#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 0.72 0.15 2.12 0.52 -0.03 -0.90 118.95 121.53 3knp s ARG 2 Ca 0.00 -0.14 0.06 0.00 -0.52 0.00 0.00 55.73 55.13 3knp s ARG 2 Cb 0.00 -0.72 -0.04 0.00 0.52 0.00 0.00 34.95 34.70 3knp s ARG 2 CO 0.00 -0.01 -0.13 0.54 0.02 0.00 0.00 175.30 175.72 3knp s VAL 3 N 0.59 1.34 -0.28 3.52 0.11 -1.06 0.33 120.40 124.95 3knp s VAL 3 Ca -0.08 -1.92 0.00 0.00 -2.93 0.00 0.00 61.98 57.05 3knp s VAL 3 Cb -0.11 -1.73 0.08 0.00 -1.53 0.00 0.00 36.38 33.10 3knp s VAL 3 CO 0.00 -0.57 0.04 -0.69 -3.33 0.00 0.00 175.10 170.55 3knp s VAL 4 N -2.71 1.23 -0.21 2.04 1.01 -1.00 -3.06 120.40 117.69 3knp s VAL 4 Ca 0.14 -1.38 -0.19 0.00 0.00 0.00 0.00 61.98 60.55 3knp s VAL 4 Cb -0.02 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 3knp s VAL 4 CO 0.03 -0.44 0.54 -0.63 0.00 0.00 0.00 175.10 174.59 3knp s ILE 5 N 1.48 5.08 -0.12 2.22 1.09 -0.23 -1.63 121.20 129.09 3knp s ILE 5 Ca 0.04 0.98 0.02 0.00 -1.10 0.00 0.00 60.65 60.60 3knp s ILE 5 Cb -0.18 -3.86 0.01 0.00 -1.06 0.00 0.00 42.46 37.37 3knp s ILE 5 CO -0.15 0.14 -0.19 -1.10 -0.10 0.00 0.00 174.94 173.54 3knp s GLN 6 N 1.86 2.68 -0.11 2.79 -0.21 -0.70 -0.35 119.66 125.62 3knp s GLN 6 Ca 0.24 -0.73 -0.30 0.00 0.02 0.00 0.00 55.36 54.59 3knp s GLN 6 Cb -0.15 -2.17 -0.02 0.00 1.00 0.00 0.00 33.01 31.66 3knp s GLN 6 CO 0.09 -0.00 1.14 0.50 -2.12 0.00 0.00 175.29 174.90 3knp s ARG 7 N 0.80 4.34 0.35 2.91 3.52 -0.16 -2.20 118.95 128.50 3knp s ARG 7 Ca -0.09 1.55 0.03 0.00 -0.13 0.00 0.00 55.73 57.10 3knp s ARG 7 Cb -0.16 -3.60 -0.05 0.00 -1.56 0.00 0.00 34.95 29.59 3knp s ARG 7 CO 0.00 -0.47 0.08 0.14 -0.81 0.00 0.00 175.30 174.24 3knp s VAL 8 N 2.48 0.96 -0.02 7.11 -7.23 -0.60 0.11 120.40 123.20 3knp s VAL 8 Ca 0.52 -2.00 0.13 0.00 -1.81 0.00 0.00 61.98 58.82 3knp s VAL 8 Cb -0.21 -2.64 -0.19 0.00 0.56 0.00 0.00 36.38 33.89 3knp s VAL 8 CO 0.18 0.00 0.26 0.29 -0.31 0.00 0.00 175.10 175.52 3knp n LYS 9 N -0.74 0.50 0.00 4.82 4.76 -0.36 -2.63 118.16 124.51 3knp n LYS 9 Ca -0.03 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.30 3knp n LYS 9 Cb 0.66 -1.30 0.00 0.00 -1.84 0.00 0.00 35.03 32.55 3knp n LYS 9 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3knp n GLY 10 N 1.81 1.06 3.49 0.72 0.00 -0.77 -1.63 105.19 109.87 3knp n GLY 10 Ca -0.04 -0.77 -0.12 0.00 0.00 0.00 0.00 46.02 45.09 3knp n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3knp s ALA 11 N -2.00 -1.49 -0.18 4.61 0.00 0.93 -1.25 121.76 122.38 3knp s ALA 11 Ca 0.00 1.81 -0.01 0.00 0.00 0.00 0.00 51.96 53.76 3knp s ALA 11 Cb 0.00 -1.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.05 3knp s ALA 11 CO 0.00 -0.30 -0.11 0.42 0.00 0.00 0.00 175.76 175.77 3knp s ILE 12 N 0.77 3.00 -0.21 0.00 1.09 0.66 -1.48 121.20 125.03 3knp s ILE 12 Ca -0.04 -0.64 -0.04 0.00 -1.10 0.00 0.00 60.65 58.83 3knp s ILE 12 Cb -0.05 -2.31 -0.01 0.00 -1.06 0.00 0.00 42.46 39.03 3knp s ILE 12 CO -0.06 0.48 -0.03 -0.22 -0.10 0.00 0.00 174.94 175.01 3knp s LEU 13 N 1.01 3.00 0.37 2.97 0.20 -0.57 -0.83 118.68 124.84 3knp s LEU 13 Ca -0.01 -0.33 0.08 0.00 0.69 0.00 0.00 54.13 54.56 3knp s LEU 13 Cb -0.15 -1.76 -0.07 0.00 -0.43 0.00 0.00 46.19 43.78 3knp s LEU 13 CO -0.02 0.01 -0.04 -0.44 -0.29 0.00 0.00 176.35 175.58 3knp s SER 14 N 1.29 3.72 0.37 3.68 0.01 0.05 -1.56 113.70 121.27 3knp s SER 14 Ca 0.04 -1.29 0.06 0.00 1.31 0.00 0.00 55.95 56.06 3knp s SER 14 Cb -0.14 -0.36 -0.03 0.00 0.21 0.00 0.00 66.02 65.70 3knp s SER 14 CO -0.01 -0.35 0.21 0.68 0.41 0.00 0.00 173.24 174.18 3knp s VAL 15 N -2.70 0.27 -0.50 3.43 -7.23 -0.95 -1.25 120.40 111.47 3knp s VAL 15 Ca 0.34 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.24 3knp s VAL 15 Cb 0.06 -2.40 -0.05 0.00 0.56 0.00 0.00 36.38 34.56 3knp s VAL 15 CO 0.17 0.00 2.18 -0.13 -0.31 0.00 0.00 175.10 177.01 3knp s ARG 16 N -3.57 2.42 -0.08 4.82 1.81 -1.26 -2.09 118.95 121.00 3knp s ARG 16 Ca 0.31 1.19 0.05 0.00 -1.72 0.00 0.00 55.73 55.56 3knp s ARG 16 Cb 0.02 -4.48 -0.00 0.00 -0.45 0.00 0.00 34.95 30.04 3knp s ARG 16 CO 0.21 -2.93 -0.23 -0.48 -0.68 0.00 0.00 175.30 171.19 3knp s LEU 27 N 10.58 2.03 -0.13 2.53 0.05 -1.26 -5.14 118.68 127.34 3knp s LEU 27 Ca 0.87 -0.50 -0.02 0.00 0.05 0.00 0.00 54.13 54.53 3knp s LEU 27 Cb -0.17 -1.30 -0.02 0.00 -2.05 0.00 0.00 46.19 42.64 3knp s LEU 27 CO 0.25 0.17 -0.07 -1.83 -0.55 0.00 0.00 176.35 174.32 3knp s GLU 28 N 0.18 3.42 0.51 1.48 -1.05 -0.89 -5.10 118.70 117.25 3knp s GLU 28 Ca -0.12 -0.58 -0.22 0.00 -0.15 0.00 0.00 54.97 53.90 3knp s GLU 28 Cb -0.16 -2.76 -0.06 0.00 -0.44 0.00 0.00 34.13 30.71 3knp s GLU 28 CO 0.06 0.31 1.24 0.42 0.95 0.00 0.00 175.26 178.24 3knp s ILE 29 N 0.15 2.65 0.00 1.83 1.09 -1.26 -2.23 121.20 123.42 3knp s ILE 29 Ca -0.03 0.48 0.00 0.00 -1.10 0.00 0.00 60.65 59.99 3knp s ILE 29 Cb -0.14 -3.23 0.00 0.00 -1.06 0.00 0.00 42.46 38.02 3knp s ILE 29 CO 0.04 -0.02 0.03 2.30 -0.10 0.00 0.00 174.94 177.19 3knp n ILE 30 N -0.86 0.00 -3.55 2.92 -0.00 -0.60 -4.92 119.36 112.35 3knp n ILE 30 Ca 0.09 -0.04 -0.09 0.00 -0.00 0.00 0.00 62.75 62.71 3knp n ILE 30 Cb 0.47 1.76 -0.04 0.00 -0.00 0.00 0.00 39.64 41.83 3knp n ILE 30 CO 0.00 0.00 0.00 -0.94 -0.00 0.00 0.00 176.55 175.61 3knp s SER 31 N -0.01 -0.35 0.11 7.28 1.04 -1.19 -5.01 113.70 115.56 3knp s SER 31 Ca 0.00 0.24 -0.25 0.00 0.48 0.00 0.00 55.95 56.42 3knp s SER 31 Cb 0.00 0.32 0.07 0.00 0.10 0.00 0.00 66.02 66.51 3knp s SER 31 CO 0.00 -0.43 0.62 -0.70 0.98 0.00 0.00 173.24 173.71 3knp s GLU 32 N -1.86 1.22 0.04 4.02 2.12 -1.26 -1.51 118.70 121.46 3knp s GLU 32 Ca 0.01 -0.29 -0.18 0.00 0.36 0.00 0.00 54.97 54.88 3knp s GLU 32 Cb -0.01 0.57 0.03 0.00 0.26 0.00 0.00 34.13 34.98 3knp s GLU 32 CO -0.02 -0.50 0.40 0.96 -0.54 0.00 0.00 175.26 175.56 3knp s ILE 33 N -3.11 0.06 0.00 -3.70 -0.00 -0.55 -4.96 121.20 108.94 3knp s ILE 33 Ca -0.02 -0.47 0.00 0.00 -0.00 0.00 0.00 60.65 60.16 3knp s ILE 33 Cb -0.01 -0.93 0.00 0.00 -0.00 0.00 0.00 42.46 41.53 3knp s ILE 33 CO -0.07 -0.26 0.00 0.29 -0.00 0.00 0.00 174.94 174.90 3knp n LYS 34 N 0.58 0.00 -1.98 0.37 4.76 -1.26 -0.05 118.16 120.59 3knp n LYS 34 Ca -0.19 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.83 3knp n LYS 34 Cb 0.59 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.75 3knp n LYS 34 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3knp s ASN 35 N -0.80 6.64 0.00 4.39 0.01 -0.65 -1.85 114.94 122.68 3knp s ASN 35 Ca 0.00 2.50 0.00 0.00 -0.71 0.00 0.00 52.86 54.65 3knp s ASN 35 Cb 0.00 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.08 3knp s ASN 35 CO 0.00 -0.82 0.00 0.61 -1.51 0.00 0.00 177.10 175.38 3knp n GLY 36 N 3.80 -0.56 3.15 0.66 0.00 -1.08 -2.76 105.19 108.41 3knp n GLY 36 Ca 0.14 -0.40 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 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 2.49 -0.09 0.99 1.43 -0.55 -1.56 118.68 121.40 3knp s LEU 37 Ca 0.00 -0.98 0.01 0.00 -1.03 0.00 0.00 54.13 52.13 3knp s LEU 37 Cb 0.00 -0.05 0.02 0.00 0.03 0.00 0.00 46.19 46.19 3knp s LEU 37 CO 0.00 -0.46 -0.09 -0.51 0.23 0.00 0.00 176.35 175.52 3knp s ILE 38 N -3.52 1.00 -0.28 -0.59 -1.16 -0.94 -1.77 121.20 113.95 3knp s ILE 38 Ca 0.10 -0.34 -0.03 0.00 -0.51 0.00 0.00 60.65 59.87 3knp s ILE 38 Cb 0.05 -0.98 0.03 0.00 0.61 0.00 0.00 42.46 42.17 3knp s ILE 38 CO -0.05 0.35 -0.00 0.00 -2.81 0.00 0.00 174.94 172.42 3knp s PHE 40 N 1.34 2.74 -0.45 0.00 0.08 -0.65 -2.36 117.98 118.68 3knp s PHE 40 Ca -0.01 -0.95 -0.22 0.00 0.12 0.00 0.00 56.93 55.87 3knp s PHE 40 Cb -0.18 -4.50 0.03 0.00 -0.57 0.00 0.00 43.02 37.79 3knp s PHE 40 CO -0.01 -1.76 0.74 -1.17 -0.10 0.00 0.00 175.22 172.91 3knp s LEU 41 N 4.13 4.34 -0.21 -0.37 0.20 -0.71 -2.38 118.68 123.67 3knp s LEU 41 Ca 0.38 -0.19 -0.09 0.00 0.69 0.00 0.00 54.13 54.91 3knp s LEU 41 Cb -0.04 -2.88 -0.05 0.00 -0.43 0.00 0.00 46.19 42.79 3knp s LEU 41 CO -0.06 -0.87 0.12 -0.83 -0.29 0.00 0.00 176.35 174.42 3knp s GLY 42 N 2.09 1.97 -0.31 7.98 0.00 0.15 -2.61 107.32 116.60 3knp s GLY 42 Ca 0.27 -0.80 -0.14 0.00 0.00 0.00 0.00 44.72 44.05 3knp s GLY 42 CO 0.21 0.24 0.34 -0.42 0.00 0.00 0.00 173.10 173.47 3knp s ILE 43 N 0.69 5.19 0.86 0.90 -1.09 -1.26 -0.85 121.20 125.64 3knp s ILE 43 Ca 0.06 0.27 -0.11 0.00 -2.23 0.00 0.00 60.65 58.64 3knp s ILE 43 Cb -0.13 -3.73 0.11 0.00 -1.58 0.00 0.00 42.46 37.13 3knp s ILE 43 CO 0.01 0.05 1.09 -2.28 -1.23 0.00 0.00 174.94 172.59 3knp s HIS 44 N 2.01 2.38 -0.73 3.97 5.04 -1.26 -2.44 115.29 124.26 3knp s HIS 44 Ca 0.12 1.37 0.21 0.00 -1.54 0.00 0.00 55.06 55.23 3knp s HIS 44 Cb -0.16 -3.13 0.85 0.00 0.04 0.00 0.00 32.58 30.19 3knp s HIS 44 CO 0.11 -2.21 1.64 0.36 -2.34 0.00 0.00 174.74 172.30 3knp n LYS 45 N -3.78 0.12 -1.63 2.88 2.85 -1.08 -3.44 118.16 114.07 3knp n LYS 45 Ca 0.08 0.31 -0.01 0.00 -1.05 0.00 0.00 58.31 57.64 3knp n LYS 45 Cb 0.54 -1.71 0.08 0.00 -0.65 0.00 0.00 35.03 33.30 3knp n LYS 45 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3knp n ASN 46 N -1.92 1.97 -4.72 -5.58 3.02 -1.26 -4.82 115.26 101.94 3knp n ASN 46 Ca 0.03 -2.81 -0.42 0.00 -0.03 0.00 0.00 54.58 51.36 3knp n ASN 46 Cb 0.23 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 38.97 3knp n ASN 46 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3knp s ASP 47 N -2.99 7.03 0.27 6.41 1.01 -1.22 -5.03 116.67 122.14 3knp s ASP 47 Ca 0.36 2.14 0.04 0.00 0.71 0.00 0.00 52.55 55.80 3knp s ASP 47 Cb 0.37 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.69 3knp s ASP 47 CO -0.08 -0.48 0.41 0.42 0.21 0.00 0.00 175.17 175.65 3knp s THR 48 N 0.78 5.20 0.48 -1.27 -4.23 -1.26 -4.92 115.64 110.42 3knp s THR 48 Ca 0.58 -0.86 0.27 0.00 -1.18 0.00 0.00 61.69 60.51 3knp s THR 48 Cb -0.32 -3.85 0.27 0.00 1.34 0.00 0.00 72.50 69.95 3knp s THR 48 CO 0.31 -0.38 1.82 -0.25 -0.54 0.00 0.00 174.62 175.58 3knp h TRP 49 N 1.06 0.00 0.00 3.99 -0.00 -1.99 1.22 115.95 120.23 3knp h TRP 49 Ca -0.51 0.00 -0.08 0.00 -0.00 0.00 0.00 58.89 58.30 3knp h TRP 49 Cb 1.23 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 30.38 3knp h TRP 49 CO 0.46 0.00 -0.37 0.93 -0.00 0.00 0.00 178.44 179.46 3knp h GLU 50 N 0.00 0.00 0.05 2.65 4.39 -1.99 -0.43 114.58 119.25 3knp h GLU 50 Ca 0.00 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.46 3knp h GLU 50 Cb 0.55 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 3knp h GLU 50 CO 0.00 0.37 -1.09 -0.44 -1.16 0.00 0.00 179.01 176.69 3knp h ASP 51 N 0.00 0.18 -0.46 1.42 3.32 0.11 -3.25 116.42 117.75 3knp h ASP 51 Ca -0.00 -0.19 -0.04 0.00 0.02 0.00 0.00 57.03 56.82 3knp h ASP 51 Cb 0.91 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.38 3knp h ASP 51 CO 0.05 1.14 0.14 0.00 -1.72 0.00 0.00 179.24 178.85 3knp h ALA 52 N 0.83 0.60 0.00 3.45 0.00 -0.95 -2.92 119.26 120.26 3knp h ALA 52 Ca -0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3knp h ALA 52 Cb 1.84 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.45 3knp h ALA 52 CO 0.16 0.25 -0.06 -0.07 0.00 0.00 0.00 179.25 179.53 3knp h LEU 53 N 0.60 0.00 0.07 0.00 4.07 -1.15 -1.32 115.31 117.57 3knp h LEU 53 Ca 0.15 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 58.00 3knp h LEU 53 Cb 0.27 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.02 3knp h LEU 53 CO -0.00 0.06 -0.46 0.22 -1.08 0.00 0.00 178.44 177.18 3knp h TYR 54 N 0.00 0.34 -0.37 1.13 -0.00 -1.56 -2.44 116.97 114.06 3knp h TYR 54 Ca -0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 58.73 58.50 3knp h TYR 54 Cb 0.36 -0.02 -0.02 0.00 -0.00 0.00 0.00 36.73 37.05 3knp h TYR 54 CO 0.00 1.15 0.24 0.82 -0.00 0.00 0.00 178.16 180.37 3knp h ILE 55 N -0.57 1.09 -0.54 1.81 5.03 -1.32 -1.93 117.51 121.08 3knp h ILE 55 Ca -0.08 -0.17 -0.11 0.00 -0.12 0.00 0.00 64.86 64.38 3knp h ILE 55 Cb 1.33 0.55 -0.02 0.00 -3.03 0.00 0.00 36.82 35.65 3knp h ILE 55 CO 0.09 0.09 -0.10 0.40 -0.68 0.00 0.00 178.15 177.95 3knp h ILE 56 N 0.50 1.27 0.00 -0.67 5.03 -1.36 -1.74 117.51 120.54 3knp h ILE 56 Ca 0.14 -1.26 -0.05 0.00 -0.12 0.00 0.00 64.86 63.57 3knp h ILE 56 Cb -0.05 0.96 -0.01 0.00 -3.03 0.00 0.00 36.82 34.69 3knp h ILE 56 CO -0.03 0.45 -0.25 0.08 -0.68 0.00 0.00 178.15 177.71 3knp h ARG 57 N 0.91 0.00 0.09 2.37 -0.00 -1.26 -3.11 114.38 113.38 3knp h ARG 57 Ca 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 60.12 3knp h ARG 57 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.64 3knp h ARG 57 CO 0.05 0.25 -0.04 0.87 -0.00 0.00 0.00 179.97 181.10 3knp h LYS 58 N 0.00 -0.12 0.00 0.08 1.79 -1.00 -1.11 116.57 116.21 3knp h LYS 58 Ca -0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 3knp h LYS 58 Cb 0.47 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 3knp h LYS 58 CO 0.03 0.39 0.13 0.00 -1.08 0.00 0.00 179.45 178.92 3knp n LEU 60 N -2.47 0.00 -0.03 0.00 4.77 -1.18 -4.70 117.00 113.39 3knp n LEU 60 Ca -0.02 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.97 3knp n LEU 60 Cb 0.17 0.04 -0.11 0.00 -2.33 0.00 0.00 43.42 41.18 3knp n LEU 60 CO 0.11 0.04 -0.80 0.59 -1.33 0.00 0.00 177.39 176.00 3knp n ASN 61 N -2.04 1.60 -4.67 -1.43 4.13 -0.42 -4.02 115.26 108.41 3knp n ASN 61 Ca -0.05 0.00 -0.45 0.00 1.68 0.00 0.00 54.58 55.76 3knp n ASN 61 Cb 0.42 1.30 -0.04 0.00 -1.54 0.00 0.00 39.78 39.93 3knp n ASN 61 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3knp n LEU 62 N -2.24 3.77 -4.60 3.41 4.77 -0.46 -4.83 117.00 116.82 3knp n LEU 62 Ca -0.12 0.96 -0.43 0.00 -0.03 0.00 0.00 56.01 56.39 3knp n LEU 62 Cb 0.64 -1.46 -0.02 0.00 -2.33 0.00 0.00 43.42 40.25 3knp n LEU 62 CO 0.30 0.05 0.96 -0.13 -1.33 0.00 0.00 177.39 177.25 3knp s ARG 63 N 3.74 3.77 -0.06 3.23 0.52 -1.26 -4.35 118.95 124.55 3knp s ARG 63 Ca 0.89 0.61 0.08 0.00 -0.52 0.00 0.00 55.73 56.79 3knp s ARG 63 Cb -0.57 -3.87 0.12 0.00 0.52 0.00 0.00 34.95 31.15 3knp s ARG 63 CO 0.45 -1.24 1.01 1.28 0.02 0.00 0.00 175.30 176.82 3knp n LEU 64 N 7.50 1.27 -3.91 2.53 4.77 -0.96 -4.73 117.00 123.47 3knp n LEU 64 Ca 0.11 -1.92 -0.17 0.00 -0.03 0.00 0.00 56.01 54.01 3knp n LEU 64 Cb 0.48 -0.18 -0.15 0.00 -2.33 0.00 0.00 43.42 41.24 3knp n LEU 64 CO 0.67 0.45 -0.40 0.26 -1.33 0.00 0.00 177.39 177.05 3knp s TRP 65 N -1.36 0.47 0.82 -1.77 0.51 -1.07 -4.91 118.94 111.63 3knp s TRP 65 Ca 0.14 -0.09 -0.11 0.00 -2.12 0.00 0.00 56.10 53.92 3knp s TRP 65 Cb 0.12 -0.39 0.08 0.00 -0.81 0.00 0.00 33.47 32.48 3knp s TRP 65 CO 0.01 -0.07 1.10 -0.80 -0.51 0.00 0.00 176.95 176.68 3knp s ASN 66 N 0.34 4.04 -0.41 2.95 0.01 -1.26 -1.81 114.94 118.80 3knp s ASN 66 Ca -0.04 1.86 0.07 0.00 -0.71 0.00 0.00 52.86 54.04 3knp s ASN 66 Cb -0.07 -2.50 0.22 0.00 0.41 0.00 0.00 41.25 39.31 3knp s ASN 66 CO -0.00 -2.34 0.52 -3.20 -1.51 0.00 0.00 177.10 170.56 3knp n ASN 67 N -3.72 -0.57 -2.61 -1.22 5.15 -0.39 -4.72 115.26 107.18 3knp n ASN 67 Ca 0.09 -2.67 -0.05 0.00 -0.60 0.00 0.00 54.58 51.35 3knp n ASN 67 Cb 0.53 -0.21 -0.04 0.00 -0.53 0.00 0.00 39.78 39.53 3knp n ASN 67 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 3knp n ASP 68 N 1.96 -1.93 0.00 1.20 2.03 -1.26 -3.77 116.55 114.78 3knp n ASP 68 Ca 0.22 1.38 0.00 0.00 0.52 0.00 0.00 54.79 56.91 3knp n ASP 68 Cb 0.53 -4.92 0.00 0.00 -0.72 0.00 0.00 41.12 36.01 3knp n ASP 68 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3knp n ASN 69 N 1.82 0.00 -4.59 1.67 3.02 -1.26 -4.84 115.26 111.08 3knp n ASN 69 Ca -0.34 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.79 3knp n ASN 69 Cb 0.53 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.67 3knp n ASN 69 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3knp s LYS 70 N 0.00 2.98 0.23 3.52 1.02 -1.25 -4.97 119.74 121.28 3knp s LYS 70 Ca 0.00 1.87 -0.19 0.00 0.02 0.00 0.00 55.97 57.67 3knp s LYS 70 Cb 0.00 -4.39 -0.08 0.00 -0.52 0.00 0.00 37.83 32.84 3knp s LYS 70 CO 0.00 -2.28 0.71 0.95 -0.92 0.00 0.00 175.35 173.82 3knp s THR 71 N 8.80 4.60 -1.46 2.17 -4.23 -1.26 -1.27 115.64 122.99 3knp s THR 71 Ca 0.98 1.22 0.00 0.00 -1.18 0.00 0.00 61.69 62.71 3knp s THR 71 Cb -0.29 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 69.72 3knp s THR 71 CO 0.33 0.17 0.00 0.79 -0.54 0.00 0.00 174.62 175.37 3knp n TRP 72 N 0.61 -0.60 0.00 3.99 7.02 -1.26 -4.93 117.44 122.26 3knp n TRP 72 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 3knp n TRP 72 Cb 0.51 -3.20 0.00 0.00 -2.42 0.00 0.00 31.31 26.20 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 -0.99 0.00 -4.39 -0.99 2.03 -0.75 -4.49 116.55 106.97 3knp n ASP 73 Ca -0.19 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 54.84 3knp n ASP 73 Cb 0.62 0.00 0.25 0.00 -0.72 0.00 0.00 41.12 41.28 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 0.00 -1.15 0.37 -0.67 -0.14 -1.04 -4.55 119.74 112.57 3knp s LYS 74 Ca 0.00 0.69 0.03 0.00 -1.36 0.00 0.00 55.97 55.33 3knp s LYS 74 Cb 0.00 -1.54 -0.01 0.00 -1.68 0.00 0.00 37.83 34.60 3knp s LYS 74 CO 0.00 -3.84 0.09 0.27 -0.76 0.00 0.00 175.35 171.12 3knp n ASN 75 N -4.98 1.71 -0.28 2.83 0.23 -1.26 -2.25 115.26 111.27 3knp n ASN 75 Ca 0.04 -2.87 0.09 0.00 -0.53 0.00 0.00 54.58 51.30 3knp n ASN 75 Cb 0.55 0.74 0.24 0.00 -2.08 0.00 0.00 39.78 39.23 3knp n ASN 75 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 3knp h VAL 76 N 1.49 0.47 0.40 3.53 -1.51 -1.77 -2.25 116.25 116.61 3knp h VAL 76 Ca -0.30 -0.10 -0.02 0.00 -1.23 0.00 0.00 66.70 65.05 3knp h VAL 76 Cb 1.06 0.14 0.00 0.00 -2.13 0.00 0.00 31.29 30.35 3knp h VAL 76 CO 0.48 0.06 -0.19 0.11 -1.23 0.00 0.00 177.57 176.79 3knp h LYS 77 N 0.31 -0.52 -0.56 5.19 1.57 -1.92 -1.85 116.57 118.78 3knp h LYS 77 Ca 0.48 0.04 0.16 0.00 -1.87 0.00 0.00 60.65 59.46 3knp h LYS 77 Cb 0.88 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.29 3knp h LYS 77 CO -0.54 -0.22 0.72 -0.44 -0.57 0.00 0.00 179.45 178.40 3knp h ASP 78 N -0.99 0.00 -0.41 0.86 3.32 -1.78 1.32 116.42 118.75 3knp h ASP 78 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3knp h ASP 78 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 3knp h ASP 78 CO 0.09 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.79 3knp n LEU 79 N -3.42 4.12 -2.45 1.55 4.77 -0.89 -4.96 117.00 115.71 3knp n LEU 79 Ca 0.11 -2.66 -0.07 0.00 -0.03 0.00 0.00 56.01 53.37 3knp n LEU 79 Cb 0.92 -0.50 -0.00 0.00 -2.33 0.00 0.00 43.42 41.50 3knp n LEU 79 CO 0.23 0.71 -0.09 -3.20 -1.33 0.00 0.00 177.39 173.72 3knp n ASN 80 N 0.23 -2.63 -2.46 -1.43 2.85 0.45 -4.93 115.26 107.34 3knp n ASN 80 Ca 0.21 0.33 0.00 0.00 -0.11 0.00 0.00 54.58 55.01 3knp n ASN 80 Cb 0.83 -2.30 0.00 0.00 1.24 0.00 0.00 39.78 39.55 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 -2.98 -2.67 -4.38 1.20 4.01 -0.71 -5.04 117.16 106.59 3knp n TYR 81 Ca -0.08 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.47 3knp n TYR 81 Cb 0.56 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.49 3knp n TYR 81 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 3knp s GLU 82 N -2.16 1.45 -0.02 -0.72 -1.05 -1.11 -4.86 118.70 110.22 3knp s GLU 82 Ca 0.00 -1.74 0.02 0.00 -0.15 0.00 0.00 54.97 53.10 3knp s GLU 82 Cb 0.00 -0.84 0.00 0.00 -0.44 0.00 0.00 34.13 32.86 3knp s GLU 82 CO 0.00 -0.06 -0.09 -0.51 0.95 0.00 0.00 175.26 175.55 3knp s LEU 83 N -3.37 1.79 -0.36 1.83 1.43 -0.03 -1.48 118.68 118.49 3knp s LEU 83 Ca 0.30 -0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 53.17 3knp s LEU 83 Cb 0.05 -0.53 0.07 0.00 0.03 0.00 0.00 46.19 45.81 3knp s LEU 83 CO 0.10 0.06 0.12 -0.22 0.23 0.00 0.00 176.35 176.65 3knp s LEU 84 N 0.18 4.59 -0.27 1.79 2.96 -0.73 -0.76 118.68 126.44 3knp s LEU 84 Ca -0.03 -1.51 -0.11 0.00 -0.22 0.00 0.00 54.13 52.26 3knp s LEU 84 Cb -0.08 -1.82 -0.05 0.00 0.50 0.00 0.00 46.19 44.74 3knp s LEU 84 CO 0.00 -0.40 0.20 -0.63 -1.32 0.00 0.00 176.35 174.20 3knp s ILE 85 N 1.28 5.31 -0.03 6.68 1.09 -0.22 -0.97 121.20 134.34 3knp s ILE 85 Ca 0.01 0.20 0.01 0.00 -1.10 0.00 0.00 60.65 59.77 3knp s ILE 85 Cb -0.21 -3.54 0.02 0.00 -1.06 0.00 0.00 42.46 37.67 3knp s ILE 85 CO -0.01 0.26 -0.03 0.68 -0.10 0.00 0.00 174.94 175.74 3knp s VAL 86 N 1.66 0.36 0.74 2.92 -7.23 -1.00 -3.96 120.40 113.90 3knp s VAL 86 Ca 0.08 -0.08 -0.15 0.00 -1.81 0.00 0.00 61.98 60.02 3knp s VAL 86 Cb -0.16 -0.38 0.03 0.00 0.56 0.00 0.00 36.38 36.43 3knp s VAL 86 CO 0.10 0.16 1.08 -0.24 -0.31 0.00 0.00 175.10 175.89 3knp n SER 87 N 3.71 0.85 -2.85 4.85 2.88 -1.26 -1.75 113.62 120.06 3knp n SER 87 Ca -0.22 0.66 -0.02 0.00 -1.33 0.00 0.00 58.87 57.96 3knp n SER 87 Cb 0.53 -1.46 0.01 0.00 -0.75 0.00 0.00 64.21 62.54 3knp n SER 87 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 3knp s GLN 88 N -3.61 0.75 0.52 -1.46 -1.52 -1.07 -4.78 119.66 108.49 3knp s GLN 88 Ca 0.74 -0.59 0.34 0.00 -1.95 0.00 0.00 55.36 53.90 3knp s GLN 88 Cb -0.33 0.00 1.48 0.00 -0.22 0.00 0.00 33.01 33.94 3knp s GLN 88 CO 0.49 -0.97 2.00 0.27 -0.25 0.00 0.00 175.29 176.84 3knp h PHE 89 N 5.37 0.00 0.00 0.91 -5.15 -1.94 -2.15 116.94 113.97 3knp h PHE 89 Ca 0.03 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.80 3knp h PHE 89 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.32 3knp h PHE 89 CO 0.05 0.00 0.00 0.25 -2.00 0.00 0.00 178.31 176.61 3knp n THR 90 N -2.95 1.46 1.23 0.88 -2.24 -1.26 -0.55 114.28 110.85 3knp n THR 90 Ca 0.00 0.43 0.08 0.00 -2.27 0.00 0.00 64.05 62.29 3knp n THR 90 Cb 0.25 -1.35 0.45 0.00 -2.10 0.00 0.00 70.33 67.58 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 -1.67 0.00 -0.22 3.22 4.77 -0.81 -2.30 117.00 119.98 3knp n LEU 91 Ca 0.01 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.04 3knp n LEU 91 Cb 0.08 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.24 3knp n LEU 91 CO 0.07 0.00 0.43 0.49 -1.33 0.00 0.00 177.39 177.05 3knp n PHE 92 N -0.88 0.00 -1.97 -1.77 3.72 0.29 -4.93 117.46 111.91 3knp n PHE 92 Ca 0.11 -0.55 -0.42 0.00 -0.05 0.00 0.00 57.45 56.54 3knp n PHE 92 Cb 0.05 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 38.49 3knp n PHE 92 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3knp n GLY 93 N -0.78 4.54 3.14 1.37 0.00 -0.97 -4.50 105.19 107.98 3knp n GLY 93 Ca 0.08 -1.78 -0.58 0.00 0.00 0.00 0.00 46.02 43.74 3knp n GLY 93 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3knp n ASN 94 N 5.27 0.81 -0.51 1.61 2.85 -0.71 -4.09 115.26 120.47 3knp n ASN 94 Ca 0.47 0.75 0.11 0.00 -0.11 0.00 0.00 54.58 55.81 3knp n ASN 94 Cb 0.38 -0.83 0.04 0.00 1.24 0.00 0.00 39.78 40.60 3knp n ASN 94 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 3knp n THR 95 N 5.46 0.00 -0.26 -0.44 -2.24 -1.26 -2.73 114.28 112.81 3knp n THR 95 Ca 0.46 -0.27 0.07 0.00 -2.27 0.00 0.00 64.05 62.03 3knp n THR 95 Cb -0.04 1.21 0.20 0.00 -2.10 0.00 0.00 70.33 69.59 3knp n THR 95 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3knp h LYS 96 N 2.52 0.30 0.14 -0.78 1.57 -1.97 -2.87 116.57 115.48 3knp h LYS 96 Ca 0.00 -0.02 -0.28 0.00 -1.87 0.00 0.00 60.65 58.48 3knp h LYS 96 Cb 0.76 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 33.01 3knp h LYS 96 CO 0.00 0.20 -1.26 1.57 -0.57 0.00 0.00 179.45 179.39 3knp h LYS 97 N 0.31 0.37 -4.38 3.15 5.09 -1.96 -3.48 116.57 115.66 3knp h LYS 97 Ca 0.44 -0.59 -0.32 0.00 0.09 0.00 0.00 60.65 60.27 3knp h LYS 97 Cb 0.76 0.21 -0.10 0.00 0.10 0.00 0.00 32.23 33.20 3knp h LYS 97 CO -0.50 1.27 -0.32 0.20 -2.09 0.00 0.00 179.45 178.01 3knp s GLY 98 N -4.60 1.71 0.00 0.07 0.00 -1.09 -5.03 107.32 98.39 3knp s GLY 98 Ca -0.06 -1.68 0.27 0.00 0.00 0.00 0.00 44.72 43.26 3knp s GLY 98 CO 0.90 -1.16 1.66 0.70 0.00 0.00 0.00 173.10 175.19 3knp n ASN 99 N -1.31 1.59 -4.28 1.64 5.03 -1.26 -4.62 115.26 112.05 3knp n ASN 99 Ca 0.03 -1.46 -0.37 0.00 0.87 0.00 0.00 54.58 53.65 3knp n ASN 99 Cb 0.62 0.03 -0.13 0.00 -1.02 0.00 0.00 39.78 39.28 3knp n ASN 99 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 3knp s LYS 100 N -2.08 2.82 0.22 3.52 2.36 -1.26 -5.08 119.74 120.23 3knp s LYS 100 Ca 0.35 -1.03 -0.32 0.00 -2.55 0.00 0.00 55.97 52.42 3knp s LYS 100 Cb 0.21 -3.33 -0.12 0.00 -1.05 0.00 0.00 37.83 33.54 3knp s LYS 100 CO 0.36 -0.53 1.67 -0.35 1.55 0.00 0.00 175.35 178.06 3knp n PRO 101 N 4.79 2.66 -3.56 4.03 -0.04 -1.26 -4.91 135.00 136.71 3knp n PRO 101 Ca -0.14 0.96 -0.39 0.00 -0.04 0.00 0.00 63.50 63.89 3knp n PRO 101 Cb 0.46 -2.78 -0.11 0.00 -0.04 0.00 0.00 33.50 31.04 3knp n PRO 101 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3knp s ASP 102 N 1.00 6.04 -0.38 3.54 2.15 -1.10 -4.92 116.67 123.00 3knp s ASP 102 Ca 0.74 -0.14 0.05 0.00 0.43 0.00 0.00 52.55 53.63 3knp s ASP 102 Cb -0.53 -2.13 0.65 0.00 -0.30 0.00 0.00 42.92 40.61 3knp s ASP 102 CO 0.36 -0.12 1.82 0.49 -0.17 0.00 0.00 175.17 177.55 3knp n PHE 103 N 5.09 2.69 0.04 -5.34 3.72 -1.26 -1.74 117.46 120.65 3knp n PHE 103 Ca -0.13 -1.55 -0.19 0.00 -0.05 0.00 0.00 57.45 55.52 3knp n PHE 103 Cb 0.51 -0.82 -0.14 0.00 -0.94 0.00 0.00 39.48 38.09 3knp n PHE 103 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3knp h HIS 104 N 1.44 0.54 0.00 1.38 3.86 -1.95 -3.27 115.15 117.15 3knp h HIS 104 Ca 0.48 -0.37 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 3knp h HIS 104 Cb 2.58 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 31.02 3knp h HIS 104 CO 1.40 1.26 0.34 -0.11 0.86 0.00 0.00 177.93 181.67 3knp n LEU 105 N -4.16 0.09 -4.89 2.43 7.94 -1.26 -4.61 117.00 112.54 3knp n LEU 105 Ca -0.13 0.31 -0.30 0.00 -1.11 0.00 0.00 56.01 54.78 3knp n LEU 105 Cb 0.78 -0.27 -0.04 0.00 0.53 0.00 0.00 43.42 44.41 3knp n LEU 105 CO 0.48 -0.35 0.24 0.00 -1.11 0.00 0.00 177.39 176.65 3knp s ALA 106 N -2.74 3.57 0.48 1.96 0.00 -1.24 -2.65 121.76 121.15 3knp s ALA 106 Ca -0.00 -0.41 -0.22 0.00 0.00 0.00 0.00 51.96 51.32 3knp s ALA 106 Cb 0.01 -2.40 -0.07 0.00 0.00 0.00 0.00 23.12 20.67 3knp s ALA 106 CO 0.03 0.31 1.18 0.21 0.00 0.00 0.00 175.76 177.50 3knp s LYS 107 N -3.31 3.65 0.58 0.00 2.20 -1.02 -4.47 119.74 117.38 3knp s LYS 107 Ca 0.46 1.81 -0.19 0.00 -0.36 0.00 0.00 55.97 57.69 3knp s LYS 107 Cb -0.11 -2.36 -0.04 0.00 -1.51 0.00 0.00 37.83 33.82 3knp s LYS 107 CO 0.27 -0.65 1.24 -2.00 -0.36 0.00 0.00 175.35 173.85 3knp s GLU 108 N -2.77 2.99 0.05 4.03 -6.30 -1.26 -4.89 118.70 110.55 3knp s GLU 108 Ca 0.65 1.93 -0.15 0.00 -2.50 0.00 0.00 54.97 54.90 3knp s GLU 108 Cb -0.29 -2.01 -0.06 0.00 0.00 0.00 0.00 34.13 31.77 3knp s GLU 108 CO 0.35 -1.21 1.24 -1.35 0.02 0.00 0.00 175.26 174.31 3knp h PRO 109 N 1.02 -0.29 0.00 4.30 0.11 -2.00 -2.89 132.00 132.24 3knp h PRO 109 Ca -0.51 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3knp h PRO 109 Cb 1.30 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.48 3knp h PRO 109 CO 0.56 -0.20 0.39 -0.91 -0.21 0.00 0.00 178.00 177.63 3knp h ASN 110 N -0.30 0.00 0.00 -2.05 2.35 -2.02 -0.81 115.58 112.75 3knp h ASN 110 Ca 0.00 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.61 3knp h ASN 110 Cb 0.32 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.66 3knp h ASN 110 CO -0.15 0.00 -2.09 1.21 -1.65 0.00 0.00 177.43 174.75 3knp n GLU 111 N -2.49 0.74 0.18 0.81 2.13 -1.19 -4.34 120.64 116.48 3knp n GLU 111 Ca -0.01 -0.11 -0.14 0.00 0.66 0.00 0.00 57.16 57.55 3knp n GLU 111 Cb 0.42 -1.49 -0.08 0.00 0.27 0.00 0.00 31.44 30.57 3knp n GLU 111 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3knp h ALA 112 N 1.47 -0.44 -1.00 4.31 0.00 -0.93 -1.94 119.26 120.73 3knp h ALA 112 Ca -0.22 -0.15 0.31 0.00 0.00 0.00 0.00 54.91 54.85 3knp h ALA 112 Cb 1.46 0.17 -0.15 0.00 0.00 0.00 0.00 17.79 19.27 3knp h ALA 112 CO 0.01 -0.65 0.56 1.25 0.00 0.00 0.00 179.25 180.42 3knp h LEU 113 N -0.63 0.53 0.38 0.00 5.85 -1.74 1.18 115.31 120.87 3knp h LEU 113 Ca -0.05 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 3knp h LEU 113 Cb 0.45 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.61 3knp h LEU 113 CO 0.07 -0.10 -0.18 0.40 -0.34 0.00 0.00 178.44 178.29 3knp h ILE 114 N 0.36 0.61 -0.68 4.05 5.03 -1.67 -0.53 117.51 124.69 3knp h ILE 114 Ca 0.72 -0.37 0.05 0.00 -0.12 0.00 0.00 64.86 65.14 3knp h ILE 114 Cb 1.60 0.79 -0.05 0.00 -3.03 0.00 0.00 36.82 36.13 3knp h ILE 114 CO -0.59 0.07 0.40 0.15 -0.68 0.00 0.00 178.15 177.49 3knp h PHE 115 N -0.73 0.73 0.78 1.37 -0.00 0.41 -1.57 116.94 117.92 3knp h PHE 115 Ca -0.05 0.02 -0.04 0.00 -0.00 0.00 0.00 57.97 57.90 3knp h PHE 115 Cb 0.51 -0.23 0.01 0.00 -0.00 0.00 0.00 35.95 36.23 3knp h PHE 115 CO -0.00 0.37 -0.37 -0.92 -0.00 0.00 0.00 178.31 177.39 3knp h TYR 116 N 0.74 -0.97 0.00 0.41 5.03 0.13 2.07 116.97 124.38 3knp h TYR 116 Ca 0.29 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.58 3knp h TYR 116 Cb 0.13 0.32 0.00 0.00 1.55 0.00 0.00 36.73 38.73 3knp h TYR 116 CO -0.06 -0.60 0.19 -0.91 -1.32 0.00 0.00 178.16 175.45 3knp h ASN 117 N -1.14 0.00 0.10 -2.11 2.35 -1.05 0.16 115.58 113.88 3knp h ASN 117 Ca -0.11 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.31 3knp h ASN 117 Cb 0.80 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 3knp h ASN 117 CO 0.18 0.00 -1.83 1.17 -1.65 0.00 0.00 177.43 175.29 3knp n LYS 118 N -2.92 0.71 0.22 0.81 4.81 -0.60 -3.48 118.16 117.71 3knp n LYS 118 Ca -0.02 0.34 0.15 0.00 -0.87 0.00 0.00 58.31 57.91 3knp n LYS 118 Cb 0.24 -1.72 0.72 0.00 0.02 0.00 0.00 35.03 34.30 3knp n LYS 118 CO 0.00 0.00 0.00 0.97 1.17 0.00 0.00 177.40 179.54 3knp h ILE 119 N -0.19 0.00 0.00 3.15 6.09 0.60 -1.11 117.51 126.05 3knp h ILE 119 Ca -0.41 -0.18 -0.20 0.00 -1.37 0.00 0.00 64.86 62.70 3knp h ILE 119 Cb 1.86 0.96 -0.04 0.00 0.47 0.00 0.00 36.82 40.08 3knp h ILE 119 CO 0.01 0.00 -1.58 -0.38 -3.07 0.00 0.00 178.15 173.13 3knp n ILE 120 N -2.62 1.23 0.31 2.19 -0.00 0.01 -3.75 119.36 116.72 3knp n ILE 120 Ca -0.00 -0.72 0.20 0.00 -0.00 0.00 0.00 62.75 62.23 3knp n ILE 120 Cb 0.16 -0.73 1.00 0.00 -0.00 0.00 0.00 39.64 40.06 3knp n ILE 120 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.55 176.99 3knp h ASP 121 N 0.00 0.00 0.21 4.38 3.32 -1.23 -2.56 116.42 120.54 3knp h ASP 121 Ca -0.21 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.49 3knp h ASP 121 Cb 1.69 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.25 3knp h ASP 121 CO 0.05 0.01 -1.73 -0.08 -1.72 0.00 0.00 179.24 175.77 3knp h GLU 122 N 0.00 0.39 -0.43 3.56 4.57 -1.64 -2.62 114.58 118.41 3knp h GLU 122 Ca -0.00 -0.67 0.04 0.00 -1.18 0.00 0.00 59.36 57.55 3knp h GLU 122 Cb 0.20 0.25 -0.04 0.00 -0.16 0.00 0.00 28.75 28.99 3knp h GLU 122 CO 0.00 1.31 0.19 0.74 -1.18 0.00 0.00 179.01 180.08 3knp h PHE 123 N 0.11 0.35 0.04 0.92 0.04 -1.59 0.22 116.94 117.02 3knp h PHE 123 Ca -0.34 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.48 3knp h PHE 123 Cb 2.10 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 40.11 3knp h PHE 123 CO 0.10 0.16 -0.37 0.87 -0.60 0.00 0.00 178.31 178.47 3knp h LYS 124 N 0.39 -0.53 0.50 1.51 1.79 -1.55 0.08 116.57 118.76 3knp h LYS 124 Ca 0.19 0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.68 3knp h LYS 124 Cb 0.14 0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 3knp h LYS 124 CO -0.16 -0.36 -0.45 -0.22 -1.08 0.00 0.00 179.45 177.19 3knp h LYS 125 N -0.55 -0.90 0.42 3.15 3.64 -0.99 -3.05 116.57 118.29 3knp h LYS 125 Ca 0.05 0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 3knp h LYS 125 Cb 0.62 0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 3knp h LYS 125 CO -0.27 -0.60 -0.49 1.96 -2.27 0.00 0.00 179.45 177.78 3knp h GLN 126 N -0.93 -0.89 0.00 1.90 4.20 -0.50 -3.42 115.11 115.47 3knp h GLN 126 Ca -0.06 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3knp h GLN 126 Cb 0.79 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.77 3knp h GLN 126 CO -0.02 -0.60 0.00 0.98 -0.67 0.00 0.00 178.83 178.52 3knp n TYR 127 N -5.38 0.00 -3.47 2.96 9.36 0.01 -5.07 117.16 115.56 3knp n TYR 127 Ca -0.11 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.12 3knp n TYR 127 Cb 0.44 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.11 3knp n TYR 127 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3knp s ASN 128 N -1.00 -1.03 0.46 2.98 3.84 -1.15 -5.00 114.94 114.03 3knp s ASN 128 Ca 0.00 1.20 0.41 0.00 0.21 0.00 0.00 52.86 54.68 3knp s ASN 128 Cb 0.00 2.09 1.44 0.00 -0.55 0.00 0.00 41.25 44.22 3knp s ASN 128 CO 0.00 -0.20 1.31 -0.67 -2.79 0.00 0.00 177.10 174.75 3knp n ASP 129 N 5.34 0.02 0.12 -4.21 2.03 -1.21 -0.67 116.55 117.96 3knp n ASP 129 Ca -0.09 0.87 -0.01 0.00 0.52 0.00 0.00 54.79 56.08 3knp n ASP 129 Cb 0.50 -0.44 0.02 0.00 -0.72 0.00 0.00 41.12 40.49 3knp n ASP 129 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 3knp h ASP 130 N 0.00 0.00 0.11 1.67 3.58 -1.97 -3.32 116.42 116.49 3knp h ASP 130 Ca 0.79 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.24 3knp h ASP 130 Cb 3.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 44.14 3knp h ASP 130 CO -0.05 0.68 -0.15 0.29 -2.88 0.00 0.00 179.24 177.12 3knp n LYS 131 N -3.35 1.26 -3.41 0.28 4.76 0.15 -4.84 118.16 113.01 3knp n LYS 131 Ca 0.01 -0.78 -0.42 0.00 -2.87 0.00 0.00 58.31 54.25 3knp n LYS 131 Cb 0.77 -1.48 -0.09 0.00 -1.84 0.00 0.00 35.03 32.39 3knp n LYS 131 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3knp s ILE 132 N -2.27 5.18 0.18 -0.18 1.09 -1.24 -0.85 121.20 123.11 3knp s ILE 132 Ca 0.30 -0.30 0.09 0.00 -1.10 0.00 0.00 60.65 59.64 3knp s ILE 132 Cb 0.20 -3.90 -0.04 0.00 -1.06 0.00 0.00 42.46 37.66 3knp s ILE 132 CO 0.44 -0.24 -0.08 -0.54 -0.10 0.00 0.00 174.94 174.42 3knp s LYS 133 N 1.93 2.10 0.31 2.79 -0.14 0.06 -5.02 119.74 121.77 3knp s LYS 133 Ca 0.09 -1.26 0.05 0.00 -1.36 0.00 0.00 55.97 53.49 3knp s LYS 133 Cb -0.17 -2.18 -0.03 0.00 -1.68 0.00 0.00 37.83 33.77 3knp s LYS 133 CO 0.12 0.43 0.22 0.96 -0.76 0.00 0.00 175.35 176.32 3knp s ILE 134 N -1.73 0.11 0.00 2.17 -0.00 -1.26 -1.05 121.20 119.43 3knp s ILE 134 Ca 0.25 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 58.90 3knp s ILE 134 Cb -0.09 -2.48 0.00 0.00 -0.00 0.00 0.00 42.46 39.89 3knp s ILE 134 CO 0.16 0.00 0.00 0.61 -0.00 0.00 0.00 174.94 175.71 3knp n GLY 135 N -0.59 5.26 3.30 6.27 0.00 -1.25 -4.71 105.19 113.46 3knp n GLY 135 Ca 0.04 -2.08 -0.45 0.00 0.00 0.00 0.00 46.02 43.53 3knp n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3knp s LYS 136 N 0.49 3.59 0.09 1.61 2.47 -1.26 -5.03 119.74 121.71 3knp s LYS 136 Ca 0.00 -2.62 -0.30 0.00 -1.56 0.00 0.00 55.97 51.49 3knp s LYS 136 Cb 0.00 -4.37 -0.16 0.00 -1.46 0.00 0.00 37.83 31.84 3knp s LYS 136 CO 0.00 -1.27 0.69 0.34 0.16 0.00 0.00 175.35 175.27 3knp n PHE 137 N 3.66 0.04 0.00 4.03 7.35 -1.26 -1.55 117.46 129.73 3knp n PHE 137 Ca 0.15 0.90 0.00 0.00 -0.76 0.00 0.00 57.45 57.74 3knp n PHE 137 Cb 0.45 -1.80 0.00 0.00 0.35 0.00 0.00 39.48 38.47 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 1.57 1.44 3.69 7.13 0.00 -1.26 -4.99 105.19 112.77 3knp n GLY 138 Ca 0.17 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 3.06 0.11 1.61 0.02 -0.60 -4.99 114.94 114.16 3knp s ASN 139 Ca 0.00 1.47 -0.30 0.00 -1.02 0.00 0.00 52.86 53.02 3knp s ASN 139 Cb 0.00 -2.14 -0.06 0.00 0.02 0.00 0.00 41.25 39.07 3knp s ASN 139 CO 0.00 -2.89 0.94 -0.47 0.02 0.00 0.00 177.10 174.70 3knp s TYR 140 N -2.88 3.81 -0.04 2.20 5.04 -1.26 -4.95 117.35 119.27 3knp s TYR 140 Ca 0.64 1.78 0.03 0.00 -2.44 0.00 0.00 57.07 57.08 3knp s TYR 140 Cb -0.19 -3.03 0.00 0.00 0.35 0.00 0.00 41.96 39.09 3knp s TYR 140 CO 0.58 0.22 -0.13 -1.64 -1.34 0.00 0.00 175.55 173.23 3knp s MET 141 N -0.02 1.42 -0.41 4.97 -1.94 -1.26 -4.12 119.30 117.93 3knp s MET 141 Ca 0.46 -0.46 -0.12 0.00 -1.71 0.00 0.00 55.69 53.86 3knp s MET 141 Cb -0.23 -1.25 0.05 0.00 2.01 0.00 0.00 34.83 35.41 3knp s MET 141 CO 0.29 0.17 0.27 1.21 -0.01 0.00 0.00 175.02 176.95 3knp s ASN 142 N 0.16 5.83 -0.21 3.03 2.47 -0.38 -4.93 114.94 120.92 3knp s ASN 142 Ca -0.04 -1.21 -0.02 0.00 0.42 0.00 0.00 52.86 52.01 3knp s ASN 142 Cb -0.11 -2.06 0.01 0.00 -1.45 0.00 0.00 41.25 37.64 3knp s ASN 142 CO 0.02 -0.49 -0.11 -0.63 -3.72 0.00 0.00 177.10 172.16 3knp s ILE 143 N 1.54 2.80 -0.15 -5.21 1.09 -1.26 -0.77 121.20 119.25 3knp s ILE 143 Ca 0.03 -0.71 -0.16 0.00 -1.10 0.00 0.00 60.65 58.71 3knp s ILE 143 Cb -0.21 -2.25 -0.04 0.00 -1.06 0.00 0.00 42.46 38.89 3knp s ILE 143 CO 0.06 0.46 0.38 -1.81 -0.10 0.00 0.00 174.94 173.93 3knp s ASP 144 N 1.39 6.54 -0.05 3.58 1.01 -0.01 -4.95 116.67 124.19 3knp s ASP 144 Ca 0.05 0.63 -0.01 0.00 0.71 0.00 0.00 52.55 53.93 3knp s ASP 144 Cb -0.14 -2.23 0.03 0.00 1.01 0.00 0.00 42.92 41.59 3knp s ASP 144 CO -0.07 0.03 0.03 0.54 0.21 0.00 0.00 175.17 175.91 3knp s VAL 145 N 0.65 0.08 -0.58 -1.27 0.11 -1.26 -0.24 120.40 117.89 3knp s VAL 145 Ca 0.21 0.27 -0.24 0.00 -2.93 0.00 0.00 61.98 59.29 3knp s VAL 145 Cb -0.14 -0.27 0.05 0.00 -1.53 0.00 0.00 36.38 34.48 3knp s VAL 145 CO 0.07 0.19 0.96 -0.89 -3.33 0.00 0.00 175.10 172.10 3knp s THR 146 N 1.86 4.35 0.39 5.04 2.01 -0.38 -5.02 115.64 123.89 3knp s THR 146 Ca 0.02 0.17 -0.25 0.00 0.31 0.00 0.00 61.69 61.94 3knp s THR 146 Cb -0.12 -4.58 -0.09 0.00 0.01 0.00 0.00 72.50 67.72 3knp s THR 146 CO -0.03 -1.21 1.15 0.20 -0.69 0.00 0.00 174.62 174.04 3knp s ASN 147 N 3.03 6.62 -0.79 3.53 0.01 -1.26 -1.23 114.94 124.86 3knp s ASN 147 Ca 0.29 2.30 0.03 0.00 -0.71 0.00 0.00 52.86 54.77 3knp s ASN 147 Cb -0.13 -2.61 0.28 0.00 0.41 0.00 0.00 41.25 39.20 3knp s ASN 147 CO 0.17 -0.60 1.05 -0.67 -1.51 0.00 0.00 177.10 175.54 3knp n ASP 148 N 0.16 4.85 0.00 -1.22 2.03 0.30 -4.69 116.55 117.98 3knp n ASP 148 Ca 0.04 -3.48 0.00 0.00 0.52 0.00 0.00 54.79 51.87 3knp n ASP 148 Cb 0.47 -0.87 0.00 0.00 -0.72 0.00 0.00 41.12 40.00 3knp n ASP 148 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3knp n GLY 149 N 0.81 0.03 3.55 0.27 0.00 -1.26 -4.36 105.19 104.23 3knp n GLY 149 Ca 0.30 0.19 -0.23 0.00 0.00 0.00 0.00 46.02 46.28 3knp n GLY 149 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3knp n PRO 150 N 0.00 -0.42 -3.57 1.61 -0.04 -1.26 -5.18 135.00 126.15 3knp n PRO 150 Ca 0.00 -2.30 -0.10 0.00 -0.04 0.00 0.00 63.50 61.06 3knp n PRO 150 Cb 0.00 -0.81 -0.10 0.00 -0.04 0.00 0.00 33.50 32.54 3knp n PRO 150 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3knp s VAL 151 N -3.09 -0.57 -0.17 0.52 1.01 -1.26 -5.02 120.40 111.82 3knp s VAL 151 Ca 0.63 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.74 3knp s VAL 151 Cb -0.03 -0.66 0.02 0.00 0.00 0.00 0.00 36.38 35.71 3knp s VAL 151 CO 0.43 0.02 -0.19 -0.89 0.00 0.00 0.00 175.10 174.47 3knp s THR 152 N 2.54 1.93 -0.04 3.92 2.01 -1.26 -0.99 115.64 123.75 3knp s THR 152 Ca 0.03 -0.86 0.03 0.00 0.31 0.00 0.00 61.69 61.20 3knp s THR 152 Cb -0.13 -1.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.60 3knp s THR 152 CO -0.13 0.52 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.59 3knp s ILE 153 N 1.31 3.37 0.01 1.82 1.09 0.53 -4.95 121.20 124.38 3knp s ILE 153 Ca 0.04 -0.67 0.07 0.00 -1.10 0.00 0.00 60.65 59.00 3knp s ILE 153 Cb -0.13 -2.37 -0.02 0.00 -1.06 0.00 0.00 42.46 38.88 3knp s ILE 153 CO -0.12 0.55 -0.23 -0.47 -0.10 0.00 0.00 174.94 174.58 3knp s TYR 154 N -0.81 2.00 -0.00 3.97 6.14 -1.26 -1.06 117.35 126.32 3knp s TYR 154 Ca 0.13 -0.38 -0.08 0.00 0.64 0.00 0.00 57.07 57.37 3knp s TYR 154 Cb -0.11 -1.24 0.01 0.00 0.42 0.00 0.00 41.96 41.04 3knp s TYR 154 CO 0.02 0.03 0.17 0.42 0.64 0.00 0.00 175.55 176.83 3knp s ILE 155 N -0.66 0.08 -0.11 3.14 1.09 -1.17 -5.03 121.20 118.53 3knp s ILE 155 Ca 0.09 -0.62 -0.01 0.00 -1.10 0.00 0.00 60.65 59.00 3knp s ILE 155 Cb -0.09 -0.45 0.03 0.00 -1.06 0.00 0.00 42.46 40.89 3knp s ILE 155 CO 0.00 -0.34 -0.02 -0.62 -0.10 0.00 0.00 174.94 173.86 3knp s ASP 156 N -1.30 2.09 0.11 3.58 -1.08 -1.26 -2.58 116.67 116.23 3knp s ASP 156 Ca -0.14 -0.32 0.12 0.00 -0.52 0.00 0.00 52.55 51.70 3knp s ASP 156 Cb -0.07 -0.63 0.58 0.00 -1.46 0.00 0.00 42.92 41.34 3knp s ASP 156 CO 0.02 -0.19 1.39 0.35 0.52 0.00 0.00 175.17 177.26 3knp n THR 157 N 5.04 1.32 1.91 1.71 -2.24 -0.07 -5.02 114.28 116.94 3knp n THR 157 Ca -0.09 0.43 0.15 0.00 -2.27 0.00 0.00 64.05 62.27 3knp n THR 157 Cb 0.49 -1.34 0.91 0.00 -2.10 0.00 0.00 70.33 68.29 3knp n THR 157 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91