#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ct6 s SER 2 N 0.00 -0.45 0.11 1.61 1.04 -1.26 -5.17 113.70 109.57 2ct6 s SER 2 Ca 0.00 -0.05 0.06 0.00 0.48 0.00 0.00 55.95 56.43 2ct6 s SER 2 Cb 0.00 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.60 2ct6 s SER 2 CO 0.00 -0.85 -0.02 -0.55 0.98 0.00 0.00 173.24 172.80 2ct6 s SER 3 N -2.67 4.84 0.00 7.02 0.15 -1.26 -5.07 113.70 116.72 2ct6 s SER 3 Ca 0.04 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.42 2ct6 s SER 3 Cb -0.01 -1.08 0.00 0.00 -1.71 0.00 0.00 66.02 63.21 2ct6 s SER 3 CO -0.10 0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.11 2ct6 n GLY 4 N 0.44 1.53 2.61 9.45 0.00 -1.26 -5.05 105.19 112.91 2ct6 n GLY 4 Ca -0.11 0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 2ct6 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ct6 n SER 5 N 0.00 2.73 0.00 1.61 2.88 -1.26 -4.19 113.62 115.39 2ct6 n SER 5 Ca 0.00 -3.18 0.00 0.00 -1.33 0.00 0.00 58.87 54.36 2ct6 n SER 5 Cb 0.00 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 62.76 2ct6 n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2ct6 n SER 6 N 1.57 0.00 0.00 -3.46 7.64 -1.26 -5.15 113.62 112.96 2ct6 n SER 6 Ca 0.25 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2ct6 n SER 6 Cb 0.40 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2ct6 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ct6 n GLY 7 N 2.16 0.38 3.70 0.23 0.00 -1.26 -5.02 105.19 105.39 2ct6 n GLY 7 Ca 0.00 -1.35 -0.37 0.00 0.00 0.00 0.00 46.02 44.30 2ct6 n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ct6 s MET 8 N -4.99 4.20 -0.40 1.61 1.00 -1.26 -5.05 119.30 114.40 2ct6 s MET 8 Ca 0.00 0.02 -0.20 0.00 0.00 0.00 0.00 55.69 55.51 2ct6 s MET 8 Cb 0.00 -3.47 0.01 0.00 0.00 0.00 0.00 34.83 31.37 2ct6 s MET 8 CO 0.00 0.14 0.61 0.08 0.00 0.00 0.00 175.02 175.85 2ct6 s VAL 9 N 0.77 4.88 -1.23 -6.03 1.01 -1.26 -4.52 120.40 114.02 2ct6 s VAL 9 Ca 0.15 0.24 -0.20 0.00 0.00 0.00 0.00 61.98 62.17 2ct6 s VAL 9 Cb -0.13 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 2ct6 s VAL 9 CO 0.04 -0.46 1.87 -0.38 0.00 0.00 0.00 175.10 176.18 2ct6 n ILE 10 N 5.70 3.01 -1.54 2.22 2.08 -0.88 -3.46 119.36 126.49 2ct6 n ILE 10 Ca -0.02 -3.05 -0.39 0.00 0.56 0.00 0.00 62.75 59.85 2ct6 n ILE 10 Cb 0.48 -2.31 -0.05 0.00 -0.75 0.00 0.00 39.64 37.01 2ct6 n ILE 10 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2ct6 n ARG 11 N 8.00 1.01 -3.31 0.38 1.74 -0.25 -2.64 116.66 121.58 2ct6 n ARG 11 Ca 0.48 0.09 -0.45 0.00 -0.77 0.00 0.00 57.85 57.20 2ct6 n ARG 11 Cb 0.45 -3.05 -0.07 0.00 -1.02 0.00 0.00 32.46 28.77 2ct6 n ARG 11 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ct6 s VAL 12 N 10.85 5.13 0.15 1.55 1.01 0.48 -0.67 120.40 138.89 2ct6 s VAL 12 Ca 1.05 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 2ct6 s VAL 12 Cb -0.41 -4.22 -0.08 0.00 0.00 0.00 0.00 36.38 31.66 2ct6 s VAL 12 CO 0.33 -0.71 1.29 -0.36 0.00 0.00 0.00 175.10 175.64 2ct6 s PHE 13 N 1.91 3.32 0.03 5.22 0.40 -0.91 -0.34 117.98 127.62 2ct6 s PHE 13 Ca 0.07 1.21 0.01 0.00 -0.60 0.00 0.00 56.93 57.62 2ct6 s PHE 13 Cb -0.24 -3.56 -0.02 0.00 0.51 0.00 0.00 43.02 39.71 2ct6 s PHE 13 CO 0.07 -1.76 -0.06 0.96 0.70 0.00 0.00 175.22 175.13 2ct6 s ILE 14 N 0.50 0.37 -0.75 0.64 -4.36 0.75 -2.51 121.20 115.84 2ct6 s ILE 14 Ca 0.58 -1.04 0.04 0.00 -0.26 0.00 0.00 60.65 59.97 2ct6 s ILE 14 Cb -0.35 -0.50 0.20 0.00 1.25 0.00 0.00 42.46 43.06 2ct6 s ILE 14 CO 0.34 -0.45 0.62 0.00 0.24 0.00 0.00 174.94 175.70 2ct6 n ALA 15 N 1.47 3.65 -0.64 2.27 0.00 -1.26 0.19 120.51 126.19 2ct6 n ALA 15 Ca -0.23 -4.60 0.49 0.00 0.00 0.00 0.00 53.44 49.10 2ct6 n ALA 15 Cb 0.55 -1.18 0.76 0.00 0.00 0.00 0.00 19.45 19.58 2ct6 n ALA 15 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2ct6 n SER 16 N 1.83 0.04 -4.05 0.00 3.41 -1.26 -2.00 113.62 111.59 2ct6 n SER 16 Ca 0.22 1.03 -0.34 0.00 -0.26 0.00 0.00 58.87 59.52 2ct6 n SER 16 Cb 0.36 -0.51 -0.10 0.00 -0.26 0.00 0.00 64.21 63.70 2ct6 n SER 16 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2ct6 s SER 17 N -3.95 5.17 0.12 4.04 0.15 -1.26 -4.81 113.70 113.16 2ct6 s SER 17 Ca -0.05 -3.20 0.00 0.00 0.70 0.00 0.00 55.95 53.40 2ct6 s SER 17 Cb 0.27 -1.80 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 2ct6 s SER 17 CO 0.84 -0.27 0.00 -0.24 1.20 0.00 0.00 173.24 174.78 2ct6 n SER 18 N 2.97 0.94 0.00 5.45 2.88 -0.85 -4.88 113.62 120.14 2ct6 n SER 18 Ca 0.12 0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2ct6 n SER 18 Cb 0.36 -0.24 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 2ct6 n SER 18 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ct6 n GLY 19 N 3.25 1.93 3.47 0.46 0.00 -1.26 -5.04 105.19 108.00 2ct6 n GLY 19 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2ct6 n GLY 19 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ct6 s PHE 20 N -1.86 3.30 0.36 1.61 0.40 -1.26 -4.83 117.98 115.70 2ct6 s PHE 20 Ca 0.00 -1.82 0.18 0.00 -0.60 0.00 0.00 56.93 54.69 2ct6 s PHE 20 Cb 0.00 -4.34 1.19 0.00 0.51 0.00 0.00 43.02 40.38 2ct6 s PHE 20 CO 0.00 -1.47 1.65 -0.24 0.70 0.00 0.00 175.22 175.86 2ct6 h VAL 21 N 5.17 0.23 -0.62 -0.44 3.04 -1.99 1.30 116.25 122.94 2ct6 h VAL 21 Ca 0.27 -0.08 0.11 0.00 -1.01 0.00 0.00 66.70 65.99 2ct6 h VAL 21 Cb 0.93 -0.03 -0.08 0.00 -2.01 0.00 0.00 31.29 30.10 2ct6 h VAL 21 CO 1.22 0.04 0.17 0.00 -1.01 0.00 0.00 177.57 177.99 2ct6 h ALA 22 N 1.84 0.77 -0.16 3.17 0.00 -2.00 0.21 119.26 123.09 2ct6 h ALA 22 Ca 0.76 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.78 2ct6 h ALA 22 Cb 1.90 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 2ct6 h ALA 22 CO -0.60 -0.27 0.06 0.82 0.00 0.00 0.00 179.25 179.27 2ct6 h ILE 23 N 0.32 1.16 -1.00 0.00 2.04 0.13 -2.21 117.51 117.94 2ct6 h ILE 23 Ca 0.33 -0.48 0.18 0.00 1.00 0.00 0.00 64.86 65.89 2ct6 h ILE 23 Cb 0.47 1.18 -0.10 0.00 -0.74 0.00 0.00 36.82 37.62 2ct6 h ILE 23 CO -0.38 0.15 0.62 0.50 0.00 0.00 0.00 178.15 179.03 2ct6 h LYS 24 N 0.10 0.79 0.86 2.37 3.64 -0.26 0.17 116.57 124.24 2ct6 h LYS 24 Ca 0.05 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 2ct6 h LYS 24 Cb 0.18 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2ct6 h LYS 24 CO -0.00 0.52 -0.46 0.87 -2.27 0.00 0.00 179.45 178.10 2ct6 h LYS 25 N 0.81 -1.17 -0.42 1.90 1.79 -0.11 -2.78 116.57 116.58 2ct6 h LYS 25 Ca 0.56 0.08 0.09 0.00 -2.18 0.00 0.00 60.65 59.20 2ct6 h LYS 25 Cb 0.81 0.27 -0.09 0.00 -1.58 0.00 0.00 32.23 31.64 2ct6 h LYS 25 CO -0.36 -0.78 -0.26 0.87 -1.08 0.00 0.00 179.45 177.84 2ct6 h LYS 26 N -1.22 -0.17 -1.42 3.15 1.57 -0.72 0.38 116.57 118.14 2ct6 h LYS 26 Ca -0.12 0.01 0.48 0.00 -1.87 0.00 0.00 60.65 59.16 2ct6 h LYS 26 Cb 0.95 0.04 -0.13 0.00 0.08 0.00 0.00 32.23 33.17 2ct6 h LYS 26 CO 0.16 -0.11 0.93 1.04 -0.57 0.00 0.00 179.45 180.89 2ct6 n GLN 27 N -5.40 -0.03 0.01 3.15 6.02 0.51 -0.76 117.38 120.88 2ct6 n GLN 27 Ca 0.02 1.23 -0.01 0.00 -0.01 0.00 0.00 57.00 58.23 2ct6 n GLN 27 Cb 0.32 -2.45 -0.00 0.00 1.02 0.00 0.00 30.24 29.12 2ct6 n GLN 27 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 2ct6 h GLN 28 N 0.00 -0.03 -1.34 -1.09 4.20 0.02 -2.87 115.11 113.99 2ct6 h GLN 28 Ca 0.88 0.00 0.43 0.00 0.06 0.00 0.00 58.65 60.02 2ct6 h GLN 28 Cb 2.90 0.01 -0.10 0.00 0.30 0.00 0.00 27.48 30.59 2ct6 h GLN 28 CO -0.42 -0.02 0.91 -3.47 -0.67 0.00 0.00 178.83 175.16 2ct6 n ASP 29 N -2.20 0.11 0.17 1.46 2.03 -0.18 0.22 116.55 118.15 2ct6 n ASP 29 Ca -0.00 1.03 -0.07 0.00 0.52 0.00 0.00 54.79 56.27 2ct6 n ASP 29 Cb 0.01 -0.51 -0.03 0.00 -0.72 0.00 0.00 41.12 39.87 2ct6 n ASP 29 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2ct6 h VAL 30 N 0.00 0.00 -0.19 5.18 2.07 -0.95 -2.18 116.25 120.18 2ct6 h VAL 30 Ca 0.75 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 68.20 2ct6 h VAL 30 Cb 2.67 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 2ct6 h VAL 30 CO -0.24 0.00 0.04 -0.37 0.02 0.00 0.00 177.57 177.02 2ct6 h VAL 31 N -0.49 1.21 -0.92 2.57 -1.51 0.61 -2.97 116.25 114.76 2ct6 h VAL 31 Ca -0.04 -0.67 0.15 0.00 -1.23 0.00 0.00 66.70 64.90 2ct6 h VAL 31 Cb 0.33 1.30 -0.15 0.00 -2.13 0.00 0.00 31.29 30.64 2ct6 h VAL 31 CO 0.07 0.21 -0.34 0.54 -1.23 0.00 0.00 177.57 176.82 2ct6 n ARG 32 N -4.78 -0.19 -0.01 5.19 5.12 0.59 0.18 116.66 122.76 2ct6 n ARG 32 Ca -0.04 1.41 -0.10 0.00 -1.93 0.00 0.00 57.85 57.19 2ct6 n ARG 32 Cb 0.17 -2.10 -0.04 0.00 -1.16 0.00 0.00 32.46 29.33 2ct6 n ARG 32 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 2ct6 h PHE 33 N 0.00 -0.03 -0.39 -1.55 3.04 -1.27 0.76 116.94 117.50 2ct6 h PHE 33 Ca 0.34 0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.30 2ct6 h PHE 33 Cb 0.57 0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.09 2ct6 h PHE 33 CO -0.79 -0.03 0.26 -0.07 -2.02 0.00 0.00 178.31 175.66 2ct6 h LEU 34 N 0.03 0.44 -0.23 0.59 3.38 0.41 0.86 115.31 120.79 2ct6 h LEU 34 Ca 0.06 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2ct6 h LEU 34 Cb 0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2ct6 h LEU 34 CO -0.11 0.32 0.13 -0.33 0.09 0.00 0.00 178.44 178.54 2ct6 h GLU 35 N 0.52 0.32 0.00 1.13 4.39 0.23 1.89 114.58 123.07 2ct6 h GLU 35 Ca 0.14 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2ct6 h GLU 35 Cb -0.06 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 2ct6 h GLU 35 CO -0.03 0.28 -0.13 0.00 -1.16 0.00 0.00 179.01 177.96 2ct6 h ALA 36 N 1.03 1.10 -0.52 3.43 0.00 0.92 -0.96 119.26 124.26 2ct6 h ALA 36 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ct6 h ALA 36 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2ct6 h ALA 36 CO -0.01 0.17 0.00 0.09 0.00 0.00 0.00 179.25 179.49 2ct6 n ASN 37 N -3.39 3.55 -4.22 0.00 3.02 0.30 -4.94 115.26 109.57 2ct6 n ASN 37 Ca -0.01 -1.98 -0.35 0.00 -0.03 0.00 0.00 54.58 52.22 2ct6 n ASN 37 Cb 0.32 -0.34 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 2ct6 n ASN 37 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ct6 n LYS 38 N 1.41 -2.86 -3.41 3.52 4.76 0.48 -4.90 118.16 117.14 2ct6 n LYS 38 Ca 0.20 0.34 -0.33 0.00 -2.87 0.00 0.00 58.31 55.65 2ct6 n LYS 38 Cb 0.58 -4.91 -0.05 0.00 -1.84 0.00 0.00 35.03 28.80 2ct6 n LYS 38 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ct6 s ILE 39 N -3.44 4.92 0.23 -0.18 1.01 0.53 -4.98 121.20 119.29 2ct6 s ILE 39 Ca 0.61 0.57 -0.30 0.00 0.00 0.00 0.00 60.65 61.53 2ct6 s ILE 39 Cb -0.33 -3.66 -0.09 0.00 0.01 0.00 0.00 42.46 38.39 2ct6 s ILE 39 CO 0.94 0.06 1.19 -0.70 0.00 0.00 0.00 174.94 176.42 2ct6 s GLU 40 N -2.48 4.51 -0.09 2.79 2.12 -1.26 -4.58 118.70 119.71 2ct6 s GLU 40 Ca 0.43 1.90 -0.32 0.00 0.36 0.00 0.00 54.97 57.34 2ct6 s GLU 40 Cb -0.13 -3.21 0.13 0.00 0.26 0.00 0.00 34.13 31.19 2ct6 s GLU 40 CO 0.20 -0.02 1.42 -0.59 -0.54 0.00 0.00 175.26 175.73 2ct6 s PHE 41 N -0.45 -0.00 -0.11 5.30 -0.12 -1.26 -2.06 117.98 119.27 2ct6 s PHE 41 Ca 0.50 -0.01 -0.13 0.00 -0.05 0.00 0.00 56.93 57.24 2ct6 s PHE 41 Cb -0.33 0.51 0.03 0.00 -0.63 0.00 0.00 43.02 42.60 2ct6 s PHE 41 CO 0.39 -0.03 0.36 -1.83 -0.05 0.00 0.00 175.22 174.06 2ct6 s GLU 42 N -2.03 0.47 -1.03 1.99 -1.05 -1.08 -4.76 118.70 111.20 2ct6 s GLU 42 Ca 0.20 0.38 -0.17 0.00 -0.15 0.00 0.00 54.97 55.23 2ct6 s GLU 42 Cb 0.06 0.22 0.14 0.00 -0.44 0.00 0.00 34.13 34.11 2ct6 s GLU 42 CO -0.06 -0.08 1.25 -1.21 0.95 0.00 0.00 175.26 176.12 2ct6 s GLU 43 N -0.08 3.77 -0.78 -4.83 2.02 -1.25 0.18 118.70 117.72 2ct6 s GLU 43 Ca -0.02 -2.02 -0.25 0.00 0.02 0.00 0.00 54.97 52.70 2ct6 s GLU 43 Cb -0.03 -5.00 -0.04 0.00 0.10 0.00 0.00 34.13 29.16 2ct6 s GLU 43 CO 0.01 -1.80 1.95 0.08 0.02 0.00 0.00 175.26 175.52 2ct6 s VAL 44 N 2.43 3.39 -0.66 2.63 1.01 0.54 -4.77 120.40 124.97 2ct6 s VAL 44 Ca 0.37 -0.14 -0.26 0.00 0.00 0.00 0.00 61.98 61.95 2ct6 s VAL 44 Cb -0.04 -3.92 -0.06 0.00 0.00 0.00 0.00 36.38 32.36 2ct6 s VAL 44 CO -0.06 -0.87 2.16 -0.62 0.00 0.00 0.00 175.10 175.71 2ct6 s ASP 45 N 8.28 4.70 0.27 3.32 -1.08 -1.25 -0.18 116.67 130.72 2ct6 s ASP 45 Ca 0.71 0.33 0.03 0.00 -0.52 0.00 0.00 52.55 53.09 2ct6 s ASP 45 Cb -0.09 -2.53 0.38 0.00 -1.46 0.00 0.00 42.92 39.22 2ct6 s ASP 45 CO 0.08 -2.92 1.69 0.16 0.52 0.00 0.00 175.17 174.70 2ct6 h ILE 46 N 7.38 1.28 -0.56 4.11 3.07 0.19 -0.79 117.51 132.19 2ct6 h ILE 46 Ca -0.13 -1.40 0.04 0.00 1.55 0.00 0.00 64.86 64.91 2ct6 h ILE 46 Cb 1.13 1.48 -0.04 0.00 -0.27 0.00 0.00 36.82 39.12 2ct6 h ILE 46 CO 1.16 0.44 0.32 0.74 -1.05 0.00 0.00 178.15 179.75 2ct6 h THR 47 N 0.37 1.01 -0.01 0.16 2.02 -1.85 -2.96 112.91 111.67 2ct6 h THR 47 Ca 0.05 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 2ct6 h THR 47 Cb 0.76 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 2ct6 h THR 47 CO 0.06 0.11 -0.04 0.24 0.37 0.00 0.00 175.52 176.27 2ct6 h MET 48 N 0.62 0.04 -4.77 6.66 2.86 -1.82 -3.41 114.93 115.12 2ct6 h MET 48 Ca 0.24 -0.03 -0.70 0.00 -2.06 0.00 0.00 59.70 57.14 2ct6 h MET 48 Cb 0.08 0.01 -0.19 0.00 0.06 0.00 0.00 31.60 31.56 2ct6 h MET 48 CO -0.13 0.66 -0.18 -1.12 1.06 0.00 0.00 176.91 177.21 2ct6 s SER 49 N -5.91 6.19 0.19 1.22 0.01 -0.32 -4.93 113.70 110.16 2ct6 s SER 49 Ca -0.16 -0.87 -0.10 0.00 1.31 0.00 0.00 55.95 56.13 2ct6 s SER 49 Cb 0.01 -2.23 0.12 0.00 0.21 0.00 0.00 66.02 64.13 2ct6 s SER 49 CO 0.69 -0.66 1.77 -0.08 0.41 0.00 0.00 173.24 175.36 2ct6 h GLU 50 N 8.79 1.04 0.04 12.44 4.81 -1.80 -2.96 114.58 136.94 2ct6 h GLU 50 Ca -0.27 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2ct6 h GLU 50 Cb 1.11 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 2ct6 h GLU 50 CO 0.85 0.85 -0.14 1.49 -0.73 0.00 0.00 179.01 181.32 2ct6 h GLU 51 N 1.00 -0.20 -0.94 1.92 4.81 -1.91 -0.23 114.58 119.02 2ct6 h GLU 51 Ca 0.24 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.58 2ct6 h GLU 51 Cb 0.17 0.05 -0.12 0.00 0.63 0.00 0.00 28.75 29.48 2ct6 h GLU 51 CO -0.02 -0.13 -0.50 1.04 -0.73 0.00 0.00 179.01 178.66 2ct6 n GLN 52 N -3.26 -0.36 -0.18 1.92 1.13 -1.21 0.38 117.38 115.79 2ct6 n GLN 52 Ca -0.02 1.42 -0.05 0.00 -1.94 0.00 0.00 57.00 56.41 2ct6 n GLN 52 Cb 0.11 -2.10 0.02 0.00 0.11 0.00 0.00 30.24 28.38 2ct6 n GLN 52 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 2ct6 h ARG 53 N 0.00 -0.14 -0.03 -1.09 2.43 -1.31 0.25 114.38 114.50 2ct6 h ARG 53 Ca 0.20 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.41 2ct6 h ARG 53 Cb 0.43 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.96 2ct6 h ARG 53 CO -0.89 -0.09 -0.44 1.96 -1.51 0.00 0.00 179.97 178.99 2ct6 h GLN 54 N -0.15 -0.55 -0.64 0.20 1.08 0.18 0.17 115.11 115.40 2ct6 h GLN 54 Ca 0.24 0.04 0.13 0.00 -1.45 0.00 0.00 58.65 57.61 2ct6 h GLN 54 Cb 0.53 0.13 -0.11 0.00 -0.05 0.00 0.00 27.48 27.98 2ct6 h GLN 54 CO -0.64 -0.37 0.02 2.35 -0.95 0.00 0.00 178.83 179.24 2ct6 h TRP 55 N -0.58 -0.01 -0.88 2.96 7.01 0.25 0.39 115.95 125.09 2ct6 h TRP 55 Ca 0.05 0.05 0.12 0.00 2.11 0.00 0.00 58.89 61.21 2ct6 h TRP 55 Cb 0.66 0.10 -0.08 0.00 -2.10 0.00 0.00 29.16 27.74 2ct6 h TRP 55 CO -0.45 -0.16 0.50 1.98 -2.79 0.00 0.00 178.44 177.53 2ct6 h MET 56 N 0.13 0.77 0.00 2.65 4.05 0.11 0.63 114.93 123.27 2ct6 h MET 56 Ca 0.34 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.71 2ct6 h MET 56 Cb 0.55 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 2ct6 h MET 56 CO -0.53 0.51 0.00 0.66 0.23 0.00 0.00 176.91 177.78 2ct6 n TYR 57 N -4.75 0.00 0.36 1.39 4.02 0.13 -1.62 117.16 116.68 2ct6 n TYR 57 Ca 0.16 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 58.12 2ct6 n TYR 57 Cb 0.35 -0.15 -0.10 0.00 -0.02 0.00 0.00 39.34 39.42 2ct6 n TYR 57 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2ct6 n LYS 58 N -1.15 1.38 -1.78 -0.72 5.02 0.21 -4.40 118.16 116.71 2ct6 n LYS 58 Ca 0.11 -0.06 -0.24 0.00 -2.02 0.00 0.00 58.31 56.10 2ct6 n LYS 58 Cb 0.11 -1.26 0.05 0.00 -0.02 0.00 0.00 35.03 33.90 2ct6 n LYS 58 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ct6 n ASN 59 N -1.66 5.18 -3.54 4.39 3.02 -0.41 -4.93 115.26 117.32 2ct6 n ASN 59 Ca 0.00 -3.77 -0.10 0.00 -0.03 0.00 0.00 54.58 50.69 2ct6 n ASN 59 Cb 0.30 -0.48 -0.10 0.00 -0.61 0.00 0.00 39.78 38.90 2ct6 n ASN 59 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2ct6 s VAL 60 N -4.52 -0.59 0.91 2.41 1.01 -1.16 -4.80 120.40 113.66 2ct6 s VAL 60 Ca 0.53 0.09 -0.12 0.00 0.00 0.00 0.00 61.98 62.47 2ct6 s VAL 60 Cb 0.43 -0.69 0.14 0.00 0.00 0.00 0.00 36.38 36.25 2ct6 s VAL 60 CO 0.02 -0.00 1.14 -2.16 0.00 0.00 0.00 175.10 174.10 2ct6 s PRO 61 N 2.55 1.17 0.25 2.72 0.04 -1.26 -4.87 135.00 135.60 2ct6 s PRO 61 Ca 0.05 0.30 0.11 0.00 0.04 0.00 0.00 61.00 61.50 2ct6 s PRO 61 Cb -0.13 -1.84 0.23 0.00 0.04 0.00 0.00 34.50 32.79 2ct6 s PRO 61 CO -0.13 -2.18 1.53 -1.00 0.04 0.00 0.00 177.00 175.26 2ct6 h PRO 62 N -1.49 0.00 0.00 0.56 0.13 -1.98 -0.51 132.00 128.72 2ct6 h PRO 62 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2ct6 h PRO 62 Cb 1.33 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 2ct6 h PRO 62 CO 0.62 0.68 -0.10 1.05 -0.23 0.00 0.00 178.00 180.02 2ct6 h GLU 63 N 0.00 0.00 0.00 0.86 4.11 -2.02 -2.75 114.58 114.78 2ct6 h GLU 63 Ca -0.01 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 59.07 2ct6 h GLU 63 Cb 1.27 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.46 2ct6 h GLU 63 CO 0.09 0.10 -2.26 1.63 0.07 0.00 0.00 179.01 178.63 2ct6 n LYS 64 N -3.32 0.68 -1.61 1.06 4.76 -1.11 -4.96 118.16 113.65 2ct6 n LYS 64 Ca -0.01 0.08 -0.63 0.00 -2.87 0.00 0.00 58.31 54.88 2ct6 n LYS 64 Cb 0.30 -1.58 -0.09 0.00 -1.84 0.00 0.00 35.03 31.82 2ct6 n LYS 64 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2ct6 n LYS 65 N -2.89 0.02 -1.56 1.97 5.02 -0.22 -4.89 118.16 115.62 2ct6 n LYS 65 Ca -0.32 0.01 -0.30 0.00 -2.02 0.00 0.00 58.31 55.68 2ct6 n LYS 65 Cb 1.12 -1.51 0.08 0.00 -0.02 0.00 0.00 35.03 34.69 2ct6 n LYS 65 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2ct6 s PRO 66 N 1.37 2.35 0.14 1.97 0.04 -1.26 -4.69 135.00 134.93 2ct6 s PRO 66 Ca 0.97 0.73 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2ct6 s PRO 66 Cb -1.37 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2ct6 s PRO 66 CO 0.68 -1.45 0.00 2.41 0.04 0.00 0.00 177.00 178.68 2ct6 n THR 67 N -3.34 0.00 -3.62 1.26 -1.04 -1.26 -4.34 114.28 101.95 2ct6 n THR 67 Ca 0.07 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.97 2ct6 n THR 67 Cb 0.55 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 69.00 2ct6 n THR 67 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ct6 s GLN 68 N 0.00 0.60 0.52 -2.82 -2.07 -1.26 -5.15 119.66 109.48 2ct6 s GLN 68 Ca 0.00 0.58 0.00 0.00 -1.82 0.00 0.00 55.36 54.12 2ct6 s GLN 68 Cb 0.00 0.29 0.00 0.00 -1.09 0.00 0.00 33.01 32.21 2ct6 s GLN 68 CO 0.00 -0.10 0.00 0.41 -1.32 0.00 0.00 175.29 174.28 2ct6 n GLY 69 N 2.00 -1.81 3.07 2.60 0.00 -1.26 -4.97 105.19 104.81 2ct6 n GLY 69 Ca -0.13 -1.79 -0.37 0.00 0.00 0.00 0.00 46.02 43.74 2ct6 n GLY 69 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ct6 n ASN 70 N 0.26 -5.41 -4.78 1.61 0.23 -1.26 -4.71 115.26 101.21 2ct6 n ASN 70 Ca 0.00 0.30 -0.37 0.00 -0.53 0.00 0.00 54.58 53.99 2ct6 n ASN 70 Cb 0.00 -0.79 -0.04 0.00 -2.08 0.00 0.00 39.78 36.87 2ct6 n ASN 70 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 2ct6 s PRO 71 N -1.76 4.18 0.21 -0.53 0.04 -1.26 -4.72 135.00 131.16 2ct6 s PRO 71 Ca 0.44 1.54 0.09 0.00 0.04 0.00 0.00 61.00 63.11 2ct6 s PRO 71 Cb -0.26 -2.58 -0.05 0.00 0.04 0.00 0.00 34.50 31.66 2ct6 s PRO 71 CO 0.79 -0.13 -0.17 -0.51 0.04 0.00 0.00 177.00 177.02 2ct6 s LEU 72 N -2.58 2.53 0.90 -3.56 1.43 -1.26 -4.95 118.68 111.19 2ct6 s LEU 72 Ca 0.57 -0.97 -0.12 0.00 -1.03 0.00 0.00 54.13 52.58 2ct6 s LEU 72 Cb -0.23 -0.83 0.13 0.00 0.03 0.00 0.00 46.19 45.30 2ct6 s LEU 72 CO 0.29 -0.08 1.13 -2.16 0.23 0.00 0.00 176.35 175.76 2ct6 s PRO 73 N -3.34 1.22 0.68 1.29 0.04 -1.26 -4.60 135.00 129.03 2ct6 s PRO 73 Ca 0.22 0.32 -0.12 0.00 0.04 0.00 0.00 61.00 61.46 2ct6 s PRO 73 Cb -0.03 -1.85 -0.00 0.00 0.04 0.00 0.00 34.50 32.66 2ct6 s PRO 73 CO 0.09 -2.15 1.06 -1.25 0.04 0.00 0.00 177.00 174.79 2ct6 s PRO 74 N -5.27 3.01 -0.34 0.56 0.04 -1.26 -4.81 135.00 126.94 2ct6 s PRO 74 Ca 0.64 0.99 -0.01 0.00 0.04 0.00 0.00 61.00 62.66 2ct6 s PRO 74 Cb -0.15 -2.00 0.13 0.00 0.04 0.00 0.00 34.50 32.53 2ct6 s PRO 74 CO 0.53 -1.04 0.20 -0.65 0.04 0.00 0.00 177.00 176.09 2ct6 s GLN 75 N -4.88 0.46 0.41 4.56 -1.52 -1.04 -3.66 119.66 113.99 2ct6 s GLN 75 Ca 0.59 -1.10 -0.26 0.00 -1.95 0.00 0.00 55.36 52.63 2ct6 s GLN 75 Cb -0.14 -1.22 -0.09 0.00 -0.22 0.00 0.00 33.01 31.34 2ct6 s GLN 75 CO 0.52 -1.16 1.36 0.42 -0.25 0.00 0.00 175.29 176.18 2ct6 s ILE 76 N 1.34 2.39 -0.28 1.08 1.09 -1.01 -2.13 121.20 123.68 2ct6 s ILE 76 Ca 0.16 0.35 0.01 0.00 -1.10 0.00 0.00 60.65 60.07 2ct6 s ILE 76 Cb -0.21 -3.21 0.17 0.00 -1.06 0.00 0.00 42.46 38.15 2ct6 s ILE 76 CO -0.08 0.06 0.48 -0.36 -0.10 0.00 0.00 174.94 174.93 2ct6 s PHE 77 N -1.22 -1.28 -1.04 3.97 0.08 0.16 -3.20 117.98 115.46 2ct6 s PHE 77 Ca 0.57 0.89 -0.23 0.00 0.12 0.00 0.00 56.93 58.28 2ct6 s PHE 77 Cb -0.41 0.13 0.05 0.00 -0.57 0.00 0.00 43.02 42.22 2ct6 s PHE 77 CO 0.53 -0.93 1.48 1.21 -0.10 0.00 0.00 175.22 177.41 2ct6 s ASN 78 N 2.67 6.50 -0.55 1.36 3.84 -0.22 -1.09 114.94 127.45 2ct6 s ASN 78 Ca 0.13 -1.51 -0.03 0.00 0.21 0.00 0.00 52.86 51.65 2ct6 s ASN 78 Cb -0.13 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.00 2ct6 s ASN 78 CO -0.24 -1.51 0.56 0.61 -2.79 0.00 0.00 177.10 173.73 2ct6 n GLY 79 N 6.78 -1.11 1.94 1.21 0.00 -1.23 -2.65 105.19 110.13 2ct6 n GLY 79 Ca 0.34 0.53 -0.10 0.00 0.00 0.00 0.00 46.02 46.79 2ct6 n GLY 79 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ct6 n ASP 80 N -1.32 -2.72 -4.27 1.61 9.92 -1.26 -4.87 116.55 113.64 2ct6 n ASP 80 Ca 0.02 0.24 -0.37 0.00 -0.53 0.00 0.00 54.79 54.16 2ct6 n ASP 80 Cb 0.47 -2.58 -0.13 0.00 -0.64 0.00 0.00 41.12 38.25 2ct6 n ASP 80 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 2ct6 s ARG 81 N -3.43 2.70 0.05 -1.24 3.52 -1.08 -5.06 118.95 114.40 2ct6 s ARG 81 Ca 0.00 -1.11 -0.30 0.00 -0.13 0.00 0.00 55.73 54.18 2ct6 s ARG 81 Cb 0.00 -3.37 -0.09 0.00 -1.56 0.00 0.00 34.95 29.92 2ct6 s ARG 81 CO 0.00 -0.60 1.95 0.98 -0.81 0.00 0.00 175.30 176.83 2ct6 n TYR 82 N 4.79 2.53 -0.03 5.12 9.36 -1.26 -1.05 117.16 136.62 2ct6 n TYR 82 Ca -0.13 -0.33 -0.05 0.00 3.32 0.00 0.00 57.90 60.70 2ct6 n TYR 82 Cb 0.45 -2.79 -0.02 0.00 -0.63 0.00 0.00 39.34 36.36 2ct6 n TYR 82 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2ct6 n GLY 84 N 2.40 3.01 0.00 0.00 0.00 -1.24 -5.02 105.19 104.33 2ct6 n GLY 84 Ca -0.08 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.12 2ct6 n GLY 84 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ct6 n ASP 85 N 0.00 0.00 -0.30 1.61 5.75 -1.26 -2.40 116.55 119.95 2ct6 n ASP 85 Ca 0.00 -0.96 0.10 0.00 -0.01 0.00 0.00 54.79 53.92 2ct6 n ASP 85 Cb 0.00 0.00 0.27 0.00 -1.03 0.00 0.00 41.12 40.36 2ct6 n ASP 85 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 2ct6 h TYR 86 N -0.80 0.72 -0.12 2.11 3.20 -1.93 -0.52 116.97 119.63 2ct6 h TYR 86 Ca 0.00 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.95 2ct6 h TYR 86 Cb 0.00 -0.18 -0.06 0.00 1.54 0.00 0.00 36.73 38.02 2ct6 h TYR 86 CO 0.00 0.07 -0.39 0.22 -1.64 0.00 0.00 178.16 176.42 2ct6 h ASP 87 N 0.52 -1.21 0.05 -2.11 1.82 -1.92 0.18 116.42 113.74 2ct6 h ASP 87 Ca 0.52 0.16 0.02 0.00 -0.39 0.00 0.00 57.03 57.34 2ct6 h ASP 87 Cb 0.87 0.50 -0.03 0.00 0.68 0.00 0.00 39.33 41.34 2ct6 h ASP 87 CO -0.44 -0.41 -0.20 0.28 -1.61 0.00 0.00 179.24 176.85 2ct6 h SER 88 N -0.47 -0.58 -0.49 2.28 0.02 -1.47 -0.08 113.55 112.75 2ct6 h SER 88 Ca 0.08 0.08 0.08 0.00 -0.84 0.00 0.00 61.79 61.18 2ct6 h SER 88 Cb 0.61 0.23 -0.10 0.00 0.14 0.00 0.00 62.40 63.28 2ct6 h SER 88 CO -0.38 -0.28 -0.44 0.15 -1.14 0.00 0.00 176.83 174.74 2ct6 h PHE 89 N -0.35 -1.31 0.11 3.45 3.57 -0.42 0.88 116.94 122.87 2ct6 h PHE 89 Ca 0.04 0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.64 2ct6 h PHE 89 Cb 0.40 0.64 -0.03 0.00 2.79 0.00 0.00 35.95 39.75 2ct6 h PHE 89 CO -0.22 -0.44 -0.25 0.35 -2.23 0.00 0.00 178.31 175.51 2ct6 h PHE 90 N -0.28 -0.68 -0.83 0.41 3.04 -0.36 0.55 116.94 118.78 2ct6 h PHE 90 Ca 0.15 0.01 0.21 0.00 3.98 0.00 0.00 57.97 62.32 2ct6 h PHE 90 Cb 0.57 0.29 -0.13 0.00 2.56 0.00 0.00 35.95 39.24 2ct6 h PHE 90 CO -0.68 -0.36 0.17 1.49 -2.02 0.00 0.00 178.31 176.92 2ct6 h GLU 91 N -0.46 0.19 0.00 1.11 4.81 -0.03 1.04 114.58 121.24 2ct6 h GLU 91 Ca 0.03 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.13 2ct6 h GLU 91 Cb 0.49 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 2ct6 h GLU 91 CO -0.15 0.13 -0.60 0.77 -0.73 0.00 0.00 179.01 178.43 2ct6 h SER 92 N 0.20 0.00 -0.35 1.04 0.02 -0.12 -3.13 113.55 111.21 2ct6 h SER 92 Ca 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.45 2ct6 h SER 92 Cb 0.96 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 2ct6 h SER 92 CO -0.64 0.60 0.23 0.50 -1.14 0.00 0.00 176.83 176.38 2ct6 h LYS 93 N 0.00 0.45 -0.08 3.45 3.64 0.64 0.80 116.57 125.48 2ct6 h LYS 93 Ca -0.01 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2ct6 h LYS 93 Cb 1.17 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 2ct6 h LYS 93 CO 0.08 0.30 0.06 0.93 -2.27 0.00 0.00 179.45 178.55 2ct6 h GLU 94 N 0.47 0.00 -0.45 1.90 5.08 -0.94 0.27 114.58 120.90 2ct6 h GLU 94 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2ct6 h GLU 94 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2ct6 h GLU 94 CO -0.03 0.00 0.00 0.45 -1.00 0.00 0.00 179.01 178.43 2ct6 n SER 95 N -4.38 3.55 -3.76 1.42 2.88 -0.37 -4.96 113.62 107.99 2ct6 n SER 95 Ca -0.01 -1.99 -0.29 0.00 -1.33 0.00 0.00 58.87 55.25 2ct6 n SER 95 Cb 0.17 -0.30 0.02 0.00 -0.75 0.00 0.00 64.21 63.35 2ct6 n SER 95 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2ct6 n ASN 96 N 1.50 -3.41 0.00 -3.46 2.85 0.23 -4.87 115.26 108.10 2ct6 n ASN 96 Ca 0.20 -0.99 0.00 0.00 -0.11 0.00 0.00 54.58 53.68 2ct6 n ASN 96 Cb 0.60 -3.36 0.00 0.00 1.24 0.00 0.00 39.78 38.26 2ct6 n ASN 96 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2ct6 n THR 97 N -4.26 0.26 -0.32 -0.44 -2.24 0.17 -4.82 114.28 102.64 2ct6 n THR 97 Ca -0.18 -0.49 -0.03 0.00 -2.27 0.00 0.00 64.05 61.08 2ct6 n THR 97 Cb 0.63 1.05 -0.00 0.00 -2.10 0.00 0.00 70.33 69.91 2ct6 n THR 97 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2ct6 n VAL 98 N -0.13 -0.46 -0.20 2.28 0.31 -1.24 0.21 118.33 119.10 2ct6 n VAL 98 Ca 0.00 1.90 -0.01 0.00 -0.01 0.00 0.00 64.34 66.22 2ct6 n VAL 98 Cb 0.17 -2.45 0.06 0.00 -0.91 0.00 0.00 33.84 30.70 2ct6 n VAL 98 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2ct6 h PHE 99 N 0.00 -0.28 -0.32 3.52 -1.00 -1.90 0.16 116.94 117.12 2ct6 h PHE 99 Ca 0.23 0.05 -0.14 0.00 2.81 0.00 0.00 57.97 60.92 2ct6 h PHE 99 Cb 0.43 0.22 -0.00 0.00 3.61 0.00 0.00 35.95 40.20 2ct6 h PHE 99 CO -0.74 -0.24 -0.34 0.77 -1.61 0.00 0.00 178.31 176.14 2ct6 h SER 100 N 0.01 0.86 -0.91 2.17 0.02 0.15 1.68 113.55 117.53 2ct6 h SER 100 Ca 0.29 -0.48 0.18 0.00 -0.84 0.00 0.00 61.79 60.94 2ct6 h SER 100 Cb 0.45 -0.24 -0.07 0.00 0.14 0.00 0.00 62.40 62.67 2ct6 h SER 100 CO -0.60 1.16 0.59 0.15 -1.14 0.00 0.00 176.83 176.99 2ct6 h PHE 101 N 0.57 0.75 0.00 3.45 3.57 0.42 0.13 116.94 125.82 2ct6 h PHE 101 Ca 0.05 0.02 -0.25 0.00 3.53 0.00 0.00 57.97 61.33 2ct6 h PHE 101 Cb 0.92 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 2ct6 h PHE 101 CO 0.07 0.23 -1.38 -0.07 -2.23 0.00 0.00 178.31 174.93 2ct6 h LEU 102 N 0.59 0.00 0.00 0.59 3.38 -0.61 -3.44 115.31 115.81 2ct6 h LEU 102 Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.45 2ct6 h LEU 102 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2ct6 h LEU 102 CO -0.22 0.95 0.00 0.61 0.09 0.00 0.00 178.44 179.87 2ct6 n GLY 103 N 1.45 0.91 2.76 0.83 0.00 0.44 -4.48 105.19 107.11 2ct6 n GLY 103 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 2ct6 n GLY 103 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ct6 n LEU 104 N 0.00 6.10 -3.83 0.99 4.77 0.55 -4.96 117.00 120.61 2ct6 n LEU 104 Ca 0.00 -5.38 0.00 0.00 -0.03 0.00 0.00 56.01 50.60 2ct6 n LEU 104 Cb 0.00 -0.86 0.01 0.00 -2.33 0.00 0.00 43.42 40.24 2ct6 n LEU 104 CO 0.00 2.13 0.98 -0.75 -1.33 0.00 0.00 177.39 178.42 2ct6 s LYS 105 N -3.91 0.71 -0.33 3.23 2.20 -1.26 -4.56 119.74 115.82 2ct6 s LYS 105 Ca 0.46 -0.44 -0.24 0.00 -0.36 0.00 0.00 55.97 55.39 2ct6 s LYS 105 Cb 0.29 0.21 0.03 0.00 -1.51 0.00 0.00 37.83 36.85 2ct6 s LYS 105 CO -0.19 -0.33 0.45 -1.13 -0.36 0.00 0.00 175.35 173.79 2ct6 n SER 106 N -0.89 -6.32 0.00 1.43 3.41 -1.26 -4.87 113.62 105.12 2ct6 n SER 106 Ca -0.02 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 2ct6 n SER 106 Cb 0.60 -2.47 0.00 0.00 -0.26 0.00 0.00 64.21 62.08 2ct6 n SER 106 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ct6 n GLY 107 N 0.22 0.04 3.80 5.00 0.00 -1.26 -5.13 105.19 107.86 2ct6 n GLY 107 Ca -0.03 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 2ct6 n GLY 107 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ct6 s PRO 108 N -2.00 1.86 -0.16 1.61 0.04 -1.26 -4.70 135.00 130.39 2ct6 s PRO 108 Ca 0.00 0.56 -0.11 0.00 0.04 0.00 0.00 61.00 61.48 2ct6 s PRO 108 Cb 0.00 -1.90 0.04 0.00 0.04 0.00 0.00 34.50 32.68 2ct6 s PRO 108 CO 0.00 -1.75 0.22 0.45 0.04 0.00 0.00 177.00 175.96 2ct6 n SER 109 N -3.51 -1.05 -1.55 6.66 2.88 -1.26 -4.88 113.62 110.91 2ct6 n SER 109 Ca 0.07 1.32 0.00 0.00 -1.33 0.00 0.00 58.87 58.93 2ct6 n SER 109 Cb 0.57 -5.06 0.00 0.00 -0.75 0.00 0.00 64.21 58.97 2ct6 n SER 109 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ct6 n SER 110 N 1.64 -8.37 -0.74 -3.46 2.88 -1.26 -4.87 113.62 99.44 2ct6 n SER 110 Ca -0.38 1.20 0.13 0.00 -1.33 0.00 0.00 58.87 58.49 2ct6 n SER 110 Cb 0.58 -4.56 0.29 0.00 -0.75 0.00 0.00 64.21 59.78 2ct6 n SER 110 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42