#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ou9 s TYR 3 N 0.00 3.28 0.36 4.31 1.51 -1.26 -5.08 117.35 120.46 1ou9 s TYR 3 Ca 0.00 0.10 -0.25 0.00 -1.01 0.00 0.00 57.07 55.92 1ou9 s TYR 3 Cb 0.00 -2.13 -0.10 0.00 -0.11 0.00 0.00 41.96 39.62 1ou9 s TYR 3 CO 0.00 0.13 0.98 0.21 -1.11 0.00 0.00 175.55 175.76 1ou9 s LYS 4 N 0.56 4.40 -0.07 -0.62 2.20 -1.26 -5.05 119.74 119.90 1ou9 s LYS 4 Ca 0.05 1.36 -0.25 0.00 -0.36 0.00 0.00 55.97 56.77 1ou9 s LYS 4 Cb -0.13 -2.64 0.06 0.00 -1.51 0.00 0.00 37.83 33.62 1ou9 s LYS 4 CO 0.01 0.10 0.58 -1.54 -0.36 0.00 0.00 175.35 174.14 1ou9 s SER 5 N -1.67 -0.54 0.80 1.43 1.04 -1.26 -5.17 113.70 108.33 1ou9 s SER 5 Ca 0.54 0.66 -0.11 0.00 0.48 0.00 0.00 55.95 57.52 1ou9 s SER 5 Cb -0.18 0.61 0.07 0.00 0.10 0.00 0.00 66.02 66.62 1ou9 s SER 5 CO 0.24 -0.50 1.09 -0.94 0.98 0.00 0.00 173.24 174.10 1ou9 s SER 6 N -0.96 4.32 0.61 7.02 1.04 -1.26 -5.00 113.70 119.47 1ou9 s SER 6 Ca -0.10 1.68 -0.18 0.00 0.48 0.00 0.00 55.95 57.83 1ou9 s SER 6 Cb -0.02 -2.40 -0.03 0.00 0.10 0.00 0.00 66.02 63.68 1ou9 s SER 6 CO 0.07 -2.13 1.21 -2.84 0.98 0.00 0.00 173.24 170.53 1ou9 s PRO 7 N -4.94 2.87 0.22 4.02 0.02 -1.26 -4.95 135.00 130.98 1ou9 s PRO 7 Ca 0.61 1.84 0.20 0.00 0.02 0.00 0.00 61.00 63.67 1ou9 s PRO 7 Cb -0.17 -1.91 0.03 0.00 0.02 0.00 0.00 34.50 32.47 1ou9 s PRO 7 CO 0.56 -1.29 1.14 0.87 -0.33 0.00 0.00 177.00 177.95 1ou9 h LYS 8 N 0.75 0.00 -0.85 5.54 1.57 -2.00 -3.41 116.57 118.18 1ou9 h LYS 8 Ca -0.50 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.45 1ou9 h LYS 8 Cb 1.30 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.45 1ou9 h LYS 8 CO 0.54 0.16 -0.22 -0.09 -0.57 0.00 0.00 179.45 179.27 1ou9 h ARG 9 N 0.00 -0.01 -0.09 3.15 2.43 -1.95 -0.77 114.38 117.15 1ou9 h ARG 9 Ca -0.05 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1ou9 h ARG 9 Cb 1.23 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 1ou9 h ARG 9 CO 0.02 -0.00 -0.02 -1.35 -1.51 0.00 0.00 179.97 177.11 1ou9 h PRO 10 N -0.01 0.13 -0.15 0.20 0.11 -1.84 0.15 132.00 130.58 1ou9 h PRO 10 Ca 0.40 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 66.28 1ou9 h PRO 10 Cb 0.62 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 31.71 1ou9 h PRO 10 CO -0.87 0.17 -0.75 1.88 -0.21 0.00 0.00 178.00 178.21 1ou9 h TYR 11 N 0.13 1.05 -0.42 0.65 -1.99 -1.45 -1.78 116.97 113.16 1ou9 h TYR 11 Ca 0.03 -0.46 -0.13 0.00 2.00 0.00 0.00 58.73 60.17 1ou9 h TYR 11 Cb 0.13 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 38.69 1ou9 h TYR 11 CO 0.00 1.29 -0.24 -0.07 -0.00 0.00 0.00 178.16 179.15 1ou9 h LEU 12 N 0.51 0.89 -0.35 3.88 3.38 -0.91 -1.11 115.31 121.60 1ou9 h LEU 12 Ca -0.05 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 1ou9 h LEU 12 Cb 1.38 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1ou9 h LEU 12 CO 0.16 1.09 0.12 0.25 0.09 0.00 0.00 178.44 180.14 1ou9 h LEU 13 N 0.75 0.50 -1.18 1.67 6.46 -0.69 -1.33 115.31 121.48 1ou9 h LEU 13 Ca 0.10 -0.19 -0.07 0.00 -0.12 0.00 0.00 57.88 57.59 1ou9 h LEU 13 Cb 0.78 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 1ou9 h LEU 13 CO 0.06 0.55 -0.23 0.03 -0.62 0.00 0.00 178.44 178.23 1ou9 h ARG 14 N 0.41 0.28 0.05 1.25 3.08 -1.20 0.33 114.38 118.58 1ou9 h ARG 14 Ca 0.11 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1ou9 h ARG 14 Cb 0.23 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1ou9 h ARG 14 CO -0.01 0.50 -0.02 0.00 -1.07 0.00 0.00 179.97 179.37 1ou9 h ALA 15 N 1.51 -0.07 -0.26 0.04 0.00 -0.84 -1.16 119.26 118.49 1ou9 h ALA 15 Ca 0.04 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1ou9 h ALA 15 Cb 0.56 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1ou9 h ALA 15 CO 0.04 -0.42 -0.25 1.88 0.00 0.00 0.00 179.25 180.50 1ou9 h TYR 16 N -0.31 0.55 0.00 0.00 -1.99 -1.11 -0.63 116.97 113.48 1ou9 h TYR 16 Ca -0.01 -0.12 -0.00 0.00 2.00 0.00 0.00 58.73 60.61 1ou9 h TYR 16 Cb 0.28 -0.13 0.00 0.00 2.00 0.00 0.00 36.73 38.87 1ou9 h TYR 16 CO 0.01 0.70 -0.00 -0.92 -0.00 0.00 0.00 178.16 177.95 1ou9 h TYR 17 N 0.43 -0.00 -0.67 4.88 3.20 -0.80 0.12 116.97 124.14 1ou9 h TYR 17 Ca 0.06 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 1ou9 h TYR 17 Cb 0.67 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.91 1ou9 h TYR 17 CO 0.02 0.03 0.29 -0.44 -1.64 0.00 0.00 178.16 176.42 1ou9 h ASP 18 N -0.03 0.90 -0.34 -2.11 3.32 -1.02 -0.47 116.42 116.67 1ou9 h ASP 18 Ca -0.00 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 1ou9 h ASP 18 Cb 0.03 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1ou9 h ASP 18 CO 0.00 0.81 0.16 -0.25 -1.72 0.00 0.00 179.24 178.24 1ou9 h TRP 19 N 0.94 0.50 0.15 4.55 7.01 -0.91 0.16 115.95 128.34 1ou9 h TRP 19 Ca 0.23 -0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.19 1ou9 h TRP 19 Cb 0.17 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.08 1ou9 h TRP 19 CO 0.01 0.43 -0.08 -0.07 -2.79 0.00 0.00 178.44 175.95 1ou9 h LEU 20 N 0.41 -0.18 -0.96 0.65 3.38 -0.45 -2.10 115.31 116.07 1ou9 h LEU 20 Ca 0.12 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1ou9 h LEU 20 Cb 0.13 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1ou9 h LEU 20 CO -0.01 -0.13 -0.01 0.58 0.09 0.00 0.00 178.44 178.96 1ou9 h VAL 21 N -0.21 1.24 0.00 1.22 2.07 -0.99 0.10 116.25 119.68 1ou9 h VAL 21 Ca -0.02 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.49 1ou9 h VAL 21 Cb 0.16 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1ou9 h VAL 21 CO 0.03 0.34 -0.16 0.44 0.02 0.00 0.00 177.57 178.25 1ou9 h ASP 22 N 0.70 0.00 -0.59 0.57 3.32 -0.51 -1.70 116.42 118.21 1ou9 h ASP 22 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1ou9 h ASP 22 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1ou9 h ASP 22 CO 0.02 0.16 0.00 0.59 -1.72 0.00 0.00 179.24 178.29 1ou9 n ASN 23 N -3.56 4.36 -1.54 6.45 3.02 -0.80 -4.94 115.26 118.24 1ou9 n ASN 23 Ca -0.01 -2.41 -0.18 0.00 -0.03 0.00 0.00 54.58 51.95 1ou9 n ASN 23 Cb 0.30 -0.55 -0.06 0.00 -0.61 0.00 0.00 39.78 38.86 1ou9 n ASN 23 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1ou9 n SER 24 N 1.01 -5.17 -4.91 6.41 7.64 -0.64 -5.00 113.62 112.95 1ou9 n SER 24 Ca 0.23 0.32 -0.27 0.00 1.01 0.00 0.00 58.87 60.17 1ou9 n SER 24 Cb 0.82 -4.24 -0.00 0.00 -1.01 0.00 0.00 64.21 59.78 1ou9 n SER 24 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ou9 s PHE 25 N -2.72 3.55 -0.39 1.43 2.99 -0.04 -5.00 117.98 117.81 1ou9 s PHE 25 Ca 0.00 0.75 -0.17 0.00 0.00 0.00 0.00 56.93 57.51 1ou9 s PHE 25 Cb 0.00 -2.25 0.01 0.00 0.00 0.00 0.00 43.02 40.78 1ou9 s PHE 25 CO 0.00 -0.23 0.42 0.99 -0.00 0.00 0.00 175.22 176.40 1ou9 s THR 26 N -2.69 5.11 -0.12 0.64 2.01 -1.26 -4.24 115.64 115.09 1ou9 s THR 26 Ca 0.46 -0.16 -0.29 0.00 0.31 0.00 0.00 61.69 62.01 1ou9 s THR 26 Cb -0.10 -3.96 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 1ou9 s THR 26 CO 0.44 -0.29 1.31 -2.16 -0.69 0.00 0.00 174.62 173.22 1ou9 s PRO 27 N 2.11 4.25 -0.14 4.92 0.04 -1.26 -1.51 135.00 143.41 1ou9 s PRO 27 Ca 0.12 1.75 -0.03 0.00 0.04 0.00 0.00 61.00 62.88 1ou9 s PRO 27 Cb -0.17 -3.74 -0.03 0.00 0.04 0.00 0.00 34.50 30.61 1ou9 s PRO 27 CO 0.13 -0.66 -0.02 0.71 0.04 0.00 0.00 177.00 177.19 1ou9 s TYR 28 N 3.24 3.07 -0.16 0.56 1.51 0.34 -0.44 117.35 125.45 1ou9 s TYR 28 Ca 0.58 -0.13 -0.03 0.00 -1.01 0.00 0.00 57.07 56.48 1ou9 s TYR 28 Cb -0.24 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.67 1ou9 s TYR 28 CO 0.19 0.12 -0.05 -1.17 -1.11 0.00 0.00 175.55 173.52 1ou9 s LEU 29 N 0.00 3.10 -0.21 -1.29 2.96 0.69 -1.23 118.68 122.71 1ou9 s LEU 29 Ca 0.02 -0.21 -0.15 0.00 -0.22 0.00 0.00 54.13 53.57 1ou9 s LEU 29 Cb -0.13 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1ou9 s LEU 29 CO 0.02 0.13 0.34 -0.69 -1.32 0.00 0.00 176.35 174.84 1ou9 s VAL 30 N 0.58 5.24 0.02 1.68 1.01 -0.01 -0.80 120.40 128.13 1ou9 s VAL 30 Ca -0.04 0.59 0.08 0.00 0.00 0.00 0.00 61.98 62.62 1ou9 s VAL 30 Cb -0.15 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1ou9 s VAL 30 CO 0.03 0.28 -0.25 -0.69 0.00 0.00 0.00 175.10 174.47 1ou9 s VAL 31 N 1.23 2.24 -0.67 2.92 1.01 0.17 -0.71 120.40 126.58 1ou9 s VAL 31 Ca 0.16 -1.27 -0.21 0.00 0.00 0.00 0.00 61.98 60.67 1ou9 s VAL 31 Cb -0.14 -1.86 0.09 0.00 0.00 0.00 0.00 36.38 34.47 1ou9 s VAL 31 CO 0.07 0.43 0.91 -0.62 0.00 0.00 0.00 175.10 175.89 1ou9 s ASP 32 N -1.08 6.23 0.00 3.32 2.15 0.26 -1.60 116.67 125.95 1ou9 s ASP 32 Ca 0.12 -1.25 0.15 0.00 0.43 0.00 0.00 52.55 52.00 1ou9 s ASP 32 Cb -0.10 -2.38 0.75 0.00 -0.30 0.00 0.00 42.92 40.89 1ou9 s ASP 32 CO 0.02 -1.31 1.40 0.00 -0.17 0.00 0.00 175.17 175.11 1ou9 n ALA 33 N 7.18 1.85 0.58 3.66 0.00 0.07 -2.22 120.51 131.63 1ou9 n ALA 33 Ca -0.02 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1ou9 n ALA 33 Cb 0.45 -1.24 0.15 0.00 0.00 0.00 0.00 19.45 18.81 1ou9 n ALA 33 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ou9 n THR 34 N -1.26 0.32 -1.93 0.00 -2.24 -1.24 -4.87 114.28 103.05 1ou9 n THR 34 Ca 0.07 -0.27 -0.41 0.00 -2.27 0.00 0.00 64.05 61.17 1ou9 n THR 34 Cb 0.11 -0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 68.25 1ou9 n THR 34 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ou9 s TYR 35 N -3.17 2.92 0.31 4.78 5.04 -0.94 -4.93 117.35 121.35 1ou9 s TYR 35 Ca 0.06 0.97 -0.29 0.00 -2.44 0.00 0.00 57.07 55.36 1ou9 s TYR 35 Cb 0.14 -3.90 -0.10 0.00 0.35 0.00 0.00 41.96 38.44 1ou9 s TYR 35 CO 0.73 -2.95 1.37 -0.51 -1.34 0.00 0.00 175.55 172.86 1ou9 s LEU 36 N -0.53 4.40 0.00 6.97 1.43 -1.26 -2.53 118.68 127.16 1ou9 s LEU 36 Ca 0.60 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 56.42 1ou9 s LEU 36 Cb -0.44 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.14 1ou9 s LEU 36 CO 0.46 -0.63 0.00 0.61 0.23 0.00 0.00 176.35 177.02 1ou9 n GLY 37 N 1.25 1.64 3.72 -3.19 0.00 -1.26 -4.61 105.19 102.74 1ou9 n GLY 37 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1ou9 n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ou9 s VAL 38 N -2.35 2.72 -0.37 1.61 1.01 -1.05 -4.66 120.40 117.31 1ou9 s VAL 38 Ca 0.00 0.54 0.02 0.00 0.00 0.00 0.00 61.98 62.54 1ou9 s VAL 38 Cb 0.00 -3.34 0.11 0.00 0.00 0.00 0.00 36.38 33.15 1ou9 s VAL 38 CO 0.00 0.05 0.13 0.21 0.00 0.00 0.00 175.10 175.49 1ou9 s ASN 39 N 0.96 4.20 0.14 3.32 3.04 0.10 -5.01 114.94 121.68 1ou9 s ASN 39 Ca 0.67 -2.14 -0.02 0.00 0.04 0.00 0.00 52.86 51.41 1ou9 s ASN 39 Cb -0.42 -1.20 -0.04 0.00 -1.54 0.00 0.00 41.25 38.05 1ou9 s ASN 39 CO 0.34 -0.36 0.09 0.68 -3.04 0.00 0.00 177.10 174.81 1ou9 s VAL 40 N 0.95 0.10 -0.41 -5.21 -7.23 -1.26 -1.63 120.40 105.70 1ou9 s VAL 40 Ca 0.13 -1.84 -0.28 0.00 -1.81 0.00 0.00 61.98 58.17 1ou9 s VAL 40 Cb -0.20 -2.02 -0.02 0.00 0.56 0.00 0.00 36.38 34.70 1ou9 s VAL 40 CO -0.12 -0.44 1.77 -2.84 -0.31 0.00 0.00 175.10 173.16 1ou9 s PRO 41 N -4.04 3.18 0.55 4.82 0.02 -1.26 -4.85 135.00 133.42 1ou9 s PRO 41 Ca 0.23 1.16 0.24 0.00 0.02 0.00 0.00 61.00 62.66 1ou9 s PRO 41 Cb 0.07 -4.23 1.45 0.00 0.02 0.00 0.00 34.50 31.81 1ou9 s PRO 41 CO 0.02 -2.05 2.07 -0.39 -0.33 0.00 0.00 177.00 176.32 1ou9 h VAL 42 N 6.79 0.71 0.00 3.83 -1.51 -1.98 -0.97 116.25 123.11 1ou9 h VAL 42 Ca -0.31 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.16 1ou9 h VAL 42 Cb 1.16 0.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 1ou9 h VAL 42 CO 1.09 0.00 0.00 -1.84 -1.23 0.00 0.00 177.57 175.59 1ou9 n GLU 43 N -4.23 0.03 -0.16 5.19 0.00 -1.26 -1.40 120.64 118.82 1ou9 n GLU 43 Ca 0.04 0.40 0.08 0.00 0.00 0.00 0.00 57.16 57.68 1ou9 n GLU 43 Cb 0.39 -1.58 0.16 0.00 0.00 0.00 0.00 31.44 30.41 1ou9 n GLU 43 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1ou9 n TYR 44 N -1.64 0.42 -2.97 -1.84 4.02 -0.37 -4.96 117.16 109.82 1ou9 n TYR 44 Ca 0.02 -0.33 -0.40 0.00 -0.01 0.00 0.00 57.90 57.18 1ou9 n TYR 44 Cb 0.10 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.36 1ou9 n TYR 44 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1ou9 s VAL 45 N -1.10 4.72 -0.07 -0.72 1.01 -0.49 -4.75 120.40 119.00 1ou9 s VAL 45 Ca 0.27 1.66 0.01 0.00 0.00 0.00 0.00 61.98 63.92 1ou9 s VAL 45 Cb 0.15 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.43 1ou9 s VAL 45 CO 0.21 0.36 -0.07 -0.75 0.00 0.00 0.00 175.10 174.85 1ou9 s LYS 46 N -0.04 1.27 -1.46 2.72 2.20 0.51 -4.77 119.74 120.18 1ou9 s LYS 46 Ca 0.39 -0.22 -0.10 0.00 -0.36 0.00 0.00 55.97 55.68 1ou9 s LYS 46 Cb -0.21 -1.24 0.06 0.00 -1.51 0.00 0.00 37.83 34.93 1ou9 s LYS 46 CO 0.23 -0.12 0.77 -0.25 -0.36 0.00 0.00 175.35 175.62 1ou9 n ASP 47 N 4.34 -4.91 0.00 1.43 10.43 -1.26 -1.29 116.55 125.29 1ou9 n ASP 47 Ca -0.19 -0.53 0.00 0.00 2.57 0.00 0.00 54.79 56.64 1ou9 n ASP 47 Cb 0.51 -3.96 0.00 0.00 1.84 0.00 0.00 41.12 39.50 1ou9 n ASP 47 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1ou9 n GLY 48 N -1.52 0.56 3.31 0.44 0.00 -1.26 -5.00 105.19 101.72 1ou9 n GLY 48 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1ou9 n GLY 48 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ou9 s GLN 49 N -0.36 1.24 -0.00 1.61 -0.21 -0.41 -0.75 119.66 120.78 1ou9 s GLN 49 Ca 0.00 -1.49 0.00 0.00 0.02 0.00 0.00 55.36 53.89 1ou9 s GLN 49 Cb 0.00 -1.05 0.00 0.00 1.00 0.00 0.00 33.01 32.96 1ou9 s GLN 49 CO 0.00 0.18 -0.00 -1.50 -2.12 0.00 0.00 175.29 171.85 1ou9 s ILE 50 N -2.75 0.04 -0.18 1.08 2.07 -0.63 -0.37 121.20 120.46 1ou9 s ILE 50 Ca 0.19 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.37 1ou9 s ILE 50 Cb -0.02 -0.06 -0.03 0.00 0.13 0.00 0.00 42.46 42.48 1ou9 s ILE 50 CO 0.05 0.02 0.01 -0.69 -1.91 0.00 0.00 174.94 172.43 1ou9 s VAL 51 N 0.12 4.21 0.01 4.00 1.01 -1.26 -0.66 120.40 127.84 1ou9 s VAL 51 Ca -0.01 -0.24 0.08 0.00 0.00 0.00 0.00 61.98 61.82 1ou9 s VAL 51 Cb -0.02 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1ou9 s VAL 51 CO -0.00 0.46 -0.25 -0.76 0.00 0.00 0.00 175.10 174.55 1ou9 s LEU 52 N 0.56 2.21 -0.35 3.92 1.43 0.02 -4.93 118.68 121.54 1ou9 s LEU 52 Ca -0.00 -0.50 -0.20 0.00 -1.03 0.00 0.00 54.13 52.39 1ou9 s LEU 52 Cb -0.14 -1.35 0.00 0.00 0.03 0.00 0.00 46.19 44.73 1ou9 s LEU 52 CO 0.02 0.29 0.64 0.21 0.23 0.00 0.00 176.35 177.74 1ou9 s ASN 53 N -0.99 6.44 -0.17 2.29 3.84 -1.26 -0.22 114.94 124.87 1ou9 s ASN 53 Ca 0.11 0.21 0.16 0.00 0.21 0.00 0.00 52.86 53.56 1ou9 s ASN 53 Cb -0.10 -2.33 0.76 0.00 -0.55 0.00 0.00 41.25 39.03 1ou9 s ASN 53 CO 0.01 -0.58 1.68 0.18 -2.79 0.00 0.00 177.10 175.60 1ou9 n LEU 54 N 6.02 5.17 -4.68 3.21 4.77 0.41 -4.59 117.00 127.32 1ou9 n LEU 54 Ca -0.01 -2.68 -0.31 0.00 -0.03 0.00 0.00 56.01 52.98 1ou9 n LEU 54 Cb 0.49 -0.62 0.16 0.00 -2.33 0.00 0.00 43.42 41.11 1ou9 n LEU 54 CO 0.48 0.73 0.67 -0.94 -1.33 0.00 0.00 177.39 177.01 1ou9 s SER 55 N -0.90 3.01 0.36 -1.43 1.04 -1.26 -4.81 113.70 109.71 1ou9 s SER 55 Ca 0.52 2.11 0.08 0.00 0.48 0.00 0.00 55.95 59.14 1ou9 s SER 55 Cb 0.37 -2.54 0.69 0.00 0.10 0.00 0.00 66.02 64.63 1ou9 s SER 55 CO 0.20 -3.04 1.86 0.00 0.98 0.00 0.00 173.24 173.25 1ou9 h ALA 56 N -1.82 1.40 0.00 5.32 0.00 -1.94 -2.49 119.26 119.73 1ou9 h ALA 56 Ca -0.44 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 1ou9 h ALA 56 Cb 1.27 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1ou9 h ALA 56 CO 0.43 0.41 -0.19 0.66 0.00 0.00 0.00 179.25 180.57 1ou9 h SER 57 N 0.26 0.00 0.13 0.00 4.64 -1.98 -3.27 113.55 113.32 1ou9 h SER 57 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1ou9 h SER 57 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1ou9 h SER 57 CO 0.03 0.19 -0.45 0.00 -0.87 0.00 0.00 176.83 175.72 1ou9 n ALA 58 N -2.15 3.51 -2.35 5.18 0.00 -1.01 -4.95 120.51 118.74 1ou9 n ALA 58 Ca 0.03 -0.52 -0.18 0.00 0.00 0.00 0.00 53.44 52.77 1ou9 n ALA 58 Cb 0.58 -0.95 -0.10 0.00 0.00 0.00 0.00 19.45 18.98 1ou9 n ALA 58 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ou9 s THR 59 N -2.59 1.63 -0.02 0.00 -4.23 -0.97 -4.44 115.64 105.02 1ou9 s THR 59 Ca 0.19 -2.13 0.05 0.00 -1.18 0.00 0.00 61.69 58.62 1ou9 s THR 59 Cb 0.18 -1.96 -0.01 0.00 1.34 0.00 0.00 72.50 72.05 1ou9 s THR 59 CO 0.60 -0.58 -0.17 -0.83 -0.54 0.00 0.00 174.62 173.10 1ou9 s GLY 60 N -3.18 0.83 -1.36 3.99 0.00 0.45 -4.82 107.32 103.22 1ou9 s GLY 60 Ca 0.20 -0.71 -0.01 0.00 0.00 0.00 0.00 44.72 44.20 1ou9 s GLY 60 CO 0.06 -0.55 0.59 0.70 0.00 0.00 0.00 173.10 173.90 1ou9 n ASN 61 N 2.76 -0.95 -4.69 1.64 3.02 -1.26 -0.70 115.26 115.08 1ou9 n ASN 61 Ca -0.15 -0.90 -0.42 0.00 -0.03 0.00 0.00 54.58 53.07 1ou9 n ASN 61 Cb 0.54 -3.60 -0.03 0.00 -0.61 0.00 0.00 39.78 36.09 1ou9 n ASN 61 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1ou9 s LEU 62 N -6.83 4.33 -0.12 3.41 2.96 -1.26 -4.30 118.68 116.86 1ou9 s LEU 62 Ca 0.04 2.24 0.02 0.00 -0.22 0.00 0.00 54.13 56.21 1ou9 s LEU 62 Cb -0.02 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.12 1ou9 s LEU 62 CO 0.85 -0.79 -0.18 -1.10 -1.32 0.00 0.00 176.35 173.80 1ou9 s GLN 63 N 2.58 2.60 -0.64 1.98 -0.21 0.35 -5.00 119.66 121.32 1ou9 s GLN 63 Ca 0.68 -0.70 0.03 0.00 0.02 0.00 0.00 55.36 55.39 1ou9 s GLN 63 Cb -0.34 -2.15 0.16 0.00 1.00 0.00 0.00 33.01 31.67 1ou9 s GLN 63 CO 0.28 -0.04 0.41 -0.51 -2.12 0.00 0.00 175.29 173.32 1ou9 s LEU 64 N 0.91 4.70 0.00 2.90 1.43 -1.26 -1.54 118.68 125.82 1ou9 s LEU 64 Ca -0.07 -3.43 0.01 0.00 -1.03 0.00 0.00 54.13 49.62 1ou9 s LEU 64 Cb -0.15 -1.68 0.14 0.00 0.03 0.00 0.00 46.19 44.53 1ou9 s LEU 64 CO -0.02 -0.17 1.00 0.35 0.23 0.00 0.00 176.35 177.74 1ou9 n THR 65 N 2.58 0.00 0.22 5.49 -2.24 -0.21 -4.99 114.28 115.13 1ou9 n THR 65 Ca 0.13 -1.66 0.10 0.00 -2.27 0.00 0.00 64.05 60.35 1ou9 n THR 65 Cb 0.34 -0.83 0.45 0.00 -2.10 0.00 0.00 70.33 68.19 1ou9 n THR 65 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1ou9 h ASN 66 N -0.51 0.00 0.00 3.42 2.35 -1.98 -3.30 115.58 115.55 1ou9 h ASN 66 Ca -0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 1ou9 h ASN 66 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 1ou9 h ASN 66 CO 0.37 0.22 -1.68 0.47 -1.65 0.00 0.00 177.43 175.16 1ou9 n ASP 67 N -3.36 1.42 -3.76 5.81 8.00 -1.26 -4.72 116.55 118.69 1ou9 n ASP 67 Ca 0.00 -0.03 -0.07 0.00 0.71 0.00 0.00 54.79 55.41 1ou9 n ASP 67 Cb 0.44 1.69 -0.02 0.00 -0.02 0.00 0.00 41.12 43.20 1ou9 n ASP 67 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1ou9 s PHE 68 N -3.06 -0.22 -0.09 1.24 -0.12 -1.25 -4.58 117.98 109.91 1ou9 s PHE 68 Ca -0.05 -0.14 0.03 0.00 -0.05 0.00 0.00 56.93 56.71 1ou9 s PHE 68 Cb 0.10 0.66 -0.02 0.00 -0.63 0.00 0.00 43.02 43.14 1ou9 s PHE 68 CO 0.65 -1.03 -0.18 0.42 -0.05 0.00 0.00 175.22 175.02 1ou9 s ILE 69 N -3.67 2.67 -0.07 -4.49 1.01 0.15 -1.04 121.20 115.77 1ou9 s ILE 69 Ca 0.10 -0.83 -0.08 0.00 0.00 0.00 0.00 60.65 59.84 1ou9 s ILE 69 Cb -0.04 -2.06 0.02 0.00 0.01 0.00 0.00 42.46 40.40 1ou9 s ILE 69 CO 0.02 0.56 0.22 -1.58 0.00 0.00 0.00 174.94 174.16 1ou9 s GLN 70 N -0.08 0.31 -0.00 2.79 0.74 -0.59 -0.33 119.66 122.50 1ou9 s GLN 70 Ca -0.04 0.20 -0.30 0.00 0.05 0.00 0.00 55.36 55.28 1ou9 s GLN 70 Cb -0.14 0.14 0.11 0.00 1.10 0.00 0.00 33.01 34.22 1ou9 s GLN 70 CO 0.04 -0.05 1.20 -0.59 -0.55 0.00 0.00 175.29 175.35 1ou9 s PHE 71 N -0.13 -0.08 0.02 1.67 -0.12 -1.04 -0.50 117.98 117.81 1ou9 s PHE 71 Ca -0.02 -0.06 0.00 0.00 -0.05 0.00 0.00 56.93 56.80 1ou9 s PHE 71 Cb -0.02 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.89 1ou9 s PHE 71 CO 0.01 -0.38 0.11 -0.80 -0.05 0.00 0.00 175.22 174.10 1ou9 s ASN 72 N -2.87 5.80 0.15 1.98 -0.87 0.12 -0.27 114.94 118.99 1ou9 s ASN 72 Ca 0.13 0.15 -0.17 0.00 -1.57 0.00 0.00 52.86 51.39 1ou9 s ASN 72 Cb 0.03 -1.68 0.04 0.00 -0.02 0.00 0.00 41.25 39.62 1ou9 s ASN 72 CO -0.03 0.23 0.46 0.00 -2.57 0.00 0.00 177.10 175.19 1ou9 s ALA 73 N -1.30 -1.02 -0.15 0.60 0.00 -0.36 -0.41 121.76 119.12 1ou9 s ALA 73 Ca 0.26 -0.02 -0.06 0.00 0.00 0.00 0.00 51.96 52.15 1ou9 s ALA 73 Cb -0.12 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 1ou9 s ALA 73 CO 0.18 -0.70 0.04 1.03 0.00 0.00 0.00 175.76 176.31 1ou9 s ARG 74 N -3.81 3.70 -0.16 0.00 0.52 -1.26 -0.84 118.95 117.09 1ou9 s ARG 74 Ca 0.04 -0.36 0.00 0.00 -0.52 0.00 0.00 55.73 54.89 1ou9 s ARG 74 Cb 0.01 -3.08 0.03 0.00 0.52 0.00 0.00 34.95 32.43 1ou9 s ARG 74 CO -0.10 0.40 -0.11 -0.06 0.02 0.00 0.00 175.30 175.44 1ou9 s PHE 75 N 0.00 2.11 -1.42 -0.53 0.40 -0.38 -4.65 117.98 113.52 1ou9 s PHE 75 Ca 0.05 -1.26 -0.06 0.00 -0.60 0.00 0.00 56.93 55.06 1ou9 s PHE 75 Cb -0.12 -1.53 0.03 0.00 0.51 0.00 0.00 43.02 41.90 1ou9 s PHE 75 CO 0.01 -0.67 0.50 1.63 0.70 0.00 0.00 175.22 177.40 1ou9 n LYS 76 N 4.78 -4.02 -0.30 0.44 4.76 -1.26 -1.07 118.16 121.48 1ou9 n LYS 76 Ca -0.15 0.72 0.00 0.00 -2.87 0.00 0.00 58.31 56.01 1ou9 n LYS 76 Cb 0.49 -5.50 0.00 0.00 -1.84 0.00 0.00 35.03 28.18 1ou9 n LYS 76 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ou9 n GLY 77 N -1.32 1.82 3.67 0.72 0.00 -1.26 -5.03 105.19 103.80 1ou9 n GLY 77 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1ou9 n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ou9 s VAL 78 N -3.09 5.34 0.02 1.61 1.01 -0.24 -4.99 120.40 120.07 1ou9 s VAL 78 Ca 0.00 0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.94 1ou9 s VAL 78 Cb 0.00 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 1ou9 s VAL 78 CO 0.00 0.34 1.01 -0.55 0.00 0.00 0.00 175.10 175.90 1ou9 s SER 79 N 0.96 7.34 0.00 3.32 0.15 -1.26 -1.25 113.70 122.97 1ou9 s SER 79 Ca 0.09 1.73 -0.06 0.00 0.70 0.00 0.00 55.95 58.41 1ou9 s SER 79 Cb -0.13 -2.57 -0.00 0.00 -1.71 0.00 0.00 66.02 61.60 1ou9 s SER 79 CO 0.04 -0.27 0.12 -0.13 1.20 0.00 0.00 173.24 174.20 1ou9 s ARG 80 N 0.88 0.45 -0.12 5.44 0.52 -0.02 -4.94 118.95 121.16 1ou9 s ARG 80 Ca 0.52 -0.41 -0.16 0.00 -0.52 0.00 0.00 55.73 55.17 1ou9 s ARG 80 Cb -0.22 0.18 -0.05 0.00 0.52 0.00 0.00 34.95 35.38 1ou9 s ARG 80 CO 0.28 -0.10 0.39 -2.00 0.02 0.00 0.00 175.30 173.89 1ou9 s GLU 81 N -1.35 4.23 0.02 3.54 2.12 -1.26 -1.22 118.70 124.78 1ou9 s GLU 81 Ca -0.14 0.29 0.03 0.00 0.36 0.00 0.00 54.97 55.50 1ou9 s GLU 81 Cb -0.08 -3.40 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 1ou9 s GLU 81 CO 0.01 0.27 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.48 1ou9 s LEU 82 N 0.30 3.39 -0.08 2.70 1.43 0.63 -4.87 118.68 122.19 1ou9 s LEU 82 Ca 0.22 -0.08 -0.00 0.00 -1.03 0.00 0.00 54.13 53.23 1ou9 s LEU 82 Cb -0.14 -1.98 0.02 0.00 0.03 0.00 0.00 46.19 44.12 1ou9 s LEU 82 CO 0.08 0.26 -0.05 -0.47 0.23 0.00 0.00 176.35 176.41 1ou9 s TYR 83 N -1.09 1.06 -0.23 0.29 5.04 -0.65 -2.50 117.35 119.27 1ou9 s TYR 83 Ca 0.20 -0.42 -0.00 0.00 -2.44 0.00 0.00 57.07 54.40 1ou9 s TYR 83 Cb -0.11 -0.96 0.06 0.00 0.35 0.00 0.00 41.96 41.30 1ou9 s TYR 83 CO 0.11 -0.37 -0.01 0.42 -1.34 0.00 0.00 175.55 174.36 1ou9 s ILE 84 N 1.55 1.19 0.00 3.14 1.01 0.56 -0.72 121.20 127.92 1ou9 s ILE 84 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 60.65 59.59 1ou9 s ILE 84 Cb -0.13 -1.57 0.00 0.00 0.01 0.00 0.00 42.46 40.77 1ou9 s ILE 84 CO -0.04 -0.19 0.00 -2.65 0.00 0.00 0.00 174.94 172.06 1ou9 n PRO 85 N 4.79 1.84 0.00 2.79 -0.02 -1.26 -0.67 135.00 142.47 1ou9 n PRO 85 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 1ou9 n PRO 85 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.93 1ou9 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ou9 n GLY 87 N 0.00 0.00 0.02 -1.23 0.00 -1.26 -3.70 105.19 99.01 1ou9 n GLY 87 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1ou9 n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ou9 n ALA 88 N 0.00 3.09 -2.52 4.61 0.00 -1.26 -4.81 120.51 119.63 1ou9 n ALA 88 Ca 0.00 -0.26 -0.43 0.00 0.00 0.00 0.00 53.44 52.75 1ou9 n ALA 88 Cb 0.00 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 1ou9 n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ou9 s ALA 89 N -3.03 3.35 -0.15 0.00 0.00 -1.24 -0.58 121.76 120.10 1ou9 s ALA 89 Ca 0.11 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.04 1ou9 s ALA 89 Cb 0.17 -3.78 -0.23 0.00 0.00 0.00 0.00 23.12 19.28 1ou9 s ALA 89 CO 0.66 -1.81 0.23 1.28 0.00 0.00 0.00 175.76 176.12 1ou9 n LEU 90 N 7.51 1.94 -3.61 0.00 4.77 0.11 -4.84 117.00 122.89 1ou9 n LEU 90 Ca 0.14 0.13 -0.06 0.00 -0.03 0.00 0.00 56.01 56.19 1ou9 n LEU 90 Cb 0.47 -0.54 -0.02 0.00 -2.33 0.00 0.00 43.42 41.01 1ou9 n LEU 90 CO 0.64 0.72 0.70 0.00 -1.33 0.00 0.00 177.39 178.12 1ou9 s ALA 91 N -2.55 -1.75 -0.07 -1.18 0.00 -1.20 -1.42 121.76 113.59 1ou9 s ALA 91 Ca -0.20 0.62 -0.04 0.00 0.00 0.00 0.00 51.96 52.34 1ou9 s ALA 91 Cb 0.07 0.52 0.03 0.00 0.00 0.00 0.00 23.12 23.75 1ou9 s ALA 91 CO 0.75 -0.85 0.16 -1.50 0.00 0.00 0.00 175.76 174.32 1ou9 s ILE 92 N -3.19 -0.03 0.22 0.00 2.07 -0.77 -0.83 121.20 118.67 1ou9 s ILE 92 Ca 0.08 0.12 -0.14 0.00 -1.41 0.00 0.00 60.65 59.30 1ou9 s ILE 92 Cb -0.01 -0.25 0.00 0.00 0.13 0.00 0.00 42.46 42.33 1ou9 s ILE 92 CO -0.04 0.05 0.47 -0.72 -1.91 0.00 0.00 174.94 172.78 1ou9 s TYR 93 N 0.83 0.24 -0.10 3.50 -0.85 -0.37 -1.25 117.35 119.36 1ou9 s TYR 93 Ca -0.06 -0.61 -0.27 0.00 -0.52 0.00 0.00 57.07 55.62 1ou9 s TYR 93 Cb -0.08 0.21 -0.02 0.00 0.38 0.00 0.00 41.96 42.45 1ou9 s TYR 93 CO -0.04 -0.94 0.86 0.00 -1.52 0.00 0.00 175.55 173.90 1ou9 s ALA 94 N -3.98 3.38 0.29 9.51 0.00 0.33 -0.50 121.76 130.80 1ou9 s ALA 94 Ca 0.18 0.22 -0.01 0.00 0.00 0.00 0.00 51.96 52.35 1ou9 s ALA 94 Cb -0.00 -3.22 0.46 0.00 0.00 0.00 0.00 23.12 20.36 1ou9 s ALA 94 CO 0.05 -0.43 1.93 -0.09 0.00 0.00 0.00 175.76 177.22 1ou9 h ARG 95 N 7.05 1.07 -0.65 0.00 2.43 -1.62 0.51 114.38 123.16 1ou9 h ARG 95 Ca -0.35 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 1ou9 h ARG 95 Cb 1.17 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 1ou9 h ARG 95 CO 0.80 0.71 0.42 0.93 -1.51 0.00 0.00 179.97 181.33 1ou9 h GLU 96 N 1.11 0.87 0.00 0.20 3.07 -1.92 -3.37 114.58 114.54 1ou9 h GLU 96 Ca 0.37 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 1ou9 h GLU 96 Cb 0.06 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.78 1ou9 h GLU 96 CO -0.12 0.59 0.00 0.27 -1.40 0.00 0.00 179.01 178.35 1ou9 n ASN 97 N -4.61 0.23 0.00 1.42 2.04 -1.14 -5.02 115.26 108.17 1ou9 n ASN 97 Ca 0.05 -1.11 0.00 0.00 -0.44 0.00 0.00 54.58 53.08 1ou9 n ASN 97 Cb 0.03 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.28 1ou9 n ASN 97 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1ou9 n GLY 98 N -0.06 0.35 3.74 4.83 0.00 0.18 -4.96 105.19 109.27 1ou9 n GLY 98 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1ou9 n GLY 98 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ou9 s ASP 99 N -2.21 7.08 0.00 1.61 3.68 -1.26 -4.55 116.67 121.02 1ou9 s ASP 99 Ca 0.00 2.27 0.00 0.00 2.13 0.00 0.00 52.55 56.95 1ou9 s ASP 99 Cb 0.00 -2.61 0.00 0.00 -1.45 0.00 0.00 42.92 38.86 1ou9 s ASP 99 CO 0.00 -0.37 0.00 0.61 0.13 0.00 0.00 175.17 175.54 1ou9 n GLY 100 N 2.06 -0.81 0.00 2.66 0.00 -1.26 -0.51 105.19 107.33 1ou9 n GLY 100 Ca 0.04 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1ou9 n GLY 100 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1ou9 n VAL 101 N 0.35 0.00 -4.67 1.61 3.14 -0.38 -5.00 118.33 113.39 1ou9 n VAL 101 Ca 0.00 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.15 1ou9 n VAL 101 Cb 0.00 0.00 -0.15 0.00 -1.06 0.00 0.00 33.84 32.63 1ou9 n VAL 101 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 1ou9 s PHE 103 N -0.26 1.31 0.52 1.45 0.40 -0.51 -1.86 117.98 119.04 1ou9 s PHE 103 Ca 0.00 -0.27 -0.18 0.00 -0.60 0.00 0.00 56.93 55.88 1ou9 s PHE 103 Cb 0.00 -0.86 -0.07 0.00 0.51 0.00 0.00 43.02 42.60 1ou9 s PHE 103 CO 0.00 -0.05 1.02 -1.21 0.70 0.00 0.00 175.22 175.68 1ou9 s GLU 104 N -0.25 3.74 0.53 0.44 0.41 -1.26 -4.96 118.70 117.35 1ou9 s GLU 104 Ca 0.04 1.18 -0.22 0.00 -0.41 0.00 0.00 54.97 55.56 1ou9 s GLU 104 Cb -0.07 -2.10 -0.05 0.00 -1.78 0.00 0.00 34.13 30.13 1ou9 s GLU 104 CO -0.00 -0.46 1.28 -2.14 -0.49 0.00 0.00 175.26 173.45 1ou9 s PRO 105 N -3.70 3.29 -0.16 0.39 0.02 -1.26 -5.01 135.00 128.57 1ou9 s PRO 105 Ca 0.63 2.04 -0.05 0.00 0.02 0.00 0.00 61.00 63.64 1ou9 s PRO 105 Cb -0.14 -2.25 0.06 0.00 0.02 0.00 0.00 34.50 32.19 1ou9 s PRO 105 CO 0.27 -1.01 0.10 -1.21 -0.33 0.00 0.00 177.00 174.82 1ou9 s GLU 106 N -2.91 0.06 0.52 5.54 2.02 -1.26 -5.04 118.70 117.63 1ou9 s GLU 106 Ca 0.70 -0.03 0.37 0.00 0.02 0.00 0.00 54.97 56.03 1ou9 s GLU 106 Cb -0.35 -1.70 1.53 0.00 0.10 0.00 0.00 34.13 33.71 1ou9 s GLU 106 CO 0.42 -0.65 1.72 0.93 0.02 0.00 0.00 175.26 177.70 1ou9 h GLU 107 N 8.41 0.05 -0.61 1.61 5.08 -2.02 0.19 114.58 127.29 1ou9 h GLU 107 Ca -0.15 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.30 1ou9 h GLU 107 Cb 1.15 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1ou9 h GLU 107 CO 0.28 0.04 0.41 0.82 -1.00 0.00 0.00 179.01 179.55 1ou9 h ILE 108 N 0.05 0.90 0.00 3.13 5.03 -2.00 -0.06 117.51 124.57 1ou9 h ILE 108 Ca 0.69 -0.15 0.00 0.00 -0.12 0.00 0.00 64.86 65.28 1ou9 h ILE 108 Cb 2.59 0.44 0.00 0.00 -3.03 0.00 0.00 36.82 36.82 1ou9 h ILE 108 CO -0.09 0.08 0.00 1.88 -0.68 0.00 0.00 178.15 179.34 1ou9 h TYR 109 N 0.42 0.00 0.12 1.37 0.99 -1.36 -0.66 116.97 117.85 1ou9 h TYR 109 Ca 0.28 0.00 -0.22 0.00 2.00 0.00 0.00 58.73 60.79 1ou9 h TYR 109 Cb 0.54 0.00 0.02 0.00 1.00 0.00 0.00 36.73 38.29 1ou9 h TYR 109 CO -0.00 0.00 -0.95 -0.44 -0.00 0.00 0.00 178.16 176.77 1ou9 h ASP 110 N 0.00 0.63 0.10 3.88 3.32 -1.15 -2.73 116.42 120.46 1ou9 h ASP 110 Ca 0.00 -0.87 -0.07 0.00 0.02 0.00 0.00 57.03 56.11 1ou9 h ASP 110 Cb 0.43 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1ou9 h ASP 110 CO 0.00 1.45 -0.22 -0.33 -1.72 0.00 0.00 179.24 178.41 1ou9 h GLU 111 N -0.09 0.23 -0.01 3.56 5.08 -1.29 -2.36 114.58 119.70 1ou9 h GLU 111 Ca -0.15 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1ou9 h GLU 111 Cb 1.70 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.92 1ou9 h GLU 111 CO 0.18 0.45 -0.10 1.28 -1.00 0.00 0.00 179.01 179.82 1ou9 n LEU 112 N -4.19 0.66 -4.01 1.33 4.77 -0.30 -4.58 117.00 110.68 1ou9 n LEU 112 Ca -0.01 -0.12 -0.40 0.00 -0.03 0.00 0.00 56.01 55.45 1ou9 n LEU 112 Cb 0.34 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 1ou9 n LEU 112 CO 0.39 0.12 2.18 -3.20 -1.33 0.00 0.00 177.39 175.55 1ou9 n ASN 113 N -0.73 3.55 -4.10 -1.43 2.85 -0.89 -4.85 115.26 109.67 1ou9 n ASN 113 Ca 0.16 -2.79 -0.21 0.00 -0.11 0.00 0.00 54.58 51.64 1ou9 n ASN 113 Cb 0.28 -1.53 -0.14 0.00 1.24 0.00 0.00 39.78 39.63 1ou9 n ASN 113 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1ou9 s ILE 114 N 5.24 1.01 -0.21 -1.44 1.01 -1.26 -4.82 121.20 120.73 1ou9 s ILE 114 Ca 0.55 -0.67 -0.29 0.00 0.00 0.00 0.00 60.65 60.24 1ou9 s ILE 114 Cb 0.10 -0.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.69 1ou9 s ILE 114 CO 0.04 0.19 1.36 -0.70 0.00 0.00 0.00 174.94 175.83 1ou9 s GLU 115 N -0.56 4.06 0.82 2.79 2.12 -1.26 -4.49 118.70 122.19 1ou9 s GLU 115 Ca 0.04 1.57 -0.12 0.00 0.36 0.00 0.00 54.97 56.81 1ou9 s GLU 115 Cb -0.06 -3.86 0.09 0.00 0.26 0.00 0.00 34.13 30.56 1ou9 s GLU 115 CO 0.00 -0.94 1.19 -2.14 -0.54 0.00 0.00 175.26 172.83 1ou9 s PRO 116 N 3.93 1.84 -0.13 4.30 0.02 -1.26 -5.00 135.00 138.71 1ou9 s PRO 116 Ca 0.59 0.09 -0.25 0.00 0.02 0.00 0.00 61.00 61.44 1ou9 s PRO 116 Cb -0.21 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.35 1ou9 s PRO 116 CO 0.21 -1.68 0.81 -0.51 -0.33 0.00 0.00 177.00 175.50 1ou9 s ASP 117 N -4.58 7.00 0.00 2.53 1.01 -1.26 -4.90 116.67 116.47 1ou9 s ASP 117 Ca 0.63 1.22 0.10 0.00 0.71 0.00 0.00 52.55 55.21 1ou9 s ASP 117 Cb -0.11 -2.45 -0.10 0.00 1.01 0.00 0.00 42.92 41.27 1ou9 s ASP 117 CO 0.49 -0.31 0.45 0.35 0.21 0.00 0.00 175.17 176.36 1ou9 n THR 118 N 4.40 0.00 -4.01 -1.27 -2.24 -1.26 -4.99 114.28 104.91 1ou9 n THR 118 Ca 0.03 -0.27 -0.31 0.00 -2.27 0.00 0.00 64.05 61.23 1ou9 n THR 118 Cb 0.50 1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 69.68 1ou9 n THR 118 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ou9 s GLU 119 N -1.91 3.08 0.70 -0.78 0.41 -1.26 -5.11 118.70 113.83 1ou9 s GLU 119 Ca 0.04 -0.58 -0.11 0.00 -0.41 0.00 0.00 54.97 53.91 1ou9 s GLU 119 Cb 0.08 -2.85 0.02 0.00 -1.78 0.00 0.00 34.13 29.60 1ou9 s GLU 119 CO 0.40 0.59 1.07 -0.65 -0.49 0.00 0.00 175.26 176.18 1ou9 s GLN 120 N -2.33 2.81 0.00 1.61 -1.52 -1.26 -5.26 119.66 113.71 1ou9 s GLN 120 Ca 0.30 1.04 0.04 0.00 -1.95 0.00 0.00 55.36 54.79 1ou9 s GLN 120 Cb -0.12 -1.97 0.24 0.00 -0.22 0.00 0.00 33.01 30.94 1ou9 s GLN 120 CO 0.23 -1.21 0.72 -2.30 -0.25 0.00 0.00 175.29 172.48