#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nn6 s SER 27 N 0.96 3.39 0.46 0.00 0.15 -1.26 -4.83 113.70 112.56 2nn6 s SER 27 Ca 0.37 -0.60 -0.16 0.00 0.70 0.00 0.00 55.95 56.27 2nn6 s SER 27 Cb 0.02 -0.35 -0.08 0.00 -1.71 0.00 0.00 66.02 63.89 2nn6 s SER 27 CO 0.01 0.23 0.91 -1.48 1.20 0.00 0.00 173.24 174.11 2nn6 s LEU 28 N -1.55 3.77 0.00 3.45 2.34 -1.25 -4.08 118.68 121.35 2nn6 s LEU 28 Ca 0.13 1.47 -0.18 0.00 0.06 0.00 0.00 54.13 55.62 2nn6 s LEU 28 Cb -0.10 -4.37 0.26 0.00 -0.56 0.00 0.00 46.19 41.42 2nn6 s LEU 28 CO 0.04 -0.47 0.98 -2.11 -1.06 0.00 0.00 176.35 173.73 2nn6 n ARG 29 N -1.22 -2.70 -1.43 1.48 1.85 -1.25 -4.94 116.66 108.45 2nn6 n ARG 29 Ca 0.05 -1.56 -0.49 0.00 -1.00 0.00 0.00 57.85 54.86 2nn6 n ARG 29 Cb 0.54 -1.41 -0.03 0.00 -1.05 0.00 0.00 32.46 30.51 2nn6 n ARG 29 CO 0.00 0.00 0.00 1.58 -0.01 0.00 0.00 177.63 179.20 2nn6 n HIS 30 N -4.47 -0.18 -4.82 2.89 -0.00 -1.26 -4.72 115.22 102.66 2nn6 n HIS 30 Ca 0.13 0.95 -0.29 0.00 -0.00 0.00 0.00 57.72 58.51 2nn6 n HIS 30 Cb 0.51 -2.01 -0.17 0.00 -0.00 0.00 0.00 29.99 28.33 2nn6 n HIS 30 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 2nn6 s PHE 31 N -0.87 2.14 -0.02 1.57 2.99 -1.26 0.05 117.98 122.57 2nn6 s PHE 31 Ca 0.67 -0.91 -0.30 0.00 0.00 0.00 0.00 56.93 56.39 2nn6 s PHE 31 Cb -0.95 -1.48 0.07 0.00 0.00 0.00 0.00 43.02 40.66 2nn6 s PHE 31 CO 0.56 -0.41 0.66 0.00 -0.00 0.00 0.00 175.22 176.03 2nn6 s ALA 32 N 0.62 -1.73 -0.06 5.36 0.00 0.18 -4.98 121.76 121.16 2nn6 s ALA 32 Ca -0.14 1.20 -0.24 0.00 0.00 0.00 0.00 51.96 52.78 2nn6 s ALA 32 Cb -0.16 0.10 0.05 0.00 0.00 0.00 0.00 23.12 23.11 2nn6 s ALA 32 CO 0.04 -0.41 0.54 0.00 0.00 0.00 0.00 175.76 175.93 2nn6 s GLU 34 N -1.06 2.56 0.12 0.00 2.02 0.72 -4.97 118.70 118.10 2nn6 s GLU 34 Ca -0.11 -0.87 0.10 0.00 0.02 0.00 0.00 54.97 54.11 2nn6 s GLU 34 Cb -0.02 -2.12 -0.04 0.00 0.10 0.00 0.00 34.13 32.05 2nn6 s GLU 34 CO 0.07 0.33 -0.21 -1.14 0.02 0.00 0.00 175.26 174.33 2nn6 s GLN 35 N -0.04 1.66 -0.41 1.61 0.74 -1.26 0.15 119.66 122.11 2nn6 s GLN 35 Ca -0.07 -1.24 -0.21 0.00 0.05 0.00 0.00 55.36 53.89 2nn6 s GLN 35 Cb -0.14 -2.04 0.03 0.00 1.10 0.00 0.00 33.01 31.96 2nn6 s GLN 35 CO 0.05 0.47 0.55 -1.71 -0.55 0.00 0.00 175.29 174.09 2nn6 n ASN 36 N 0.80 -7.16 0.00 6.67 5.15 -0.56 -4.95 115.26 115.20 2nn6 n ASN 36 Ca -0.16 0.39 0.00 0.00 -0.60 0.00 0.00 54.58 54.21 2nn6 n ASN 36 Cb 0.53 -4.09 0.00 0.00 -0.53 0.00 0.00 39.78 35.69 2nn6 n ASN 36 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2nn6 n LEU 37 N -0.11 0.00 -4.54 1.20 4.32 -1.26 -4.97 117.00 111.63 2nn6 n LEU 37 Ca 0.04 0.00 -0.46 0.00 -0.02 0.00 0.00 56.01 55.58 2nn6 n LEU 37 Cb 0.49 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.25 2nn6 n LEU 37 CO 0.48 0.00 1.84 0.18 -1.22 0.00 0.00 177.39 178.68 2nn6 n LEU 38 N -1.13 2.83 0.28 2.23 4.32 -1.26 -4.85 117.00 119.41 2nn6 n LEU 38 Ca 0.00 0.25 0.14 0.00 -0.02 0.00 0.00 56.01 56.38 2nn6 n LEU 38 Cb 0.00 -1.45 0.82 0.00 -1.62 0.00 0.00 43.42 41.17 2nn6 n LEU 38 CO 0.00 -0.73 1.06 0.77 -1.22 0.00 0.00 177.39 177.27 2nn6 h SER 39 N 14.26 0.00 0.47 -1.43 4.64 -2.01 -3.30 113.55 126.18 2nn6 h SER 39 Ca -0.36 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.95 2nn6 h SER 39 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 2nn6 h SER 39 CO 0.99 0.05 -0.37 -0.09 -0.87 0.00 0.00 176.83 176.55 2nn6 h ARG 40 N 0.00 -0.78 -7.16 4.77 9.65 -2.01 -3.46 114.38 115.40 2nn6 h ARG 40 Ca -0.00 0.05 -0.48 0.00 -1.10 0.00 0.00 59.98 58.45 2nn6 h ARG 40 Cb 0.15 0.18 0.06 0.00 -1.39 0.00 0.00 29.97 28.96 2nn6 h ARG 40 CO 0.01 -0.52 0.21 -2.14 2.80 0.00 0.00 179.97 180.33 2nn6 s PRO 41 N -5.09 2.98 0.43 0.20 0.02 -1.25 -5.00 135.00 127.30 2nn6 s PRO 41 Ca -0.13 0.09 0.30 0.00 0.02 0.00 0.00 61.00 61.27 2nn6 s PRO 41 Cb 0.03 -2.24 1.18 0.00 0.02 0.00 0.00 34.50 33.48 2nn6 s PRO 41 CO 0.43 -0.70 1.87 -0.44 -0.33 0.00 0.00 177.00 177.83 2nn6 h ASP 42 N -0.21 0.00 -3.30 2.53 3.32 -1.70 -3.42 116.42 113.64 2nn6 h ASP 42 Ca -0.45 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.23 2nn6 h ASP 42 Cb 1.25 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.41 2nn6 h ASP 42 CO 0.61 0.00 -0.74 -0.83 -1.72 0.00 0.00 179.24 176.57 2nn6 s GLY 43 N -3.94 0.20 -0.04 2.75 0.00 0.73 -3.93 107.32 103.09 2nn6 s GLY 43 Ca 0.03 0.21 0.05 0.00 0.00 0.00 0.00 44.72 45.00 2nn6 s GLY 43 CO 0.50 1.39 -0.18 -0.56 0.00 0.00 0.00 173.10 174.25 2nn6 s SER 44 N 2.16 2.25 -0.28 1.64 0.01 -1.26 0.16 113.70 118.38 2nn6 s SER 44 Ca 0.05 -0.36 -0.12 0.00 1.31 0.00 0.00 55.95 56.82 2nn6 s SER 44 Cb -0.12 -0.54 0.10 0.00 0.21 0.00 0.00 66.02 65.68 2nn6 s SER 44 CO -0.03 0.18 0.63 0.00 0.41 0.00 0.00 173.24 174.43 2nn6 s ALA 45 N -0.09 -1.86 -0.19 1.44 0.00 -0.33 -1.50 121.76 119.23 2nn6 s ALA 45 Ca -0.01 2.27 0.01 0.00 0.00 0.00 0.00 51.96 54.22 2nn6 s ALA 45 Cb -0.11 -1.57 0.02 0.00 0.00 0.00 0.00 23.12 21.47 2nn6 s ALA 45 CO 0.02 -0.68 -0.18 0.45 0.00 0.00 0.00 175.76 175.36 2nn6 s SER 46 N 2.34 3.34 -0.03 0.00 0.15 0.40 0.21 113.70 120.11 2nn6 s SER 46 Ca -0.07 -0.73 0.03 0.00 0.70 0.00 0.00 55.95 55.88 2nn6 s SER 46 Cb -0.09 -1.50 -0.03 0.00 -1.71 0.00 0.00 66.02 62.69 2nn6 s SER 46 CO -0.19 -0.02 -0.09 0.12 1.20 0.00 0.00 173.24 174.26 2nn6 s PHE 47 N 1.28 2.85 -0.15 3.44 5.36 0.54 0.26 117.98 131.56 2nn6 s PHE 47 Ca 0.03 -0.06 -0.01 0.00 -0.96 0.00 0.00 56.93 55.94 2nn6 s PHE 47 Cb -0.14 -1.63 0.04 0.00 -0.34 0.00 0.00 43.02 40.94 2nn6 s PHE 47 CO -0.12 0.32 -0.05 -0.51 -1.46 0.00 0.00 175.22 173.40 2nn6 s LEU 48 N -1.10 1.40 -0.69 6.12 1.02 1.16 0.25 118.68 126.84 2nn6 s LEU 48 Ca 0.14 -0.54 -0.07 0.00 0.02 0.00 0.00 54.13 53.68 2nn6 s LEU 48 Cb -0.11 -0.84 0.18 0.00 0.02 0.00 0.00 46.19 45.44 2nn6 s LEU 48 CO 0.04 -0.18 0.56 -1.10 0.02 0.00 0.00 176.35 175.69 2nn6 s GLN 49 N 1.69 2.95 6.31 1.70 -0.21 1.20 0.51 119.66 133.81 2nn6 s GLN 49 Ca 0.02 -2.48 0.00 0.00 0.02 0.00 0.00 55.36 52.92 2nn6 s GLN 49 Cb -0.14 -4.00 0.00 0.00 1.00 0.00 0.00 33.01 29.87 2nn6 s GLN 49 CO -0.08 -1.22 0.00 0.41 -2.12 0.00 0.00 175.29 172.29 2nn6 n GLY 50 N 3.72 2.91 0.58 3.09 0.00 0.11 -0.97 105.19 114.63 2nn6 n GLY 50 Ca 0.09 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2nn6 n GLY 50 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nn6 n ASP 51 N 2.22 1.00 -4.05 1.61 8.00 -1.26 -4.62 116.55 119.45 2nn6 n ASP 51 Ca 0.00 -1.53 -0.21 0.00 0.71 0.00 0.00 54.79 53.76 2nn6 n ASP 51 Cb 0.00 -0.38 -0.15 0.00 -0.02 0.00 0.00 41.12 40.57 2nn6 n ASP 51 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2nn6 s THR 52 N -0.81 0.93 0.17 -3.53 2.01 -0.14 -4.58 115.64 109.69 2nn6 s THR 52 Ca 0.00 -0.48 -0.19 0.00 0.31 0.00 0.00 61.69 61.33 2nn6 s THR 52 Cb 0.00 -0.79 0.04 0.00 0.01 0.00 0.00 72.50 71.76 2nn6 s THR 52 CO 0.00 0.27 0.53 -0.94 -0.69 0.00 0.00 174.62 173.79 2nn6 s SER 53 N -0.10 -0.36 0.02 3.53 1.04 0.21 0.38 113.70 118.42 2nn6 s SER 53 Ca 0.01 -0.28 -0.15 0.00 0.48 0.00 0.00 55.95 56.01 2nn6 s SER 53 Cb -0.06 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.65 2nn6 s SER 53 CO 0.00 -0.99 0.32 -0.69 0.98 0.00 0.00 173.24 172.86 2nn6 s VAL 54 N -3.82 0.07 -0.07 5.02 1.01 0.14 0.19 120.40 122.95 2nn6 s VAL 54 Ca 0.05 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.50 2nn6 s VAL 54 Cb -0.01 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.53 2nn6 s VAL 54 CO -0.08 -0.32 -0.24 -0.22 0.00 0.00 0.00 175.10 174.24 2nn6 s LEU 55 N -1.81 2.05 -0.03 3.92 2.96 -1.18 0.20 118.68 124.79 2nn6 s LEU 55 Ca -0.08 -0.50 0.07 0.00 -0.22 0.00 0.00 54.13 53.40 2nn6 s LEU 55 Cb -0.02 -1.32 -0.02 0.00 0.50 0.00 0.00 46.19 45.33 2nn6 s LEU 55 CO -0.01 0.21 -0.24 0.00 -1.32 0.00 0.00 176.35 174.99 2nn6 s ALA 56 N 0.00 2.23 -0.07 5.97 0.00 0.57 -0.94 121.76 129.52 2nn6 s ALA 56 Ca -0.08 -1.09 0.05 0.00 0.00 0.00 0.00 51.96 50.85 2nn6 s ALA 56 Cb -0.15 -0.64 -0.01 0.00 0.00 0.00 0.00 23.12 22.33 2nn6 s ALA 56 CO 0.05 0.51 -0.23 0.20 0.00 0.00 0.00 175.76 176.28 2nn6 s GLY 57 N -0.53 1.34 -0.09 0.00 0.00 0.36 -1.19 107.32 107.20 2nn6 s GLY 57 Ca 0.07 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.81 2nn6 s GLY 57 CO 0.00 -0.56 -0.19 0.14 0.00 0.00 0.00 173.10 172.49 2nn6 s VAL 58 N -0.06 1.69 -0.68 1.40 1.01 0.41 0.10 120.40 124.27 2nn6 s VAL 58 Ca -0.06 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.14 2nn6 s VAL 58 Cb -0.15 -1.49 0.37 0.00 0.00 0.00 0.00 36.38 35.12 2nn6 s VAL 58 CO 0.05 0.48 1.42 -1.22 0.00 0.00 0.00 175.10 175.83 2nn6 n TYR 59 N 3.71 3.35 0.00 5.22 4.02 0.38 0.26 117.16 134.10 2nn6 n TYR 59 Ca -0.20 -3.03 0.00 0.00 -0.01 0.00 0.00 57.90 54.65 2nn6 n TYR 59 Cb 0.52 -0.64 0.00 0.00 -0.02 0.00 0.00 39.34 39.20 2nn6 n TYR 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2nn6 n GLY 60 N -0.37 0.00 3.67 2.72 0.00 -1.26 -3.98 105.19 105.98 2nn6 n GLY 60 Ca 0.42 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.02 2nn6 n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nn6 s PRO 61 N 0.00 4.15 -0.00 1.61 0.04 -1.26 -3.75 135.00 135.78 2nn6 s PRO 61 Ca 0.00 2.54 0.00 0.00 0.04 0.00 0.00 61.00 63.59 2nn6 s PRO 61 Cb 0.00 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.64 2nn6 s PRO 61 CO 0.00 -0.89 -0.01 0.00 0.04 0.00 0.00 177.00 176.14 2nn6 s ALA 62 N 3.69 0.13 -0.20 8.56 0.00 0.21 -4.93 121.76 129.21 2nn6 s ALA 62 Ca 0.83 -0.03 -0.13 0.00 0.00 0.00 0.00 51.96 52.64 2nn6 s ALA 62 Cb -0.43 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 22.59 2nn6 s ALA 62 CO 0.38 0.02 0.25 -2.00 0.00 0.00 0.00 175.76 174.40 2nn6 s GLU 63 N 0.09 4.17 -0.27 0.00 -6.30 -1.26 0.31 118.70 115.44 2nn6 s GLU 63 Ca -0.01 -0.05 -0.05 0.00 -2.50 0.00 0.00 54.97 52.36 2nn6 s GLU 63 Cb -0.02 -3.49 0.01 0.00 0.00 0.00 0.00 34.13 30.63 2nn6 s GLU 63 CO -0.00 0.12 0.03 0.08 0.02 0.00 0.00 175.26 175.51 2nn6 s VAL 64 N 0.85 3.66 -0.32 3.70 1.01 -1.23 -4.92 120.40 123.15 2nn6 s VAL 64 Ca 0.13 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 2nn6 s VAL 64 Cb -0.13 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 2nn6 s VAL 64 CO 0.04 0.18 1.41 2.29 0.00 0.00 0.00 175.10 179.02 2nn6 n LYS 65 N 4.82 0.73 -4.40 2.72 2.85 -1.26 -5.03 118.16 118.59 2nn6 n LYS 65 Ca -0.16 -0.86 -0.23 0.00 -1.05 0.00 0.00 58.31 56.02 2nn6 n LYS 65 Cb 0.49 -2.18 -0.11 0.00 -0.65 0.00 0.00 35.03 32.58 2nn6 n LYS 65 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2nn6 s ASN 72 N 4.52 3.10 0.87 -5.58 0.01 -1.26 -5.23 114.94 111.37 2nn6 s ASN 72 Ca 0.16 -0.95 0.00 0.00 -0.71 0.00 0.00 52.86 51.36 2nn6 s ASN 72 Cb 0.04 -0.22 0.00 0.00 0.41 0.00 0.00 41.25 41.48 2nn6 s ASN 72 CO 0.00 -0.01 0.00 0.29 -1.51 0.00 0.00 177.10 175.87 2nn6 n LYS 73 N -0.15 0.00 -3.68 -0.60 5.02 -1.25 -3.92 118.16 113.58 2nn6 n LYS 73 Ca -0.09 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.02 2nn6 n LYS 73 Cb 0.58 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 35.43 2nn6 n LYS 73 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nn6 s ALA 74 N -1.65 -0.04 -0.09 7.82 0.00 -0.55 -1.48 121.76 125.77 2nn6 s ALA 74 Ca 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 51.96 52.39 2nn6 s ALA 74 Cb 0.00 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 2nn6 s ALA 74 CO 0.00 -0.50 -0.03 0.95 0.00 0.00 0.00 175.76 176.18 2nn6 s THR 75 N 2.15 4.03 -0.20 0.00 -4.23 -0.88 -4.37 115.64 112.14 2nn6 s THR 75 Ca 0.03 -0.35 -0.01 0.00 -1.18 0.00 0.00 61.69 60.18 2nn6 s THR 75 Cb -0.12 -2.69 0.01 0.00 1.34 0.00 0.00 72.50 71.04 2nn6 s THR 75 CO -0.05 0.58 -0.13 -0.22 -0.54 0.00 0.00 174.62 174.27 2nn6 s LEU 76 N -0.62 2.48 -0.09 4.79 2.96 -1.26 0.28 118.68 127.22 2nn6 s LEU 76 Ca 0.10 -0.54 0.04 0.00 -0.22 0.00 0.00 54.13 53.51 2nn6 s LEU 76 Cb -0.12 -1.60 -0.00 0.00 0.50 0.00 0.00 46.19 44.98 2nn6 s LEU 76 CO 0.02 -0.01 -0.23 -0.70 -1.32 0.00 0.00 176.35 174.11 2nn6 s GLU 77 N 1.37 2.85 -0.03 1.98 -6.30 -1.14 -4.93 118.70 112.52 2nn6 s GLU 77 Ca 0.05 -0.84 0.04 0.00 -2.50 0.00 0.00 54.97 51.72 2nn6 s GLU 77 Cb -0.14 -2.19 -0.00 0.00 0.00 0.00 0.00 34.13 31.80 2nn6 s GLU 77 CO -0.09 0.19 -0.14 0.08 0.02 0.00 0.00 175.26 175.33 2nn6 s VAL 78 N 0.30 1.12 -0.09 3.70 1.01 -1.26 -2.90 120.40 122.28 2nn6 s VAL 78 Ca -0.17 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.29 2nn6 s VAL 78 Cb -0.17 -0.96 -0.00 0.00 0.00 0.00 0.00 36.38 35.24 2nn6 s VAL 78 CO 0.08 0.33 -0.24 0.27 0.00 0.00 0.00 175.10 175.54 2nn6 s ILE 79 N -0.02 2.09 -0.08 2.22 -5.25 -0.85 -4.75 121.20 114.57 2nn6 s ILE 79 Ca -0.01 -1.02 0.02 0.00 -0.99 0.00 0.00 60.65 58.66 2nn6 s ILE 79 Cb -0.09 -1.79 0.01 0.00 2.95 0.00 0.00 42.46 43.55 2nn6 s ILE 79 CO 0.01 0.56 -0.15 -0.22 -1.79 0.00 0.00 174.94 173.35 2nn6 s LEU 80 N 0.21 1.73 0.22 0.37 2.96 -1.26 0.32 118.68 123.23 2nn6 s LEU 80 Ca -0.15 -0.36 0.08 0.00 -0.22 0.00 0.00 54.13 53.48 2nn6 s LEU 80 Cb -0.17 -0.97 -0.05 0.00 0.50 0.00 0.00 46.19 45.50 2nn6 s LEU 80 CO 0.08 0.05 -0.15 -0.13 -1.32 0.00 0.00 176.35 174.88 2nn6 s ARG 81 N 0.65 1.39 0.18 1.98 0.52 -0.93 -4.88 118.95 117.86 2nn6 s ARG 81 Ca -0.14 -1.62 0.05 0.00 -0.52 0.00 0.00 55.73 53.49 2nn6 s ARG 81 Cb -0.16 -1.22 -0.04 0.00 0.52 0.00 0.00 34.95 34.05 2nn6 s ARG 81 CO 0.04 0.20 0.21 -1.25 0.02 0.00 0.00 175.30 174.52 2nn6 s PRO 82 N -3.63 3.11 0.23 3.54 0.04 -1.26 -1.89 135.00 135.14 2nn6 s PRO 82 Ca 0.24 -0.81 -0.07 0.00 0.04 0.00 0.00 61.00 60.40 2nn6 s PRO 82 Cb -0.01 -2.74 0.31 0.00 0.04 0.00 0.00 34.50 32.09 2nn6 s PRO 82 CO 0.08 0.48 1.84 1.57 0.04 0.00 0.00 177.00 181.00 2nn6 h LYS 83 N 2.06 0.84 -5.79 4.56 2.10 -1.93 -3.42 116.57 115.00 2nn6 h LYS 83 Ca -0.48 -0.05 -0.65 0.00 -2.00 0.00 0.00 60.65 57.47 2nn6 h LYS 83 Cb 1.21 -0.19 -0.06 0.00 -0.90 0.00 0.00 32.23 32.29 2nn6 h LYS 83 CO 0.64 0.56 -0.50 0.96 -2.00 0.00 0.00 179.45 179.11 2nn6 s ILE 84 N -6.07 5.40 0.30 0.07 -5.25 -1.26 -5.00 121.20 109.39 2nn6 s ILE 84 Ca -0.13 -0.10 0.00 0.00 -0.99 0.00 0.00 60.65 59.43 2nn6 s ILE 84 Cb 0.18 -3.48 0.00 0.00 2.95 0.00 0.00 42.46 42.10 2nn6 s ILE 84 CO 0.78 0.39 0.00 0.61 -1.79 0.00 0.00 174.94 174.93 2nn6 n GLY 85 N 1.17 -1.66 3.95 6.27 0.00 -1.26 -4.87 105.19 108.79 2nn6 n GLY 85 Ca -0.13 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 44.80 2nn6 n GLY 85 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2nn6 s LEU 86 N -5.90 2.96 -0.11 0.99 0.05 -1.26 -4.58 118.68 110.82 2nn6 s LEU 86 Ca 0.00 0.24 -0.29 0.00 0.05 0.00 0.00 54.13 54.12 2nn6 s LEU 86 Cb 0.00 -2.90 -0.05 0.00 -2.05 0.00 0.00 46.19 41.19 2nn6 s LEU 86 CO 0.00 -1.54 1.71 -2.16 -0.55 0.00 0.00 176.35 173.81 2nn6 s PRO 87 N -5.13 3.98 0.69 1.48 0.04 -1.26 -4.77 135.00 130.04 2nn6 s PRO 87 Ca 0.60 2.05 -0.09 0.00 0.04 0.00 0.00 61.00 63.60 2nn6 s PRO 87 Cb -0.10 -4.04 0.15 0.00 0.04 0.00 0.00 34.50 30.55 2nn6 s PRO 87 CO 0.43 -1.08 0.94 0.41 0.04 0.00 0.00 177.00 177.74 2nn6 n GLY 88 N 4.44 -0.83 0.12 0.56 0.00 -1.26 -4.95 105.19 103.27 2nn6 n GLY 88 Ca 0.19 -1.79 -0.04 0.00 0.00 0.00 0.00 46.02 44.38 2nn6 n GLY 88 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2nn6 h VAL 89 N -1.30 1.52 -0.92 1.61 2.07 -2.00 -2.78 116.25 114.46 2nn6 h VAL 89 Ca -0.31 -2.53 0.14 0.00 0.82 0.00 0.00 66.70 64.83 2nn6 h VAL 89 Cb 0.91 2.37 -0.09 0.00 -1.52 0.00 0.00 31.29 32.96 2nn6 h VAL 89 CO 0.24 0.73 0.53 0.00 0.02 0.00 0.00 177.57 179.08 2nn6 h ALA 90 N 1.21 1.41 0.61 1.67 0.00 -2.00 -0.26 119.26 121.91 2nn6 h ALA 90 Ca -0.01 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2nn6 h ALA 90 Cb 1.33 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2nn6 h ALA 90 CO 0.10 0.01 -0.38 0.93 0.00 0.00 0.00 179.25 179.92 2nn6 h GLU 91 N 0.76 -0.89 -0.87 0.00 4.39 -1.86 -1.19 114.58 114.92 2nn6 h GLU 91 Ca 0.49 0.06 0.19 0.00 0.34 0.00 0.00 59.36 60.44 2nn6 h GLU 91 Cb 0.64 0.20 -0.16 0.00 -0.10 0.00 0.00 28.75 29.33 2nn6 h GLU 91 CO -0.33 -0.60 -0.18 1.17 -1.16 0.00 0.00 179.01 177.92 2nn6 n LYS 92 N -4.77 -0.08 -0.00 2.33 3.00 -0.20 0.16 118.16 118.60 2nn6 n LYS 92 Ca -0.11 1.35 -0.12 0.00 -0.00 0.00 0.00 58.31 59.42 2nn6 n LYS 92 Cb 0.39 -2.04 -0.08 0.00 0.00 0.00 0.00 35.03 33.30 2nn6 n LYS 92 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2nn6 h SER 93 N 0.00 0.04 -0.77 3.14 4.64 -1.08 -2.83 113.55 116.70 2nn6 h SER 93 Ca 0.44 -0.31 0.07 0.00 -0.47 0.00 0.00 61.79 61.53 2nn6 h SER 93 Cb 0.72 -0.01 -0.06 0.00 -0.31 0.00 0.00 62.40 62.73 2nn6 h SER 93 CO -0.88 0.34 0.44 0.03 -0.87 0.00 0.00 176.83 175.89 2nn6 h ARG 94 N -0.26 0.76 0.00 4.77 3.08 0.29 0.17 114.38 123.19 2nn6 h ARG 94 Ca 0.01 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 2nn6 h ARG 94 Cb 0.32 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 2nn6 h ARG 94 CO 0.00 0.50 -0.00 1.05 -1.07 0.00 0.00 179.97 180.45 2nn6 h GLU 95 N 0.78 0.00 0.03 0.04 4.11 0.02 -2.22 114.58 117.34 2nn6 h GLU 95 Ca 0.35 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.78 2nn6 h GLU 95 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2nn6 h GLU 95 CO -0.21 0.00 -0.01 -0.09 0.07 0.00 0.00 179.01 178.77 2nn6 h ARG 96 N 0.00 -0.04 -0.52 1.06 2.43 -0.40 -2.46 114.38 114.46 2nn6 h ARG 96 Ca -0.00 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.28 2nn6 h ARG 96 Cb 0.18 0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.65 2nn6 h ARG 96 CO 0.00 0.63 -0.07 -0.07 -1.51 0.00 0.00 179.97 178.95 2nn6 h LEU 97 N -0.76 -0.36 -0.21 3.80 4.07 -1.20 0.28 115.31 120.93 2nn6 h LEU 97 Ca -0.00 0.14 0.05 0.00 0.08 0.00 0.00 57.88 58.15 2nn6 h LEU 97 Cb 0.68 0.27 -0.05 0.00 1.08 0.00 0.00 40.66 42.64 2nn6 h LEU 97 CO 0.01 -0.13 -0.11 -0.29 -1.08 0.00 0.00 178.44 176.83 2nn6 h ILE 98 N 0.05 0.65 -0.60 1.22 6.09 -1.59 0.13 117.51 123.46 2nn6 h ILE 98 Ca 0.26 0.00 0.12 0.00 -1.37 0.00 0.00 64.86 63.87 2nn6 h ILE 98 Cb 0.40 0.65 -0.11 0.00 0.47 0.00 0.00 36.82 38.24 2nn6 h ILE 98 CO -0.49 0.00 -0.06 -0.09 -3.07 0.00 0.00 178.15 174.45 2nn6 h ARG 99 N -0.09 0.07 0.21 2.19 1.12 -0.09 -2.41 114.38 115.38 2nn6 h ARG 99 Ca 0.12 -0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.97 2nn6 h ARG 99 Cb 0.27 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.21 2nn6 h ARG 99 CO -0.27 0.04 -0.10 -0.91 -3.11 0.00 0.00 179.97 175.62 2nn6 h ASN 100 N 0.07 -0.24 -0.99 -3.80 2.35 -0.01 -2.49 115.58 110.47 2nn6 h ASN 100 Ca 0.30 -0.26 0.29 0.00 -0.55 0.00 0.00 56.30 56.08 2nn6 h ASN 100 Cb 0.49 0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.88 2nn6 h ASN 100 CO -0.55 0.17 0.99 0.74 -1.65 0.00 0.00 177.43 177.13 2nn6 h THR 101 N -0.70 0.14 0.05 2.81 2.02 -0.39 -0.38 112.91 116.47 2nn6 h THR 101 Ca -0.03 0.00 -0.26 0.00 0.77 0.00 0.00 66.41 66.89 2nn6 h THR 101 Cb 0.49 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 2nn6 h THR 101 CO 0.05 0.00 -1.38 0.00 0.37 0.00 0.00 175.52 174.56 2nn6 h GLU 103 N -0.63 0.10 0.59 0.00 5.08 -0.63 0.77 114.58 119.85 2nn6 h GLU 103 Ca -0.34 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 2nn6 h GLU 103 Cb 1.54 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.76 2nn6 h GLU 103 CO -0.08 0.06 -0.40 0.00 -1.00 0.00 0.00 179.01 177.59 2nn6 h ALA 104 N 1.43 -0.98 0.00 3.43 0.00 -1.50 -3.27 119.26 118.37 2nn6 h ALA 104 Ca 0.65 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 55.22 2nn6 h ALA 104 Cb 2.32 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 20.60 2nn6 h ALA 104 CO -0.13 -1.07 -1.23 -0.39 0.00 0.00 0.00 179.25 176.43 2nn6 h VAL 105 N -0.95 0.58 -0.90 0.00 -1.51 -0.49 -3.44 116.25 109.55 2nn6 h VAL 105 Ca -0.07 -2.05 -0.22 0.00 -1.23 0.00 0.00 66.70 63.14 2nn6 h VAL 105 Cb 0.78 2.11 -0.01 0.00 -2.13 0.00 0.00 31.29 32.05 2nn6 h VAL 105 CO 0.05 0.33 0.69 -0.69 -1.23 0.00 0.00 177.57 176.72 2nn6 s VAL 106 N -2.93 3.08 0.46 7.19 1.01 0.23 0.21 120.40 129.65 2nn6 s VAL 106 Ca -0.01 -0.03 0.28 0.00 0.00 0.00 0.00 61.98 62.22 2nn6 s VAL 106 Cb 0.08 -3.20 0.31 0.00 0.00 0.00 0.00 36.38 33.58 2nn6 s VAL 106 CO 0.80 -0.19 2.12 0.25 0.00 0.00 0.00 175.10 178.08 2nn6 h LEU 107 N 20.70 0.00 -1.19 3.92 6.46 -1.58 -2.41 115.31 141.21 2nn6 h LEU 107 Ca -0.08 0.00 0.40 0.00 -0.12 0.00 0.00 57.88 58.08 2nn6 h LEU 107 Cb 1.10 0.00 -0.10 0.00 -0.73 0.00 0.00 40.66 40.92 2nn6 h LEU 107 CO 1.09 0.09 0.79 0.61 -0.62 0.00 0.00 178.44 180.40 2nn6 n GLY 108 N -0.85 -0.69 0.47 3.75 0.00 0.15 0.21 105.19 108.23 2nn6 n GLY 108 Ca -0.02 0.59 0.25 0.00 0.00 0.00 0.00 46.02 46.84 2nn6 n GLY 108 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2nn6 h THR 109 N 0.00 0.13 0.00 2.61 1.35 -1.63 -3.30 112.91 112.07 2nn6 h THR 109 Ca 0.71 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.57 2nn6 h THR 109 Cb 2.41 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 2nn6 h THR 109 CO -0.30 0.00 0.00 -0.11 -0.25 0.00 0.00 175.52 174.86 2nn6 n LEU 110 N -3.40 0.00 -3.59 3.87 7.94 0.56 -1.49 117.00 120.89 2nn6 n LEU 110 Ca 0.17 0.00 -0.39 0.00 -1.11 0.00 0.00 56.01 54.68 2nn6 n LEU 110 Cb 1.17 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 45.10 2nn6 n LEU 110 CO 0.25 0.00 -0.04 1.57 -1.11 0.00 0.00 177.39 178.05 2nn6 n HIS 111 N 0.00 -0.53 -1.86 1.96 -0.00 -1.24 -4.29 115.22 109.26 2nn6 n HIS 111 Ca 0.00 0.77 -0.24 0.00 0.46 0.00 0.00 57.72 58.71 2nn6 n HIS 111 Cb 0.00 -1.59 0.16 0.00 -0.12 0.00 0.00 29.99 28.45 2nn6 n HIS 111 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2nn6 n PRO 112 N 0.84 -0.95 0.00 1.57 -0.04 -1.16 -2.40 135.00 132.86 2nn6 n PRO 112 Ca 0.14 -1.78 0.00 0.00 -0.04 0.00 0.00 63.50 61.82 2nn6 n PRO 112 Cb 0.22 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 2nn6 n PRO 112 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2nn6 n ARG 113 N -3.25 0.00 -2.36 0.54 1.74 -0.92 -4.30 116.66 108.10 2nn6 n ARG 113 Ca 0.14 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.87 2nn6 n ARG 113 Cb 0.48 -2.73 -0.01 0.00 -1.02 0.00 0.00 32.46 29.19 2nn6 n ARG 113 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2nn6 s THR 114 N 0.00 3.42 0.06 0.55 -1.32 -0.55 -3.50 115.64 114.32 2nn6 s THR 114 Ca 0.00 0.88 0.06 0.00 -1.21 0.00 0.00 61.69 61.42 2nn6 s THR 114 Cb 0.00 -3.35 -0.03 0.00 -1.51 0.00 0.00 72.50 67.61 2nn6 s THR 114 CO 0.00 -0.20 -0.16 -0.55 -2.21 0.00 0.00 174.62 171.51 2nn6 s SER 115 N -1.88 1.85 -0.03 8.08 0.15 0.91 -2.08 113.70 120.70 2nn6 s SER 115 Ca 0.70 -0.57 -0.00 0.00 0.70 0.00 0.00 55.95 56.78 2nn6 s SER 115 Cb -0.21 -0.09 0.03 0.00 -1.71 0.00 0.00 66.02 64.04 2nn6 s SER 115 CO 0.24 -0.01 0.02 -0.63 1.20 0.00 0.00 173.24 174.07 2nn6 s ILE 116 N -1.10 0.04 -0.00 6.45 1.09 0.14 0.67 121.20 128.49 2nn6 s ILE 116 Ca 0.01 0.19 0.08 0.00 -1.10 0.00 0.00 60.65 59.83 2nn6 s ILE 116 Cb -0.09 -0.17 -0.02 0.00 -1.06 0.00 0.00 42.46 41.11 2nn6 s ILE 116 CO 0.02 0.13 -0.25 -0.89 -0.10 0.00 0.00 174.94 173.85 2nn6 s THR 117 N 1.22 1.95 0.08 2.92 2.01 -1.25 -2.88 115.64 119.70 2nn6 s THR 117 Ca -0.07 -1.13 0.08 0.00 0.31 0.00 0.00 61.69 60.88 2nn6 s THR 117 Cb -0.13 -1.63 -0.03 0.00 0.01 0.00 0.00 72.50 70.71 2nn6 s THR 117 CO -0.03 0.48 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.50 2nn6 s VAL 118 N -0.64 1.62 -0.02 3.82 1.01 -1.14 -0.47 120.40 124.58 2nn6 s VAL 118 Ca 0.10 -1.41 0.01 0.00 0.00 0.00 0.00 61.98 60.67 2nn6 s VAL 118 Cb -0.09 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 34.84 2nn6 s VAL 118 CO -0.00 -0.01 -0.01 -0.69 0.00 0.00 0.00 175.10 174.39 2nn6 s VAL 119 N -1.06 0.19 -0.01 2.92 1.01 0.28 -2.00 120.40 121.73 2nn6 s VAL 119 Ca 0.06 -0.00 0.05 0.00 0.00 0.00 0.00 61.98 62.09 2nn6 s VAL 119 Cb -0.10 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 2nn6 s VAL 119 CO 0.03 0.11 -0.16 -0.76 0.00 0.00 0.00 175.10 174.31 2nn6 s LEU 120 N 0.53 2.64 -0.10 3.92 1.02 0.15 0.13 118.68 126.98 2nn6 s LEU 120 Ca -0.05 -0.31 0.02 0.00 0.02 0.00 0.00 54.13 53.81 2nn6 s LEU 120 Cb -0.08 -1.54 0.01 0.00 0.02 0.00 0.00 46.19 44.61 2nn6 s LEU 120 CO -0.01 0.30 -0.15 -1.58 0.02 0.00 0.00 176.35 174.93 2nn6 s GLN 121 N -1.04 2.21 -0.62 1.70 2.00 -0.12 -2.19 119.66 121.62 2nn6 s GLN 121 Ca 0.13 -0.56 -0.26 0.00 -2.00 0.00 0.00 55.36 52.67 2nn6 s GLN 121 Cb -0.11 -1.86 -0.05 0.00 0.80 0.00 0.00 33.01 31.79 2nn6 s GLN 121 CO 0.03 -0.04 2.09 0.08 -0.50 0.00 0.00 175.29 176.95 2nn6 s VAL 122 N 0.93 3.22 -0.04 1.34 1.01 -0.79 -3.09 120.40 122.97 2nn6 s VAL 122 Ca -0.08 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 2nn6 s VAL 122 Cb -0.15 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 2nn6 s VAL 122 CO -0.01 -0.55 -0.07 0.52 0.00 0.00 0.00 175.10 175.00 2nn6 n VAL 123 N 7.66 0.42 -3.91 2.92 0.31 -1.13 -3.41 118.33 121.18 2nn6 n VAL 123 Ca 0.30 0.41 -0.31 0.00 -0.01 0.00 0.00 64.34 64.73 2nn6 n VAL 123 Cb 0.52 -1.76 -0.15 0.00 -0.91 0.00 0.00 33.84 31.54 2nn6 n VAL 123 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2nn6 s SER 124 N -4.28 4.37 0.45 4.52 0.15 0.51 -4.87 113.70 114.56 2nn6 s SER 124 Ca -0.06 -1.82 -0.06 0.00 0.70 0.00 0.00 55.95 54.72 2nn6 s SER 124 Cb 0.01 -1.30 -0.04 0.00 -1.71 0.00 0.00 66.02 62.97 2nn6 s SER 124 CO 0.08 -0.37 0.76 -0.62 1.20 0.00 0.00 173.24 174.30 2nn6 s ASP 125 N 1.22 6.32 0.00 5.45 -1.08 -1.26 0.66 116.67 127.98 2nn6 s ASP 125 Ca 0.08 0.93 0.00 0.00 -0.52 0.00 0.00 52.55 53.04 2nn6 s ASP 125 Cb -0.18 -2.24 0.00 0.00 -1.46 0.00 0.00 42.92 39.03 2nn6 s ASP 125 CO -0.13 -0.51 0.00 0.00 0.52 0.00 0.00 175.17 175.04 2nn6 n ALA 126 N -2.00 0.00 0.00 3.66 0.00 -1.26 -4.69 120.51 116.22 2nn6 n ALA 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2nn6 n ALA 126 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2nn6 n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nn6 n GLY 127 N 0.00 4.39 3.00 0.00 0.00 -1.26 0.22 105.19 111.54 2nn6 n GLY 127 Ca 0.00 -1.30 -0.21 0.00 0.00 0.00 0.00 46.02 44.51 2nn6 n GLY 127 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2nn6 n SER 128 N 0.00 -5.85 0.00 1.61 7.64 -1.26 -4.86 113.62 110.89 2nn6 n SER 128 Ca 0.00 -0.30 0.00 0.00 1.01 0.00 0.00 58.87 59.58 2nn6 n SER 128 Cb 0.00 -4.64 0.00 0.00 -1.01 0.00 0.00 64.21 58.56 2nn6 n SER 128 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2nn6 n LEU 129 N -3.89 0.00 -0.34 -3.43 0.00 -1.26 -1.76 117.00 106.31 2nn6 n LEU 129 Ca -0.09 0.89 0.15 0.00 0.00 0.00 0.00 56.01 56.97 2nn6 n LEU 129 Cb 0.60 -0.39 0.37 0.00 0.00 0.00 0.00 43.42 44.00 2nn6 n LEU 129 CO 0.46 -0.39 1.20 -0.07 0.00 0.00 0.00 177.39 178.59 2nn6 h LEU 130 N 0.00 0.70 0.18 -1.96 3.38 -2.00 -1.29 115.31 114.31 2nn6 h LEU 130 Ca 0.00 0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.08 2nn6 h LEU 130 Cb 0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2nn6 h LEU 130 CO 0.00 0.22 -0.48 0.00 0.09 0.00 0.00 178.44 178.28 2nn6 h ALA 131 N 1.65 -0.90 -0.63 1.53 0.00 -1.66 -2.48 119.26 116.76 2nn6 h ALA 131 Ca 0.58 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.51 2nn6 h ALA 131 Cb 1.04 0.78 -0.12 0.00 0.00 0.00 0.00 17.79 19.49 2nn6 h ALA 131 CO -0.36 -1.07 -0.20 0.00 0.00 0.00 0.00 179.25 177.62 2nn6 h LEU 134 N 0.25 -0.35 -1.56 0.00 3.38 -0.23 0.77 115.31 117.57 2nn6 h LEU 134 Ca 0.31 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.40 2nn6 h LEU 134 Cb 0.46 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 2nn6 h LEU 134 CO -0.41 -0.08 0.40 -0.55 0.09 0.00 0.00 178.44 177.90 2nn6 h ASN 135 N -0.09 0.47 0.61 -0.43 -1.07 -1.52 1.03 115.58 114.58 2nn6 h ASN 135 Ca 0.01 0.01 -0.03 0.00 0.07 0.00 0.00 56.30 56.36 2nn6 h ASN 135 Cb 0.12 -0.09 0.01 0.00 -2.07 0.00 0.00 38.32 36.28 2nn6 h ASN 135 CO -0.11 0.29 -0.30 0.00 0.07 0.00 0.00 177.43 177.39 2nn6 h ALA 136 N 1.68 -0.82 -0.78 4.14 0.00 0.30 0.38 119.26 124.16 2nn6 h ALA 136 Ca 0.27 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2nn6 h ALA 136 Cb 0.38 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 2nn6 h ALA 136 CO -0.08 -0.89 0.51 0.00 0.00 0.00 0.00 179.25 178.79 2nn6 h ALA 137 N -0.66 1.51 0.76 0.00 0.00 0.19 1.09 119.26 122.15 2nn6 h ALA 137 Ca -0.08 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2nn6 h ALA 137 Cb 0.67 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2nn6 h ALA 137 CO 0.14 0.42 -0.43 0.00 0.00 0.00 0.00 179.25 179.38 2nn6 h MET 139 N -1.11 0.97 -0.90 0.00 2.86 0.49 0.55 114.93 117.80 2nn6 h MET 139 Ca -0.10 -0.06 0.24 0.00 -2.06 0.00 0.00 59.70 57.72 2nn6 h MET 139 Cb 0.88 -0.22 -0.16 0.00 0.06 0.00 0.00 31.60 32.17 2nn6 h MET 139 CO 0.12 0.64 0.12 0.00 1.06 0.00 0.00 176.91 178.86 2nn6 h ALA 140 N 1.52 1.16 0.03 6.32 0.00 0.23 0.66 119.26 129.18 2nn6 h ALA 140 Ca 0.41 0.27 -0.07 0.00 0.00 0.00 0.00 54.91 55.52 2nn6 h ALA 140 Cb 0.27 0.45 0.01 0.00 0.00 0.00 0.00 17.79 18.51 2nn6 h ALA 140 CO -0.16 -0.51 -0.30 -0.07 0.00 0.00 0.00 179.25 178.20 2nn6 h LEU 141 N 0.10 0.21 -0.95 0.00 -0.00 0.15 -0.77 115.31 114.06 2nn6 h LEU 141 Ca 0.55 -0.90 0.15 0.00 -0.00 0.00 0.00 57.88 57.69 2nn6 h LEU 141 Cb 1.11 -0.07 -0.16 0.00 -0.00 0.00 0.00 40.66 41.55 2nn6 h LEU 141 CO -0.76 1.08 -0.36 0.58 -0.00 0.00 0.00 178.44 178.98 2nn6 h VAL 142 N -0.64 0.03 0.03 1.22 2.07 0.26 0.91 116.25 120.13 2nn6 h VAL 142 Ca -0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 2nn6 h VAL 142 Cb 1.16 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2nn6 h VAL 142 CO 0.06 0.00 -0.02 -0.78 0.02 0.00 0.00 177.57 176.85 2nn6 h ASP 143 N -0.02 -0.04 0.00 0.57 3.58 0.07 0.11 116.42 120.69 2nn6 h ASP 143 Ca 0.35 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.75 2nn6 h ASP 143 Cb 0.61 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.67 2nn6 h ASP 143 CO -0.96 0.02 0.00 0.00 -2.88 0.00 0.00 179.24 175.43 2nn6 n ALA 144 N -2.14 1.67 -0.42 -0.78 0.00 0.26 -4.79 120.51 114.32 2nn6 n ALA 144 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2nn6 n ALA 144 Cb 0.07 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.52 2nn6 n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nn6 n GLY 145 N -0.16 0.00 3.66 0.00 0.00 0.17 -4.79 105.19 104.06 2nn6 n GLY 145 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2nn6 n GLY 145 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2nn6 n VAL 146 N -0.42 1.92 -1.92 1.61 0.31 -1.21 -4.85 118.33 113.77 2nn6 n VAL 146 Ca 0.00 -0.48 -0.42 0.00 -0.01 0.00 0.00 64.34 63.43 2nn6 n VAL 146 Cb 0.00 -1.36 -0.03 0.00 -0.91 0.00 0.00 33.84 31.54 2nn6 n VAL 146 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2nn6 s PRO 147 N -1.66 4.21 0.38 5.55 0.04 -1.26 -4.81 135.00 137.45 2nn6 s PRO 147 Ca 0.57 2.38 0.08 0.00 0.04 0.00 0.00 61.00 64.07 2nn6 s PRO 147 Cb -0.62 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 30.69 2nn6 s PRO 147 CO 0.61 -0.63 0.21 -1.64 0.04 0.00 0.00 177.00 175.59 2nn6 s MET 148 N 1.27 2.37 -0.12 4.56 -1.94 -1.26 0.32 119.30 124.49 2nn6 s MET 148 Ca 0.71 -1.63 -0.01 0.00 -1.71 0.00 0.00 55.69 53.04 2nn6 s MET 148 Cb -0.44 -2.17 -0.07 0.00 2.01 0.00 0.00 34.83 34.16 2nn6 s MET 148 CO 0.31 -0.03 -0.13 2.89 -0.01 0.00 0.00 175.02 178.06 2nn6 n ARG 149 N -1.27 0.30 -4.15 2.03 1.85 0.13 -4.49 116.66 111.06 2nn6 n ARG 149 Ca -0.01 0.09 -0.13 0.00 -1.00 0.00 0.00 57.85 56.80 2nn6 n ARG 149 Cb 0.62 -1.16 -0.08 0.00 -1.05 0.00 0.00 32.46 30.79 2nn6 n ARG 149 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2nn6 s ALA 150 N -2.24 0.88 0.12 2.89 0.00 -1.24 -4.98 121.76 117.19 2nn6 s ALA 150 Ca -0.17 -1.53 0.08 0.00 0.00 0.00 0.00 51.96 50.33 2nn6 s ALA 150 Cb 0.05 1.29 -0.04 0.00 0.00 0.00 0.00 23.12 24.42 2nn6 s ALA 150 CO 0.27 -0.69 -0.11 -0.51 0.00 0.00 0.00 175.76 174.72 2nn6 s LEU 151 N -3.17 2.99 -0.04 0.00 1.43 -1.26 -4.77 118.68 113.87 2nn6 s LEU 151 Ca 0.34 -0.45 0.04 0.00 -1.03 0.00 0.00 54.13 53.03 2nn6 s LEU 151 Cb 0.04 -1.77 -0.00 0.00 0.03 0.00 0.00 46.19 44.49 2nn6 s LEU 151 CO 0.15 0.16 -0.14 0.72 0.23 0.00 0.00 176.35 177.46 2nn6 s PHE 152 N -1.32 1.44 0.19 0.29 -0.12 -1.26 -0.32 117.98 116.89 2nn6 s PHE 152 Ca 0.22 -0.40 0.09 0.00 -0.05 0.00 0.00 56.93 56.78 2nn6 s PHE 152 Cb -0.11 -0.99 -0.04 0.00 -0.63 0.00 0.00 43.02 41.25 2nn6 s PHE 152 CO 0.14 -0.15 -0.17 0.00 -0.05 0.00 0.00 175.22 174.99 2nn6 s GLY 154 N -2.98 1.48 0.02 0.00 0.00 -1.26 -2.77 107.32 101.81 2nn6 s GLY 154 Ca 0.20 -1.25 0.03 0.00 0.00 0.00 0.00 44.72 43.70 2nn6 s GLY 154 CO 0.08 -1.14 -0.10 -1.34 0.00 0.00 0.00 173.10 170.59 2nn6 s VAL 155 N -0.86 0.80 0.14 1.40 -7.23 -1.14 -4.79 120.40 108.72 2nn6 s VAL 155 Ca 0.13 -0.76 0.08 0.00 -1.81 0.00 0.00 61.98 59.62 2nn6 s VAL 155 Cb -0.10 -0.73 -0.04 0.00 0.56 0.00 0.00 36.38 36.07 2nn6 s VAL 155 CO 0.03 -0.01 -0.17 0.00 -0.31 0.00 0.00 175.10 174.64 2nn6 s ALA 156 N -0.70 1.80 -0.03 1.32 0.00 -1.26 -1.19 121.76 121.71 2nn6 s ALA 156 Ca -0.00 -1.37 -0.12 0.00 0.00 0.00 0.00 51.96 50.46 2nn6 s ALA 156 Cb -0.06 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2nn6 s ALA 156 CO 0.00 0.22 0.26 0.00 0.00 0.00 0.00 175.76 176.25 2nn6 s ALA 158 N -1.09 1.61 -0.02 0.00 0.00 -1.15 -1.70 121.76 119.40 2nn6 s ALA 158 Ca -0.12 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 50.95 2nn6 s ALA 158 Cb -0.05 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.73 2nn6 s ALA 158 CO 0.03 0.36 -0.24 -0.51 0.00 0.00 0.00 175.76 175.40 2nn6 s LEU 159 N -1.05 2.05 0.33 0.00 2.01 -0.13 -1.06 118.68 120.83 2nn6 s LEU 159 Ca 0.06 -0.43 0.06 0.00 0.01 0.00 0.00 54.13 53.83 2nn6 s LEU 159 Cb -0.08 -1.24 -0.01 0.00 0.01 0.00 0.00 46.19 44.87 2nn6 s LEU 159 CO 0.01 0.29 0.47 1.51 1.01 0.00 0.00 176.35 179.65 2nn6 s ASP 160 N -0.55 5.98 0.00 2.29 3.84 0.04 0.62 116.67 128.90 2nn6 s ASP 160 Ca 0.09 -0.16 0.00 0.00 -0.00 0.00 0.00 52.55 52.48 2nn6 s ASP 160 Cb -0.09 -1.27 0.00 0.00 -1.38 0.00 0.00 42.92 40.18 2nn6 s ASP 160 CO -0.01 -0.43 0.29 -1.54 -0.00 0.00 0.00 175.17 173.49 2nn6 n SER 161 N -1.65 0.00 -0.32 2.11 3.41 -1.26 0.88 113.62 116.80 2nn6 n SER 161 Ca -0.00 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.65 2nn6 n SER 161 Cb 0.58 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.63 2nn6 n SER 161 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2nn6 n ASP 162 N -0.79 2.57 -3.08 4.04 8.00 -1.26 -5.01 116.55 121.02 2nn6 n ASP 162 Ca 0.00 -2.29 -0.14 0.00 0.71 0.00 0.00 54.79 53.08 2nn6 n ASP 162 Cb 0.00 -0.20 0.06 0.00 -0.02 0.00 0.00 41.12 40.96 2nn6 n ASP 162 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nn6 n GLY 163 N -0.33 -0.92 3.01 0.44 0.00 0.25 -5.03 105.19 102.61 2nn6 n GLY 163 Ca 0.09 0.47 -0.24 0.00 0.00 0.00 0.00 46.02 46.34 2nn6 n GLY 163 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nn6 s THR 164 N -3.35 1.09 0.05 2.61 2.01 -1.24 -4.86 115.64 111.95 2nn6 s THR 164 Ca 0.39 -0.44 0.07 0.00 0.31 0.00 0.00 61.69 62.01 2nn6 s THR 164 Cb -0.05 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.42 2nn6 s THR 164 CO 0.67 0.35 -0.17 -1.48 -0.69 0.00 0.00 174.62 173.29 2nn6 s LEU 165 N 0.75 2.66 0.07 4.42 2.34 -1.20 -0.78 118.68 126.94 2nn6 s LEU 165 Ca -0.13 -0.43 0.05 0.00 0.06 0.00 0.00 54.13 53.68 2nn6 s LEU 165 Cb -0.16 -1.55 -0.03 0.00 -0.56 0.00 0.00 46.19 43.90 2nn6 s LEU 165 CO 0.03 0.24 -0.14 -0.69 -1.06 0.00 0.00 176.35 174.73 2nn6 s VAL 166 N -0.97 1.09 -0.12 1.48 1.01 -0.22 -4.89 120.40 117.77 2nn6 s VAL 166 Ca 0.15 -1.31 -0.17 0.00 0.00 0.00 0.00 61.98 60.65 2nn6 s VAL 166 Cb -0.11 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2nn6 s VAL 166 CO 0.06 -0.24 0.44 -0.76 0.00 0.00 0.00 175.10 174.61 2nn6 s LEU 167 N -1.76 4.27 -0.80 3.92 1.43 -1.26 -2.93 118.68 121.56 2nn6 s LEU 167 Ca -0.02 0.76 -0.03 0.00 -1.03 0.00 0.00 54.13 53.81 2nn6 s LEU 167 Cb -0.10 -2.64 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 2nn6 s LEU 167 CO 0.02 0.02 0.72 -0.67 0.23 0.00 0.00 176.35 176.68 2nn6 n ASP 168 N 3.62 -6.55 -2.78 2.29 -0.08 -0.73 -3.77 116.55 108.55 2nn6 n ASP 168 Ca -0.08 -0.37 0.00 0.00 -1.51 0.00 0.00 54.79 52.83 2nn6 n ASP 168 Cb 0.52 -4.72 0.00 0.00 2.34 0.00 0.00 41.12 39.26 2nn6 n ASP 168 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2nn6 n PRO 169 N -2.42 2.19 -3.70 -0.67 -0.04 -1.25 -4.21 135.00 124.90 2nn6 n PRO 169 Ca -0.03 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.32 2nn6 n PRO 169 Cb 0.56 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.96 2nn6 n PRO 169 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2nn6 s THR 170 N -0.01 0.08 0.53 0.52 2.01 -1.26 -4.52 115.64 113.00 2nn6 s THR 170 Ca 0.00 -0.70 0.20 0.00 0.31 0.00 0.00 61.69 61.51 2nn6 s THR 170 Cb 0.00 -1.13 0.32 0.00 0.01 0.00 0.00 72.50 71.70 2nn6 s THR 170 CO 0.00 -0.38 2.10 0.28 -0.69 0.00 0.00 174.62 175.93 2nn6 h SER 171 N 2.69 0.00 0.17 3.53 0.02 0.24 3.81 113.55 124.00 2nn6 h SER 171 Ca -0.33 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.61 2nn6 h SER 171 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2nn6 h SER 171 CO 0.48 0.00 -0.08 0.11 -1.14 0.00 0.00 176.83 176.20 2nn6 h LYS 172 N 0.00 -0.22 -0.37 3.45 1.57 -1.94 -3.24 116.57 115.83 2nn6 h LYS 172 Ca 0.08 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.95 2nn6 h LYS 172 Cb 0.34 0.05 -0.09 0.00 0.08 0.00 0.00 32.23 32.62 2nn6 h LYS 172 CO -0.00 -0.14 -0.30 1.96 -0.57 0.00 0.00 179.45 180.39 2nn6 h GLN 173 N -1.04 -0.24 -0.86 3.15 7.50 -1.53 -1.72 115.11 120.37 2nn6 h GLN 173 Ca -0.02 0.02 0.21 0.00 0.50 0.00 0.00 58.65 59.35 2nn6 h GLN 173 Cb 0.17 0.05 -0.13 0.00 0.05 0.00 0.00 27.48 27.63 2nn6 h GLN 173 CO 0.04 -0.16 0.30 0.93 -1.50 0.00 0.00 178.83 178.44 2nn6 h GLU 174 N -0.25 0.31 0.00 1.46 5.08 0.71 0.12 114.58 122.02 2nn6 h GLU 174 Ca 0.17 -0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.32 2nn6 h GLU 174 Cb 0.52 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 2nn6 h GLU 174 CO -0.51 0.21 -1.16 -0.22 -1.00 0.00 0.00 179.01 176.34 2nn6 h LYS 175 N 0.32 0.00 0.00 2.33 1.63 -1.49 -3.25 116.57 116.12 2nn6 h LYS 175 Ca 0.52 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.32 2nn6 h LYS 175 Cb 0.99 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.62 2nn6 h LYS 175 CO -0.55 0.58 0.00 0.93 -3.45 0.00 0.00 179.45 176.96 2nn6 h GLU 176 N 0.00 0.00 -7.30 1.90 5.08 -0.25 -3.44 114.58 110.57 2nn6 h GLU 176 Ca -0.11 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.79 2nn6 h GLU 176 Cb 1.69 0.00 0.10 0.00 0.50 0.00 0.00 28.75 31.04 2nn6 h GLU 176 CO 0.08 0.00 0.19 0.00 -1.00 0.00 0.00 179.01 178.28 2nn6 s ALA 177 N -3.64 3.28 0.00 3.43 0.00 0.29 -4.72 121.76 120.39 2nn6 s ALA 177 Ca 0.01 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.50 2nn6 s ALA 177 Cb 0.09 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.93 2nn6 s ALA 177 CO 0.52 -1.64 0.00 2.89 0.00 0.00 0.00 175.76 177.53 2nn6 n ARG 178 N -3.05 0.91 -4.18 0.00 1.85 0.20 -4.96 116.66 107.44 2nn6 n ARG 178 Ca 0.14 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.70 2nn6 n ARG 178 Cb 0.60 -0.93 -0.17 0.00 -1.05 0.00 0.00 32.46 30.92 2nn6 n ARG 178 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2nn6 s ALA 179 N -1.72 1.74 -0.05 2.89 0.00 -1.15 -2.06 121.76 121.41 2nn6 s ALA 179 Ca 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.18 2nn6 s ALA 179 Cb 0.00 -0.95 0.01 0.00 0.00 0.00 0.00 23.12 22.18 2nn6 s ALA 179 CO 0.00 -0.27 -0.08 0.08 0.00 0.00 0.00 175.76 175.50 2nn6 s VAL 180 N 1.31 0.78 -0.01 0.00 1.01 -0.77 -0.95 120.40 121.77 2nn6 s VAL 180 Ca 0.00 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 61.60 2nn6 s VAL 180 Cb -0.14 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.51 2nn6 s VAL 180 CO -0.07 0.27 0.18 -0.76 0.00 0.00 0.00 175.10 174.72 2nn6 s LEU 181 N 0.65 1.36 -0.04 3.92 1.02 -0.69 -2.80 118.68 122.11 2nn6 s LEU 181 Ca -0.11 -0.09 0.02 0.00 0.02 0.00 0.00 54.13 53.97 2nn6 s LEU 181 Cb -0.14 0.81 0.01 0.00 0.02 0.00 0.00 46.19 46.90 2nn6 s LEU 181 CO 0.01 -0.36 -0.08 -0.89 0.02 0.00 0.00 176.35 175.05 2nn6 s THR 182 N -1.25 0.77 0.00 5.49 2.01 -1.21 -0.93 115.64 120.52 2nn6 s THR 182 Ca -0.13 -0.30 0.06 0.00 0.31 0.00 0.00 61.69 61.63 2nn6 s THR 182 Cb -0.07 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.70 2nn6 s THR 182 CO 0.02 0.26 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.66 2nn6 s PHE 183 N 0.55 2.55 -0.20 4.92 2.99 -0.33 -2.67 117.98 125.79 2nn6 s PHE 183 Ca -0.09 -0.27 -0.07 0.00 0.00 0.00 0.00 56.93 56.50 2nn6 s PHE 183 Cb -0.12 -1.51 -0.04 0.00 0.00 0.00 0.00 43.02 41.35 2nn6 s PHE 183 CO 0.01 0.18 0.06 0.00 -0.00 0.00 0.00 175.22 175.47 2nn6 s ALA 184 N -0.81 3.30 0.20 5.36 0.00 0.79 -2.87 121.76 127.73 2nn6 s ALA 184 Ca 0.13 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.29 2nn6 s ALA 184 Cb -0.10 -1.96 -0.05 0.00 0.00 0.00 0.00 23.12 21.01 2nn6 s ALA 184 CO 0.03 -0.04 -0.16 -0.51 0.00 0.00 0.00 175.76 175.08 2nn6 s LEU 185 N 0.79 2.53 0.14 0.00 1.02 -1.11 0.11 118.68 122.15 2nn6 s LEU 185 Ca 0.03 -0.98 -0.30 0.00 0.02 0.00 0.00 54.13 52.90 2nn6 s LEU 185 Cb -0.14 -0.73 -0.07 0.00 0.02 0.00 0.00 46.19 45.28 2nn6 s LEU 185 CO 0.02 -0.13 0.98 -0.62 0.02 0.00 0.00 176.35 176.62 2nn6 s ASP 186 N -3.17 7.50 0.05 2.29 -1.08 -0.98 -3.66 116.67 117.61 2nn6 s ASP 186 Ca 0.21 1.86 -0.11 0.00 -0.52 0.00 0.00 52.55 53.99 2nn6 s ASP 186 Cb -0.02 -2.59 -0.32 0.00 -1.46 0.00 0.00 42.92 38.52 2nn6 s ASP 186 CO 0.07 -0.05 1.05 0.77 0.52 0.00 0.00 175.17 177.54 2nn6 h SER 187 N 5.26 0.66 0.09 -0.34 4.64 -1.03 0.32 113.55 123.15 2nn6 h SER 187 Ca -0.43 -0.71 -0.00 0.00 -0.47 0.00 0.00 61.79 60.17 2nn6 h SER 187 Cb 1.21 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2nn6 h SER 187 CO 0.71 1.56 -0.04 0.58 -0.87 0.00 0.00 176.83 178.77 2nn6 h VAL 188 N 0.11 0.84 -0.02 0.95 2.07 -1.93 -3.40 116.25 114.88 2nn6 h VAL 188 Ca -0.21 -1.38 0.00 0.00 0.82 0.00 0.00 66.70 65.93 2nn6 h VAL 188 Cb 2.09 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 33.36 2nn6 h VAL 188 CO 0.24 0.25 -0.32 -0.62 0.02 0.00 0.00 177.57 177.15 2nn6 n GLU 189 N -4.82 1.54 0.00 1.57 1.02 -1.26 -4.91 120.64 113.78 2nn6 n GLU 189 Ca -0.06 -1.12 0.00 0.00 -0.02 0.00 0.00 57.16 55.96 2nn6 n GLU 189 Cb 0.25 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 2nn6 n GLU 189 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2nn6 n ARG 190 N 0.24 0.00 -1.36 3.49 3.00 0.11 -4.81 116.66 117.33 2nn6 n ARG 190 Ca 0.09 0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.68 2nn6 n ARG 190 Cb 0.44 -2.42 -0.18 0.00 0.00 0.00 0.00 32.46 30.30 2nn6 n ARG 190 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2nn6 n LYS 191 N -1.50 0.00 -1.35 -0.14 4.81 -1.26 -3.17 118.16 115.54 2nn6 n LYS 191 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.13 2nn6 n LYS 191 Cb 0.00 -1.07 -0.16 0.00 0.02 0.00 0.00 35.03 33.82 2nn6 n LYS 191 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2nn6 n LEU 192 N 6.66 -0.29 -0.24 3.14 0.00 -1.26 -2.31 117.00 122.69 2nn6 n LEU 192 Ca 0.61 -0.07 0.01 0.00 0.00 0.00 0.00 56.01 56.56 2nn6 n LEU 192 Cb 0.09 -0.71 0.03 0.00 0.00 0.00 0.00 43.42 42.83 2nn6 n LEU 192 CO 0.95 -0.87 0.46 0.18 0.00 0.00 0.00 177.39 178.11 2nn6 n LEU 193 N 7.88 0.59 0.00 -1.96 4.77 0.29 -4.89 117.00 123.69 2nn6 n LEU 193 Ca 0.60 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2nn6 n LEU 193 Cb 0.06 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2nn6 n LEU 193 CO 0.90 0.13 0.00 0.80 -1.33 0.00 0.00 177.39 177.89 2nn6 n MET 194 N -0.23 0.00 -3.59 3.23 0.00 -0.13 -4.74 117.12 111.66 2nn6 n MET 194 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 57.70 57.60 2nn6 n MET 194 Cb 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.28 2nn6 n MET 194 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2nn6 s SER 195 N 0.00 -0.52 -0.15 6.12 0.15 -1.26 0.28 113.70 118.32 2nn6 s SER 195 Ca 0.00 0.76 -0.09 0.00 0.70 0.00 0.00 55.95 57.32 2nn6 s SER 195 Cb 0.00 0.69 0.05 0.00 -1.71 0.00 0.00 66.02 65.05 2nn6 s SER 195 CO 0.00 -0.34 0.36 -0.55 1.20 0.00 0.00 173.24 173.91 2nn6 s SER 196 N -0.54 -0.43 0.11 5.45 0.15 -1.09 -5.01 113.70 112.34 2nn6 s SER 196 Ca -0.02 0.77 -0.21 0.00 0.70 0.00 0.00 55.95 57.19 2nn6 s SER 196 Cb -0.02 0.69 0.05 0.00 -1.71 0.00 0.00 66.02 65.03 2nn6 s SER 196 CO 0.01 -0.17 0.51 -0.89 1.20 0.00 0.00 173.24 173.91 2nn6 s THR 197 N 1.05 0.03 -0.05 6.45 2.01 -1.26 -3.30 115.64 120.56 2nn6 s THR 197 Ca -0.07 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.69 2nn6 s THR 197 Cb -0.07 -1.04 0.01 0.00 0.01 0.00 0.00 72.50 71.41 2nn6 s THR 197 CO -0.08 -0.15 -0.10 -0.54 -0.69 0.00 0.00 174.62 173.06 2nn6 s LYS 198 N -3.26 1.37 0.00 4.92 3.01 -1.12 -5.06 119.74 119.60 2nn6 s LYS 198 Ca -0.01 -0.35 0.00 0.00 -1.01 0.00 0.00 55.97 54.61 2nn6 s LYS 198 Cb 0.00 -1.19 0.00 0.00 -1.01 0.00 0.00 37.83 35.63 2nn6 s LYS 198 CO -0.08 0.05 0.00 0.41 0.51 0.00 0.00 175.35 176.23 2nn6 n GLY 199 N 3.67 -1.61 1.13 -3.33 0.00 -1.26 -1.85 105.19 101.94 2nn6 n GLY 199 Ca -0.22 -1.07 -0.03 0.00 0.00 0.00 0.00 46.02 44.70 2nn6 n GLY 199 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2nn6 n LEU 200 N 0.00 4.08 -4.94 0.99 4.77 -0.87 -4.95 117.00 116.08 2nn6 n LEU 200 Ca 0.00 -3.71 -0.24 0.00 -0.03 0.00 0.00 56.01 52.02 2nn6 n LEU 200 Cb 0.00 -0.63 0.01 0.00 -2.33 0.00 0.00 43.42 40.47 2nn6 n LEU 200 CO 0.00 1.21 0.31 -0.72 -1.33 0.00 0.00 177.39 176.86 2nn6 s TYR 201 N -3.21 3.34 0.00 -1.77 -0.85 -1.26 -5.01 117.35 108.58 2nn6 s TYR 201 Ca 0.44 0.38 0.00 0.00 -0.52 0.00 0.00 57.07 57.38 2nn6 s TYR 201 Cb 0.40 -2.26 0.00 0.00 0.38 0.00 0.00 41.96 40.48 2nn6 s TYR 201 CO 0.00 -0.28 0.00 -1.13 -1.52 0.00 0.00 175.55 172.62 2nn6 n SER 202 N -2.09 1.90 -0.07 -0.18 3.41 -1.26 -4.95 113.62 110.38 2nn6 n SER 202 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 2nn6 n SER 202 Cb 0.57 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.47 2nn6 n SER 202 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2nn6 h ASP 203 N 0.00 0.38 -0.15 4.04 3.58 -2.00 0.13 116.42 122.41 2nn6 h ASP 203 Ca 0.00 -0.35 0.04 0.00 0.42 0.00 0.00 57.03 57.14 2nn6 h ASP 203 Cb 0.00 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 40.94 2nn6 h ASP 203 CO 0.00 0.64 0.48 0.71 -2.88 0.00 0.00 179.24 178.19 2nn6 h THR 204 N 0.11 0.09 0.00 2.25 1.35 -2.01 -1.54 112.91 113.16 2nn6 h THR 204 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.91 2nn6 h THR 204 Cb 0.47 0.55 0.00 0.00 -1.73 0.00 0.00 68.15 67.44 2nn6 h THR 204 CO 0.02 0.00 -0.10 -0.33 -0.25 0.00 0.00 175.52 174.85 2nn6 h GLU 205 N 0.00 0.00 0.00 4.72 4.39 -1.62 -3.38 114.58 118.69 2nn6 h GLU 205 Ca 0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2nn6 h GLU 205 Cb 1.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 2nn6 h GLU 205 CO -0.00 0.00 0.51 -0.11 -1.16 0.00 0.00 179.01 178.25 2nn6 n LEU 206 N -2.84 0.03 0.00 1.33 7.94 0.35 -3.14 117.00 120.67 2nn6 n LEU 206 Ca -0.01 0.16 0.00 0.00 -1.11 0.00 0.00 56.01 55.05 2nn6 n LEU 206 Cb 0.05 -0.09 0.00 0.00 0.53 0.00 0.00 43.42 43.92 2nn6 n LEU 206 CO 0.02 -0.17 0.00 0.00 -1.11 0.00 0.00 177.39 176.13 2nn6 n GLN 207 N -1.35 0.00 0.27 1.96 10.64 -0.66 -3.77 117.38 124.47 2nn6 n GLN 207 Ca -0.00 0.38 -0.16 0.00 -1.83 0.00 0.00 57.00 55.38 2nn6 n GLN 207 Cb 0.51 -0.88 -0.08 0.00 -0.86 0.00 0.00 30.24 28.93 2nn6 n GLN 207 CO 0.00 0.00 0.00 1.96 -1.83 0.00 0.00 177.06 177.19 2nn6 h GLN 208 N 0.00 -0.77 -0.84 2.61 7.50 -1.78 -2.04 115.11 119.79 2nn6 h GLN 208 Ca 0.00 0.05 0.17 0.00 0.50 0.00 0.00 58.65 59.38 2nn6 h GLN 208 Cb 0.00 0.18 -0.16 0.00 0.05 0.00 0.00 27.48 27.55 2nn6 h GLN 208 CO 0.00 -0.51 -0.19 0.00 -1.50 0.00 0.00 178.83 176.63 2nn6 h LEU 210 N 0.01 -0.87 -0.55 0.00 5.85 -1.60 3.35 115.31 121.50 2nn6 h LEU 210 Ca 0.41 0.04 0.11 0.00 0.84 0.00 0.00 57.88 59.29 2nn6 h LEU 210 Cb 0.65 0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.83 2nn6 h LEU 210 CO -0.86 -0.58 -0.00 0.00 -0.34 0.00 0.00 178.44 176.66 2nn6 h ALA 211 N -0.62 0.53 -0.29 1.25 0.00 0.65 0.64 119.26 121.42 2nn6 h ALA 211 Ca -0.08 0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2nn6 h ALA 211 Cb 0.74 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2nn6 h ALA 211 CO 0.12 -0.39 0.16 0.00 0.00 0.00 0.00 179.25 179.14 2nn6 h ALA 212 N 1.50 0.35 -1.10 0.00 0.00 0.76 0.37 119.26 121.15 2nn6 h ALA 212 Ca 0.28 -0.00 0.32 0.00 0.00 0.00 0.00 54.91 55.51 2nn6 h ALA 212 Cb 0.44 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 2nn6 h ALA 212 CO -0.47 -0.21 0.79 0.00 0.00 0.00 0.00 179.25 179.36 2nn6 h ALA 213 N 1.13 3.02 0.79 0.00 0.00 1.17 0.27 119.26 125.64 2nn6 h ALA 213 Ca 0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2nn6 h ALA 213 Cb -0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2nn6 h ALA 213 CO -0.05 -1.34 -0.43 1.96 0.00 0.00 0.00 179.25 179.39 2nn6 h GLN 214 N 0.01 -1.09 -0.93 0.00 7.50 0.28 0.18 115.11 121.05 2nn6 h GLN 214 Ca 0.52 0.07 0.19 0.00 0.50 0.00 0.00 58.65 59.94 2nn6 h GLN 214 Cb 2.08 0.25 -0.11 0.00 0.05 0.00 0.00 27.48 29.75 2nn6 h GLN 214 CO -0.01 -0.72 0.51 0.00 -1.50 0.00 0.00 178.83 177.11 2nn6 h ALA 215 N -1.36 1.52 0.32 3.87 0.00 -0.40 0.37 119.26 123.59 2nn6 h ALA 215 Ca -0.11 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2nn6 h ALA 215 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2nn6 h ALA 215 CO 0.15 -0.14 -0.16 0.00 0.00 0.00 0.00 179.25 179.10 2nn6 h ALA 216 N 1.64 -0.43 -0.88 0.00 0.00 -0.97 -2.71 119.26 115.90 2nn6 h ALA 216 Ca 0.55 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.40 2nn6 h ALA 216 Cb 0.89 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 2nn6 h ALA 216 CO -0.41 -0.67 0.53 0.66 0.00 0.00 0.00 179.25 179.35 2nn6 h SER 217 N -0.58 0.80 -1.01 0.00 4.64 0.81 0.10 113.55 118.32 2nn6 h SER 217 Ca -0.04 0.03 0.24 0.00 -0.47 0.00 0.00 61.79 61.55 2nn6 h SER 217 Cb 0.42 -0.13 -0.10 0.00 -0.31 0.00 0.00 62.40 62.28 2nn6 h SER 217 CO 0.07 0.48 0.63 1.56 -0.87 0.00 0.00 176.83 178.71 2nn6 h GLN 218 N 0.92 0.52 0.19 4.77 4.20 -0.01 0.24 115.11 125.95 2nn6 h GLN 218 Ca 0.40 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 59.07 2nn6 h GLN 218 Cb 0.28 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2nn6 h GLN 218 CO -0.21 0.35 -0.09 0.45 -0.67 0.00 0.00 178.83 178.65 2nn6 h HIS 219 N 0.54 -0.24 -0.20 2.96 3.86 -0.56 0.09 115.15 121.59 2nn6 h HIS 219 Ca 0.60 -0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.85 2nn6 h HIS 219 Cb 1.26 0.08 -0.07 0.00 1.06 0.00 0.00 27.41 29.74 2nn6 h HIS 219 CO -0.00 0.09 -0.41 0.28 0.86 0.00 0.00 177.93 178.75 2nn6 h VAL 220 N -0.60 0.15 -0.97 2.45 2.07 -1.02 1.23 116.25 119.56 2nn6 h VAL 220 Ca -0.03 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.72 2nn6 h VAL 220 Cb 0.44 0.15 -0.08 0.00 -1.52 0.00 0.00 31.29 30.29 2nn6 h VAL 220 CO 0.04 0.00 0.63 -0.26 0.02 0.00 0.00 177.57 178.01 2nn6 h PHE 221 N -0.44 0.60 -0.09 1.57 0.05 -0.47 0.28 116.94 118.44 2nn6 h PHE 221 Ca 0.09 0.02 -0.13 0.00 3.82 0.00 0.00 57.97 61.77 2nn6 h PHE 221 Cb 0.61 -0.18 0.01 0.00 2.00 0.00 0.00 35.95 38.38 2nn6 h PHE 221 CO -0.51 0.12 -0.45 0.00 -0.18 0.00 0.00 178.31 177.28 2nn6 h ARG 222 N 0.42 0.46 -0.56 1.51 3.08 0.26 -3.20 114.38 116.35 2nn6 h ARG 222 Ca 0.52 -0.38 0.11 0.00 0.07 0.00 0.00 59.98 60.31 2nn6 h ARG 222 Cb 1.30 0.08 -0.10 0.00 0.08 0.00 0.00 29.97 31.33 2nn6 h ARG 222 CO -0.23 1.01 -0.03 0.35 -1.07 0.00 0.00 179.97 180.01 2nn6 h PHE 223 N 0.03 -0.09 -0.36 3.04 3.57 0.46 -2.17 116.94 121.41 2nn6 h PHE 223 Ca -0.03 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.55 2nn6 h PHE 223 Cb 1.10 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.90 2nn6 h PHE 223 CO 0.12 -0.16 -0.49 1.88 -2.23 0.00 0.00 178.31 177.43 2nn6 h TYR 224 N 0.09 -1.49 -0.71 0.41 -1.99 -1.08 -0.74 116.97 111.46 2nn6 h TYR 224 Ca 0.28 0.07 0.07 0.00 2.00 0.00 0.00 58.73 61.16 2nn6 h TYR 224 Cb 0.44 0.70 -0.10 0.00 2.00 0.00 0.00 36.73 39.77 2nn6 h TYR 224 CO -0.37 -0.43 -0.57 0.00 -0.00 0.00 0.00 178.16 176.80 2nn6 h ARG 225 N -0.34 -0.19 0.07 4.88 3.08 -1.42 0.65 114.38 121.11 2nn6 h ARG 225 Ca 0.06 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.14 2nn6 h ARG 225 Cb 0.52 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.56 2nn6 h ARG 225 CO -0.52 -0.12 -0.51 1.49 -1.07 0.00 0.00 179.97 179.24 2nn6 h GLU 226 N -0.19 -0.68 -0.58 0.04 4.81 -1.09 0.20 114.58 117.10 2nn6 h GLU 226 Ca 0.12 0.05 0.11 0.00 -0.13 0.00 0.00 59.36 59.51 2nn6 h GLU 226 Cb 0.50 0.15 -0.08 0.00 0.63 0.00 0.00 28.75 29.95 2nn6 h GLU 226 CO -0.77 -0.45 0.11 0.77 -0.73 0.00 0.00 179.01 177.93 2nn6 h SER 227 N -0.70 -0.02 -0.00 1.04 0.02 0.38 0.95 113.55 115.21 2nn6 h SER 227 Ca 0.01 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2nn6 h SER 227 Cb 0.73 0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.43 2nn6 h SER 227 CO -0.31 0.00 0.01 -0.07 -1.14 0.00 0.00 176.83 175.32 2nn6 h LEU 228 N 0.24 0.00 -0.87 5.07 3.38 0.14 1.36 115.31 124.63 2nn6 h LEU 228 Ca 0.30 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.16 2nn6 h LEU 228 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2nn6 h LEU 228 CO -0.39 0.00 -0.42 1.56 0.09 0.00 0.00 178.44 179.28 2nn6 h GLN 229 N 0.00 0.30 0.84 1.13 4.20 0.40 -2.97 115.11 119.01 2nn6 h GLN 229 Ca 0.00 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.52 2nn6 h GLN 229 Cb 0.01 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.80 2nn6 h GLN 229 CO -0.00 0.67 -0.40 0.00 -0.67 0.00 0.00 178.83 178.43 2nn6 h ARG 230 N 0.25 -1.08 -0.53 1.46 2.47 0.26 0.11 114.38 117.31 2nn6 h ARG 230 Ca 0.02 0.07 0.11 0.00 -1.26 0.00 0.00 59.98 58.92 2nn6 h ARG 230 Cb 0.85 0.25 -0.09 0.00 -1.65 0.00 0.00 29.97 29.32 2nn6 h ARG 230 CO 0.07 -0.71 -0.04 0.00 0.56 0.00 0.00 179.97 179.85 2nn6 h ARG 231 N -1.20 0.08 -0.12 0.04 2.47 -1.41 0.49 114.38 114.72 2nn6 h ARG 231 Ca -0.11 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 2nn6 h ARG 231 Cb 0.87 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.17 2nn6 h ARG 231 CO 0.19 0.05 0.00 0.66 0.56 0.00 0.00 179.97 181.43 2nn6 n TYR 232 N -5.28 0.15 -0.43 3.04 4.02 -1.13 -4.41 117.16 113.12 2nn6 n TYR 232 Ca 0.06 -0.08 0.37 0.00 -0.01 0.00 0.00 57.90 58.25 2nn6 n TYR 232 Cb 0.29 0.00 0.57 0.00 -0.02 0.00 0.00 39.34 40.19 2nn6 n TYR 232 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2nn6 n SER 233 N -0.16 0.00 -0.49 7.72 7.64 0.17 -1.25 113.62 127.25 2nn6 n SER 233 Ca 0.11 0.80 0.00 0.00 1.01 0.00 0.00 58.87 60.78 2nn6 n SER 233 Cb 0.17 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 2nn6 n SER 233 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2nn6 n LYS 234 N -3.40 0.00 0.00 1.43 5.02 -1.26 -5.07 118.16 114.88 2nn6 n LYS 234 Ca 0.31 -0.93 0.13 0.00 -2.02 0.00 0.00 58.31 55.80 2nn6 n LYS 234 Cb 1.62 -0.47 0.74 0.00 -0.02 0.00 0.00 35.03 36.91 2nn6 n LYS 234 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33