 h ASN 48 Cb 1.08 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.41 1ri1 h ASN 48 CO 0.10 0.23 -0.27 0.00 -1.65 0.00 0.00 177.43 175.84 1ri1 h ALA 49 N 1.21 -0.72 -0.58 -0.83 0.00 -0.96 0.28 119.26 117.65 1ri1 h ALA 49 Ca 0.17 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.01 1ri1 h ALA 49 Cb 0.07 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1ri1 h ALA 49 CO -0.11 -0.91 0.24 -0.91 0.00 0.00 0.00 179.25 177.55 1ri1 h ASN 50 N -0.72 0.28 -0.10 0.00 -0.26 -1.18 0.29 115.58 113.89 1ri1 h ASN 50 Ca -0.06 0.06 -0.10 0.00 -0.56 0.00 0.00 56.30 55.64 1ri1 h ASN 50 Cb 0.57 0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.84 1ri1 h ASN 50 CO 0.09 0.17 -0.23 0.78 -1.06 0.00 0.00 177.43 177.18 1ri1 h ASN 51 N 0.44 0.53 0.72 5.81 2.35 -0.70 -0.45 115.58 124.29 1ri1 h ASN 51 Ca 0.28 -0.18 -0.04 0.00 -0.55 0.00 0.00 56.30 55.82 1ri1 h ASN 51 Cb 0.30 -0.14 0.01 0.00 0.05 0.00 0.00 38.32 38.54 1ri1 h ASN 51 CO -0.26 0.76 -0.35 0.15 -1.65 0.00 0.00 177.43 176.08 1ri1 h PHE 52 N 0.47 -0.90 -0.73 1.19 3.57 0.62 0.11 116.94 121.26 1ri1 h PHE 52 Ca 0.07 -0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.69 1ri1 h PHE 52 Cb 0.66 0.30 -0.10 0.00 2.79 0.00 0.00 35.95 39.60 1ri1 h PHE 52 CO 0.02 -0.54 0.25 0.82 -2.23 0.00 0.00 178.31 176.63 1ri1 h ILE 53 N -1.10 0.61 -0.46 1.41 2.04 -0.33 0.85 117.51 120.54 1ri1 h ILE 53 Ca -0.10 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.55 1ri1 h ILE 53 Cb 0.77 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1ri1 h ILE 53 CO 0.16 0.07 -0.04 0.11 0.00 0.00 0.00 178.15 178.45 1ri1 h LYS 54 N 0.37 0.78 -0.09 2.37 1.57 -0.90 -1.42 116.57 119.25 1ri1 h LYS 54 Ca 0.40 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1ri1 h LYS 54 Cb 0.64 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 1ri1 h LYS 54 CO -0.43 0.81 0.01 0.00 -0.57 0.00 0.00 179.45 179.27 1ri1 h ALA 55 N 1.24 0.12 -0.45 3.86 0.00 0.12 -1.73 119.26 122.42 1ri1 h ALA 55 Ca 0.14 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1ri1 h ALA 55 Cb 0.49 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1ri1 h ALA 55 CO 0.03 -0.21 0.14 0.00 0.00 0.00 0.00 179.25 179.20 1ri1 h LEU 57 N 0.30 -0.40 -0.83 0.00 5.85 -1.06 0.12 115.31 119.30 1ri1 h LEU 57 Ca 0.21 0.12 0.04 0.00 0.84 0.00 0.00 57.88 59.09 1ri1 h LEU 57 Cb 0.22 0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.45 1ri1 h LEU 57 CO -0.23 -0.14 0.53 0.40 -0.34 0.00 0.00 178.44 178.65 1ri1 h ILE 58 N -0.03 1.11 -0.67 4.05 2.04 -0.68 -1.66 117.51 121.67 1ri1 h ILE 58 Ca 0.18 -0.35 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 1ri1 h ILE 58 Cb 0.30 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 1ri1 h ILE 58 CO -0.39 0.18 0.17 -0.09 0.00 0.00 0.00 178.15 178.02 1ri1 h ARG 59 N 1.01 1.07 -0.62 2.37 2.43 0.29 -0.52 114.38 120.41 1ri1 h ARG 59 Ca 0.34 -0.26 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 1ri1 h ARG 59 Cb 0.04 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 1ri1 h ARG 59 CO -0.13 0.95 0.20 -0.07 -1.51 0.00 0.00 179.97 179.41 1ri1 h LEU 60 N 1.00 0.89 -1.06 3.80 3.38 -0.02 -3.33 115.31 119.97 1ri1 h LEU 60 Ca 0.21 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ri1 h LEU 60 Cb 0.36 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1ri1 h LEU 60 CO 0.00 0.86 -0.21 -1.22 0.09 0.00 0.00 178.44 177.96 1ri1 n TYR 61 N -4.39 0.00 -4.17 1.13 4.02 -0.70 -5.00 117.16 108.05 1ri1 n TYR 61 Ca 0.04 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.66 1ri1 n TYR 61 Cb 0.21 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.45 1ri1 n TYR 61 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1ri1 s THR 62 N -1.58 3.91 0.13 -0.72 -4.23 -0.21 -4.94 115.64 108.01 1ri1 s THR 62 Ca 0.13 -1.32 0.03 0.00 -1.18 0.00 0.00 61.69 59.35 1ri1 s THR 62 Cb 0.12 -2.97 -0.04 0.00 1.34 0.00 0.00 72.50 70.94 1ri1 s THR 62 CO 0.30 -0.10 -0.07 -1.59 -0.54 0.00 0.00 174.62 172.63 1ri1 s LYS 63 N -2.95 0.98 0.24 3.99 -2.85 -1.26 -4.83 119.74 113.06 1ri1 s LYS 63 Ca 0.28 -1.42 -0.31 0.00 -1.00 0.00 0.00 55.97 53.52 1ri1 s LYS 63 Cb -0.10 -0.38 -0.13 0.00 -2.06 0.00 0.00 37.83 35.16 1ri1 s LYS 63 CO 0.20 -0.00 1.43 -2.13 0.10 0.00 0.00 175.35 174.94 1ri1 n ARG 64 N -0.15 2.10 -0.75 1.78 0.63 -1.26 -1.90 116.66 117.12 1ri1 n ARG 64 Ca -0.10 0.75 0.00 0.00 -0.92 0.00 0.00 57.85 57.57 1ri1 n ARG 64 Cb 0.61 -2.42 0.00 0.00 0.45 0.00 0.00 32.46 31.10 1ri1 n ARG 64 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ri1 n GLY 65 N 2.16 0.87 3.75 5.14 0.00 -0.52 -4.89 105.19 111.71 1ri1 n GLY 65 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1ri1 n GLY 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ri1 s ASP 66 N -3.00 4.34 -0.16 1.61 1.01 -0.80 -4.07 116.67 115.61 1ri1 s ASP 66 Ca 0.00 1.91 -0.03 0.00 0.71 0.00 0.00 52.55 55.14 1ri1 s ASP 66 Cb 0.00 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.38 1ri1 s ASP 66 CO 0.00 -2.15 -0.07 -0.55 0.21 0.00 0.00 175.17 172.62 1ri1 s SER 67 N -3.17 4.43 -0.04 0.27 0.15 -1.26 -0.28 113.70 113.79 1ri1 s SER 67 Ca 0.63 -0.25 0.06 0.00 0.70 0.00 0.00 55.95 57.09 1ri1 s SER 67 Cb -0.19 -1.72 -0.01 0.00 -1.71 0.00 0.00 66.02 62.39 1ri1 s SER 67 CO 0.54 0.12 -0.23 -0.69 1.20 0.00 0.00 173.24 174.19 1ri1 s VAL 68 N 0.62 1.86 -0.31 4.45 1.01 -0.39 -1.96 120.40 125.69 1ri1 s VAL 68 Ca -0.04 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 60.92 1ri1 s VAL 68 Cb -0.15 -1.56 0.04 0.00 0.00 0.00 0.00 36.38 34.71 1ri1 s VAL 68 CO 0.03 0.52 0.03 -0.22 0.00 0.00 0.00 175.10 175.46 1ri1 s LEU 69 N -0.32 3.95 -0.60 3.92 2.96 -0.74 -0.40 118.68 127.46 1ri1 s LEU 69 Ca 0.02 -1.18 -0.18 0.00 -0.22 0.00 0.00 54.13 52.58 1ri1 s LEU 69 Cb -0.11 -1.76 0.12 0.00 0.50 0.00 0.00 46.19 44.94 1ri1 s LEU 69 CO 0.01 -0.26 0.67 -0.62 -1.32 0.00 0.00 176.35 174.82 1ri1 s ASP 70 N 1.31 6.22 -0.04 3.68 3.68 0.17 -1.01 116.67 130.68 1ri1 s ASP 70 Ca -0.04 -1.59 -0.26 0.00 2.13 0.00 0.00 52.55 52.79 1ri1 s ASP 70 Cb -0.19 -2.28 -0.03 0.00 -1.45 0.00 0.00 42.92 38.97 1ri1 s ASP 70 CO -0.00 -1.03 0.80 -0.76 0.13 0.00 0.00 175.17 174.31 1ri1 s LEU 71 N 2.31 4.33 -0.64 -1.34 1.43 0.85 -0.89 118.68 124.73 1ri1 s LEU 71 Ca 0.10 1.36 -0.01 0.00 -1.03 0.00 0.00 54.13 54.55 1ri1 s LEU 71 Cb -0.25 -3.26 0.00 0.00 0.03 0.00 0.00 46.19 42.71 1ri1 s LEU 71 CO 0.04 -0.17 0.14 0.61 0.23 0.00 0.00 176.35 177.20 1ri1 n GLY 72 N 3.04 0.14 0.50 -3.19 0.00 0.19 -4.11 105.19 101.76 1ri1 n GLY 72 Ca 0.01 -0.48 0.30 0.00 0.00 0.00 0.00 46.02 45.86 1ri1 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ri1 n GLY 74 N -1.68 1.56 1.81 0.00 0.00 -1.26 -2.91 105.19 102.71 1ri1 n GLY 74 Ca 0.21 -0.65 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 1ri1 n GLY 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ri1 n LYS 75 N 10.32 1.75 -3.14 1.61 5.02 -1.26 -4.13 118.16 128.33 1ri1 n LYS 75 Ca 0.00 -1.53 -0.22 0.00 -2.02 0.00 0.00 58.31 54.54 1ri1 n LYS 75 Cb 0.00 -1.60 0.05 0.00 -0.02 0.00 0.00 35.03 33.46 1ri1 n LYS 75 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ri1 n GLY 76 N 0.18 -0.48 0.00 0.72 0.00 -1.15 -4.10 105.19 100.37 1ri1 n GLY 76 Ca 0.30 0.13 0.04 0.00 0.00 0.00 0.00 46.02 46.48 1ri1 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ri1 n GLY 77 N -1.63 -0.72 0.33 -0.02 0.00 -1.26 -2.63 105.19 99.26 1ri1 n GLY 77 Ca -0.08 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 45.95 1ri1 n GLY 77 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ri1 n ASP 78 N -1.46 1.97 -0.23 1.61 8.00 -1.26 -4.66 116.55 120.52 1ri1 n ASP 78 Ca 0.02 -1.56 0.01 0.00 0.71 0.00 0.00 54.79 53.97 1ri1 n ASP 78 Cb 0.08 -0.06 0.13 0.00 -0.02 0.00 0.00 41.12 41.26 1ri1 n ASP 78 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1ri1 h LEU 79 N 1.36 0.33 -0.35 0.64 3.38 -1.90 -0.32 115.31 118.45 1ri1 h LEU 79 Ca 0.00 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1ri1 h LEU 79 Cb 0.43 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1ri1 h LEU 79 CO 0.00 0.19 0.16 -0.07 0.09 0.00 0.00 178.44 178.80 1ri1 h LEU 80 N 0.50 0.47 -0.51 1.67 4.07 -1.83 -0.40 115.31 119.29 1ri1 h LEU 80 Ca 0.34 -0.15 0.08 0.00 0.08 0.00 0.00 57.88 58.23 1ri1 h LEU 80 Cb 0.40 -0.12 -0.06 0.00 1.08 0.00 0.00 40.66 41.96 1ri1 h LEU 80 CO -0.30 0.49 0.16 0.11 -1.08 0.00 0.00 178.44 177.81 1ri1 h LYS 81 N 0.43 0.31 -0.16 1.13 1.57 -1.63 -0.14 116.57 118.07 1ri1 h LYS 81 Ca 0.12 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.80 1ri1 h LYS 81 Cb 0.15 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1ri1 h LYS 81 CO -0.01 0.20 -0.23 1.88 -0.57 0.00 0.00 179.45 180.72 1ri1 h TYR 82 N 0.32 0.32 -0.72 -1.35 -1.99 -0.76 -2.08 116.97 110.71 1ri1 h TYR 82 Ca 0.25 -0.06 -0.04 0.00 2.00 0.00 0.00 58.73 60.89 1ri1 h TYR 82 Cb 0.30 -0.08 -0.03 0.00 2.00 0.00 0.00 36.73 38.91 1ri1 h TYR 82 CO -0.18 0.51 0.31 1.49 -0.00 0.00 0.00 178.16 180.28 1ri1 h GLU 83 N 0.27 1.06 -0.13 4.88 4.57 0.68 -2.30 114.58 123.60 1ri1 h GLU 83 Ca 0.04 -0.17 -0.16 0.00 -1.18 0.00 0.00 59.36 57.89 1ri1 h GLU 83 Cb 0.56 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1ri1 h GLU 83 CO 0.04 0.85 -0.59 0.00 -1.18 0.00 0.00 179.01 178.12 1ri1 h ARG 84 N 1.04 0.44 0.00 1.92 3.08 -0.96 -2.70 114.38 117.20 1ri1 h ARG 84 Ca 0.25 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1ri1 h ARG 84 Cb 0.17 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1ri1 h ARG 84 CO -0.02 0.90 0.00 0.00 -1.07 0.00 0.00 179.97 179.78 1ri1 n ALA 85 N -2.50 1.60 -2.97 0.04 0.00 -0.81 -4.86 120.51 111.01 1ri1 n ALA 85 Ca -0.03 -0.05 -0.19 0.00 0.00 0.00 0.00 53.44 53.18 1ri1 n ALA 85 Cb 0.62 -1.18 0.04 0.00 0.00 0.00 0.00 19.45 18.93 1ri1 n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ri1 n GLY 86 N -0.35 -0.31 3.82 0.00 0.00 -1.01 -4.04 105.19 103.31 1ri1 n GLY 86 Ca 0.04 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1ri1 n GLY 86 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ri1 s ILE 87 N -3.10 4.03 -0.15 -0.61 -4.36 -1.13 -1.43 121.20 114.45 1ri1 s ILE 87 Ca 0.29 0.66 0.17 0.00 -0.26 0.00 0.00 60.65 61.51 1ri1 s ILE 87 Cb -0.13 -3.41 -0.24 0.00 1.25 0.00 0.00 42.46 39.93 1ri1 s ILE 87 CO 0.36 -0.86 0.30 0.61 0.24 0.00 0.00 174.94 175.58 1ri1 n GLY 88 N -2.04 -1.02 2.96 6.27 0.00 0.61 -4.36 105.19 107.61 1ri1 n GLY 88 Ca 0.07 -0.27 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1ri1 n GLY 88 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ri1 s GLU 89 N -2.64 0.15 -0.06 1.61 2.12 -0.98 -2.29 118.70 116.60 1ri1 s GLU 89 Ca -0.08 -0.08 -0.01 0.00 0.36 0.00 0.00 54.97 55.15 1ri1 s GLU 89 Cb 0.07 0.06 0.03 0.00 0.26 0.00 0.00 34.13 34.55 1ri1 s GLU 89 CO 0.83 -0.03 0.01 -0.47 -0.54 0.00 0.00 175.26 175.07 1ri1 s TYR 90 N -0.35 0.52 -0.22 5.30 6.14 0.65 -1.26 117.35 128.13 1ri1 s TYR 90 Ca -0.04 -0.07 -0.01 0.00 0.64 0.00 0.00 57.07 57.59 1ri1 s TYR 90 Cb -0.03 -0.71 0.02 0.00 0.42 0.00 0.00 41.96 41.66 1ri1 s TYR 90 CO 0.00 -0.29 -0.11 -0.47 0.64 0.00 0.00 175.55 175.33 1ri1 s TYR 91 N 1.96 2.96 -0.10 4.97 6.04 0.47 -0.24 117.35 133.40 1ri1 s TYR 91 Ca 0.04 -1.49 -0.01 0.00 0.04 0.00 0.00 57.07 55.65 1ri1 s TYR 91 Cb -0.12 -2.01 -0.03 0.00 -1.04 0.00 0.00 41.96 38.75 1ri1 s TYR 91 CO -0.05 -0.72 -0.05 0.20 -1.54 0.00 0.00 175.55 173.39 1ri1 s GLY 92 N 1.33 1.72 -0.05 8.97 0.00 0.59 0.46 107.32 120.35 1ri1 s GLY 92 Ca 0.03 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 43.91 1ri1 s GLY 92 CO -0.07 -0.43 -0.08 0.14 0.00 0.00 0.00 173.10 172.66 1ri1 s VAL 93 N -0.36 0.80 -0.04 1.40 1.01 -0.07 -1.30 120.40 121.85 1ri1 s VAL 93 Ca 0.06 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.65 1ri1 s VAL 93 Cb -0.12 -0.76 0.01 0.00 0.00 0.00 0.00 36.38 35.51 1ri1 s VAL 93 CO 0.02 0.27 0.19 -0.62 0.00 0.00 0.00 175.10 174.97 1ri1 s ASP 94 N 0.65 -0.11 0.26 3.32 -1.08 -0.98 0.57 116.67 119.29 1ri1 s ASP 94 Ca -0.11 0.12 0.06 0.00 -0.52 0.00 0.00 52.55 52.11 1ri1 s ASP 94 Cb -0.14 0.32 0.35 0.00 -1.46 0.00 0.00 42.92 41.99 1ri1 s ASP 94 CO 0.02 -0.24 1.62 -0.29 0.52 0.00 0.00 175.17 176.79 1ri1 h ILE 95 N 4.47 1.37 -3.37 4.11 2.10 -1.64 0.51 117.51 125.06 1ri1 h ILE 95 Ca -0.28 -1.83 -0.59 0.00 1.08 0.00 0.00 64.86 63.24 1ri1 h ILE 95 Cb 1.19 1.91 -0.08 0.00 -1.09 0.00 0.00 36.82 38.75 1ri1 h ILE 95 CO 0.39 0.54 0.23 0.00 -1.08 0.00 0.00 178.15 178.23 1ri1 s ALA 96 N -3.87 3.53 0.12 0.18 0.00 -1.26 -4.43 121.76 116.02 1ri1 s ALA 96 Ca -0.04 -0.14 0.18 0.00 0.00 0.00 0.00 51.96 51.97 1ri1 s ALA 96 Cb 0.13 -3.07 0.58 0.00 0.00 0.00 0.00 23.12 20.76 1ri1 s ALA 96 CO 0.78 -0.58 1.69 0.93 0.00 0.00 0.00 175.76 178.58 1ri1 h GLU 97 N 7.40 0.00 -0.24 0.00 5.08 -1.95 -2.93 114.58 121.94 1ri1 h GLU 97 Ca -0.31 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.99 1ri1 h GLU 97 Cb 1.14 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 1ri1 h GLU 97 CO 0.80 0.40 -0.12 -0.24 -1.00 0.00 0.00 179.01 178.85 1ri1 h VAL 98 N 0.00 1.21 0.23 3.13 3.04 -1.98 -2.27 116.25 119.61 1ri1 h VAL 98 Ca -0.00 -0.91 -0.33 0.00 -1.01 0.00 0.00 66.70 64.45 1ri1 h VAL 98 Cb 0.98 1.16 0.03 0.00 -2.01 0.00 0.00 31.29 31.45 1ri1 h VAL 98 CO 0.05 0.29 -1.48 0.28 -1.01 0.00 0.00 177.57 175.70 1ri1 h SER 99 N 0.36 0.76 -0.25 3.17 0.02 -1.84 -3.19 113.55 112.57 1ri1 h SER 99 Ca 0.07 -0.84 0.05 0.00 -0.84 0.00 0.00 61.79 60.23 1ri1 h SER 99 Cb 0.43 -0.25 -0.05 0.00 0.14 0.00 0.00 62.40 62.68 1ri1 h SER 99 CO 0.02 1.67 -0.06 0.40 -1.14 0.00 0.00 176.83 177.72 1ri1 h ILE 100 N 0.13 0.75 -0.25 3.27 1.08 -1.36 0.15 117.51 121.29 1ri1 h ILE 100 Ca -0.25 -0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.25 1ri1 h ILE 100 Cb 2.14 0.75 -0.01 0.00 -3.07 0.00 0.00 36.82 36.62 1ri1 h ILE 100 CO 0.25 0.00 0.17 0.78 -0.69 0.00 0.00 178.15 178.66 1ri1 h ASN 101 N 0.01 0.15 0.28 1.72 2.35 -1.51 0.16 115.58 118.73 1ri1 h ASN 101 Ca 0.12 -0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.69 1ri1 h ASN 101 Cb 0.18 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1ri1 h ASN 101 CO -0.26 0.10 -0.71 0.44 -1.65 0.00 0.00 177.43 175.36 1ri1 h ASP 102 N 0.17 0.44 0.98 5.81 3.45 -1.03 -2.33 116.42 123.91 1ri1 h ASP 102 Ca 0.11 -0.29 -0.06 0.00 0.43 0.00 0.00 57.03 57.22 1ri1 h ASP 102 Cb 0.22 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.85 1ri1 h ASP 102 CO -0.02 1.01 -0.30 0.00 -1.57 0.00 0.00 179.24 178.37 1ri1 h ALA 103 N 0.98 0.97 -0.04 3.45 0.00 0.13 -2.51 119.26 122.25 1ri1 h ALA 103 Ca -0.03 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 1ri1 h ALA 103 Cb 1.27 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.02 1ri1 h ALA 103 CO 0.12 0.38 -0.35 0.00 0.00 0.00 0.00 179.25 179.39 1ri1 h ARG 104 N 0.00 0.31 -0.08 0.00 3.08 -0.53 -2.27 114.38 114.90 1ri1 h ARG 104 Ca -0.00 -0.28 0.02 0.00 0.07 0.00 0.00 59.98 59.78 1ri1 h ARG 104 Cb 0.87 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1ri1 h ARG 104 CO 0.04 0.95 -0.02 0.28 -1.07 0.00 0.00 179.97 180.15 1ri1 h VAL 105 N -0.23 0.92 -0.12 2.04 2.07 -1.39 0.26 116.25 119.80 1ri1 h VAL 105 Ca -0.03 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1ri1 h VAL 105 Cb 1.04 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 1ri1 h VAL 105 CO 0.07 0.00 -0.15 -0.09 0.02 0.00 0.00 177.57 177.42 1ri1 h ARG 106 N -0.00 -0.18 -0.89 1.57 2.43 -1.51 0.15 114.38 115.95 1ri1 h ARG 106 Ca 0.04 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1ri1 h ARG 106 Cb 0.06 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 1ri1 h ARG 106 CO -0.08 -0.12 0.57 0.00 -1.51 0.00 0.00 179.97 178.83 1ri1 h ALA 107 N 0.86 1.32 -0.04 2.80 0.00 -1.10 -2.19 119.26 120.92 1ri1 h ALA 107 Ca 0.09 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1ri1 h ALA 107 Cb 0.32 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1ri1 h ALA 107 CO -0.24 0.61 -0.40 -0.09 0.00 0.00 0.00 179.25 179.13 1ri1 h ARG 108 N 1.22 0.07 -2.18 0.00 2.43 0.37 -3.28 114.38 113.01 1ri1 h ARG 108 Ca 0.32 -0.03 -0.64 0.00 -0.81 0.00 0.00 59.98 58.82 1ri1 h ARG 108 Cb -0.10 -0.00 -0.38 0.00 -0.42 0.00 0.00 29.97 29.06 1ri1 h ARG 108 CO -0.07 0.47 -0.25 0.09 -1.51 0.00 0.00 179.97 178.70 1ri1 n ASN 109 N -4.05 5.21 -3.61 -3.80 3.02 0.44 -5.01 115.26 107.46 1ri1 n ASN 109 Ca -0.02 -3.70 -0.15 0.00 -0.03 0.00 0.00 54.58 50.69 1ri1 n ASN 109 Cb 0.45 -0.69 -0.06 0.00 -0.61 0.00 0.00 39.78 38.86 1ri1 n ASN 109 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ri1 s MET 110 N -3.68 0.95 -0.91 3.52 0.23 -1.17 -4.89 119.30 113.34 1ri1 s MET 110 Ca 0.47 -0.10 -0.24 0.00 -1.03 0.00 0.00 55.69 54.78 1ri1 s MET 110 Cb 0.28 0.43 0.02 0.00 -1.53 0.00 0.00 34.83 34.04 1ri1 s MET 110 CO -0.15 -0.31 1.52 0.15 -2.03 0.00 0.00 175.02 174.20 1ri1 s LYS 111 N -1.85 3.26 0.07 3.16 1.02 -1.26 -4.96 119.74 119.19 1ri1 s LYS 111 Ca -0.09 -0.66 0.07 0.00 0.02 0.00 0.00 55.97 55.31 1ri1 s LYS 111 Cb -0.01 -4.98 -0.03 0.00 -0.52 0.00 0.00 37.83 32.29 1ri1 s LYS 111 CO 0.03 -2.43 -0.19 -0.98 -0.92 0.00 0.00 175.35 170.86 1ri1 s ARG 112 N 5.63 1.14 0.00 1.68 1.70 -1.26 -5.03 118.95 122.82 1ri1 s ARG 112 Ca 0.49 -1.03 0.14 0.00 -0.47 0.00 0.00 55.73 54.87 1ri1 s ARG 112 Cb -0.04 -1.31 0.05 0.00 -0.57 0.00 0.00 34.95 33.08 1ri1 s ARG 112 CO -0.01 0.31 0.86 0.54 -1.08 0.00 0.00 175.30 175.93 1ri1 n ARG 113 N 1.42 1.50 -4.22 3.89 1.74 -1.26 -4.98 116.66 114.75 1ri1 n ARG 113 Ca -0.19 -1.01 -0.31 0.00 -0.77 0.00 0.00 57.85 55.57 1ri1 n ARG 113 Cb 0.54 -1.24 -0.09 0.00 -1.02 0.00 0.00 32.46 30.65 1ri1 n ARG 113 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 1ri1 s PHE 114 N -1.51 3.00 0.16 -1.55 -0.12 -1.26 -4.94 117.98 111.76 1ri1 s PHE 114 Ca 0.14 0.00 -0.30 0.00 -0.05 0.00 0.00 56.93 56.72 1ri1 s PHE 114 Cb 0.12 -1.58 -0.07 0.00 -0.63 0.00 0.00 43.02 40.85 1ri1 s PHE 114 CO 0.28 0.46 1.03 0.15 -0.05 0.00 0.00 175.22 177.09 1ri1 s LYS 115 N -1.97 4.67 0.19 1.99 1.02 -0.97 -4.86 119.74 119.80 1ri1 s LYS 115 Ca 0.23 1.59 0.08 0.00 0.02 0.00 0.00 55.97 57.88 1ri1 s LYS 115 Cb -0.12 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.84 1ri1 s LYS 115 CO 0.14 0.19 0.02 0.14 -0.92 0.00 0.00 175.35 174.92 1ri1 s VAL 116 N -0.28 3.75 -0.13 3.17 -7.23 -1.26 -0.25 120.40 118.17 1ri1 s VAL 116 Ca 0.47 -1.48 -0.05 0.00 -1.81 0.00 0.00 61.98 59.11 1ri1 s VAL 116 Cb -0.27 -2.91 0.06 0.00 0.56 0.00 0.00 36.38 33.82 1ri1 s VAL 116 CO 0.33 -0.16 0.27 -0.36 -0.31 0.00 0.00 175.10 174.87 1ri1 s PHE 117 N -1.84 -0.43 0.02 2.82 0.40 0.66 -4.94 117.98 114.68 1ri1 s PHE 117 Ca 0.28 0.98 0.07 0.00 -0.60 0.00 0.00 56.93 57.66 1ri1 s PHE 117 Cb -0.09 -0.00 -0.03 0.00 0.51 0.00 0.00 43.02 43.41 1ri1 s PHE 117 CO 0.19 -0.35 -0.19 -0.06 0.70 0.00 0.00 175.22 175.52 1ri1 s PHE 118 N 2.26 2.54 -0.08 0.36 0.40 -1.26 -0.30 117.98 121.91 1ri1 s PHE 118 Ca -0.00 -0.27 -0.03 0.00 -0.60 0.00 0.00 56.93 56.02 1ri1 s PHE 118 Cb -0.12 -1.49 0.04 0.00 0.51 0.00 0.00 43.02 41.97 1ri1 s PHE 118 CO -0.09 0.21 0.17 0.50 0.70 0.00 0.00 175.22 176.71 1ri1 s ARG 119 N -1.24 0.10 -0.43 0.44 3.52 -0.42 -4.97 118.95 115.97 1ri1 s ARG 119 Ca 0.13 0.45 -0.16 0.00 -0.13 0.00 0.00 55.73 56.02 1ri1 s ARG 119 Cb -0.10 -0.18 0.03 0.00 -1.56 0.00 0.00 34.95 33.13 1ri1 s ARG 119 CO 0.04 -0.20 0.39 0.00 -0.81 0.00 0.00 175.30 174.72 1ri1 s ALA 120 N 1.46 3.46 0.22 6.12 0.00 -1.26 -2.32 121.76 129.45 1ri1 s ALA 120 Ca -0.06 -1.67 -0.19 0.00 0.00 0.00 0.00 51.96 50.03 1ri1 s ALA 120 Cb -0.11 -3.01 0.07 0.00 0.00 0.00 0.00 23.12 20.06 1ri1 s ALA 120 CO -0.06 -1.58 0.92 0.00 0.00 0.00 0.00 175.76 175.04 1ri1 n GLN 121 N 5.42 0.72 -3.20 0.00 10.64 0.17 -4.92 117.38 126.21 1ri1 n GLN 121 Ca -0.09 -1.56 -0.42 0.00 -1.83 0.00 0.00 57.00 53.09 1ri1 n GLN 121 Cb 0.47 2.07 -0.07 0.00 -0.86 0.00 0.00 30.24 31.84 1ri1 n GLN 121 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1ri1 s ASP 122 N -3.23 6.30 0.00 2.61 -1.08 -1.26 -1.68 116.67 118.33 1ri1 s ASP 122 Ca 0.20 -0.29 0.22 0.00 -0.52 0.00 0.00 52.55 52.16 1ri1 s ASP 122 Cb -0.03 -2.28 0.51 0.00 -1.46 0.00 0.00 42.92 39.66 1ri1 s ASP 122 CO 0.07 -0.63 1.45 -1.54 0.52 0.00 0.00 175.17 175.03 1ri1 n SER 123 N 5.94 3.23 -0.03 -0.34 3.41 -1.26 -3.94 113.62 120.63 1ri1 n SER 123 Ca -0.04 -1.96 -0.07 0.00 -0.26 0.00 0.00 58.87 56.54 1ri1 n SER 123 Cb 0.48 -0.29 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 1ri1 n SER 123 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1ri1 n TYR 124 N 1.32 0.00 -1.48 7.33 0.53 -1.26 -4.65 117.16 118.95 1ri1 n TYR 124 Ca 0.20 0.00 -0.05 0.00 -1.02 0.00 0.00 57.90 57.02 1ri1 n TYR 124 Cb 0.55 -0.25 0.19 0.00 -1.03 0.00 0.00 39.34 38.81 1ri1 n TYR 124 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1ri1 n GLY 125 N 2.72 4.95 3.31 2.72 0.00 -1.26 -1.08 105.19 116.55 1ri1 n GLY 125 Ca -0.13 -1.27 -0.10 0.00 0.00 0.00 0.00 46.02 44.52 1ri1 n GLY 125 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ri1 s ARG 126 N -3.27 0.42 0.40 1.61 1.81 -1.25 -4.99 118.95 113.67 1ri1 s ARG 126 Ca 0.45 0.84 -0.23 0.00 -1.72 0.00 0.00 55.73 55.07 1ri1 s ARG 126 Cb 0.41 0.01 -0.13 0.00 -0.45 0.00 0.00 34.95 34.79 1ri1 s ARG 126 CO -0.00 -0.16 0.58 1.58 -0.68 0.00 0.00 175.30 176.61 1ri1 n HIS 127 N 4.32 -0.37 -3.77 -0.53 -0.00 -1.26 -4.57 115.22 109.04 1ri1 n HIS 127 Ca -0.22 0.63 -0.15 0.00 -0.00 0.00 0.00 57.72 57.97 1ri1 n HIS 127 Cb 0.55 -2.01 -0.16 0.00 -0.00 0.00 0.00 29.99 28.37 1ri1 n HIS 127 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 1ri1 s MET 128 N -1.54 -0.03 -0.30 1.57 1.75 -1.26 -4.98 119.30 114.50 1ri1 s MET 128 Ca 0.63 0.20 -0.02 0.00 -1.25 0.00 0.00 55.69 55.24 1ri1 s MET 128 Cb -0.63 -0.27 0.11 0.00 2.84 0.00 0.00 34.83 36.88 1ri1 s MET 128 CO 0.58 -0.18 0.18 0.34 -0.65 0.00 0.00 175.02 175.30 1ri1 s ASP 129 N 1.15 2.99 0.00 1.11 -1.08 -1.26 -4.85 116.67 114.73 1ri1 s ASP 129 Ca -0.08 -1.32 0.27 0.00 -0.52 0.00 0.00 52.55 50.90 1ri1 s ASP 129 Cb -0.13 -0.15 0.89 0.00 -1.46 0.00 0.00 42.92 42.07 1ri1 s ASP 129 CO -0.03 -0.40 1.67 0.18 0.52 0.00 0.00 175.17 177.11 1ri1 n LEU 130 N 5.06 0.38 0.00 -1.34 4.77 -1.26 -4.96 117.00 119.65 1ri1 n LEU 130 Ca -0.02 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1ri1 n LEU 130 Cb 0.42 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1ri1 n LEU 130 CO 0.05 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 1ri1 n GLY 131 N 1.44 2.97 3.77 -0.72 0.00 -1.26 -5.02 105.19 106.37 1ri1 n GLY 131 Ca 0.08 -0.79 -0.22 0.00 0.00 0.00 0.00 46.02 45.09 1ri1 n GLY 131 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ri1 s LYS 132 N 0.00 2.47 0.45 1.61 -2.85 -1.26 -5.14 119.74 115.01 1ri1 s LYS 132 Ca 0.00 -1.49 0.07 0.00 -1.00 0.00 0.00 55.97 53.55 1ri1 s LYS 132 Cb 0.00 -2.26 0.01 0.00 -2.06 0.00 0.00 37.83 33.52 1ri1 s LYS 132 CO 0.00 0.08 0.61 -1.21 0.10 0.00 0.00 175.35 174.93 1ri1 s GLU 133 N -3.90 2.77 0.07 1.78 2.02 -1.26 -4.73 118.70 115.45 1ri1 s GLU 133 Ca 0.39 -1.14 0.01 0.00 0.02 0.00 0.00 54.97 54.25 1ri1 s GLU 133 Cb -0.03 -2.71 -0.04 0.00 0.10 0.00 0.00 34.13 31.46 1ri1 s GLU 133 CO 0.24 -0.36 -0.06 -0.06 0.02 0.00 0.00 175.26 175.04 1ri1 s PHE 134 N -2.43 0.76 0.04 1.61 0.40 0.12 -4.86 117.98 113.62 1ri1 s PHE 134 Ca 0.55 -0.80 -0.17 0.00 -0.60 0.00 0.00 56.93 55.92 1ri1 s PHE 134 Cb -0.10 -0.46 -0.24 0.00 0.51 0.00 0.00 43.02 42.74 1ri1 s PHE 134 CO 0.34 -0.16 1.14 -0.44 0.70 0.00 0.00 175.22 176.80 1ri1 h ASP 135 N 3.49 0.74 -3.89 1.36 5.19 -1.70 -0.21 116.42 121.39 1ri1 h ASP 135 Ca -0.35 -0.75 -0.46 0.00 -0.62 0.00 0.00 57.03 54.85 1ri1 h ASP 135 Cb 1.17 -0.23 -0.31 0.00 0.18 0.00 0.00 39.33 40.15 1ri1 h ASP 135 CO 0.57 1.40 -0.80 -0.69 -3.12 0.00 0.00 179.24 176.60 1ri1 s VAL 136 N -3.24 0.94 -0.18 -1.35 1.01 -1.06 -1.60 120.40 114.92 1ri1 s VAL 136 Ca -0.11 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1ri1 s VAL 136 Cb 0.05 -0.82 0.03 0.00 0.00 0.00 0.00 36.38 35.64 1ri1 s VAL 136 CO 0.88 0.28 -0.17 -0.63 0.00 0.00 0.00 175.10 175.46 1ri1 s ILE 137 N 0.07 1.90 -0.03 2.22 1.01 -0.02 -1.78 121.20 124.57 1ri1 s ILE 137 Ca -0.02 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.72 1ri1 s ILE 137 Cb -0.08 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 1ri1 s ILE 137 CO 0.01 0.44 -0.02 -0.55 0.00 0.00 0.00 174.94 174.81 1ri1 s SER 138 N 1.34 4.97 -0.33 3.58 0.15 -0.18 -1.33 113.70 121.90 1ri1 s SER 138 Ca 0.03 0.00 -0.01 0.00 0.70 0.00 0.00 55.95 56.68 1ri1 s SER 138 Cb -0.14 -1.29 0.13 0.00 -1.71 0.00 0.00 66.02 63.01 1ri1 s SER 138 CO -0.11 0.32 0.22 -0.55 1.20 0.00 0.00 173.24 174.31 1ri1 s SER 139 N -1.23 2.78 -0.25 5.45 0.15 -0.72 -0.10 113.70 119.77 1ri1 s SER 139 Ca 0.16 -1.68 -0.15 0.00 0.70 0.00 0.00 55.95 54.99 1ri1 s SER 139 Cb -0.11 -0.16 -0.04 0.00 -1.71 0.00 0.00 66.02 64.00 1ri1 s SER 139 CO 0.06 -0.35 0.36 -1.10 1.20 0.00 0.00 173.24 173.41 1ri1 s GLN 140 N 1.58 4.07 -1.39 5.44 -1.52 -1.26 -3.18 119.66 123.40 1ri1 s GLN 140 Ca 0.14 0.05 -0.05 0.00 -1.95 0.00 0.00 55.36 53.56 1ri1 s GLN 140 Cb -0.19 -3.61 0.03 0.00 -0.22 0.00 0.00 33.01 29.02 1ri1 s GLN 140 CO -0.15 -0.18 0.80 1.19 -0.25 0.00 0.00 175.29 176.71 1ri1 n PHE 141 N 4.99 -2.07 -0.19 0.91 0.99 -0.15 -4.81 117.46 117.13 1ri1 n PHE 141 Ca -0.09 0.87 0.00 0.00 -0.00 0.00 0.00 57.45 58.23 1ri1 n PHE 141 Cb 0.51 -4.27 0.00 0.00 -1.00 0.00 0.00 39.48 34.72 1ri1 n PHE 141 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1ri1 n SER 142 N -2.98 0.00 0.24 4.37 2.88 -1.26 -4.95 113.62 111.92 1ri1 n SER 142 Ca -0.18 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.47 1ri1 n SER 142 Cb 0.62 0.00 0.57 0.00 -0.75 0.00 0.00 64.21 64.66 1ri1 n SER 142 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1ri1 h PHE 143 N 0.00 0.00 -0.01 0.66 3.57 -1.86 -2.80 116.94 116.51 1ri1 h PHE 143 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1ri1 h PHE 143 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1ri1 h PHE 143 CO 0.00 0.20 0.01 1.12 -2.23 0.00 0.00 178.31 177.41 1ri1 h HIS 144 N 0.00 0.00 0.00 0.41 2.07 -1.92 0.48 115.15 116.19 1ri1 h HIS 144 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1ri1 h HIS 144 Cb 0.55 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.53 1ri1 h HIS 144 CO 0.00 0.00 0.00 0.66 -3.07 0.00 0.00 177.93 175.52 1ri1 n TYR 145 N -3.66 0.00 0.58 6.12 0.53 -1.06 -1.26 117.16 118.41 1ri1 n TYR 145 Ca -0.03 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 56.98 1ri1 n TYR 145 Cb 0.09 -0.48 0.39 0.00 -1.03 0.00 0.00 39.34 38.31 1ri1 n TYR 145 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1ri1 h ALA 146 N 2.49 1.00 -0.22 -0.72 0.00 -1.10 -3.26 119.26 117.45 1ri1 h ALA 146 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1ri1 h ALA 146 Cb 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ri1 h ALA 146 CO 0.00 0.00 0.03 1.19 0.00 0.00 0.00 179.25 180.47 1ri1 n PHE 147 N -2.34 0.79 -0.09 0.00 3.01 -0.39 -1.44 117.46 117.00 1ri1 n PHE 147 Ca 0.05 -0.35 -0.06 0.00 1.01 0.00 0.00 57.45 58.10 1ri1 n PHE 147 Cb 0.43 -0.28 -0.00 0.00 -0.01 0.00 0.00 39.48 39.62 1ri1 n PHE 147 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1ri1 h SER 148 N 1.28 -0.36 -5.43 4.37 0.87 -1.77 -3.45 113.55 109.06 1ri1 h SER 148 Ca 0.03 0.10 -0.18 0.00 -1.23 0.00 0.00 61.79 60.52 1ri1 h SER 148 Cb 1.11 0.22 -0.11 0.00 -0.44 0.00 0.00 62.40 63.19 1ri1 h SER 148 CO 0.20 -0.13 -0.29 0.42 -0.53 0.00 0.00 176.83 176.50 1ri1 s THR 149 N -6.20 0.00 0.19 2.23 -4.23 -1.26 -5.02 115.64 101.35 1ri1 s THR 149 Ca -0.14 -1.64 -0.12 0.00 -1.18 0.00 0.00 61.69 58.61 1ri1 s THR 149 Cb 0.13 -2.41 0.09 0.00 1.34 0.00 0.00 72.50 71.66 1ri1 s THR 149 CO 0.70 0.00 1.80 -1.28 -0.54 0.00 0.00 174.62 175.30 1ri1 h SER 150 N 2.32 0.48 -0.45 3.99 0.87 -1.93 -2.30 113.55 116.53 1ri1 h SER 150 Ca -0.29 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.22 1ri1 h SER 150 Cb 1.25 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 63.11 1ri1 h SER 150 CO 0.41 0.33 0.05 -0.33 -0.53 0.00 0.00 176.83 176.76 1ri1 h GLU 151 N 0.61 0.76 0.31 2.24 4.39 -1.97 -2.78 114.58 118.15 1ri1 h GLU 151 Ca 0.24 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1ri1 h GLU 151 Cb 0.10 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1ri1 h GLU 151 CO -0.14 0.80 -0.47 1.03 -1.16 0.00 0.00 179.01 179.07 1ri1 h SER 152 N 0.62 -1.35 -0.62 1.42 0.87 -1.75 0.76 113.55 113.51 1ri1 h SER 152 Ca 0.13 0.13 0.13 0.00 -1.23 0.00 0.00 61.79 60.95 1ri1 h SER 152 Cb 0.43 0.47 -0.10 0.00 -0.44 0.00 0.00 62.40 62.75 1ri1 h SER 152 CO 0.01 -0.59 -0.01 0.25 -0.53 0.00 0.00 176.83 175.97 1ri1 h LEU 153 N -0.84 -0.29 -0.43 2.23 5.85 -0.69 0.14 115.31 121.28 1ri1 h LEU 153 Ca -0.03 0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.90 1ri1 h LEU 153 Cb 0.78 0.28 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 1ri1 h LEU 153 CO -0.16 -0.12 0.18 -0.78 -0.34 0.00 0.00 178.44 177.22 1ri1 h ASP 154 N 0.11 0.22 0.15 1.25 1.82 -1.08 0.44 116.42 119.33 1ri1 h ASP 154 Ca 0.32 0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 56.99 1ri1 h ASP 154 Cb 0.52 0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.53 1ri1 h ASP 154 CO -0.53 0.16 -0.07 0.40 -1.61 0.00 0.00 179.24 177.59 1ri1 h ILE 155 N 0.37 0.92 -0.57 2.25 2.04 0.09 -1.40 117.51 121.20 1ri1 h ILE 155 Ca 0.20 -0.25 0.08 0.00 1.00 0.00 0.00 64.86 65.88 1ri1 h ILE 155 Cb 0.15 1.08 -0.07 0.00 -0.74 0.00 0.00 36.82 37.25 1ri1 h ILE 155 CO -0.18 0.06 0.22 0.00 0.00 0.00 0.00 178.15 178.26 1ri1 h ALA 156 N 0.52 0.73 -0.05 1.87 0.00 0.89 0.20 119.26 123.43 1ri1 h ALA 156 Ca -0.02 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1ri1 h ALA 156 Cb 0.25 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1ri1 h ALA 156 CO 0.03 -0.18 -0.32 1.96 0.00 0.00 0.00 179.25 180.74 1ri1 h GLN 157 N 0.41 0.08 -0.06 0.00 4.20 -0.04 -1.99 115.11 117.72 1ri1 h GLN 157 Ca 0.28 -0.03 -0.19 0.00 0.06 0.00 0.00 58.65 58.77 1ri1 h GLN 157 Cb 0.32 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 1ri1 h GLN 157 CO -0.27 0.40 -0.76 0.00 -0.67 0.00 0.00 178.83 177.53 1ri1 h ARG 158 N 0.07 0.38 -0.18 1.46 3.08 0.04 -2.26 114.38 116.98 1ri1 h ARG 158 Ca 0.01 -0.32 -0.08 0.00 0.07 0.00 0.00 59.98 59.66 1ri1 h ARG 158 Cb 0.61 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1ri1 h ARG 158 CO 0.04 0.97 -0.23 -0.91 -1.07 0.00 0.00 179.97 178.78 1ri1 h ASN 159 N 0.25 0.31 -0.00 7.04 2.35 -0.28 -2.27 115.58 122.98 1ri1 h ASN 159 Ca -0.04 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1ri1 h ASN 159 Cb 1.34 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.63 1ri1 h ASN 159 CO 0.13 0.55 -0.01 0.40 -1.65 0.00 0.00 177.43 176.86 1ri1 h ILE 160 N 0.29 1.56 -0.53 2.81 5.03 -1.25 -3.24 117.51 122.19 1ri1 h ILE 160 Ca 0.05 -1.67 -0.02 0.00 -0.12 0.00 0.00 64.86 63.11 1ri1 h ILE 160 Cb 0.57 2.69 -0.03 0.00 -3.03 0.00 0.00 36.82 37.02 1ri1 h ILE 160 CO 0.04 0.43 0.26 0.00 -0.68 0.00 0.00 178.15 178.21 1ri1 h ALA 161 N 0.29 1.47 -0.00 1.87 0.00 -1.38 -2.52 119.26 118.99 1ri1 h ALA 161 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ri1 h ALA 161 Cb 0.71 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1ri1 h ALA 161 CO 0.00 0.43 -0.00 2.89 0.00 0.00 0.00 179.25 182.57 1ri1 n ARG 162 N -4.38 0.25 -0.20 0.00 1.85 -0.86 -2.90 116.66 110.42 1ri1 n ARG 162 Ca 0.05 -0.00 0.06 0.00 -1.00 0.00 0.00 57.85 56.96 1ri1 n ARG 162 Cb 0.12 -1.50 0.17 0.00 -1.05 0.00 0.00 32.46 30.20 1ri1 n ARG 162 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1ri1 n HIS 163 N -1.37 0.52 -4.38 2.89 8.25 -0.97 -4.78 115.22 115.38 1ri1 n HIS 163 Ca 0.11 -0.51 -0.34 0.00 -0.26 0.00 0.00 57.72 56.72 1ri1 n HIS 163 Cb 0.28 -0.03 -0.13 0.00 1.12 0.00 0.00 29.99 31.23 1ri1 n HIS 163 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1ri1 s LEU 164 N -1.05 3.02 0.50 2.41 2.96 -1.10 0.10 118.68 125.52 1ri1 s LEU 164 Ca 0.26 -0.25 -0.21 0.00 -0.22 0.00 0.00 54.13 53.71 1ri1 s LEU 164 Cb 0.14 -1.73 -0.07 0.00 0.50 0.00 0.00 46.19 45.03 1ri1 s LEU 164 CO 0.17 0.12 1.13 -0.13 -1.32 0.00 0.00 176.35 176.32 1ri1 s ARG 165 N 0.64 3.61 0.27 1.98 0.52 -0.09 -4.78 118.95 121.09 1ri1 s ARG 165 Ca -0.04 1.65 -0.31 0.00 -0.52 0.00 0.00 55.73 56.52 1ri1 s ARG 165 Cb -0.15 -2.21 -0.12 0.00 0.52 0.00 0.00 34.95 32.99 1ri1 s ARG 165 CO 0.02 -0.65 1.50 -2.30 0.02 0.00 0.00 175.30 173.89 1ri1 n PRO 166 N -0.86 2.36 0.00 3.54 -0.02 -1.26 0.51 135.00 139.27 1ri1 n PRO 166 Ca 0.09 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 1ri1 n PRO 166 Cb 0.50 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1ri1 n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ri1 n GLY 167 N 2.12 2.74 3.74 -1.23 0.00 0.42 -5.00 105.19 107.98 1ri1 n GLY 167 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 1ri1 n GLY 167 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ri1 s GLY 168 N -2.12 2.28 0.16 -0.02 0.00 0.18 -4.56 107.32 103.24 1ri1 s GLY 168 Ca 0.00 0.74 0.06 0.00 0.00 0.00 0.00 44.72 45.52 1ri1 s GLY 168 CO 0.00 1.12 0.07 -0.19 0.00 0.00 0.00 173.10 174.11 1ri1 s TYR 169 N -2.12 3.02 -0.30 1.90 1.51 -0.63 -0.67 117.35 120.05 1ri1 s TYR 169 Ca 0.71 -0.06 0.00 0.00 -1.01 0.00 0.00 57.07 56.71 1ri1 s TYR 169 Cb -0.25 -1.46 0.09 0.00 -0.11 0.00 0.00 41.96 40.23 1ri1 s TYR 169 CO 0.43 0.52 0.07 0.12 -1.11 0.00 0.00 175.55 175.58 1ri1 s PHE 170 N -1.71 2.18 0.07 2.71 5.36 0.30 -0.84 117.98 126.05 1ri1 s PHE 170 Ca 0.29 -1.96 -0.04 0.00 -0.96 0.00 0.00 56.93 54.27 1ri1 s PHE 170 Cb -0.10 -1.92 -0.05 0.00 -0.34 0.00 0.00 43.02 40.61 1ri1 s PHE 170 CO 0.21 -0.87 0.28 0.96 -1.46 0.00 0.00 175.22 174.34 1ri1 s ILE 171 N 1.45 5.30 0.19 3.12 -4.36 -0.44 -1.96 121.20 124.50 1ri1 s ILE 171 Ca 0.08 -0.08 -0.19 0.00 -0.26 0.00 0.00 60.65 60.19 1ri1 s ILE 171 Cb -0.18 -3.60 0.04 0.00 1.25 0.00 0.00 42.46 39.97 1ri1 s ILE 171 CO -0.19 0.18 0.56 0.00 0.24 0.00 0.00 174.94 175.74 1ri1 s MET 172 N -2.31 1.37 -0.20 0.37 0.23 -0.82 -1.76 119.30 116.18 1ri1 s MET 172 Ca 0.34 -0.75 -0.04 0.00 -1.03 0.00 0.00 55.69 54.22 1ri1 s MET 172 Cb -0.13 0.55 0.07 0.00 -1.53 0.00 0.00 34.83 33.79 1ri1 s MET 172 CO 0.23 -0.59 0.08 0.95 -2.03 0.00 0.00 175.02 173.66 1ri1 s THR 173 N -3.84 0.13 0.24 3.16 -4.23 -1.19 -2.32 115.64 107.60 1ri1 s THR 173 Ca 0.06 -0.43 0.09 0.00 -1.18 0.00 0.00 61.69 60.24 1ri1 s THR 173 Cb -0.01 -0.82 -0.05 0.00 1.34 0.00 0.00 72.50 72.96 1ri1 s THR 173 CO -0.05 -0.35 -0.15 0.68 -0.54 0.00 0.00 174.62 174.21 1ri1 s VAL 174 N 2.03 1.97 0.54 2.29 -7.23 -0.94 -0.98 120.40 118.07 1ri1 s VAL 174 Ca 0.03 -2.26 -0.20 0.00 -1.81 0.00 0.00 61.98 57.74 1ri1 s VAL 174 Cb -0.16 -2.20 -0.06 0.00 0.56 0.00 0.00 36.38 34.51 1ri1 s VAL 174 CO -0.14 -0.48 1.13 -2.84 -0.31 0.00 0.00 175.10 172.46 1ri1 s PRO 175 N -3.61 3.39 -0.30 4.82 0.02 -1.26 -0.80 135.00 137.25 1ri1 s PRO 175 Ca 0.26 1.62 -0.19 0.00 0.02 0.00 0.00 61.00 62.72 1ri1 s PRO 175 Cb -0.01 -2.04 -0.01 0.00 0.02 0.00 0.00 34.50 32.46 1ri1 s PRO 175 CO 0.10 -0.82 0.54 0.45 -0.33 0.00 0.00 177.00 176.95 1ri1 s SER 176 N -1.74 6.41 0.18 2.53 0.15 0.13 -4.69 113.70 116.67 1ri1 s SER 176 Ca 0.72 0.31 -0.11 0.00 0.70 0.00 0.00 55.95 57.57 1ri1 s SER 176 Cb -0.24 -2.29 0.10 0.00 -1.71 0.00 0.00 66.02 61.88 1ri1 s SER 176 CO 0.27 -0.40 1.76 -0.09 1.20 0.00 0.00 173.24 175.98 1ri1 h ARG 177 N 8.22 0.95 -0.41 5.44 2.43 -1.88 -2.11 114.38 127.02 1ri1 h ARG 177 Ca -0.28 -0.16 0.02 0.00 -0.81 0.00 0.00 59.98 58.76 1ri1 h ARG 177 Cb 1.13 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.49 1ri1 h ARG 177 CO 0.76 0.78 0.23 -0.44 -1.51 0.00 0.00 179.97 179.78 1ri1 h ASP 178 N 0.90 0.36 0.52 -3.80 3.32 -1.95 -1.24 116.42 114.53 1ri1 h ASP 178 Ca 0.22 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 1ri1 h ASP 178 Cb 0.16 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1ri1 h ASP 178 CO -0.02 0.26 -0.38 0.58 -1.72 0.00 0.00 179.24 177.96 1ri1 h VAL 179 N 0.47 0.23 -0.11 -1.35 2.07 -1.85 -2.35 116.25 113.36 1ri1 h VAL 179 Ca 0.17 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.73 1ri1 h VAL 179 Cb 0.03 0.23 -0.06 0.00 -1.52 0.00 0.00 31.29 29.97 1ri1 h VAL 179 CO -0.09 0.00 -0.35 0.40 0.02 0.00 0.00 177.57 177.55 1ri1 h ILE 180 N -0.87 0.25 -0.67 4.57 2.04 -1.22 -1.03 117.51 120.58 1ri1 h ILE 180 Ca -0.06 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.93 1ri1 h ILE 180 Cb 0.73 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1ri1 h ILE 180 CO 0.02 0.00 0.45 -0.07 0.00 0.00 0.00 178.15 178.55 1ri1 h LEU 181 N -0.44 0.36 -0.22 1.44 3.38 -1.19 -1.25 115.31 117.41 1ri1 h LEU 181 Ca 0.09 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1ri1 h LEU 181 Cb 0.57 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1ri1 h LEU 181 CO -0.35 0.20 -0.02 -0.33 0.09 0.00 0.00 178.44 178.03 1ri1 h GLU 182 N 0.40 0.40 0.00 1.13 4.39 -0.65 -0.74 114.58 119.50 1ri1 h GLU 182 Ca 0.32 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 1ri1 h GLU 182 Cb 0.71 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1ri1 h GLU 182 CO -0.09 0.61 -0.01 0.00 -1.16 0.00 0.00 179.01 178.35 1ri1 h ARG 183 N 0.14 0.00 -0.08 2.33 3.08 -0.53 0.41 114.38 119.74 1ri1 h ARG 183 Ca 0.06 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 1ri1 h ARG 183 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1ri1 h ARG 183 CO 0.02 0.01 -0.13 -0.92 -1.07 0.00 0.00 179.97 177.88 1ri1 h TYR 184 N 0.00 0.28 0.00 3.04 3.20 -0.52 -1.03 116.97 121.94 1ri1 h TYR 184 Ca -0.00 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.77 1ri1 h TYR 184 Cb 0.03 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.25 1ri1 h TYR 184 CO 0.00 0.73 0.00 0.87 -1.64 0.00 0.00 178.16 178.12 1ri1 h LYS 185 N -0.25 0.00 -0.01 1.82 1.57 0.32 -0.41 116.57 119.61 1ri1 h LYS 185 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ri1 h LYS 185 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1ri1 h LYS 185 CO 0.03 0.00 -0.43 1.04 -0.57 0.00 0.00 179.45 179.52 1ri1 n GLN 186 N -3.08 0.73 0.00 3.15 6.02 -0.02 -4.93 117.38 119.25 1ri1 n GLN 186 Ca -0.01 -0.51 0.00 0.00 -0.01 0.00 0.00 57.00 56.47 1ri1 n GLN 186 Cb 0.20 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.97 1ri1 n GLN 186 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ri1 n GLY 187 N 1.40 2.64 3.47 1.08 0.00 -0.17 -4.93 105.19 108.68 1ri1 n GLY 187 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1ri1 n GLY 187 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ri1 s ARG 188 N 0.00 3.58 0.00 1.61 3.52 -0.50 -4.77 118.95 122.40 1ri1 s ARG 188 Ca 0.00 -1.62 0.16 0.00 -0.13 0.00 0.00 55.73 54.14 1ri1 s ARG 188 Cb 0.00 -4.97 0.38 0.00 -1.56 0.00 0.00 34.95 28.80 1ri1 s ARG 188 CO 0.00 -1.85 1.30 -1.33 -0.81 0.00 0.00 175.30 172.61 1ri1 n MET 189 N 6.99 2.50 -3.93 5.12 2.81 -1.26 -4.51 117.12 124.84 1ri1 n MET 189 Ca 0.25 -2.14 0.01 0.00 -1.81 0.00 0.00 57.70 54.00 1ri1 n MET 189 Cb 0.49 -1.38 0.01 0.00 -0.71 0.00 0.00 33.22 31.64 1ri1 n MET 189 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1ri1 s SER 190 N -1.08 0.00 0.00 7.83 1.04 -1.26 -2.17 113.70 118.06 1ri1 s SER 190 Ca 0.31 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.39 1ri1 s SER 190 Cb 0.17 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1ri1 s SER 190 CO 0.23 -0.52 0.00 -0.46 0.98 0.00 0.00 173.24 173.46 1ri1 n ASN 191 N -1.08 0.00 0.10 7.02 0.23 -1.02 -4.99 115.26 115.52 1ri1 n ASN 191 Ca 0.01 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.17 1ri1 n ASN 191 Cb 0.59 0.00 0.45 0.00 -2.08 0.00 0.00 39.78 38.74 1ri1 n ASN 191 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1ri1 n ASP 192 N 0.00 0.54 -0.11 0.53 8.00 -1.26 -3.70 116.55 120.55 1ri1 n ASP 192 Ca 0.00 0.62 -0.14 0.00 0.71 0.00 0.00 54.79 55.98 1ri1 n ASP 192 Cb 0.00 -0.74 -0.14 0.00 -0.02 0.00 0.00 41.12 40.22 1ri1 n ASP 192 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1ri1 n PHE 193 N -2.08 0.02 -4.26 1.24 3.01 -1.26 -4.84 117.46 109.29 1ri1 n PHE 193 Ca 0.03 0.01 -0.18 0.00 1.01 0.00 0.00 57.45 58.31 1ri1 n PHE 193 Cb 0.25 -1.00 -0.07 0.00 -0.01 0.00 0.00 39.48 38.64 1ri1 n PHE 193 CO 0.00 0.00 0.00 2.48 1.01 0.00 0.00 176.76 180.25 1ri1 n TYR 194 N -3.00 -0.74 -3.64 1.38 0.18 -1.24 -0.20 117.16 109.91 1ri1 n TYR 194 Ca -0.39 -2.60 -0.08 0.00 1.88 0.00 0.00 57.90 56.71 1ri1 n TYR 194 Cb 1.08 0.27 -0.07 0.00 -0.38 0.00 0.00 39.34 40.24 1ri1 n TYR 194 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 1ri1 s LYS 195 N -3.26 0.63 -0.00 -3.48 2.20 -0.45 -2.43 119.74 112.96 1ri1 s LYS 195 Ca 0.37 0.93 0.03 0.00 -0.36 0.00 0.00 55.97 56.94 1ri1 s LYS 195 Cb 0.02 0.22 -0.01 0.00 -1.51 0.00 0.00 37.83 36.55 1ri1 s LYS 195 CO 0.26 -0.10 -0.09 0.42 -0.36 0.00 0.00 175.35 175.48 1ri1 s ILE 196 N 0.97 0.70 -0.02 5.43 1.01 -0.92 -0.84 121.20 127.53 1ri1 s ILE 196 Ca -0.05 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.18 1ri1 s ILE 196 Cb -0.05 -0.60 0.01 0.00 0.01 0.00 0.00 42.46 41.83 1ri1 s ILE 196 CO -0.11 0.16 -0.04 -1.61 0.00 0.00 0.00 174.94 173.34 1ri1 s GLU 197 N -0.31 0.60 0.17 2.79 2.02 -0.57 -4.85 118.70 118.54 1ri1 s GLU 197 Ca 0.03 -0.12 -0.01 0.00 0.02 0.00 0.00 54.97 54.88 1ri1 s GLU 197 Cb -0.04 -0.62 0.03 0.00 0.10 0.00 0.00 34.13 33.61 1ri1 s GLU 197 CO -0.00 0.00 0.23 1.28 0.02 0.00 0.00 175.26 176.79 1ri1 n LEU 198 N 3.57 0.00 -4.99 1.80 4.77 -1.26 0.33 117.00 121.23 1ri1 n LEU 198 Ca -0.20 -0.41 -0.24 0.00 -0.03 0.00 0.00 56.01 55.12 1ri1 n LEU 198 Cb 0.54 -0.16 0.11 0.00 -2.33 0.00 0.00 43.42 41.58 1ri1 n LEU 198 CO 0.24 -0.63 0.56 -1.61 -1.33 0.00 0.00 177.39 174.62 1ri1 s GLU 199 N -3.11 1.69 0.59 3.23 0.41 -1.26 -4.80 118.70 115.45 1ri1 s GLU 199 Ca 0.14 -1.04 -0.14 0.00 -0.41 0.00 0.00 54.97 53.53 1ri1 s GLU 199 Cb -0.01 -2.31 -0.04 0.00 -1.78 0.00 0.00 34.13 29.99 1ri1 s GLU 199 CO 0.10 -1.45 1.03 0.15 -0.49 0.00 0.00 175.26 174.60 1ri1 s LYS 200 N -5.16 3.51 0.00 1.61 -0.14 -1.26 -4.98 119.74 113.32 1ri1 s LYS 200 Ca 0.66 0.99 0.17 0.00 -1.36 0.00 0.00 55.97 56.43 1ri1 s LYS 200 Cb -0.06 -2.07 0.75 0.00 -1.68 0.00 0.00 37.83 34.77 1ri1 s LYS 200 CO 0.44 -0.64 1.54 -0.12 -0.76 0.00 0.00 175.35 175.81 1ri1 n MET 201 N -2.23 0.04 -1.52 1.68 0.00 -1.26 -4.71 117.12 109.12 1ri1 n MET 201 Ca 0.07 0.20 -0.33 0.00 0.00 0.00 0.00 57.70 57.64 1ri1 n MET 201 Cb 0.54 -1.50 -0.12 0.00 0.00 0.00 0.00 33.22 32.13 1ri1 n MET 201 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1ri1 n GLU 202 N -1.47 0.35 -2.78 2.12 2.13 -1.26 -0.80 120.64 118.94 1ri1 n GLU 202 Ca 0.05 -0.10 -0.21 0.00 0.66 0.00 0.00 57.16 57.55 1ri1 n GLU 202 Cb 0.19 -2.21 0.02 0.00 0.27 0.00 0.00 31.44 29.71 1ri1 n GLU 202 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1ri1 n ASP 203 N 12.08 -5.95 -3.72 4.31 8.00 -1.26 -5.00 116.55 125.00 1ri1 n ASP 203 Ca 0.56 -0.19 -0.12 0.00 0.71 0.00 0.00 54.79 55.76 1ri1 n ASP 203 Cb 0.24 -4.84 -0.10 0.00 -0.02 0.00 0.00 41.12 36.39 1ri1 n ASP 203 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1ri1 s VAL 204 N -3.11 -0.01 0.59 2.53 -7.23 0.02 -5.12 120.40 108.07 1ri1 s VAL 204 Ca 0.19 0.04 0.09 0.00 -1.81 0.00 0.00 61.98 60.49 1ri1 s VAL 204 Cb -0.08 -0.58 0.09 0.00 0.56 0.00 0.00 36.38 36.37 1ri1 s VAL 204 CO 0.23 0.02 0.77 -2.16 -0.31 0.00 0.00 175.10 173.65 1ri1 s PRO 205 N 0.69 2.25 0.13 4.82 0.04 -1.26 -4.55 135.00 137.13 1ri1 s PRO 205 Ca -0.04 -1.73 -0.20 0.00 0.04 0.00 0.00 61.00 59.08 1ri1 s PRO 205 Cb -0.05 -2.57 -0.02 0.00 0.04 0.00 0.00 34.50 31.90 1ri1 s PRO 205 CO -0.05 -0.90 1.71 0.52 0.04 0.00 0.00 177.00 178.32 1ri1 h MET 206 N 0.19 0.03 0.00 4.56 2.86 -2.00 -1.49 114.93 119.08 1ri1 h MET 206 Ca -0.29 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 1ri1 h MET 206 Cb 1.29 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.94 1ri1 h MET 206 CO 0.42 0.02 0.00 0.39 1.06 0.00 0.00 176.91 178.80 1ri1 n GLU 207 N -5.18 0.06 0.00 1.72 -0.58 -1.26 -1.49 120.64 113.91 1ri1 n GLU 207 Ca -0.02 0.47 0.12 0.00 -0.42 0.00 0.00 57.16 57.31 1ri1 n GLU 207 Cb 0.13 -1.66 0.20 0.00 -0.57 0.00 0.00 31.44 29.53 1ri1 n GLU 207 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1ri1 n SER 208 N -1.78 1.79 -4.71 1.62 2.88 -0.57 -4.90 113.62 107.95 1ri1 n SER 208 Ca 0.01 -1.39 -0.42 0.00 -1.33 0.00 0.00 58.87 55.74 1ri1 n SER 208 Cb 0.08 0.24 -0.03 0.00 -0.75 0.00 0.00 64.21 63.75 1ri1 n SER 208 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1ri1 s VAL 209 N -2.36 4.88 -0.24 2.46 1.01 -0.55 -4.91 120.40 120.69 1ri1 s VAL 209 Ca 0.24 2.00 0.19 0.00 0.00 0.00 0.00 61.98 64.40 1ri1 s VAL 209 Cb 0.19 -4.29 -0.27 0.00 0.00 0.00 0.00 36.38 32.01 1ri1 s VAL 209 CO 0.49 0.16 0.50 0.54 0.00 0.00 0.00 175.10 176.79 1ri1 n ARG 210 N 3.94 0.67 -4.01 2.72 1.74 -1.26 -4.94 116.66 115.52 1ri1 n ARG 210 Ca 0.05 -0.13 -0.09 0.00 -0.77 0.00 0.00 57.85 56.91 1ri1 n ARG 210 Cb 0.51 -1.43 -0.06 0.00 -1.02 0.00 0.00 32.46 30.46 1ri1 n ARG 210 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1ri1 s GLU 211 N -3.16 1.47 0.23 5.56 -1.05 -1.26 -1.66 118.70 118.82 1ri1 s GLU 211 Ca -0.03 -1.28 -0.14 0.00 -0.15 0.00 0.00 54.97 53.36 1ri1 s GLU 211 Cb 0.12 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 34.26 1ri1 s GLU 211 CO 0.78 -0.59 0.48 1.52 0.95 0.00 0.00 175.26 178.39 1ri1 s TYR 212 N -4.03 0.23 -0.22 4.83 -0.85 -0.65 -4.15 117.35 112.52 1ri1 s TYR 212 Ca 0.24 -0.60 -0.11 0.00 -0.52 0.00 0.00 57.07 56.08 1ri1 s TYR 212 Cb 0.01 0.23 -0.05 0.00 0.38 0.00 0.00 41.96 42.53 1ri1 s TYR 212 CO 0.08 -0.96 0.19 1.03 -1.52 0.00 0.00 175.55 174.38 1ri1 s ARG 213 N -3.98 4.14 -0.13 -3.49 1.81 0.15 -1.42 118.95 116.03 1ri1 s ARG 213 Ca 0.18 -0.16 0.02 0.00 -1.72 0.00 0.00 55.73 54.05 1ri1 s ARG 213 Cb -0.01 -3.49 0.00 0.00 -0.45 0.00 0.00 34.95 31.00 1ri1 s ARG 213 CO 0.05 0.14 -0.19 0.12 -0.68 0.00 0.00 175.30 174.74 1ri1 s PHE 214 N 0.82 2.70 -0.06 -0.53 5.36 0.21 -1.51 117.98 124.97 1ri1 s PHE 214 Ca 0.10 -1.09 0.05 0.00 -0.96 0.00 0.00 56.93 55.03 1ri1 s PHE 214 Cb -0.13 -1.82 -0.01 0.00 -0.34 0.00 0.00 43.02 40.73 1ri1 s PHE 214 CO 0.03 -0.47 -0.22 0.99 -1.46 0.00 0.00 175.22 174.09 1ri1 s THR 215 N 0.65 1.80 -0.02 0.12 2.01 -0.02 -1.07 115.64 119.10 1ri1 s THR 215 Ca -0.10 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.00 1ri1 s THR 215 Cb -0.16 -1.54 0.01 0.00 0.01 0.00 0.00 72.50 70.82 1ri1 s THR 215 CO 0.02 0.51 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.20 1ri1 s LEU 216 N 0.01 1.61 -0.00 4.42 2.96 -0.61 -1.35 118.68 125.72 1ri1 s LEU 216 Ca -0.06 -0.08 -0.36 0.00 -0.22 0.00 0.00 54.13 53.41 1ri1 s LEU 216 Cb -0.14 -0.30 -0.14 0.00 0.50 0.00 0.00 46.19 46.11 1ri1 s LEU 216 CO 0.04 -0.01 1.64 -0.11 -1.32 0.00 0.00 176.35 176.59 1ri1 n LEU 217 N 3.55 2.75 -3.40 -0.68 7.94 0.72 -0.90 117.00 126.98 1ri1 n LEU 217 Ca -0.20 1.06 -0.24 0.00 -1.11 0.00 0.00 56.01 55.52 1ri1 n LEU 217 Cb 0.54 -1.31 0.05 0.00 0.53 0.00 0.00 43.42 43.23 1ri1 n LEU 217 CO 0.24 -0.42 0.12 0.47 -1.11 0.00 0.00 177.39 176.69 1ri1 n ASP 218 N 4.45 -5.92 0.00 1.96 10.43 -1.26 -4.91 116.55 121.30 1ri1 n ASP 218 Ca 0.20 -0.46 0.00 0.00 2.57 0.00 0.00 54.79 57.10 1ri1 n ASP 218 Cb 0.24 -4.73 0.00 0.00 1.84 0.00 0.00 41.12 38.47 1ri1 n ASP 218 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 1ri1 n SER 219 N -2.76 0.00 -4.48 -2.24 2.88 -0.08 -5.14 113.62 101.80 1ri1 n SER 219 Ca -0.03 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.11 1ri1 n SER 219 Cb 0.58 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.06 1ri1 n SER 219 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1ri1 n VAL 220 N 0.00 2.19 -3.95 2.46 0.24 -1.26 -4.66 118.33 113.35 1ri1 n VAL 220 Ca 0.00 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.34 61.49 1ri1 n VAL 220 Cb 0.00 -0.71 -0.15 0.00 -1.47 0.00 0.00 33.84 31.51 1ri1 n VAL 220 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1ri1 s ASN 221 N -1.07 4.28 -1.40 -1.34 0.01 -1.26 -1.58 114.94 112.58 1ri1 s ASN 221 Ca 0.67 -1.62 -0.02 0.00 -0.71 0.00 0.00 52.86 51.17 1ri1 s ASN 221 Cb -0.50 -1.33 0.01 0.00 0.41 0.00 0.00 41.25 39.84 1ri1 s ASN 221 CO 0.55 -0.31 0.20 -3.20 -1.51 0.00 0.00 177.10 172.84 1ri1 n ASN 222 N 4.52 -4.92 -4.74 -1.22 5.15 -1.05 -4.89 115.26 108.12 1ri1 n ASN 222 Ca -0.05 -0.05 -0.42 0.00 -0.60 0.00 0.00 54.58 53.46 1ri1 n ASN 222 Cb 0.43 -4.09 -0.02 0.00 -0.53 0.00 0.00 39.78 35.56 1ri1 n ASN 222 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ri1 s ILE 224 N 0.34 4.49 -0.07 0.00 1.09 -1.26 -0.62 121.20 125.17 1ri1 s ILE 224 Ca 0.63 1.80 0.02 0.00 -1.10 0.00 0.00 60.65 62.01 1ri1 s ILE 224 Cb -0.43 -4.16 -0.02 0.00 -1.06 0.00 0.00 42.46 36.78 1ri1 s ILE 224 CO 0.40 -0.14 -0.13 -1.61 -0.10 0.00 0.00 174.94 173.36 1ri1 s GLU 225 N 3.23 2.75 -0.23 2.79 0.41 -0.51 -4.98 118.70 122.16 1ri1 s GLU 225 Ca 0.49 -0.67 -0.11 0.00 -0.41 0.00 0.00 54.97 54.27 1ri1 s GLU 225 Cb -0.18 -2.47 -0.05 0.00 -1.78 0.00 0.00 34.13 29.65 1ri1 s GLU 225 CO 0.11 0.53 0.17 0.71 -0.49 0.00 0.00 175.26 176.29 1ri1 s TYR 226 N -0.48 3.33 0.35 1.61 1.51 -1.26 -1.64 117.35 120.77 1ri1 s TYR 226 Ca 0.06 0.25 -0.28 0.00 -1.01 0.00 0.00 57.07 56.10 1ri1 s TYR 226 Cb -0.12 -2.27 -0.12 0.00 -0.11 0.00 0.00 41.96 39.34 1ri1 s TYR 226 CO 0.02 0.09 1.26 1.19 -1.11 0.00 0.00 175.55 177.00 1ri1 n PHE 227 N 4.20 2.17 -2.84 2.71 0.99 -0.66 -4.69 117.46 119.34 1ri1 n PHE 227 Ca -0.15 0.56 -0.43 0.00 -0.00 0.00 0.00 57.45 57.43 1ri1 n PHE 227 Cb 0.52 -2.40 -0.04 0.00 -1.00 0.00 0.00 39.48 36.56 1ri1 n PHE 227 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1ri1 s VAL 228 N -1.10 4.40 -0.73 -4.37 1.01 -1.26 -4.86 120.40 113.48 1ri1 s VAL 228 Ca 0.56 0.28 -0.26 0.00 0.00 0.00 0.00 61.98 62.56 1ri1 s VAL 228 Cb -0.57 -4.53 0.00 0.00 0.00 0.00 0.00 36.38 31.27 1ri1 s VAL 228 CO 0.62 -1.11 1.62 -0.62 0.00 0.00 0.00 175.10 175.61 1ri1 s ASP 229 N 2.83 5.69 0.10 3.32 -1.08 -1.26 -4.72 116.67 121.55 1ri1 s ASP 229 Ca 0.30 -0.23 -0.27 0.00 -0.52 0.00 0.00 52.55 51.83 1ri1 s ASP 229 Cb -0.13 -2.55 -0.12 0.00 -1.46 0.00 0.00 42.92 38.67 1ri1 s ASP 229 CO 0.19 -2.15 1.66 0.15 0.52 0.00 0.00 175.17 175.55 1ri1 h PHE 230 N 12.30 -0.56 -0.74 -5.34 3.57 -1.99 -2.08 116.94 122.09 1ri1 h PHE 230 Ca -0.18 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.38 1ri1 h PHE 230 Cb 1.09 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.99 1ri1 h PHE 230 CO 1.12 -0.32 0.43 1.15 -2.23 0.00 0.00 178.31 178.46 1ri1 h THR 231 N -0.46 0.98 -0.28 4.41 2.02 -2.00 0.10 112.91 117.69 1ri1 h THR 231 Ca -0.00 -0.27 -0.07 0.00 0.77 0.00 0.00 66.41 66.84 1ri1 h THR 231 Cb 0.43 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1ri1 h THR 231 CO -0.05 0.14 -0.12 -0.09 0.37 0.00 0.00 175.52 175.77 1ri1 h ARG 232 N 0.78 0.46 0.08 6.66 2.43 -1.95 -2.19 114.38 120.65 1ri1 h ARG 232 Ca 0.33 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1ri1 h ARG 232 Cb 0.20 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1ri1 h ARG 232 CO -0.19 0.58 -0.04 1.98 -1.51 0.00 0.00 179.97 180.80 1ri1 h MET 233 N 0.43 -0.11 0.27 0.20 4.05 -0.50 -1.24 114.93 118.03 1ri1 h MET 233 Ca 0.08 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.51 1ri1 h MET 233 Cb 0.47 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.27 1ri1 h MET 233 CO 0.03 0.22 -0.41 0.28 0.23 0.00 0.00 176.91 177.26 1ri1 h VAL 234 N -0.44 0.00 -0.52 -5.77 2.07 -0.88 -0.51 116.25 110.20 1ri1 h VAL 234 Ca -0.01 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.61 1ri1 h VAL 234 Cb 0.37 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.05 1ri1 h VAL 234 CO 0.02 0.00 -0.10 0.44 0.02 0.00 0.00 177.57 177.95 1ri1 h ASP 235 N -0.71 -0.42 -0.72 0.57 3.45 -1.47 0.31 116.42 117.43 1ri1 h ASP 235 Ca -0.03 0.15 0.09 0.00 0.43 0.00 0.00 57.03 57.67 1ri1 h ASP 235 Cb 0.65 0.30 -0.07 0.00 -0.56 0.00 0.00 39.33 39.65 1ri1 h ASP 235 CO -0.12 -0.15 0.36 1.23 -1.57 0.00 0.00 179.24 178.98 1ri1 h GLY 236 N 0.02 1.08 0.59 2.75 0.00 -0.91 -1.68 103.07 104.91 1ri1 h GLY 236 Ca 0.25 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 1ri1 h GLY 236 CO -0.51 0.06 -0.13 0.74 0.00 0.00 0.00 176.54 176.71 1ri1 h PHE 237 N 0.61 0.25 -0.68 5.60 0.05 0.24 -3.10 116.94 119.91 1ri1 h PHE 237 Ca 0.35 -0.09 0.20 0.00 3.82 0.00 0.00 57.97 62.25 1ri1 h PHE 237 Cb 0.37 -0.05 -0.03 0.00 2.00 0.00 0.00 35.95 38.24 1ri1 h PHE 237 CO -0.10 0.72 0.53 -0.22 -0.18 0.00 0.00 178.31 179.06 1ri1 h LYS 238 N -0.30 0.00 0.00 1.51 3.64 0.14 0.89 116.57 122.45 1ri1 h LYS 238 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1ri1 h LYS 238 Cb 0.71 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1ri1 h LYS 238 CO 0.03 0.00 -0.09 -0.09 -2.27 0.00 0.00 179.45 177.02 1ri1 h ARG 239 N 0.00 0.00 -0.46 1.90 9.65 -1.23 -3.07 114.38 121.17 1ri1 h ARG 239 Ca 0.32 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.20 1ri1 h ARG 239 Cb 1.37 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.95 1ri1 h ARG 239 CO -0.00 0.09 0.00 1.28 2.80 0.00 0.00 179.97 184.14 1ri1 n LEU 240 N -3.18 3.22 0.00 3.80 4.77 0.30 -4.97 117.00 120.95 1ri1 n LEU 240 Ca 0.01 -1.97 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 1ri1 n LEU 240 Cb 0.42 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1ri1 n LEU 240 CO 0.31 0.80 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 1ri1 n GLY 241 N 0.87 0.83 3.52 -0.72 0.00 -0.81 -4.99 105.19 103.90 1ri1 n GLY 241 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1ri1 n GLY 241 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ri1 s LEU 242 N 0.00 3.36 0.08 0.99 1.02 -0.85 -1.91 118.68 121.38 1ri1 s LEU 242 Ca 0.00 -0.09 0.05 0.00 0.02 0.00 0.00 54.13 54.11 1ri1 s LEU 242 Cb 0.00 -1.82 -0.04 0.00 0.02 0.00 0.00 46.19 44.35 1ri1 s LEU 242 CO 0.00 0.17 -0.05 -0.44 0.02 0.00 0.00 176.35 176.05 1ri1 s SER 243 N 0.39 4.72 -0.14 2.29 0.01 -0.23 -2.07 113.70 118.67 1ri1 s SER 243 Ca -0.02 -0.26 -0.29 0.00 1.31 0.00 0.00 55.95 56.69 1ri1 s SER 243 Cb -0.14 -1.04 -0.02 0.00 0.21 0.00 0.00 66.02 65.04 1ri1 s SER 243 CO 0.02 0.19 1.26 -0.22 0.41 0.00 0.00 173.24 174.90 1ri1 s LEU 244 N -2.14 4.21 0.00 2.44 2.96 -1.26 -1.08 118.68 123.80 1ri1 s LEU 244 Ca 0.23 1.74 0.01 0.00 -0.22 0.00 0.00 54.13 55.88 1ri1 s LEU 244 Cb -0.11 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.04 1ri1 s LEU 244 CO 0.15 -0.72 0.42 1.33 -1.32 0.00 0.00 176.35 176.20 1ri1 n VAL 245 N 5.19 0.00 -3.62 1.68 0.24 0.95 -4.96 118.33 117.82 1ri1 n VAL 245 Ca 0.13 -0.50 -0.01 0.00 -2.04 0.00 0.00 64.34 61.92 1ri1 n VAL 245 Cb 0.45 1.01 -0.06 0.00 -1.47 0.00 0.00 33.84 33.77 1ri1 n VAL 245 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1ri1 s GLU 246 N -0.27 0.32 -0.25 7.34 2.56 -1.06 -4.92 118.70 122.41 1ri1 s GLU 246 Ca 0.01 0.58 -0.03 0.00 0.00 0.00 0.00 54.97 55.53 1ri1 s GLU 246 Cb 0.01 0.10 0.11 0.00 2.00 0.00 0.00 34.13 36.35 1ri1 s GLU 246 CO 0.01 -0.07 0.23 0.50 -0.56 0.00 0.00 175.26 175.38 1ri1 s ARG 247 N 1.42 0.24 0.02 4.30 3.52 -1.25 -0.08 118.95 127.12 1ri1 s ARG 247 Ca -0.08 -0.06 0.00 0.00 -0.13 0.00 0.00 55.73 55.46 1ri1 s ARG 247 Cb -0.04 -0.99 -0.02 0.00 -1.56 0.00 0.00 34.95 32.35 1ri1 s ARG 247 CO -0.14 -0.87 -0.03 0.21 -0.81 0.00 0.00 175.30 173.66 1ri1 s LYS 248 N 2.30 0.29 0.33 5.12 2.20 -0.00 -4.96 119.74 125.02 1ri1 s LYS 248 Ca 0.08 -0.50 -0.27 0.00 -0.36 0.00 0.00 55.97 54.92 1ri1 s LYS 248 Cb -0.15 0.01 -0.09 0.00 -1.51 0.00 0.00 37.83 36.09 1ri1 s LYS 248 CO -0.24 -0.02 1.10 0.20 -0.36 0.00 0.00 175.35 176.03 1ri1 s GLY 249 N -1.15 2.95 0.23 5.54 0.00 -1.26 0.11 107.32 113.73 1ri1 s GLY 249 Ca -0.11 0.87 -0.10 0.00 0.00 0.00 0.00 44.72 45.37 1ri1 s GLY 249 CO -0.01 1.41 1.62 0.74 0.00 0.00 0.00 173.10 176.87 1ri1 h PHE 250 N 3.27 -0.23 -0.11 1.90 -1.00 -1.69 0.92 116.94 120.00 1ri1 h PHE 250 Ca -0.47 0.06 0.00 0.00 2.81 0.00 0.00 57.97 60.36 1ri1 h PHE 250 Cb 1.22 0.21 -0.01 0.00 3.61 0.00 0.00 35.95 40.99 1ri1 h PHE 250 CO 0.58 -0.27 0.07 0.82 -1.61 0.00 0.00 178.31 177.90 1ri1 h ILE 251 N 0.04 1.04 0.12 -0.55 1.08 -1.85 0.52 117.51 117.92 1ri1 h ILE 251 Ca 0.37 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.73 1ri1 h ILE 251 Cb 0.60 0.90 0.00 0.00 -3.07 0.00 0.00 36.82 35.26 1ri1 h ILE 251 CO -0.69 0.04 -0.06 0.44 -0.69 0.00 0.00 178.15 177.19 1ri1 h ASP 252 N 0.14 -0.13 -0.63 1.72 3.32 -1.82 0.23 116.42 119.25 1ri1 h ASP 252 Ca 0.04 -0.18 0.12 0.00 0.02 0.00 0.00 57.03 57.03 1ri1 h ASP 252 Cb 0.00 0.03 -0.09 0.00 0.22 0.00 0.00 39.33 39.50 1ri1 h ASP 252 CO -0.01 0.11 0.15 0.15 -1.72 0.00 0.00 179.24 177.92 1ri1 h PHE 253 N -0.37 0.24 0.12 4.55 3.57 -0.73 0.37 116.94 124.69 1ri1 h PHE 253 Ca -0.02 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1ri1 h PHE 253 Cb 0.30 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1ri1 h PHE 253 CO -0.00 -0.02 -0.06 -0.92 -2.23 0.00 0.00 178.31 175.08 1ri1 h TYR 254 N 0.28 -0.15 -0.60 0.41 3.20 0.37 -1.00 116.97 119.48 1ri1 h TYR 254 Ca 0.33 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.16 1ri1 h TYR 254 Cb 0.50 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.79 1ri1 h TYR 254 CO -0.24 -0.08 0.21 0.93 -1.64 0.00 0.00 178.16 177.34 1ri1 h GLU 255 N -0.18 0.91 -0.35 1.82 5.08 0.42 0.21 114.58 122.50 1ri1 h GLU 255 Ca -0.02 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 1ri1 h GLU 255 Cb 0.14 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1ri1 h GLU 255 CO 0.03 0.79 0.16 -0.44 -1.00 0.00 0.00 179.01 178.55 1ri1 h ASP 256 N 0.84 0.46 -0.20 1.42 5.19 -0.23 -2.87 116.42 121.02 1ri1 h ASP 256 Ca 0.20 -0.13 -0.21 0.00 -0.62 0.00 0.00 57.03 56.26 1ri1 h ASP 256 Cb 0.24 -0.12 0.01 0.00 0.18 0.00 0.00 39.33 39.64 1ri1 h ASP 256 CO -0.01 0.46 -0.68 -0.33 -3.12 0.00 0.00 179.24 175.56 1ri1 h GLU 257 N 0.42 0.83 0.00 3.56 4.39 -1.05 -2.97 114.58 119.76 1ri1 h GLU 257 Ca 0.12 -0.61 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1ri1 h GLU 257 Cb 0.13 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1ri1 h GLU 257 CO -0.01 1.23 0.04 0.78 -1.16 0.00 0.00 179.01 179.88 1ri1 h GLY 258 N 0.62 0.00 1.02 -3.84 0.00 -0.51 0.07 103.07 100.43 1ri1 h GLY 258 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.08 1ri1 h GLY 258 CO 0.14 0.00 -1.52 3.21 0.00 0.00 0.00 176.54 178.38 1ri1 h ARG 259 N 0.00 0.00 0.00 4.80 3.08 -1.35 -3.32 114.38 117.59 1ri1 h ARG 259 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1ri1 h ARG 259 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1ri1 h ARG 259 CO 0.00 0.39 -0.98 0.00 -1.07 0.00 0.00 179.97 178.31 1ri1 h ARG 260 N 0.00 0.00 -2.20 0.04 3.08 -1.11 -3.39 114.38 110.80 1ri1 h ARG 260 Ca -0.21 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.28 1ri1 h ARG 260 Cb 1.77 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 31.41 1ri1 h ARG 260 CO 0.06 0.08 -0.81 0.09 -1.07 0.00 0.00 179.97 178.32 1ri1 n ASN 261 N -2.78 3.42 -0.01 7.04 4.13 -0.12 -4.91 115.26 122.03 1ri1 n ASN 261 Ca -0.02 -3.49 0.22 0.00 1.68 0.00 0.00 54.58 52.97 1ri1 n ASN 261 Cb 0.61 -0.58 0.71 0.00 -1.54 0.00 0.00 39.78 38.99 1ri1 n ASN 261 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1ri1 h PRO 262 N 2.99 0.00 0.11 3.52 0.11 -1.77 -1.87 132.00 135.09 1ri1 h PRO 262 Ca 0.12 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 1ri1 h PRO 262 Cb 0.64 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.75 1ri1 h PRO 262 CO 0.73 0.00 -0.05 1.05 -0.21 0.00 0.00 178.00 179.51 1ri1 h GLU 263 N 0.00 -0.14 0.00 1.05 9.09 -1.91 -2.60 114.58 120.07 1ri1 h GLU 263 Ca 0.27 0.01 -0.00 0.00 0.05 0.00 0.00 59.36 59.69 1ri1 h GLU 263 Cb 1.13 0.03 -0.00 0.00 -1.65 0.00 0.00 28.75 28.26 1ri1 h GLU 263 CO -0.00 0.20 -0.01 1.25 0.05 0.00 0.00 179.01 180.50 1ri1 h LEU 264 N -0.49 0.00 0.06 3.06 5.85 -1.77 0.62 115.31 122.64 1ri1 h LEU 264 Ca -0.01 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 1ri1 h LEU 264 Cb 0.40 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1ri1 h LEU 264 CO 0.02 0.01 -0.03 -1.28 -0.34 0.00 0.00 178.44 176.82 1ri1 h SER 265 N 0.00 -0.07 -0.02 1.25 0.87 -1.18 -1.58 113.55 112.82 1ri1 h SER 265 Ca -0.00 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 1ri1 h SER 265 Cb 0.08 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.06 1ri1 h SER 265 CO 0.00 -0.03 0.02 0.11 -0.53 0.00 0.00 176.83 176.40 1ri1 h LYS 266 N -0.12 0.00 -0.58 2.24 1.79 -1.33 0.36 116.57 118.93 1ri1 h LYS 266 Ca -0.01 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.37 1ri1 h LYS 266 Cb 0.07 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.69 1ri1 h LYS 266 CO 0.01 0.00 0.02 -0.22 -1.08 0.00 0.00 179.45 178.18 1ri1 h LYS 267 N 0.00 1.01 -0.66 3.15 3.64 -0.91 -2.27 116.57 120.52 1ri1 h LYS 267 Ca 0.01 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1ri1 h LYS 267 Cb 0.05 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1ri1 h LYS 267 CO -0.00 1.00 0.00 -1.33 -2.27 0.00 0.00 179.45 176.85 1ri1 n MET 268 N -4.24 2.57 -2.92 1.90 2.81 -0.42 -5.02 117.12 111.80 1ri1 n MET 268 Ca 0.02 -2.44 -0.01 0.00 -1.81 0.00 0.00 57.70 53.47 1ri1 n MET 268 Cb 0.33 -1.53 -0.01 0.00 -0.71 0.00 0.00 33.22 31.30 1ri1 n MET 268 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ri1 n GLY 269 N 1.58 -2.22 3.82 3.03 0.00 0.11 -4.92 105.19 106.59 1ri1 n GLY 269 Ca 0.23 0.49 -0.06 0.00 0.00 0.00 0.00 46.02 46.68 1ri1 n GLY 269 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ri1 s LEU 270 N -0.89 -0.11 0.00 0.99 0.05 -1.14 -4.96 118.68 112.61 1ri1 s LEU 270 Ca -0.06 -0.70 0.00 0.00 0.05 0.00 0.00 54.13 53.42 1ri1 s LEU 270 Cb 0.00 2.46 0.00 0.00 -2.05 0.00 0.00 46.19 46.60 1ri1 s LEU 270 CO 0.37 -1.23 0.00 0.61 -0.55 0.00 0.00 176.35 175.55 1ri1 n GLY 271 N -0.53 3.49 2.43 -3.48 0.00 -1.26 -4.68 105.19 101.17 1ri1 n GLY 271 Ca -0.05 -0.43 -0.02 0.00 0.00 0.00 0.00 46.02 45.52 1ri1 n GLY 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ri1 s LEU 273 N -1.53 4.00 0.58 0.00 1.43 -1.26 -5.05 118.68 116.86 1ri1 s LEU 273 Ca 0.06 1.53 -0.17 0.00 -1.03 0.00 0.00 54.13 54.53 1ri1 s LEU 273 Cb -0.02 -4.34 -0.04 0.00 0.03 0.00 0.00 46.19 41.83 1ri1 s LEU 273 CO 0.58 -0.29 1.07 0.42 0.23 0.00 0.00 176.35 178.36 1ri1 s THR 274 N -2.08 3.67 0.58 5.49 -4.23 -1.26 -4.78 115.64 113.03 1ri1 s THR 274 Ca 0.58 0.84 0.28 0.00 -1.18 0.00 0.00 61.69 62.21 1ri1 s THR 274 Cb -0.10 -3.34 0.34 0.00 1.34 0.00 0.00 72.50 70.74 1ri1 s THR 274 CO 0.15 -0.42 2.24 0.03 -0.54 0.00 0.00 174.62 176.08 1ri1 h ARG 275 N 0.59 0.00 -0.31 3.99 3.08 -1.98 0.22 114.38 119.97 1ri1 h ARG 275 Ca -0.47 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.43 1ri1 h ARG 275 Cb 1.23 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.27 1ri1 h ARG 275 CO 0.57 0.00 -0.40 0.93 -1.07 0.00 0.00 179.97 180.00 1ri1 h GLU 276 N 0.00 0.74 0.04 0.04 4.39 -2.01 -2.71 114.58 115.07 1ri1 h GLU 276 Ca 0.00 -0.39 -0.23 0.00 0.34 0.00 0.00 59.36 59.09 1ri1 h GLU 276 Cb 0.01 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1ri1 h GLU 276 CO -0.00 1.01 -1.01 0.93 -1.16 0.00 0.00 179.01 178.78 1ri1 h GLU 277 N 0.61 0.22 -0.54 2.33 5.08 -1.43 -3.25 114.58 117.60 1ri1 h GLU 277 Ca 0.05 -0.29 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1ri1 h GLU 277 Cb 0.95 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 1ri1 h GLU 277 CO 0.09 1.06 0.36 0.77 -1.00 0.00 0.00 179.01 180.28 1ri1 h SER 278 N 0.10 0.60 -0.72 1.42 0.02 -0.48 -1.89 113.55 112.60 1ri1 h SER 278 Ca -0.07 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 1ri1 h SER 278 Cb 1.69 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 64.05 1ri1 h SER 278 CO 0.16 0.43 0.38 -0.33 -1.14 0.00 0.00 176.83 176.33 1ri1 h GLU 279 N 0.70 1.02 -0.09 3.45 5.08 -1.51 0.69 114.58 123.93 1ri1 h GLU 279 Ca 0.20 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1ri1 h GLU 279 Cb -0.03 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.02 1ri1 h GLU 279 CO -0.05 0.77 -0.35 0.28 -1.00 0.00 0.00 179.01 178.66 1ri1 h VAL 280 N 1.03 1.40 -0.54 3.13 2.07 -1.49 -3.23 116.25 118.63 1ri1 h VAL 280 Ca 0.26 -1.71 -0.09 0.00 0.82 0.00 0.00 66.70 65.98 1ri1 h VAL 280 Cb 0.05 2.24 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 1ri1 h VAL 280 CO -0.04 0.50 -0.01 0.58 0.02 0.00 0.00 177.57 178.62 1ri1 h VAL 281 N -0.07 1.26 0.00 2.57 2.07 -1.13 -3.00 116.25 117.95 1ri1 h VAL 281 Ca -0.02 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1ri1 h VAL 281 Cb 0.98 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1ri1 h VAL 281 CO 0.07 0.40 0.00 0.61 0.02 0.00 0.00 177.57 178.67 1ri1 n GLY 282 N -0.38 -0.55 0.18 2.17 0.00 0.24 -2.44 105.19 104.40 1ri1 n GLY 282 Ca 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 46.02 45.99 1ri1 n GLY 282 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ri1 h ILE 283 N 0.00 1.35 -3.21 -0.61 2.04 -1.54 -3.45 117.51 112.09 1ri1 h ILE 283 Ca 0.00 -1.75 -0.53 0.00 1.00 0.00 0.00 64.86 63.58 1ri1 h ILE 283 Cb 0.04 1.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 1ri1 h ILE 283 CO 0.00 0.52 -0.17 -0.31 0.00 0.00 0.00 178.15 178.19 1ri1 s TYR 284 N -3.95 3.47 0.17 1.37 1.51 -1.02 0.20 117.35 119.10 1ri1 s TYR 284 Ca -0.04 0.64 0.01 0.00 -1.01 0.00 0.00 57.07 56.67 1ri1 s TYR 284 Cb 0.13 -2.10 -0.04 0.00 -0.11 0.00 0.00 41.96 39.83 1ri1 s TYR 284 CO 0.78 0.23 0.03 -1.83 -1.11 0.00 0.00 175.55 173.65 1ri1 s GLU 285 N -3.34 1.09 -0.13 -0.62 -1.05 0.02 -2.03 118.70 112.64 1ri1 s GLU 285 Ca 0.44 -1.53 -0.04 0.00 -0.15 0.00 0.00 54.97 53.68 1ri1 s GLU 285 Cb -0.11 -0.12 -0.03 0.00 -0.44 0.00 0.00 34.13 33.43 1ri1 s GLU 285 CO 0.28 -0.19 0.02 0.08 0.95 0.00 0.00 175.26 176.40 1ri1 s VAL 286 N -3.78 4.43 0.00 1.83 1.01 0.12 -2.21 120.40 121.79 1ri1 s VAL 286 Ca 0.26 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1ri1 s VAL 286 Cb 0.07 -2.92 -0.00 0.00 0.00 0.00 0.00 36.38 33.52 1ri1 s VAL 286 CO 0.04 0.54 -0.03 -0.69 0.00 0.00 0.00 175.10 174.96 1ri1 s VAL 287 N -0.23 0.24 -0.04 2.92 1.01 -0.98 -0.82 120.40 122.50 1ri1 s VAL 287 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.81 1ri1 s VAL 287 Cb -0.12 -0.22 0.03 0.00 0.00 0.00 0.00 36.38 36.07 1ri1 s VAL 287 CO 0.02 0.01 0.07 -0.69 0.00 0.00 0.00 175.10 174.51 1ri1 s VAL 288 N -0.22 -0.06 0.07 2.92 1.01 0.88 -1.94 120.40 123.07 1ri1 s VAL 288 Ca -0.00 0.22 0.08 0.00 0.00 0.00 0.00 61.98 62.28 1ri1 s VAL 288 Cb -0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 36.38 36.18 1ri1 s VAL 288 CO -0.00 0.09 -0.20 -0.36 0.00 0.00 0.00 175.10 174.63 1ri1 s PHE 289 N 1.18 2.49 0.01 5.22 0.40 -0.83 -0.04 117.98 126.42 1ri1 s PHE 289 Ca -0.08 -0.29 0.06 0.00 -0.60 0.00 0.00 56.93 56.02 1ri1 s PHE 289 Cb -0.12 -1.40 -0.02 0.00 0.51 0.00 0.00 43.02 41.99 1ri1 s PHE 289 CO -0.04 0.29 -0.19 0.50 0.70 0.00 0.00 175.22 176.48 1ri1 s ARG 290 N -1.69 1.38 -1.06 0.44 3.52 -0.24 -0.54 118.95 120.75 1ri1 s ARG 290 Ca 0.15 -0.77 -0.20 0.00 -0.13 0.00 0.00 55.73 54.79 1ri1 s ARG 290 Cb -0.10 -1.40 0.09 0.00 -1.56 0.00 0.00 34.95 31.98 1ri1 s ARG 290 CO 0.06 0.37 1.41 0.21 -0.81 0.00 0.00 175.30 176.54 1ri1 s LYS 291 N -0.78 3.72 0.00 5.12 2.20 0.15 -1.07 119.74 129.08 1ri1 s LYS 291 Ca 0.07 -1.62 0.12 0.00 -0.36 0.00 0.00 55.97 54.17 1ri1 s LYS 291 Cb -0.08 -5.23 0.69 0.00 -1.51 0.00 0.00 37.83 31.71 1ri1 s LYS 291 CO 0.00 -2.04 1.13 1.28 -0.36 0.00 0.00 175.35 175.36