#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3knp s ARG 2 N 0.00 1.19 -0.06 0.03 3.00 0.96 -1.95 118.95 122.12 3knp s ARG 2 Ca 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 55.73 55.25 3knp s ARG 2 Cb 0.00 -1.10 0.03 0.00 0.00 0.00 0.00 34.95 33.88 3knp s ARG 2 CO 0.00 0.22 0.16 0.54 0.00 0.00 0.00 175.30 176.21 3knp s VAL 3 N -0.06 -0.03 -0.34 3.52 0.11 -1.10 0.39 120.40 122.89 3knp s VAL 3 Ca 0.00 0.10 -0.04 0.00 -2.93 0.00 0.00 61.98 59.12 3knp s VAL 3 Cb -0.08 -0.24 0.06 0.00 -1.53 0.00 0.00 36.38 34.59 3knp s VAL 3 CO 0.00 0.04 0.09 -0.69 -3.33 0.00 0.00 175.10 171.21 3knp s VAL 4 N 0.73 3.40 -0.21 2.04 1.01 0.11 -2.36 120.40 125.12 3knp s VAL 4 Ca -0.05 -1.40 -0.12 0.00 0.00 0.00 0.00 61.98 60.41 3knp s VAL 4 Cb -0.07 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 3knp s VAL 4 CO -0.04 -0.25 0.22 -0.63 0.00 0.00 0.00 175.10 174.40 3knp s ILE 5 N 1.30 5.34 -0.07 2.22 1.09 0.82 -0.82 121.20 131.08 3knp s ILE 5 Ca -0.01 0.34 0.05 0.00 -1.10 0.00 0.00 60.65 59.92 3knp s ILE 5 Cb -0.20 -3.55 -0.00 0.00 -1.06 0.00 0.00 42.46 37.64 3knp s ILE 5 CO 0.00 0.36 -0.22 -1.10 -0.10 0.00 0.00 174.94 173.88 3knp s GLN 6 N 0.82 2.45 0.18 2.79 -0.21 -0.39 0.11 119.66 125.40 3knp s GLN 6 Ca 0.11 -0.78 -0.30 0.00 0.02 0.00 0.00 55.36 54.41 3knp s GLN 6 Cb -0.13 -1.99 -0.08 0.00 1.00 0.00 0.00 33.01 31.81 3knp s GLN 6 CO 0.03 0.26 1.08 0.50 -2.12 0.00 0.00 175.29 175.04 3knp s ARG 7 N 0.11 4.62 -0.07 2.91 3.52 0.15 -1.88 118.95 128.31 3knp s ARG 7 Ca -0.09 1.69 -0.21 0.00 -0.13 0.00 0.00 55.73 56.99 3knp s ARG 7 Cb -0.15 -3.28 0.05 0.00 -1.56 0.00 0.00 34.95 30.01 3knp s ARG 7 CO 0.05 0.11 0.48 0.14 -0.81 0.00 0.00 175.30 175.27 3knp s VAL 8 N -0.30 0.02 -2.45 7.11 -7.23 0.66 -2.79 120.40 115.42 3knp s VAL 8 Ca 0.49 -0.19 0.21 0.00 -1.81 0.00 0.00 61.98 60.67 3knp s VAL 8 Cb -0.29 -0.76 0.12 0.00 0.56 0.00 0.00 36.38 36.01 3knp s VAL 8 CO 0.35 -0.11 1.13 0.29 -0.31 0.00 0.00 175.10 176.45 3knp n LYS 9 N 1.59 1.82 -3.64 4.82 5.02 -0.54 0.12 118.16 127.35 3knp n LYS 9 Ca -0.18 -1.56 -0.06 0.00 -2.02 0.00 0.00 58.31 54.49 3knp n LYS 9 Cb 0.56 -1.41 -0.07 0.00 -0.02 0.00 0.00 35.03 34.10 3knp n LYS 9 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3knp s GLY 10 N -1.91 -0.17 -0.08 0.72 0.00 -1.23 -3.36 107.32 101.29 3knp s GLY 10 Ca 0.23 2.80 -0.06 0.00 0.00 0.00 0.00 44.72 47.69 3knp s GLY 10 CO 0.33 2.22 0.20 0.00 0.00 0.00 0.00 173.10 175.85 3knp s ALA 11 N 0.88 -0.47 -0.31 3.20 0.00 -0.94 0.08 121.76 124.20 3knp s ALA 11 Ca -0.04 0.62 -0.02 0.00 0.00 0.00 0.00 51.96 52.53 3knp s ALA 11 Cb -0.04 -0.38 0.12 0.00 0.00 0.00 0.00 23.12 22.82 3knp s ALA 11 CO -0.11 -0.11 0.21 0.42 0.00 0.00 0.00 175.76 176.16 3knp s ILE 12 N 0.37 -0.15 0.16 0.00 1.09 -0.61 -1.37 121.20 120.69 3knp s ILE 12 Ca -0.02 -0.86 -0.30 0.00 -1.10 0.00 0.00 60.65 58.37 3knp s ILE 12 Cb -0.04 -0.98 -0.07 0.00 -1.06 0.00 0.00 42.46 40.32 3knp s ILE 12 CO -0.02 -0.69 0.97 -0.22 -0.10 0.00 0.00 174.94 174.88 3knp s LEU 13 N 1.95 4.55 -0.07 2.97 0.20 -0.48 -2.26 118.68 125.55 3knp s LEU 13 Ca 0.11 1.88 -0.03 0.00 0.69 0.00 0.00 54.13 56.78 3knp s LEU 13 Cb -0.16 -3.60 0.04 0.00 -0.43 0.00 0.00 46.19 42.04 3knp s LEU 13 CO -0.27 0.00 0.12 -0.44 -0.29 0.00 0.00 176.35 175.47 3knp s SER 14 N -0.43 0.70 0.43 3.68 0.01 -0.95 -2.47 113.70 114.67 3knp s SER 14 Ca 0.45 0.24 0.08 0.00 1.31 0.00 0.00 55.95 58.03 3knp s SER 14 Cb -0.25 0.13 0.01 0.00 0.21 0.00 0.00 66.02 66.12 3knp s SER 14 CO 0.31 -0.23 0.57 0.68 0.41 0.00 0.00 173.24 174.98 3knp s VAL 15 N 2.04 2.89 0.05 3.43 -7.23 -0.77 -0.53 120.40 120.28 3knp s VAL 15 Ca 0.01 -1.04 -0.24 0.00 -1.81 0.00 0.00 61.98 58.91 3knp s VAL 15 Cb -0.12 -2.93 -0.06 0.00 0.56 0.00 0.00 36.38 33.83 3knp s VAL 15 CO -0.05 0.00 0.71 -0.13 -0.31 0.00 0.00 175.10 175.33 3knp s ARG 16 N -4.35 4.44 0.04 4.82 0.52 -1.26 -0.57 118.95 122.60 3knp s ARG 16 Ca 0.55 0.98 -0.30 0.00 -0.52 0.00 0.00 55.73 56.43 3knp s ARG 16 Cb -0.09 -3.34 -0.07 0.00 0.52 0.00 0.00 34.95 31.97 3knp s ARG 16 CO 0.33 0.37 1.57 0.15 0.02 0.00 0.00 175.30 177.73 3knp s LYS 17 N -0.31 4.23 0.00 3.54 1.02 -1.26 -4.83 119.74 122.12 3knp s LYS 17 Ca 0.36 2.20 0.00 0.00 0.02 0.00 0.00 55.97 58.55 3knp s LYS 17 Cb -0.20 -3.60 0.00 0.00 -0.52 0.00 0.00 37.83 33.51 3knp s LYS 17 CO 0.22 -0.68 0.00 -1.91 -0.92 0.00 0.00 175.35 172.05 3knp n GLU 18 N 5.56 0.00 -4.25 1.68 0.00 -1.26 -5.05 120.64 117.31 3knp n GLU 18 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 57.16 56.97 3knp n GLU 18 Cb 0.42 -0.86 -0.12 0.00 0.00 0.00 0.00 31.44 30.88 3knp n GLU 18 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.13 176.65 3knp s LEU 27 N 0.00 3.32 0.55 4.31 2.34 -1.26 -5.36 118.68 122.58 3knp s LEU 27 Ca 0.00 -0.12 -0.01 0.00 0.06 0.00 0.00 54.13 54.06 3knp s LEU 27 Cb 0.00 -1.82 0.03 0.00 -0.56 0.00 0.00 46.19 43.84 3knp s LEU 27 CO 0.00 0.14 0.79 -1.61 -1.06 0.00 0.00 176.35 174.61 3knp s GLU 28 N 0.56 2.66 -0.12 1.48 2.02 0.27 -4.89 118.70 120.67 3knp s GLU 28 Ca -0.02 -0.58 -0.06 0.00 0.02 0.00 0.00 54.97 54.33 3knp s GLU 28 Cb -0.14 -2.45 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 3knp s GLU 28 CO 0.02 -0.67 0.12 0.42 0.02 0.00 0.00 175.26 175.17 3knp s ILE 29 N -2.79 5.31 0.00 -1.63 1.09 -1.26 -1.85 121.20 120.07 3knp s ILE 29 Ca 0.55 0.14 0.00 0.00 -1.10 0.00 0.00 60.65 60.24 3knp s ILE 29 Cb -0.10 -3.31 0.00 0.00 -1.06 0.00 0.00 42.46 37.98 3knp s ILE 29 CO 0.40 0.60 0.00 2.30 -0.10 0.00 0.00 174.94 178.14 3knp n ILE 30 N 2.13 0.00 -3.70 2.92 -0.00 -1.03 -4.94 119.36 114.74 3knp n ILE 30 Ca -0.19 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.45 3knp n ILE 30 Cb 0.55 -0.61 -0.11 0.00 -0.00 0.00 0.00 39.64 39.47 3knp n ILE 30 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 3knp s SER 31 N -2.24 -0.50 0.07 7.28 0.15 -1.25 -5.08 113.70 112.12 3knp s SER 31 Ca 0.00 0.88 -0.05 0.00 0.70 0.00 0.00 55.95 57.48 3knp s SER 31 Cb 0.00 0.79 -0.02 0.00 -1.71 0.00 0.00 66.02 65.08 3knp s SER 31 CO 0.00 -0.18 0.09 -1.83 1.20 0.00 0.00 173.24 172.52 3knp s GLU 32 N 1.19 0.72 0.24 5.44 -1.05 -1.26 -1.38 118.70 122.60 3knp s GLU 32 Ca -0.08 -1.03 -0.01 0.00 -0.15 0.00 0.00 54.97 53.70 3knp s GLU 32 Cb -0.07 0.28 -0.03 0.00 -0.44 0.00 0.00 34.13 33.86 3knp s GLU 32 CO -0.10 -0.19 0.21 0.96 0.95 0.00 0.00 175.26 177.09 3knp s ILE 33 N -3.72 0.00 0.00 1.83 -0.00 -0.47 -5.01 121.20 113.82 3knp s ILE 33 Ca 0.04 -1.92 0.00 0.00 -0.00 0.00 0.00 60.65 58.77 3knp s ILE 33 Cb 0.05 -2.48 0.00 0.00 -0.00 0.00 0.00 42.46 40.03 3knp s ILE 33 CO -0.10 0.00 0.00 0.29 -0.00 0.00 0.00 174.94 175.13 3knp n LYS 34 N -0.36 1.59 -1.68 0.37 5.02 -1.26 -2.22 118.16 119.62 3knp n LYS 34 Ca 0.03 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.90 3knp n LYS 34 Cb 0.65 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.63 3knp n LYS 34 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3knp n ASN 35 N 0.00 4.11 0.00 4.39 4.13 -1.21 -3.53 115.26 123.14 3knp n ASN 35 Ca 0.00 0.96 0.00 0.00 1.68 0.00 0.00 54.58 57.22 3knp n ASN 35 Cb 0.00 -1.54 0.00 0.00 -1.54 0.00 0.00 39.78 36.70 3knp n ASN 35 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3knp n GLY 36 N 4.34 -0.80 3.04 7.41 0.00 0.33 -3.25 105.19 116.26 3knp n GLY 36 Ca 0.19 -0.28 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 3knp n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3knp s LEU 37 N 0.00 1.91 -0.22 0.99 1.43 -1.05 -0.25 118.68 121.50 3knp s LEU 37 Ca 0.00 -0.20 -0.09 0.00 -1.03 0.00 0.00 54.13 52.81 3knp s LEU 37 Cb 0.00 -0.58 -0.04 0.00 0.03 0.00 0.00 46.19 45.59 3knp s LEU 37 CO 0.00 0.11 0.12 -0.51 0.23 0.00 0.00 176.35 176.29 3knp s ILE 38 N -0.04 5.07 -0.21 -0.59 -1.16 -0.79 -2.46 121.20 121.03 3knp s ILE 38 Ca 0.01 0.08 -0.03 0.00 -0.51 0.00 0.00 60.65 60.19 3knp s ILE 38 Cb -0.06 -3.34 -0.01 0.00 0.61 0.00 0.00 42.46 39.66 3knp s ILE 38 CO 0.00 0.39 -0.05 0.00 -2.81 0.00 0.00 174.94 172.47 3knp s PHE 40 N 1.33 3.25 -0.23 0.00 0.08 0.00 -1.07 117.98 121.34 3knp s PHE 40 Ca 0.04 -0.86 -0.06 0.00 0.12 0.00 0.00 56.93 56.17 3knp s PHE 40 Cb -0.14 -2.97 -0.02 0.00 -0.57 0.00 0.00 43.02 39.31 3knp s PHE 40 CO -0.02 -0.74 0.03 -1.17 -0.10 0.00 0.00 175.22 173.22 3knp s LEU 41 N 1.64 3.28 -0.15 -0.37 2.96 0.16 -0.71 118.68 125.48 3knp s LEU 41 Ca 0.04 -0.25 0.00 0.00 -0.22 0.00 0.00 54.13 53.70 3knp s LEU 41 Cb -0.23 -1.86 -0.00 0.00 0.50 0.00 0.00 46.19 44.60 3knp s LEU 41 CO 0.07 -0.02 -0.14 -0.83 -1.32 0.00 0.00 176.35 174.11 3knp s GLY 42 N 1.49 1.49 0.30 7.98 0.00 0.16 0.12 107.32 118.86 3knp s GLY 42 Ca 0.06 -1.02 -0.08 0.00 0.00 0.00 0.00 44.72 43.67 3knp s GLY 42 CO 0.02 0.00 0.62 -0.42 0.00 0.00 0.00 173.10 173.32 3knp s ILE 43 N 0.75 4.91 0.12 0.90 -1.09 -1.26 -0.03 121.20 125.50 3knp s ILE 43 Ca -0.06 0.38 0.04 0.00 -2.23 0.00 0.00 60.65 58.79 3knp s ILE 43 Cb -0.15 -3.69 -0.04 0.00 -1.58 0.00 0.00 42.46 37.00 3knp s ILE 43 CO 0.01 -0.29 0.09 -2.28 -1.23 0.00 0.00 174.94 171.23 3knp s HIS 44 N -2.08 3.13 0.42 3.97 2.46 -1.26 -4.32 115.29 117.61 3knp s HIS 44 Ca 0.48 0.02 0.27 0.00 0.47 0.00 0.00 55.06 56.29 3knp s HIS 44 Cb -0.11 -1.55 1.37 0.00 -0.13 0.00 0.00 32.58 32.16 3knp s HIS 44 CO 0.27 0.51 1.63 -0.22 -2.47 0.00 0.00 174.74 174.46 3knp h LYS 45 N 2.95 0.11 -0.85 2.88 3.64 -1.74 -2.61 116.57 120.94 3knp h LYS 45 Ca -0.47 -0.01 -0.37 0.00 -1.27 0.00 0.00 60.65 58.53 3knp h LYS 45 Cb 1.18 -0.02 -0.41 0.00 -0.41 0.00 0.00 32.23 32.57 3knp h LYS 45 CO 0.64 0.07 -1.06 0.27 -2.27 0.00 0.00 179.45 177.10 3knp n ASN 46 N -4.77 2.35 -4.58 4.20 6.94 -1.26 -4.87 115.26 113.28 3knp n ASN 46 Ca 0.36 -2.74 -0.42 0.00 -0.02 0.00 0.00 54.58 51.76 3knp n ASN 46 Cb 1.36 -0.48 -0.02 0.00 -2.36 0.00 0.00 39.78 38.27 3knp n ASN 46 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3knp s ASP 47 N -3.47 6.35 0.11 0.53 1.01 -0.98 -5.02 116.67 115.20 3knp s ASP 47 Ca 0.33 0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.80 3knp s ASP 47 Cb 0.40 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.78 3knp s ASP 47 CO -0.02 -1.54 0.00 0.35 0.21 0.00 0.00 175.17 174.17 3knp n THR 48 N 6.76 0.00 -0.02 -1.27 -2.24 -1.26 -4.90 114.28 111.34 3knp n THR 48 Ca 0.10 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.81 3knp n THR 48 Cb 0.49 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.58 3knp n THR 48 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 3knp n TRP 49 N -1.19 0.90 -0.11 4.78 -0.00 -1.26 -4.03 117.44 116.53 3knp n TRP 49 Ca 0.00 0.32 -0.05 0.00 -0.00 0.00 0.00 57.50 57.78 3knp n TRP 49 Cb 0.00 -1.15 0.03 0.00 -0.00 0.00 0.00 31.31 30.18 3knp n TRP 49 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 3knp h GLU 50 N 0.00 0.14 -0.30 5.87 5.08 -2.01 -2.18 114.58 121.19 3knp h GLU 50 Ca -0.29 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.09 3knp h GLU 50 Cb 1.98 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 31.14 3knp h GLU 50 CO 0.07 0.09 -0.43 -0.44 -1.00 0.00 0.00 179.01 177.30 3knp h ASP 51 N 0.15 -1.43 -1.36 1.42 5.19 -1.91 0.33 116.42 118.80 3knp h ASP 51 Ca 0.19 0.19 0.44 0.00 -0.62 0.00 0.00 57.03 57.23 3knp h ASP 51 Cb 0.25 0.58 -0.12 0.00 0.18 0.00 0.00 39.33 40.22 3knp h ASP 51 CO -0.29 -0.32 0.89 0.00 -3.12 0.00 0.00 179.24 176.40 3knp h ALA 52 N -0.35 2.81 0.34 3.45 0.00 -1.55 -0.85 119.26 123.11 3knp h ALA 52 Ca 0.05 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3knp h ALA 52 Cb 0.47 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3knp h ALA 52 CO -0.45 -1.43 -0.16 -0.07 0.00 0.00 0.00 179.25 177.14 3knp h LEU 53 N 0.08 -0.39 -0.77 0.00 3.38 -0.01 -2.25 115.31 115.35 3knp h LEU 53 Ca 0.82 -0.17 0.18 0.00 0.09 0.00 0.00 57.88 58.81 3knp h LEU 53 Cb 2.64 0.10 -0.13 0.00 0.09 0.00 0.00 40.66 43.36 3knp h LEU 53 CO -0.39 0.03 0.09 0.22 0.09 0.00 0.00 178.44 178.48 3knp h TYR 54 N -0.88 0.10 0.23 1.13 3.20 -0.67 0.52 116.97 120.60 3knp h TYR 54 Ca -0.05 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 3knp h TYR 54 Cb 0.53 0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.87 3knp h TYR 54 CO 0.03 -0.20 -0.18 0.82 -1.64 0.00 0.00 178.16 177.00 3knp h ILE 55 N 0.16 0.00 -0.17 1.81 5.03 -1.43 -0.83 117.51 122.09 3knp h ILE 55 Ca 0.44 0.00 0.05 0.00 -0.12 0.00 0.00 64.86 65.23 3knp h ILE 55 Cb 0.79 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 34.57 3knp h ILE 55 CO -0.62 0.00 0.38 0.40 -0.68 0.00 0.00 178.15 177.62 3knp h ILE 56 N -0.39 0.16 0.60 -0.67 5.03 -0.72 -0.53 117.51 120.98 3knp h ILE 56 Ca -0.03 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.68 3knp h ILE 56 Cb 0.33 0.66 0.01 0.00 -3.03 0.00 0.00 36.82 34.78 3knp h ILE 56 CO 0.01 0.00 -0.29 -0.09 -0.68 0.00 0.00 178.15 177.10 3knp h ARG 57 N 0.00 -0.77 -0.22 2.37 2.43 0.13 -2.54 114.38 115.78 3knp h ARG 57 Ca 0.08 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 3knp h ARG 57 Cb 0.83 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 3knp h ARG 57 CO -0.00 -0.51 0.06 0.87 -1.51 0.00 0.00 179.97 178.88 3knp h LYS 58 N -1.10 0.35 -0.46 0.20 1.79 -0.05 -1.58 116.57 115.72 3knp h LYS 58 Ca -0.08 -0.08 0.09 0.00 -2.18 0.00 0.00 60.65 58.40 3knp h LYS 58 Cb 0.61 -0.05 -0.10 0.00 -1.58 0.00 0.00 32.23 31.12 3knp h LYS 58 CO 0.13 0.45 -0.22 0.00 -1.08 0.00 0.00 179.45 178.73 3knp n LEU 60 N -5.40 0.00 0.00 0.00 4.77 -0.95 -3.97 117.00 111.45 3knp n LEU 60 Ca 0.03 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3knp n LEU 60 Cb 0.31 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3knp n LEU 60 CO 0.09 -0.00 -0.01 0.59 -1.33 0.00 0.00 177.39 176.73 3knp n ASN 61 N -1.04 0.08 -4.75 -1.43 3.02 -0.40 -4.54 115.26 106.20 3knp n ASN 61 Ca 0.21 -0.21 -0.41 0.00 -0.03 0.00 0.00 54.58 54.14 3knp n ASN 61 Cb 0.12 0.44 -0.02 0.00 -0.61 0.00 0.00 39.78 39.71 3knp n ASN 61 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3knp s LEU 62 N -0.90 4.37 -0.89 3.41 1.43 0.83 -4.77 118.68 122.17 3knp s LEU 62 Ca 0.00 2.79 -0.15 0.00 -1.03 0.00 0.00 54.13 55.74 3knp s LEU 62 Cb 0.00 -3.63 0.20 0.00 0.03 0.00 0.00 46.19 42.79 3knp s LEU 62 CO 0.00 -0.78 0.90 -0.13 0.23 0.00 0.00 176.35 176.57 3knp s ARG 63 N -0.61 3.67 -0.10 1.70 0.52 -1.26 -3.62 118.95 119.24 3knp s ARG 63 Ca 0.60 -2.37 0.18 0.00 -0.52 0.00 0.00 55.73 53.61 3knp s ARG 63 Cb -0.44 -4.57 0.67 0.00 0.52 0.00 0.00 34.95 31.13 3knp s ARG 63 CO 0.47 -1.41 1.58 1.28 0.02 0.00 0.00 175.30 177.24 3knp n LEU 64 N 4.48 4.51 -4.58 2.53 4.77 -1.15 -4.16 117.00 123.40 3knp n LEU 64 Ca 0.18 -2.43 -0.24 0.00 -0.03 0.00 0.00 56.01 53.48 3knp n LEU 64 Cb 0.47 -0.54 -0.09 0.00 -2.33 0.00 0.00 43.42 40.93 3knp n LEU 64 CO 0.39 0.81 -0.36 0.26 -1.33 0.00 0.00 177.39 177.15 3knp s TRP 65 N -1.81 2.50 0.43 -1.77 0.51 -0.67 -4.85 118.94 113.28 3knp s TRP 65 Ca 0.48 -0.35 -0.08 0.00 -2.12 0.00 0.00 56.10 54.03 3knp s TRP 65 Cb 0.31 -1.26 -0.05 0.00 -0.81 0.00 0.00 33.47 31.66 3knp s TRP 65 CO 0.23 0.59 0.76 -0.80 -0.51 0.00 0.00 176.95 177.22 3knp s ASN 66 N -3.64 6.40 -0.39 2.95 -0.87 -1.26 -0.28 114.94 117.85 3knp s ASN 66 Ca 0.32 1.01 0.03 0.00 -1.57 0.00 0.00 52.86 52.65 3knp s ASN 66 Cb -0.03 -2.28 0.16 0.00 -0.02 0.00 0.00 41.25 39.08 3knp s ASN 66 CO 0.18 -0.46 0.31 0.21 -2.57 0.00 0.00 177.10 174.77 3knp s ASN 67 N -3.56 1.85 0.28 -1.22 3.04 -0.57 -4.69 114.94 110.07 3knp s ASN 67 Ca 0.49 -2.61 0.00 0.00 0.04 0.00 0.00 52.86 50.78 3knp s ASN 67 Cb -0.10 -0.28 0.00 0.00 -1.54 0.00 0.00 41.25 39.33 3knp s ASN 67 CO 0.37 -0.22 0.00 0.47 -3.04 0.00 0.00 177.10 174.68 3knp n ASP 68 N 3.37 0.00 -0.04 -4.21 10.43 -1.26 -2.44 116.55 122.39 3knp n ASP 68 Ca 0.22 0.00 -0.19 0.00 2.57 0.00 0.00 54.79 57.39 3knp n ASP 68 Cb 0.44 0.00 -0.13 0.00 1.84 0.00 0.00 41.12 43.27 3knp n ASP 68 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 3knp n ASN 69 N 5.90 1.92 -4.77 -2.24 5.15 -1.26 -4.99 115.26 114.96 3knp n ASN 69 Ca 0.00 0.10 -0.39 0.00 -0.60 0.00 0.00 54.58 53.70 3knp n ASN 69 Cb 0.00 -0.60 -0.06 0.00 -0.53 0.00 0.00 39.78 38.59 3knp n ASN 69 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 3knp s LYS 70 N -2.55 4.69 0.05 1.20 -2.85 -1.02 -5.08 119.74 114.18 3knp s LYS 70 Ca -0.25 1.34 -0.01 0.00 -1.00 0.00 0.00 55.97 56.06 3knp s LYS 70 Cb 0.07 -3.12 -0.04 0.00 -2.06 0.00 0.00 37.83 32.68 3knp s LYS 70 CO 0.72 0.46 0.22 0.95 0.10 0.00 0.00 175.35 177.80 3knp s THR 71 N -1.31 5.38 -1.27 3.79 -4.23 -1.26 -1.51 115.64 115.23 3knp s THR 71 Ca 0.43 -0.29 -0.06 0.00 -1.18 0.00 0.00 61.69 60.59 3knp s THR 71 Cb -0.23 -3.61 -0.01 0.00 1.34 0.00 0.00 72.50 70.00 3knp s THR 71 CO 0.28 0.19 0.66 0.79 -0.54 0.00 0.00 174.62 175.99 3knp n TRP 72 N 0.46 -1.87 0.00 3.99 7.02 -1.16 -4.97 117.44 120.92 3knp n TRP 72 Ca -0.06 0.71 0.00 0.00 -1.02 0.00 0.00 57.50 57.12 3knp n TRP 72 Cb 0.51 -3.94 0.00 0.00 -2.42 0.00 0.00 31.31 25.47 3knp n TRP 72 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3knp n ASP 73 N -2.94 0.00 -4.86 -0.99 2.03 0.61 -4.83 116.55 105.57 3knp n ASP 73 Ca -0.23 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.75 3knp n ASP 73 Cb 0.65 -0.40 -0.06 0.00 -0.72 0.00 0.00 41.12 40.60 3knp n ASP 73 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3knp s LYS 74 N -0.80 3.94 0.44 -0.67 -0.14 -1.20 -4.72 119.74 116.58 3knp s LYS 74 Ca 0.00 0.53 0.05 0.00 -1.36 0.00 0.00 55.97 55.19 3knp s LYS 74 Cb 0.00 -2.53 0.08 0.00 -1.68 0.00 0.00 37.83 33.70 3knp s LYS 74 CO 0.00 0.23 0.61 0.27 -0.76 0.00 0.00 175.35 175.69 3knp n ASN 75 N -0.23 1.37 -0.36 2.83 0.23 -1.26 -1.67 115.26 116.17 3knp n ASN 75 Ca 0.02 -2.02 0.03 0.00 -0.53 0.00 0.00 54.58 52.08 3knp n ASN 75 Cb 0.53 -0.34 0.20 0.00 -2.08 0.00 0.00 39.78 38.08 3knp n ASN 75 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 3knp h VAL 76 N -0.09 1.06 -0.06 3.53 3.04 -1.85 -3.00 116.25 118.89 3knp h VAL 76 Ca -0.20 -0.39 -0.10 0.00 -1.01 0.00 0.00 66.70 64.99 3knp h VAL 76 Cb 0.88 -0.17 0.01 0.00 -2.01 0.00 0.00 31.29 30.00 3knp h VAL 76 CO 0.27 0.21 -0.36 0.11 -1.01 0.00 0.00 177.57 176.78 3knp h LYS 77 N 1.13 0.36 -0.75 4.17 1.57 -1.88 -1.24 116.57 119.93 3knp h LYS 77 Ca 0.43 -0.30 0.17 0.00 -1.87 0.00 0.00 60.65 59.08 3knp h LYS 77 Cb 0.21 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 32.47 3knp h LYS 77 CO -0.18 0.95 0.12 -0.44 -0.57 0.00 0.00 179.45 179.33 3knp h ASP 78 N -0.13 -0.12 0.49 0.86 3.32 -1.91 0.66 116.42 119.59 3knp h ASP 78 Ca -0.03 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3knp h ASP 78 Cb 1.02 0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.83 3knp h ASP 78 CO 0.08 -0.10 -0.16 0.18 -1.72 0.00 0.00 179.24 177.51 3knp n LEU 79 N -5.23 0.42 -3.17 1.55 4.77 -1.20 -4.95 117.00 109.18 3knp n LEU 79 Ca 0.15 0.08 -0.08 0.00 -0.03 0.00 0.00 56.01 56.12 3knp n LEU 79 Cb 0.49 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.37 3knp n LEU 79 CO 0.09 0.08 0.18 -3.20 -1.33 0.00 0.00 177.39 173.21 3knp n ASN 80 N -1.13 -7.17 -4.70 -1.43 2.85 0.23 -5.05 115.26 98.87 3knp n ASN 80 Ca 0.11 -0.41 -0.24 0.00 -0.11 0.00 0.00 54.58 53.93 3knp n ASN 80 Cb 0.30 -5.21 0.01 0.00 1.24 0.00 0.00 39.78 36.12 3knp n ASN 80 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 3knp n TYR 81 N -2.55 -0.79 -3.61 1.20 4.01 -0.48 -5.04 117.16 109.90 3knp n TYR 81 Ca -0.04 -2.19 -0.24 0.00 -0.16 0.00 0.00 57.90 55.27 3knp n TYR 81 Cb 0.56 -0.44 0.02 0.00 -0.31 0.00 0.00 39.34 39.18 3knp n TYR 81 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3knp s GLU 82 N -4.18 2.24 -0.05 -0.72 2.02 -1.20 -4.82 118.70 112.00 3knp s GLU 82 Ca 0.32 -1.93 -0.04 0.00 0.02 0.00 0.00 54.97 53.34 3knp s GLU 82 Cb -0.03 -2.27 0.02 0.00 0.10 0.00 0.00 34.13 31.95 3knp s GLU 82 CO 0.21 -0.75 0.12 -0.51 0.02 0.00 0.00 175.26 174.34 3knp s LEU 83 N -4.44 1.36 -0.61 1.80 1.02 -0.88 -2.53 118.68 114.42 3knp s LEU 83 Ca 0.43 0.24 -0.02 0.00 0.02 0.00 0.00 54.13 54.80 3knp s LEU 83 Cb -0.03 0.38 0.16 0.00 0.02 0.00 0.00 46.19 46.71 3knp s LEU 83 CO 0.27 -0.07 0.42 -0.22 0.02 0.00 0.00 176.35 176.77 3knp s LEU 84 N 0.33 5.15 -0.82 1.79 2.96 -1.03 -1.34 118.68 125.72 3knp s LEU 84 Ca -0.02 -2.85 -0.25 0.00 -0.22 0.00 0.00 54.13 50.79 3knp s LEU 84 Cb -0.03 -1.83 -0.00 0.00 0.50 0.00 0.00 46.19 44.82 3knp s LEU 84 CO -0.01 -0.36 1.67 -0.63 -1.32 0.00 0.00 176.35 175.70 3knp s ILE 85 N -0.06 3.59 -0.23 6.68 1.09 0.19 -2.63 121.20 129.83 3knp s ILE 85 Ca 0.17 -0.14 -0.13 0.00 -1.10 0.00 0.00 60.65 59.45 3knp s ILE 85 Cb -0.21 -4.42 -0.04 0.00 -1.06 0.00 0.00 42.46 36.73 3knp s ILE 85 CO -0.03 -1.36 0.27 -0.69 -0.10 0.00 0.00 174.94 173.03 3knp s VAL 86 N 7.73 5.28 -0.57 2.92 1.01 -0.23 -4.38 120.40 132.15 3knp s VAL 86 Ca 0.56 0.40 -0.28 0.00 0.00 0.00 0.00 61.98 62.67 3knp s VAL 86 Cb -0.07 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.72 3knp s VAL 86 CO 0.06 0.29 1.41 -0.55 0.00 0.00 0.00 175.10 176.31 3knp s SER 87 N 1.17 6.12 -0.48 3.32 0.15 -1.26 -0.66 113.70 122.05 3knp s SER 87 Ca 0.12 0.25 -0.08 0.00 0.70 0.00 0.00 55.95 56.94 3knp s SER 87 Cb -0.14 -2.55 0.12 0.00 -1.71 0.00 0.00 66.02 61.74 3knp s SER 87 CO 0.07 -1.72 0.34 -1.58 1.20 0.00 0.00 173.24 171.54 3knp s GLN 88 N 5.54 2.43 0.19 5.44 2.00 0.32 -4.80 119.66 130.77 3knp s GLN 88 Ca 0.52 -1.85 0.25 0.00 -2.00 0.00 0.00 55.36 52.27 3knp s GLN 88 Cb -0.11 -3.87 0.90 0.00 0.80 0.00 0.00 33.01 30.74 3knp s GLN 88 CO 0.24 -1.18 1.74 1.97 -0.50 0.00 0.00 175.29 177.57 3knp n PHE 89 N 4.73 0.72 0.54 1.67 1.16 -1.26 -3.02 117.46 122.00 3knp n PHE 89 Ca -0.05 0.24 0.12 0.00 -1.87 0.00 0.00 57.45 55.89 3knp n PHE 89 Cb 0.41 -0.89 0.45 0.00 -1.61 0.00 0.00 39.48 37.84 3knp n PHE 89 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 3knp n THR 90 N -2.12 0.71 0.20 1.97 -2.24 -1.26 -3.09 114.28 108.46 3knp n THR 90 Ca 0.04 0.07 0.02 0.00 -2.27 0.00 0.00 64.05 61.91 3knp n THR 90 Cb 0.33 -0.91 0.11 0.00 -2.10 0.00 0.00 70.33 67.76 3knp n THR 90 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3knp n LEU 91 N -2.06 0.00 -1.04 3.22 4.77 -1.17 -0.77 117.00 119.96 3knp n LEU 91 Ca 0.04 0.37 0.08 0.00 -0.03 0.00 0.00 56.01 56.46 3knp n LEU 91 Cb 0.29 -0.37 0.25 0.00 -2.33 0.00 0.00 43.42 41.26 3knp n LEU 91 CO 0.22 -0.31 0.72 0.49 -1.33 0.00 0.00 177.39 177.18 3knp n PHE 92 N -1.37 0.93 -2.09 -1.77 3.72 -1.18 -4.96 117.46 110.74 3knp n PHE 92 Ca 0.02 -0.62 -0.42 0.00 -0.05 0.00 0.00 57.45 56.37 3knp n PHE 92 Cb 0.04 -0.16 -0.03 0.00 -0.94 0.00 0.00 39.48 38.40 3knp n PHE 92 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3knp s GLY 93 N -1.19 0.78 -0.32 1.37 0.00 0.06 -4.58 107.32 103.43 3knp s GLY 93 Ca 0.38 0.01 -0.24 0.00 0.00 0.00 0.00 44.72 44.87 3knp s GLY 93 CO 0.18 3.16 0.84 0.21 0.00 0.00 0.00 173.10 177.50 3knp s ASN 94 N 5.85 6.69 -0.30 1.64 3.84 0.11 -4.76 114.94 128.00 3knp s ASN 94 Ca 0.73 0.68 0.09 0.00 0.21 0.00 0.00 52.86 54.56 3knp s ASN 94 Cb -0.19 -2.43 0.53 0.00 -0.55 0.00 0.00 41.25 38.62 3knp s ASN 94 CO 0.31 -0.69 1.53 0.35 -2.79 0.00 0.00 177.10 175.81 3knp n THR 95 N 5.65 2.63 0.00 -5.21 -2.24 -1.26 -2.09 114.28 111.75 3knp n THR 95 Ca 0.05 -2.56 0.00 0.00 -2.27 0.00 0.00 64.05 59.27 3knp n THR 95 Cb 0.48 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 3knp n THR 95 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3knp n LYS 96 N -1.07 0.00 -3.31 -0.78 5.02 -1.26 -4.72 118.16 112.04 3knp n LYS 96 Ca 0.36 0.28 -0.29 0.00 -2.02 0.00 0.00 58.31 56.64 3knp n LYS 96 Cb 1.12 -1.23 -0.04 0.00 -0.02 0.00 0.00 35.03 34.86 3knp n LYS 96 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3knp s LYS 97 N -1.91 3.68 0.29 1.97 2.47 -1.26 -4.93 119.74 120.04 3knp s LYS 97 Ca 0.00 0.10 0.00 0.00 -1.56 0.00 0.00 55.97 54.51 3knp s LYS 97 Cb 0.00 -2.62 0.00 0.00 -1.46 0.00 0.00 37.83 33.75 3knp s LYS 97 CO 0.00 0.21 0.00 0.41 0.16 0.00 0.00 175.35 176.13 3knp n GLY 98 N -0.81 -2.82 0.00 5.54 0.00 -1.26 -4.59 105.19 101.25 3knp n GLY 98 Ca -0.01 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.74 3knp n GLY 98 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3knp n ASN 99 N -0.29 0.00 -4.66 1.61 3.02 -1.26 -4.56 115.26 109.11 3knp n ASN 99 Ca 0.00 0.43 -0.43 0.00 -0.03 0.00 0.00 54.58 54.55 3knp n ASN 99 Cb 0.00 -0.46 -0.02 0.00 -0.61 0.00 0.00 39.78 38.69 3knp n ASN 99 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3knp s LYS 100 N -2.91 4.25 0.16 3.52 2.47 -1.26 -5.00 119.74 120.97 3knp s LYS 100 Ca 0.05 1.54 -0.30 0.00 -1.56 0.00 0.00 55.97 55.70 3knp s LYS 100 Cb 0.06 -3.70 -0.07 0.00 -1.46 0.00 0.00 37.83 32.65 3knp s LYS 100 CO 0.16 -0.66 1.15 -1.25 0.16 0.00 0.00 175.35 174.91 3knp s PRO 101 N 3.29 4.53 -0.14 4.03 0.04 -1.26 -4.80 135.00 140.69 3knp s PRO 101 Ca 0.50 1.78 -0.06 0.00 0.04 0.00 0.00 61.00 63.26 3knp s PRO 101 Cb -0.19 -3.28 -0.04 0.00 0.04 0.00 0.00 34.50 31.03 3knp s PRO 101 CO 0.12 -0.03 0.06 0.34 0.04 0.00 0.00 177.00 177.53 3knp s ASP 102 N 0.15 5.69 -0.55 6.66 3.68 -0.89 -4.87 116.67 126.54 3knp s ASP 102 Ca 0.52 0.18 0.07 0.00 2.13 0.00 0.00 52.55 55.45 3knp s ASP 102 Cb -0.30 -1.86 0.29 0.00 -1.45 0.00 0.00 42.92 39.60 3knp s ASP 102 CO 0.35 0.28 0.77 0.49 0.13 0.00 0.00 175.17 177.18 3knp n PHE 103 N 2.84 2.67 -1.40 -5.34 3.72 -1.26 -0.71 117.46 117.97 3knp n PHE 103 Ca -0.18 -3.97 -0.03 0.00 -0.05 0.00 0.00 57.45 53.22 3knp n PHE 103 Cb 0.53 -0.49 0.20 0.00 -0.94 0.00 0.00 39.48 38.79 3knp n PHE 103 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3knp n HIS 104 N 0.53 1.11 -1.55 1.38 8.25 -1.26 -4.07 115.22 119.61 3knp n HIS 104 Ca 0.28 -1.54 0.00 0.00 -0.26 0.00 0.00 57.72 56.21 3knp n HIS 104 Cb 0.46 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.08 3knp n HIS 104 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3knp n LEU 105 N -1.07 0.00 -0.05 2.41 4.77 -1.26 -4.87 117.00 116.93 3knp n LEU 105 Ca 0.33 -0.54 0.03 0.00 -0.03 0.00 0.00 56.01 55.80 3knp n LEU 105 Cb 1.03 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 42.27 3knp n LEU 105 CO 0.19 0.17 0.59 0.00 -1.33 0.00 0.00 177.39 177.01 3knp n ALA 106 N 0.00 2.52 -1.82 -1.18 0.00 -1.26 -2.26 120.51 116.51 3knp n ALA 106 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3knp n ALA 106 Cb 0.60 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.98 3knp n ALA 106 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3knp n LYS 107 N -0.48 -3.54 -1.66 0.00 4.81 -1.26 -4.73 118.16 111.30 3knp n LYS 107 Ca 0.04 2.54 -0.45 0.00 -0.87 0.00 0.00 58.31 59.57 3knp n LYS 107 Cb 0.04 -2.96 -0.02 0.00 0.02 0.00 0.00 35.03 32.11 3knp n LYS 107 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3knp n GLU 108 N 0.85 1.94 -0.32 1.64 1.02 -1.26 -4.73 120.64 119.78 3knp n GLU 108 Ca 0.00 0.69 0.21 0.00 -0.02 0.00 0.00 57.16 58.04 3knp n GLU 108 Cb 0.00 -2.30 0.42 0.00 -0.02 0.00 0.00 31.44 29.54 3knp n GLU 108 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 3knp h PRO 109 N 3.69 0.17 0.15 3.49 0.11 -1.97 0.06 132.00 137.71 3knp h PRO 109 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3knp h PRO 109 Cb 1.29 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3knp h PRO 109 CO 0.72 0.11 -0.07 -0.91 -0.21 0.00 0.00 178.00 177.64 3knp h ASN 110 N 0.17 -0.17 -0.02 -2.05 4.21 -1.99 0.72 115.58 116.45 3knp h ASN 110 Ca 0.69 0.01 0.01 0.00 1.21 0.00 0.00 56.30 58.21 3knp h ASN 110 Cb 1.58 0.04 -0.00 0.00 -1.12 0.00 0.00 38.32 38.82 3knp h ASN 110 CO -0.70 -0.11 0.02 1.05 -1.29 0.00 0.00 177.43 176.39 3knp h GLU 111 N -0.22 0.00 0.12 0.81 9.09 -1.90 -2.14 114.58 120.34 3knp h GLU 111 Ca -0.02 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.21 3knp h GLU 111 Cb 0.16 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.28 3knp h GLU 111 CO 0.03 0.00 -0.79 0.00 0.05 0.00 0.00 179.01 178.31 3knp h ALA 112 N 1.97 -0.07 -0.65 1.06 0.00 -1.00 -2.80 119.26 117.77 3knp h ALA 112 Ca 0.01 -0.68 0.12 0.00 0.00 0.00 0.00 54.91 54.36 3knp h ALA 112 Cb 0.05 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.84 3knp h ALA 112 CO -0.00 0.37 0.20 1.25 0.00 0.00 0.00 179.25 181.07 3knp h LEU 113 N -0.33 0.12 0.61 0.00 5.85 -0.19 0.38 115.31 121.75 3knp h LEU 113 Ca -0.13 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 3knp h LEU 113 Cb 1.60 0.12 0.01 0.00 0.37 0.00 0.00 40.66 42.75 3knp h LEU 113 CO 0.15 0.06 -0.30 -0.29 -0.34 0.00 0.00 178.44 177.72 3knp h ILE 114 N 0.34 0.30 -0.83 4.05 6.09 -1.57 -2.69 117.51 123.19 3knp h ILE 114 Ca 0.35 -0.25 0.21 0.00 -1.37 0.00 0.00 64.86 63.79 3knp h ILE 114 Cb 0.51 0.38 -0.13 0.00 0.47 0.00 0.00 36.82 38.04 3knp h ILE 114 CO -0.39 0.03 0.20 0.15 -3.07 0.00 0.00 178.15 175.07 3knp h PHE 115 N -1.01 0.30 0.26 2.19 3.57 -1.08 0.22 116.94 121.39 3knp h PHE 115 Ca -0.08 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 3knp h PHE 115 Cb 0.68 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.41 3knp h PHE 115 CO -0.00 -0.18 -0.32 -0.92 -2.23 0.00 0.00 178.31 174.66 3knp h TYR 116 N 0.22 -0.90 -0.35 0.41 3.20 -0.17 -2.42 116.97 116.96 3knp h TYR 116 Ca 0.50 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.48 3knp h TYR 116 Cb 0.97 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.58 3knp h TYR 116 CO -0.28 -0.41 0.25 -0.91 -1.64 0.00 0.00 178.16 175.17 3knp h ASN 117 N -0.60 0.03 0.59 -2.11 4.21 -1.01 0.75 115.58 117.45 3knp h ASN 117 Ca -0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.48 3knp h ASN 117 Cb 0.53 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.73 3knp h ASN 117 CO -0.07 0.02 0.00 0.11 -1.29 0.00 0.00 177.43 176.20 3knp h LYS 118 N 0.03 0.00 0.04 0.81 1.57 -0.54 -2.63 116.57 115.86 3knp h LYS 118 Ca 0.17 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.84 3knp h LYS 118 Cb 0.63 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 3knp h LYS 118 CO -0.01 0.00 -0.53 0.82 -0.57 0.00 0.00 179.45 179.16 3knp h ILE 119 N 0.00 1.51 0.00 1.86 5.03 0.98 -3.26 117.51 123.63 3knp h ILE 119 Ca 0.00 -2.36 0.00 0.00 -0.12 0.00 0.00 64.86 62.38 3knp h ILE 119 Cb 0.30 3.08 0.00 0.00 -3.03 0.00 0.00 36.82 37.17 3knp h ILE 119 CO 0.00 0.59 0.07 0.40 -0.68 0.00 0.00 178.15 178.53 3knp h ILE 120 N -0.80 0.00 0.10 -0.67 5.03 -1.10 -0.39 117.51 119.68 3knp h ILE 120 Ca -0.12 0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.61 3knp h ILE 120 Cb 1.26 0.74 0.00 0.00 -3.03 0.00 0.00 36.82 35.79 3knp h ILE 120 CO -0.00 0.00 -0.05 0.44 -0.68 0.00 0.00 178.15 177.86 3knp h ASP 121 N 0.00 -0.11 0.72 1.72 3.32 -1.58 -1.95 116.42 118.55 3knp h ASP 121 Ca 0.00 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3knp h ASP 121 Cb 0.15 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3knp h ASP 121 CO 0.00 0.52 0.00 -0.08 -1.72 0.00 0.00 179.24 177.96 3knp h GLU 122 N -0.86 0.00 0.06 3.56 4.57 -1.32 0.02 114.58 120.61 3knp h GLU 122 Ca -0.01 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3knp h GLU 122 Cb 0.57 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 3knp h GLU 122 CO 0.02 0.00 -0.03 0.74 -1.18 0.00 0.00 179.01 178.56 3knp h PHE 123 N 0.00 -0.07 0.00 0.92 0.04 -1.13 -0.95 116.94 115.75 3knp h PHE 123 Ca 0.00 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3knp h PHE 123 Cb 0.36 0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.53 3knp h PHE 123 CO 0.00 0.44 0.00 1.63 -0.60 0.00 0.00 178.31 179.78 3knp n LYS 124 N -4.77 0.03 0.00 1.51 5.02 -0.73 -2.08 118.16 117.13 3knp n LYS 124 Ca -0.06 0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 3knp n LYS 124 Cb 0.27 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 3knp n LYS 124 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3knp n LYS 125 N -1.47 0.00 0.18 1.97 4.81 -0.02 -3.49 118.16 120.14 3knp n LYS 125 Ca 0.03 0.35 0.17 0.00 -0.87 0.00 0.00 58.31 57.99 3knp n LYS 125 Cb 0.13 -0.84 0.64 0.00 0.02 0.00 0.00 35.03 34.98 3knp n LYS 125 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 3knp h GLN 126 N 0.00 0.00 0.00 1.64 4.20 -1.12 -3.38 115.11 116.45 3knp h GLN 126 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3knp h GLN 126 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3knp h GLN 126 CO 0.00 0.00 0.00 0.98 -0.67 0.00 0.00 178.83 179.14 3knp n TYR 127 N -3.18 0.00 -3.41 2.96 9.36 -0.88 -5.10 117.16 116.90 3knp n TYR 127 Ca 0.05 0.00 -0.00 0.00 3.32 0.00 0.00 57.90 61.26 3knp n TYR 127 Cb 0.69 0.00 -0.00 0.00 -0.63 0.00 0.00 39.34 39.40 3knp n TYR 127 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3knp n ASN 128 N 0.00 -0.03 -0.07 2.98 6.94 -1.23 -4.99 115.26 118.86 3knp n ASN 128 Ca 0.00 -1.04 -0.05 0.00 -0.02 0.00 0.00 54.58 53.48 3knp n ASN 128 Cb 0.00 0.06 -0.02 0.00 -2.36 0.00 0.00 39.78 37.46 3knp n ASN 128 CO 0.00 0.00 0.00 -0.78 -1.03 0.00 0.00 177.26 175.45 3knp h ASP 129 N 0.04 0.00 0.00 0.53 3.58 -1.94 -3.38 116.42 115.24 3knp h ASP 129 Ca -0.01 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.36 3knp h ASP 129 Cb 0.03 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.08 3knp h ASP 129 CO 0.01 0.73 0.03 0.47 -2.88 0.00 0.00 179.24 177.60 3knp n ASP 130 N -4.66 0.00 0.00 2.28 8.00 -1.26 -2.32 116.55 118.59 3knp n ASP 130 Ca -0.07 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.54 3knp n ASP 130 Cb 0.21 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 3knp n ASP 130 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3knp n LYS 131 N -1.02 1.44 -3.59 -1.24 4.76 -1.26 -4.88 118.16 112.37 3knp n LYS 131 Ca 0.00 -1.06 -0.37 0.00 -2.87 0.00 0.00 58.31 54.01 3knp n LYS 131 Cb 0.03 -0.95 -0.06 0.00 -1.84 0.00 0.00 35.03 32.22 3knp n LYS 131 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 3knp n ILE 132 N -0.29 3.22 -2.73 -0.18 -0.00 -0.98 -2.06 119.36 116.33 3knp n ILE 132 Ca 0.00 -5.17 -0.29 0.00 -0.00 0.00 0.00 62.75 57.30 3knp n ILE 132 Cb 0.19 -2.39 -0.01 0.00 -0.00 0.00 0.00 39.64 37.43 3knp n ILE 132 CO 0.00 0.00 0.00 -0.54 -0.00 0.00 0.00 176.55 176.01 3knp s LYS 133 N -1.45 3.64 0.00 0.38 3.01 -0.45 -4.95 119.74 119.93 3knp s LYS 133 Ca 0.28 0.32 0.00 0.00 -1.01 0.00 0.00 55.97 55.56 3knp s LYS 133 Cb -0.06 -2.39 0.00 0.00 -1.01 0.00 0.00 37.83 34.37 3knp s LYS 133 CO -0.12 -0.13 0.00 0.44 0.51 0.00 0.00 175.35 176.06 3knp n ILE 134 N -1.82 0.00 -4.14 2.17 -0.00 -1.26 -0.63 119.36 113.68 3knp n ILE 134 Ca 0.01 0.00 -0.14 0.00 -0.00 0.00 0.00 62.75 62.62 3knp n ILE 134 Cb 0.55 0.00 -0.05 0.00 -0.00 0.00 0.00 39.64 40.14 3knp n ILE 134 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3knp n GLY 135 N 0.00 2.87 3.58 3.28 0.00 -1.26 -4.66 105.19 109.00 3knp n GLY 135 Ca 0.00 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.85 3knp n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3knp s LYS 136 N -2.93 3.21 0.20 1.61 1.02 -1.26 -4.94 119.74 116.65 3knp s LYS 136 Ca 0.29 0.91 -0.32 0.00 0.02 0.00 0.00 55.97 56.86 3knp s LYS 136 Cb 0.01 -4.19 -0.15 0.00 -0.52 0.00 0.00 37.83 32.98 3knp s LYS 136 CO 0.20 -2.02 1.30 0.34 -0.92 0.00 0.00 175.35 174.25 3knp n PHE 137 N 10.41 1.75 -3.28 3.18 7.35 -1.26 -2.92 117.46 132.69 3knp n PHE 137 Ca 0.19 0.54 -0.14 0.00 -0.76 0.00 0.00 57.45 57.28 3knp n PHE 137 Cb 0.49 -2.38 0.05 0.00 0.35 0.00 0.00 39.48 37.99 3knp n PHE 137 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3knp n GLY 138 N 2.17 -1.17 3.75 7.13 0.00 -1.26 -5.04 105.19 110.77 3knp n GLY 138 Ca 0.14 0.55 -0.08 0.00 0.00 0.00 0.00 46.02 46.63 3knp n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3knp s ASN 139 N -3.31 -0.16 -0.42 1.61 0.01 -1.15 -5.12 114.94 106.40 3knp s ASN 139 Ca 0.36 -0.77 -0.23 0.00 -0.71 0.00 0.00 52.86 51.51 3knp s ASN 139 Cb -0.06 0.68 0.02 0.00 0.41 0.00 0.00 41.25 42.30 3knp s ASN 139 CO 0.76 -1.28 0.77 -0.47 -1.51 0.00 0.00 177.10 175.37 3knp s TYR 140 N -3.88 3.04 0.04 2.20 5.04 -1.26 -5.02 117.35 117.52 3knp s TYR 140 Ca 0.16 0.29 0.05 0.00 -2.44 0.00 0.00 57.07 55.13 3knp s TYR 140 Cb -0.04 -3.54 -0.04 0.00 0.35 0.00 0.00 41.96 38.70 3knp s TYR 140 CO 0.08 -0.88 -0.10 -1.64 -1.34 0.00 0.00 175.55 171.67 3knp s MET 141 N 3.18 2.32 -0.32 4.97 -1.94 -1.26 -4.05 119.30 122.20 3knp s MET 141 Ca 0.30 -0.87 0.03 0.00 -1.71 0.00 0.00 55.69 53.43 3knp s MET 141 Cb -0.13 -2.37 0.10 0.00 2.01 0.00 0.00 34.83 34.44 3knp s MET 141 CO 0.20 0.56 0.05 1.21 -0.01 0.00 0.00 175.02 177.03 3knp s ASN 142 N -1.66 4.53 -0.32 3.03 2.47 0.31 -4.91 114.94 118.39 3knp s ASN 142 Ca 0.18 -1.95 -0.12 0.00 0.42 0.00 0.00 52.86 51.39 3knp s ASN 142 Cb -0.11 -1.42 -0.02 0.00 -1.45 0.00 0.00 41.25 38.25 3knp s ASN 142 CO 0.09 -0.37 0.21 -0.63 -3.72 0.00 0.00 177.10 172.68 3knp s ILE 143 N 1.10 5.14 -0.26 -5.21 1.09 -1.26 -2.25 121.20 119.55 3knp s ILE 143 Ca 0.09 -0.19 -0.22 0.00 -1.10 0.00 0.00 60.65 59.23 3knp s ILE 143 Cb -0.19 -3.60 -0.01 0.00 -1.06 0.00 0.00 42.46 37.60 3knp s ILE 143 CO -0.12 0.05 0.70 -1.81 -0.10 0.00 0.00 174.94 173.66 3knp s ASP 144 N 1.71 6.64 0.03 3.58 1.01 -0.96 -4.89 116.67 123.79 3knp s ASP 144 Ca 0.06 0.75 0.08 0.00 0.71 0.00 0.00 52.55 54.15 3knp s ASP 144 Cb -0.17 -2.37 -0.03 0.00 1.01 0.00 0.00 42.92 41.36 3knp s ASP 144 CO 0.10 -0.45 -0.21 -0.69 0.21 0.00 0.00 175.17 174.13 3knp s VAL 145 N 2.65 2.55 -0.80 -1.27 1.01 -1.26 -1.57 120.40 121.71 3knp s VAL 145 Ca 0.29 -1.20 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 3knp s VAL 145 Cb -0.15 -2.03 0.20 0.00 0.00 0.00 0.00 36.38 34.40 3knp s VAL 145 CO 0.09 0.39 0.66 -0.89 0.00 0.00 0.00 175.10 175.35 3knp s THR 146 N -0.84 4.01 -0.34 3.92 2.01 0.11 -4.99 115.64 119.51 3knp s THR 146 Ca 0.13 -3.69 -0.27 0.00 0.31 0.00 0.00 61.69 58.16 3knp s THR 146 Cb -0.10 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 3knp s THR 146 CO 0.03 -1.02 2.22 0.20 -0.69 0.00 0.00 174.62 175.36 3knp s ASN 147 N -0.11 5.14 -0.53 3.53 0.01 -1.26 -1.47 114.94 120.25 3knp s ASN 147 Ca 0.24 1.47 -0.25 0.00 -0.71 0.00 0.00 52.86 53.61 3knp s ASN 147 Cb -0.10 -2.51 0.04 0.00 0.41 0.00 0.00 41.25 39.08 3knp s ASN 147 CO -0.11 -2.27 1.00 -0.62 -1.51 0.00 0.00 177.10 173.59 3knp s ASP 148 N 9.40 6.41 0.00 -1.22 2.15 -1.12 -4.42 116.67 127.86 3knp s ASP 148 Ca 0.96 -0.12 0.00 0.00 0.43 0.00 0.00 52.55 53.82 3knp s ASP 148 Cb -0.25 -2.47 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 3knp s ASP 148 CO 0.31 -1.25 0.00 0.61 -0.17 0.00 0.00 175.17 174.68 3knp n GLY 149 N 5.06 1.83 3.94 2.66 0.00 -1.26 -3.55 105.19 113.86 3knp n GLY 149 Ca 0.05 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.32 3knp n GLY 149 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3knp s PRO 150 N 0.00 1.80 -0.05 1.61 0.04 -1.26 -5.19 135.00 131.94 3knp s PRO 150 Ca 0.00 -0.41 -0.02 0.00 0.04 0.00 0.00 61.00 60.61 3knp s PRO 150 Cb 0.00 -2.12 0.04 0.00 0.04 0.00 0.00 34.50 32.45 3knp s PRO 150 CO 0.00 -1.52 0.10 0.08 0.04 0.00 0.00 177.00 175.70 3knp s VAL 151 N -3.37 -0.16 0.08 -0.36 1.01 -1.23 -5.02 120.40 111.36 3knp s VAL 151 Ca 0.64 0.38 0.06 0.00 0.00 0.00 0.00 61.98 63.06 3knp s VAL 151 Cb -0.09 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 3knp s VAL 151 CO 0.46 0.16 -0.16 -0.89 0.00 0.00 0.00 175.10 174.67 3knp s THR 152 N 2.10 1.31 -0.14 3.92 2.01 -1.26 0.32 115.64 123.90 3knp s THR 152 Ca 0.03 -1.40 -0.06 0.00 0.31 0.00 0.00 61.69 60.56 3knp s THR 152 Cb -0.12 -1.25 0.06 0.00 0.01 0.00 0.00 72.50 71.20 3knp s THR 152 CO -0.04 -0.19 0.32 -0.63 -0.69 0.00 0.00 174.62 173.39 3knp s ILE 153 N -1.30 -0.25 0.25 1.82 1.09 0.31 -4.95 121.20 118.17 3knp s ILE 153 Ca 0.01 0.18 0.02 0.00 -1.10 0.00 0.00 60.65 59.76 3knp s ILE 153 Cb -0.10 -0.50 -0.03 0.00 -1.06 0.00 0.00 42.46 40.77 3knp s ILE 153 CO 0.03 0.07 0.41 -0.47 -0.10 0.00 0.00 174.94 174.89 3knp s TYR 154 N 1.85 3.48 -0.28 3.97 5.04 -1.26 -0.12 117.35 130.02 3knp s TYR 154 Ca -0.05 0.20 -0.14 0.00 -2.44 0.00 0.00 57.07 54.64 3knp s TYR 154 Cb -0.11 -1.75 0.10 0.00 0.35 0.00 0.00 41.96 40.55 3knp s TYR 154 CO -0.10 0.34 0.67 0.42 -1.34 0.00 0.00 175.55 175.53 3knp s ILE 155 N -2.02 -0.35 -0.04 3.14 1.09 -0.99 -4.98 121.20 117.05 3knp s ILE 155 Ca 0.37 0.00 0.03 0.00 -1.10 0.00 0.00 60.65 59.95 3knp s ILE 155 Cb -0.10 -0.99 -0.03 0.00 -1.06 0.00 0.00 42.46 40.29 3knp s ILE 155 CO 0.31 0.00 -0.11 -0.62 -0.10 0.00 0.00 174.94 174.42 3knp s ASP 156 N 2.07 4.32 0.14 3.58 -1.08 -1.26 -2.73 116.67 121.72 3knp s ASP 156 Ca -0.09 -0.15 0.25 0.00 -0.52 0.00 0.00 52.55 52.04 3knp s ASP 156 Cb -0.08 -0.97 0.49 0.00 -1.46 0.00 0.00 42.92 40.90 3knp s ASP 156 CO -0.19 0.33 1.46 0.35 0.52 0.00 0.00 175.17 177.63 3knp n THR 157 N 2.06 0.42 0.06 1.71 -2.24 -0.82 -3.83 114.28 111.63 3knp n THR 157 Ca -0.17 -0.27 -0.02 0.00 -2.27 0.00 0.00 64.05 61.32 3knp n THR 157 Cb 0.52 -0.25 0.24 0.00 -2.10 0.00 0.00 70.33 68.74 3knp n THR 157 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3knp h HIS 158 N 0.00 0.41 0.00 4.78 -0.00 -1.96 -2.67 115.15 115.71 3knp h HIS 158 Ca 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 60.37 60.28 3knp h HIS 158 Cb 0.74 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 28.05 3knp h HIS 158 CO 0.00 0.61 0.00 -0.25 -0.00 0.00 0.00 177.93 178.29 3knp n ASP 159 N -4.12 0.00 0.00 3.26 8.00 -1.25 -5.20 116.55 117.24 3knp n ASP 159 Ca -0.01 -1.04 0.00 0.00 0.71 0.00 0.00 54.79 54.46 3knp n ASP 159 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 3knp n ASP 159 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11