#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 0.75 -0.20 2.12 0.52 -1.12 0.32 118.95 121.34 3knp s ARG 2 Ca 0.00 -1.05 -0.18 0.00 -0.52 0.00 0.00 55.73 53.98 3knp s ARG 2 Cb 0.00 -0.44 0.05 0.00 0.52 0.00 0.00 34.95 35.09 3knp s ARG 2 CO 0.00 0.07 0.54 0.54 0.02 0.00 0.00 175.30 176.47 3knp s VAL 3 N -2.21 -0.00 -0.17 3.52 0.11 0.90 -0.70 120.40 121.85 3knp s VAL 3 Ca 0.01 0.01 -0.01 0.00 -2.93 0.00 0.00 61.98 59.06 3knp s VAL 3 Cb -0.04 -0.76 -0.00 0.00 -1.53 0.00 0.00 36.38 34.05 3knp s VAL 3 CO -0.00 0.00 -0.12 -0.69 -3.33 0.00 0.00 175.10 170.96 3knp s VAL 4 N 0.42 2.91 -0.09 2.04 1.01 -0.19 -1.22 120.40 125.28 3knp s VAL 4 Ca -0.01 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.29 3knp s VAL 4 Cb -0.04 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 3knp s VAL 4 CO -0.01 0.49 -0.07 -0.63 0.00 0.00 0.00 175.10 174.88 3knp s ILE 5 N 0.96 3.67 -0.04 2.22 1.09 0.69 -1.22 121.20 128.57 3knp s ILE 5 Ca -0.02 -0.47 0.03 0.00 -1.10 0.00 0.00 60.65 59.08 3knp s ILE 5 Cb -0.15 -2.53 0.00 0.00 -1.06 0.00 0.00 42.46 38.73 3knp s ILE 5 CO -0.01 0.57 -0.11 -1.10 -0.10 0.00 0.00 174.94 174.19 3knp s GLN 6 N -0.44 1.23 0.48 2.79 -0.21 -0.93 0.46 119.66 123.04 3knp s GLN 6 Ca 0.07 -0.38 -0.20 0.00 0.02 0.00 0.00 55.36 54.86 3knp s GLN 6 Cb -0.12 -1.11 -0.08 0.00 1.00 0.00 0.00 33.01 32.70 3knp s GLN 6 CO 0.02 0.12 1.04 0.50 -2.12 0.00 0.00 175.29 174.86 3knp s ARG 7 N 0.25 3.81 0.33 2.91 3.52 -0.47 -2.30 118.95 127.00 3knp s ARG 7 Ca -0.05 1.38 0.02 0.00 -0.13 0.00 0.00 55.73 56.95 3knp s ARG 7 Cb -0.10 -2.12 -0.02 0.00 -1.56 0.00 0.00 34.95 31.15 3knp s ARG 7 CO 0.01 -0.42 0.36 0.14 -0.81 0.00 0.00 175.30 174.58 3knp s VAL 8 N -1.95 0.00 0.00 7.11 -7.23 -0.98 -2.22 120.40 115.12 3knp s VAL 8 Ca 0.67 -1.81 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 3knp s VAL 8 Cb -0.17 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.21 3knp s VAL 8 CO 0.21 0.00 0.38 0.29 -0.31 0.00 0.00 175.10 175.66 3knp n LYS 9 N -0.57 0.14 0.00 4.82 5.02 -0.77 -3.93 118.16 122.86 3knp n LYS 9 Ca 0.04 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.93 3knp n LYS 9 Cb 0.62 -0.54 0.00 0.00 -0.02 0.00 0.00 35.03 35.09 3knp n LYS 9 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3knp n GLY 10 N -0.03 3.87 3.33 0.72 0.00 -0.98 -4.36 105.19 107.75 3knp n GLY 10 Ca 0.00 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.89 -1.23 -0.63 4.61 0.00 -0.86 -0.83 121.76 120.92 3knp s ALA 11 Ca 0.00 1.65 -0.03 0.00 0.00 0.00 0.00 51.96 53.58 3knp s ALA 11 Cb 0.00 -1.20 0.16 0.00 0.00 0.00 0.00 23.12 22.08 3knp s ALA 11 CO 0.00 -0.53 0.45 0.42 0.00 0.00 0.00 175.76 176.10 3knp s ILE 12 N 2.03 3.80 -0.22 0.00 1.09 0.14 -2.82 121.20 125.23 3knp s ILE 12 Ca -0.06 -2.89 -0.28 0.00 -1.10 0.00 0.00 60.65 56.32 3knp s ILE 12 Cb -0.10 -3.48 0.01 0.00 -1.06 0.00 0.00 42.46 37.83 3knp s ILE 12 CO -0.14 -0.88 1.01 -0.22 -0.10 0.00 0.00 174.94 174.62 3knp s LEU 13 N 0.01 4.11 0.50 2.97 0.20 -0.39 -2.44 118.68 123.64 3knp s LEU 13 Ca 0.16 1.35 0.02 0.00 0.69 0.00 0.00 54.13 56.36 3knp s LEU 13 Cb -0.20 -3.50 -0.02 0.00 -0.43 0.00 0.00 46.19 42.05 3knp s LEU 13 CO -0.04 -0.63 0.04 -0.44 -0.29 0.00 0.00 176.35 174.99 3knp s SER 14 N 1.20 4.15 -0.15 3.68 0.01 0.31 -1.40 113.70 121.50 3knp s SER 14 Ca 0.43 -1.57 -0.21 0.00 1.31 0.00 0.00 55.95 55.91 3knp s SER 14 Cb -0.15 0.36 0.05 0.00 0.21 0.00 0.00 66.02 66.49 3knp s SER 14 CO 0.07 -0.81 0.55 0.68 0.41 0.00 0.00 173.24 174.14 3knp s VAL 15 N -2.84 0.01 -0.49 3.43 -7.23 0.30 -2.20 120.40 111.38 3knp s VAL 15 Ca 0.13 -0.07 -0.44 0.00 -1.81 0.00 0.00 61.98 59.79 3knp s VAL 15 Cb 0.02 -0.80 -0.19 0.00 0.56 0.00 0.00 36.38 35.98 3knp s VAL 15 CO 0.07 -0.04 1.98 0.54 -0.31 0.00 0.00 175.10 177.35 3knp n ARG 16 N 2.20 0.09 -3.75 4.82 1.74 -1.26 -1.12 116.66 119.38 3knp n ARG 16 Ca -0.16 0.03 -0.37 0.00 -0.77 0.00 0.00 57.85 56.58 3knp n ARG 16 Cb 0.56 -1.57 -0.12 0.00 -1.02 0.00 0.00 32.46 30.31 3knp n ARG 16 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3knp s LEU 27 N 5.18 3.52 0.13 0.55 1.98 -1.26 -5.10 118.68 123.67 3knp s LEU 27 Ca 1.15 -0.27 0.03 0.00 -2.89 0.00 0.00 54.13 52.15 3knp s LEU 27 Cb -1.46 -1.93 -0.04 0.00 0.66 0.00 0.00 46.19 43.43 3knp s LEU 27 CO 0.70 -0.06 0.20 -0.70 -1.89 0.00 0.00 176.35 174.60 3knp s GLU 28 N 1.61 3.20 -0.02 1.98 2.12 -0.28 -5.12 118.70 122.19 3knp s GLU 28 Ca 0.06 -0.68 -0.05 0.00 0.36 0.00 0.00 54.97 54.66 3knp s GLU 28 Cb -0.15 -2.84 -0.04 0.00 0.26 0.00 0.00 34.13 31.35 3knp s GLU 28 CO 0.04 0.53 0.22 0.42 -0.54 0.00 0.00 175.26 175.92 3knp s ILE 29 N -1.67 5.38 0.00 -3.70 1.09 -1.26 0.11 121.20 121.15 3knp s ILE 29 Ca 0.33 0.08 0.00 0.00 -1.10 0.00 0.00 60.65 59.96 3knp s ILE 29 Cb -0.11 -3.53 0.00 0.00 -1.06 0.00 0.00 42.46 37.76 3knp s ILE 29 CO 0.26 0.40 0.35 2.30 -0.10 0.00 0.00 174.94 178.15 3knp n ILE 30 N 1.22 0.00 -3.60 2.92 -0.00 -0.49 -4.86 119.36 114.55 3knp n ILE 30 Ca -0.13 0.00 -0.09 0.00 -0.00 0.00 0.00 62.75 62.54 3knp n ILE 30 Cb 0.53 0.83 -0.06 0.00 -0.00 0.00 0.00 39.64 40.95 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 0.00 -0.33 0.19 7.28 0.15 -0.94 -5.02 113.70 115.02 3knp s SER 31 Ca 0.00 0.46 -0.19 0.00 0.70 0.00 0.00 55.95 56.92 3knp s SER 31 Cb 0.00 0.40 0.04 0.00 -1.71 0.00 0.00 66.02 64.75 3knp s SER 31 CO 0.00 -0.24 0.53 -0.70 1.20 0.00 0.00 173.24 174.03 3knp s GLU 32 N -0.69 1.35 -0.07 5.44 2.12 -1.26 -1.26 118.70 124.33 3knp s GLU 32 Ca 0.01 -0.78 -0.30 0.00 0.36 0.00 0.00 54.97 54.26 3knp s GLU 32 Cb -0.02 0.53 0.07 0.00 0.26 0.00 0.00 34.13 34.97 3knp s GLU 32 CO -0.02 -0.57 0.68 0.96 -0.54 0.00 0.00 175.26 175.76 3knp s ILE 33 N -3.84 0.00 0.00 -3.70 -0.00 -1.13 -4.95 121.20 107.58 3knp s ILE 33 Ca 0.07 -0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.72 3knp s ILE 33 Cb -0.01 -1.00 0.00 0.00 -0.00 0.00 0.00 42.46 41.45 3knp s ILE 33 CO -0.05 -0.00 0.00 1.17 -0.00 0.00 0.00 174.94 176.06 3knp n LYS 34 N 1.07 0.00 -2.70 0.37 0.00 -1.26 -2.04 118.16 113.60 3knp n LYS 34 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 58.31 57.72 3knp n LYS 34 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.55 3knp n LYS 34 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3knp s ASN 35 N -1.00 7.49 0.00 3.14 0.01 -1.26 -2.31 114.94 121.01 3knp s ASN 35 Ca 0.00 1.87 0.00 0.00 -0.71 0.00 0.00 52.86 54.02 3knp s ASN 35 Cb 0.00 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.06 3knp s ASN 35 CO 0.00 -0.05 0.00 0.61 -1.51 0.00 0.00 177.10 176.15 3knp n GLY 36 N 2.07 -0.35 3.16 0.66 0.00 -1.25 -2.78 105.19 106.70 3knp n GLY 36 Ca 0.02 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.37 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 2.41 0.04 0.99 1.43 -0.78 -2.32 118.68 120.45 3knp s LEU 37 Ca 0.00 -0.82 0.08 0.00 -1.03 0.00 0.00 54.13 52.37 3knp s LEU 37 Cb 0.00 -0.24 -0.03 0.00 0.03 0.00 0.00 46.19 45.95 3knp s LEU 37 CO 0.00 -0.29 -0.24 -0.51 0.23 0.00 0.00 176.35 175.54 3knp s ILE 38 N -2.54 1.94 -0.05 -0.59 -1.16 -0.97 -1.19 121.20 116.63 3knp s ILE 38 Ca 0.05 -1.29 -0.01 0.00 -0.51 0.00 0.00 60.65 58.89 3knp s ILE 38 Cb -0.02 -1.66 0.03 0.00 0.61 0.00 0.00 42.46 41.41 3knp s ILE 38 CO -0.01 0.31 -0.00 0.00 -2.81 0.00 0.00 174.94 172.43 3knp s PHE 40 N 1.55 3.32 -0.13 0.00 0.08 -0.36 0.51 117.98 122.95 3knp s PHE 40 Ca -0.02 -1.42 -0.06 0.00 0.12 0.00 0.00 56.93 55.56 3knp s PHE 40 Cb -0.13 -3.78 -0.04 0.00 -0.57 0.00 0.00 43.02 38.50 3knp s PHE 40 CO -0.03 -1.01 0.08 -1.17 -0.10 0.00 0.00 175.22 172.98 3knp s LEU 41 N 1.42 3.97 -0.09 -0.37 2.96 -0.88 -1.02 118.68 124.68 3knp s LEU 41 Ca 0.05 0.25 0.03 0.00 -0.22 0.00 0.00 54.13 54.24 3knp s LEU 41 Cb -0.27 -1.97 -0.01 0.00 0.50 0.00 0.00 46.19 44.44 3knp s LEU 41 CO 0.01 0.32 -0.19 -0.83 -1.32 0.00 0.00 176.35 174.34 3knp s GLY 42 N -0.51 1.43 -0.18 7.98 0.00 0.12 0.31 107.32 116.47 3knp s GLY 42 Ca 0.11 -0.97 -0.18 0.00 0.00 0.00 0.00 44.72 43.68 3knp s GLY 42 CO 0.02 -0.45 0.48 -0.42 0.00 0.00 0.00 173.10 172.73 3knp s ILE 43 N 0.01 5.15 -0.10 0.90 -1.09 -1.26 -2.78 121.20 122.03 3knp s ILE 43 Ca -0.06 0.90 -0.20 0.00 -2.23 0.00 0.00 60.65 59.05 3knp s ILE 43 Cb -0.15 -3.81 -0.04 0.00 -1.58 0.00 0.00 42.46 36.88 3knp s ILE 43 CO 0.05 0.23 0.55 -2.28 -1.23 0.00 0.00 174.94 172.26 3knp s HIS 44 N 1.31 3.54 0.25 3.97 5.04 -1.26 -3.08 115.29 125.06 3knp s HIS 44 Ca 0.23 1.01 -0.14 0.00 -1.54 0.00 0.00 55.06 54.63 3knp s HIS 44 Cb -0.15 -2.63 0.32 0.00 0.04 0.00 0.00 32.58 30.16 3knp s HIS 44 CO 0.09 0.16 1.55 1.17 -2.34 0.00 0.00 174.74 175.37 3knp n LYS 45 N 3.64 -0.18 -2.39 2.88 4.81 -1.11 -1.05 118.16 124.77 3knp n LYS 45 Ca -0.05 1.54 -0.41 0.00 -0.87 0.00 0.00 58.31 58.52 3knp n LYS 45 Cb 0.51 -2.29 0.03 0.00 0.02 0.00 0.00 35.03 33.30 3knp n LYS 45 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3knp n ASN 46 N -5.52 7.41 -4.98 3.14 3.02 -1.26 -4.81 115.26 112.26 3knp n ASN 46 Ca 0.12 -3.74 -0.20 0.00 -0.03 0.00 0.00 54.58 50.73 3knp n ASN 46 Cb 0.43 -1.13 -0.01 0.00 -0.61 0.00 0.00 39.78 38.46 3knp n ASN 46 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3knp s ASP 47 N -1.27 6.16 0.20 6.41 -1.08 -0.21 -5.02 116.67 121.87 3knp s ASP 47 Ca 0.44 -0.04 0.07 0.00 -0.52 0.00 0.00 52.55 52.50 3knp s ASP 47 Cb 0.28 -1.59 -0.05 0.00 -1.46 0.00 0.00 42.92 40.10 3knp s ASP 47 CO -0.23 -0.22 -0.14 0.42 0.52 0.00 0.00 175.17 175.52 3knp s THR 48 N -2.06 1.70 0.60 1.71 -4.23 -1.26 -5.01 115.64 107.09 3knp s THR 48 Ca 0.39 -2.20 0.34 0.00 -1.18 0.00 0.00 61.69 59.04 3knp s THR 48 Cb -0.09 -2.04 0.38 0.00 1.34 0.00 0.00 72.50 72.09 3knp s THR 48 CO 0.30 -0.60 2.29 -0.25 -0.54 0.00 0.00 174.62 175.81 3knp h TRP 49 N 2.57 0.00 -0.41 3.99 2.91 -2.01 -0.93 115.95 122.07 3knp h TRP 49 Ca -0.38 0.00 0.07 0.00 1.13 0.00 0.00 58.89 59.71 3knp h TRP 49 Cb 1.22 0.00 -0.06 0.00 -0.51 0.00 0.00 29.16 29.81 3knp h TRP 49 CO 0.71 0.01 0.07 0.93 -1.03 0.00 0.00 178.44 179.13 3knp h GLU 50 N 0.00 0.19 0.89 2.65 4.39 -2.01 -2.95 114.58 117.74 3knp h GLU 50 Ca -0.00 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 3knp h GLU 50 Cb 0.02 -0.04 0.01 0.00 -0.10 0.00 0.00 28.75 28.63 3knp h GLU 50 CO 0.00 0.13 -0.45 -0.44 -1.16 0.00 0.00 179.01 177.09 3knp h ASP 51 N 0.20 -1.09 -1.55 1.42 3.32 -1.55 -2.74 116.42 114.43 3knp h ASP 51 Ca 0.20 0.04 0.51 0.00 0.02 0.00 0.00 57.03 57.80 3knp h ASP 51 Cb 0.25 0.29 -0.12 0.00 0.22 0.00 0.00 39.33 39.97 3knp h ASP 51 CO -0.27 -0.75 1.04 0.00 -1.72 0.00 0.00 179.24 177.54 3knp n ALA 52 N -2.65 1.52 0.15 3.45 0.00 -1.16 0.19 120.51 122.01 3knp n ALA 52 Ca -0.16 0.82 0.01 0.00 0.00 0.00 0.00 53.44 54.11 3knp n ALA 52 Cb 0.49 -1.09 0.20 0.00 0.00 0.00 0.00 19.45 19.05 3knp n ALA 52 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3knp h LEU 53 N 0.00 0.00 -0.88 0.00 3.38 -1.32 -2.52 115.31 113.97 3knp h LEU 53 Ca 0.90 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.77 3knp h LEU 53 Cb 3.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 43.85 3knp h LEU 53 CO -0.35 0.57 -0.31 0.22 0.09 0.00 0.00 178.44 178.65 3knp h TYR 54 N 0.00 0.52 0.00 1.13 5.03 0.20 -1.90 116.97 121.96 3knp h TYR 54 Ca -0.01 -0.12 0.00 0.00 2.58 0.00 0.00 58.73 61.18 3knp h TYR 54 Cb 1.09 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 39.25 3knp h TYR 54 CO 0.00 0.72 0.00 -0.89 -1.32 0.00 0.00 178.16 176.67 3knp n ILE 55 N -4.08 0.00 -0.31 1.81 -0.00 -0.98 -2.78 119.36 113.02 3knp n ILE 55 Ca -0.01 1.24 0.14 0.00 -0.00 0.00 0.00 62.75 64.12 3knp n ILE 55 Cb 0.44 -2.18 0.30 0.00 -0.00 0.00 0.00 39.64 38.20 3knp n ILE 55 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 3knp h ILE 56 N 0.00 0.20 -0.43 1.39 5.03 -1.53 0.31 117.51 122.48 3knp h ILE 56 Ca 0.00 -0.04 0.08 0.00 -0.12 0.00 0.00 64.86 64.78 3knp h ILE 56 Cb 0.00 0.07 -0.10 0.00 -3.03 0.00 0.00 36.82 33.77 3knp h ILE 56 CO 0.00 0.02 -0.33 -0.09 -0.68 0.00 0.00 178.15 177.07 3knp h ARG 57 N 0.11 -0.23 0.07 2.37 2.43 -1.32 -2.28 114.38 115.52 3knp h ARG 57 Ca 0.57 0.02 -0.19 0.00 -0.81 0.00 0.00 59.98 59.56 3knp h ARG 57 Cb 1.19 0.05 0.02 0.00 -0.42 0.00 0.00 29.97 30.81 3knp h ARG 57 CO -0.75 -0.16 -0.80 0.87 -1.51 0.00 0.00 179.97 177.62 3knp h LYS 58 N -0.24 0.42 0.00 0.20 1.79 -0.99 -3.08 116.57 114.67 3knp h LYS 58 Ca 0.18 -0.54 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 3knp h LYS 58 Cb 0.54 0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.37 3knp h LYS 58 CO -0.57 1.21 0.08 0.00 -1.08 0.00 0.00 179.45 179.09 3knp n LEU 60 N -1.07 0.00 0.00 0.00 4.77 -0.90 -4.81 117.00 114.99 3knp n LEU 60 Ca 0.00 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.99 3knp n LEU 60 Cb 0.08 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.23 3knp n LEU 60 CO 0.00 -0.32 0.23 0.59 -1.33 0.00 0.00 177.39 176.56 3knp n ASN 61 N -1.96 0.00 -4.69 -1.43 4.13 -1.16 -3.47 115.26 106.68 3knp n ASN 61 Ca 0.00 -0.14 -0.42 0.00 1.68 0.00 0.00 54.58 55.70 3knp n ASN 61 Cb 0.00 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.21 3knp n ASN 61 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3knp s LEU 62 N -1.63 4.32 -0.46 3.41 1.43 -0.66 -4.77 118.68 120.32 3knp s LEU 62 Ca 0.03 2.20 -0.29 0.00 -1.03 0.00 0.00 54.13 55.04 3knp s LEU 62 Cb 0.01 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.70 3knp s LEU 62 CO 0.02 -0.77 1.19 -0.13 0.23 0.00 0.00 176.35 176.89 3knp s ARG 63 N 2.58 3.70 -0.00 1.70 3.00 -1.26 -4.06 118.95 124.61 3knp s ARG 63 Ca 0.66 0.64 0.00 0.00 0.00 0.00 0.00 55.73 57.04 3knp s ARG 63 Cb -0.33 -3.93 0.01 0.00 0.00 0.00 0.00 34.95 30.70 3knp s ARG 63 CO 0.28 -1.41 0.84 1.28 0.00 0.00 0.00 175.30 176.29 3knp n LEU 64 N 8.01 0.07 -3.98 2.53 4.77 -0.65 -4.67 117.00 123.08 3knp n LEU 64 Ca 0.13 -0.73 -0.09 0.00 -0.03 0.00 0.00 56.01 55.29 3knp n LEU 64 Cb 0.49 -0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 3knp n LEU 64 CO 0.71 0.18 -0.34 0.26 -1.33 0.00 0.00 177.39 176.88 3knp s TRP 65 N -0.07 0.27 0.07 -1.77 0.51 -0.40 -4.86 118.94 112.68 3knp s TRP 65 Ca 0.01 -0.56 -0.30 0.00 -2.12 0.00 0.00 56.10 53.12 3knp s TRP 65 Cb 0.01 -0.20 -0.05 0.00 -0.81 0.00 0.00 33.47 32.42 3knp s TRP 65 CO 0.00 -0.23 0.99 -0.80 -0.51 0.00 0.00 176.95 176.41 3knp s ASN 66 N -1.66 7.40 -0.96 2.95 -0.87 -1.26 -0.67 114.94 119.87 3knp s ASN 66 Ca -0.13 1.78 -0.12 0.00 -1.57 0.00 0.00 52.86 52.82 3knp s ASN 66 Cb -0.07 -2.58 0.24 0.00 -0.02 0.00 0.00 41.25 38.81 3knp s ASN 66 CO -0.02 -0.18 0.95 0.21 -2.57 0.00 0.00 177.10 175.49 3knp s ASN 67 N 0.46 7.00 0.93 -1.22 3.04 -0.50 -4.87 114.94 119.78 3knp s ASN 67 Ca 0.50 -3.04 0.00 0.00 0.04 0.00 0.00 52.86 50.35 3knp s ASN 67 Cb -0.23 -2.23 0.00 0.00 -1.54 0.00 0.00 41.25 37.25 3knp s ASN 67 CO 0.29 -0.48 0.00 -0.67 -3.04 0.00 0.00 177.10 173.20 3knp n ASP 68 N 3.63 0.00 -0.03 -4.21 2.03 -1.26 -2.44 116.55 114.28 3knp n ASP 68 Ca 0.19 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.29 3knp n ASP 68 Cb 0.44 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.71 3knp n ASP 68 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 3knp h ASN 69 N 0.00 0.26 -2.28 1.67 -1.24 -2.02 -3.46 115.58 108.50 3knp h ASN 69 Ca 0.00 -0.79 -0.55 0.00 0.71 0.00 0.00 56.30 55.67 3knp h ASN 69 Cb 0.00 -0.08 0.02 0.00 0.73 0.00 0.00 38.32 38.99 3knp h ASN 69 CO 0.00 1.56 1.19 0.29 -1.29 0.00 0.00 177.43 179.18 3knp n LYS 70 N -4.06 2.70 -3.12 6.67 5.02 -1.02 -4.96 118.16 119.39 3knp n LYS 70 Ca -0.26 0.99 -0.39 0.00 -2.02 0.00 0.00 58.31 56.62 3knp n LYS 70 Cb 0.83 -2.91 -0.05 0.00 -0.02 0.00 0.00 35.03 32.87 3knp n LYS 70 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3knp s THR 71 N 4.23 4.94 -0.97 -0.18 -4.23 -1.26 -1.41 115.64 116.76 3knp s THR 71 Ca 0.89 1.37 -0.05 0.00 -1.18 0.00 0.00 61.69 62.72 3knp s THR 71 Cb -0.50 -4.00 -0.06 0.00 1.34 0.00 0.00 72.50 69.29 3knp s THR 71 CO 0.44 0.35 0.86 0.79 -0.54 0.00 0.00 174.62 176.52 3knp n TRP 72 N 3.14 -2.47 -0.14 3.99 7.02 -1.25 -4.96 117.44 122.77 3knp n TRP 72 Ca -0.04 0.88 0.00 0.00 -1.02 0.00 0.00 57.50 57.31 3knp n TRP 72 Cb 0.51 -4.07 0.00 0.00 -2.42 0.00 0.00 31.31 25.33 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 -2.95 0.14 -3.97 -0.99 2.03 -0.75 -4.79 116.55 105.27 3knp n ASP 73 Ca -0.06 -0.46 -0.17 0.00 0.52 0.00 0.00 54.79 54.62 3knp n ASP 73 Cb 0.60 0.36 -0.15 0.00 -0.72 0.00 0.00 41.12 41.21 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 -0.36 0.57 0.38 -0.67 -0.14 0.15 -4.87 119.74 114.81 3knp s LYS 74 Ca 0.00 -0.21 0.08 0.00 -1.36 0.00 0.00 55.97 54.47 3knp s LYS 74 Cb 0.00 -0.56 -0.01 0.00 -1.68 0.00 0.00 37.83 35.58 3knp s LYS 74 CO 0.00 0.11 0.41 0.54 -0.76 0.00 0.00 175.35 175.65 3knp s ASN 75 N 0.02 5.39 0.38 2.83 2.20 -1.26 -1.27 114.94 123.23 3knp s ASN 75 Ca 0.00 -0.52 0.17 0.00 -0.94 0.00 0.00 52.86 51.58 3knp s ASN 75 Cb -0.04 -0.80 1.09 0.00 -2.00 0.00 0.00 41.25 39.49 3knp s ASN 75 CO -0.00 -0.57 1.74 1.62 -2.94 0.00 0.00 177.10 176.95 3knp h VAL 76 N 0.98 0.47 -0.02 3.54 3.04 -1.70 0.10 116.25 122.64 3knp h VAL 76 Ca -0.43 -0.14 -0.01 0.00 -1.01 0.00 0.00 66.70 65.12 3knp h VAL 76 Cb 1.26 0.03 -0.00 0.00 -2.01 0.00 0.00 31.29 30.58 3knp h VAL 76 CO 0.54 0.07 -0.01 0.11 -1.01 0.00 0.00 177.57 177.28 3knp h LYS 77 N 0.40 0.05 0.00 4.17 1.57 -1.89 -2.42 116.57 118.46 3knp h LYS 77 Ca 0.64 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.40 3knp h LYS 77 Cb 1.57 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.87 3knp h LYS 77 CO -0.37 0.40 0.00 -0.25 -0.57 0.00 0.00 179.45 178.66 3knp n ASP 78 N -4.88 0.00 -0.41 0.86 8.00 0.00 -0.79 116.55 119.34 3knp n ASP 78 Ca -0.08 0.25 0.04 0.00 0.71 0.00 0.00 54.79 55.71 3knp n ASP 78 Cb 0.21 -0.30 0.08 0.00 -0.02 0.00 0.00 41.12 41.10 3knp n ASP 78 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3knp n LEU 79 N -1.30 2.34 0.00 0.64 7.99 -1.10 -4.93 117.00 120.66 3knp n LEU 79 Ca 0.02 -1.68 0.00 0.00 -0.01 0.00 0.00 56.01 54.33 3knp n LEU 79 Cb 0.03 -0.11 0.00 0.00 -0.11 0.00 0.00 43.42 43.23 3knp n LEU 79 CO 0.03 0.56 0.00 0.59 -1.51 0.00 0.00 177.39 177.06 3knp n ASN 80 N 0.29 -2.12 -3.22 -1.43 5.03 0.03 -4.98 115.26 108.86 3knp n ASN 80 Ca 0.07 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.22 3knp n ASN 80 Cb 0.32 -1.62 0.29 0.00 -1.02 0.00 0.00 39.78 37.74 3knp n ASN 80 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3knp n TYR 81 N -2.23 -3.77 -4.52 3.10 4.01 -0.92 -5.02 117.16 107.81 3knp n TYR 81 Ca 0.00 -0.80 -0.25 0.00 -0.16 0.00 0.00 57.90 56.69 3knp n TYR 81 Cb 0.12 -1.21 -0.11 0.00 -0.31 0.00 0.00 39.34 37.83 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 -5.04 1.77 0.31 -0.72 2.02 -1.12 -4.84 118.70 111.09 3knp s GLU 82 Ca 0.65 -1.97 0.06 0.00 0.02 0.00 0.00 54.97 53.73 3knp s GLU 82 Cb -0.11 -1.33 -0.06 0.00 0.10 0.00 0.00 34.13 32.72 3knp s GLU 82 CO 0.55 -0.05 -0.00 -0.51 0.02 0.00 0.00 175.26 175.27 3knp s LEU 83 N -3.58 2.42 -0.07 1.80 1.02 -0.38 -1.87 118.68 118.01 3knp s LEU 83 Ca 0.34 -1.29 -0.03 0.00 0.02 0.00 0.00 54.13 53.17 3knp s LEU 83 Cb 0.07 -0.57 0.04 0.00 0.02 0.00 0.00 46.19 45.76 3knp s LEU 83 CO 0.16 -0.46 0.15 -0.22 0.02 0.00 0.00 176.35 175.99 3knp s LEU 84 N -3.49 0.32 -0.25 1.79 2.96 -0.33 -1.96 118.68 117.70 3knp s LEU 84 Ca 0.33 0.30 0.02 0.00 -0.22 0.00 0.00 54.13 54.56 3knp s LEU 84 Cb 0.07 0.29 0.05 0.00 0.50 0.00 0.00 46.19 47.09 3knp s LEU 84 CO 0.14 -0.20 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.23 3knp s ILE 85 N 1.76 2.28 -0.12 6.68 1.09 -1.02 0.97 121.20 132.84 3knp s ILE 85 Ca -0.03 -1.50 -0.02 0.00 -1.10 0.00 0.00 60.65 58.01 3knp s ILE 85 Cb -0.12 -2.28 -0.03 0.00 -1.06 0.00 0.00 42.46 38.97 3knp s ILE 85 CO -0.06 0.04 -0.04 -0.69 -0.10 0.00 0.00 174.94 174.10 3knp s VAL 86 N 1.15 3.90 0.01 2.92 1.01 0.18 -4.15 120.40 125.42 3knp s VAL 86 Ca -0.06 -0.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.24 3knp s VAL 86 Cb -0.19 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3knp s VAL 86 CO -0.06 0.54 1.16 -0.55 0.00 0.00 0.00 175.10 176.20 3knp s SER 87 N -0.15 7.12 -0.34 3.32 0.15 -1.26 -2.07 113.70 120.47 3knp s SER 87 Ca 0.03 1.89 -0.01 0.00 0.70 0.00 0.00 55.95 58.56 3knp s SER 87 Cb -0.13 -2.57 0.13 0.00 -1.71 0.00 0.00 66.02 61.74 3knp s SER 87 CO 0.02 -0.47 0.20 -1.58 1.20 0.00 0.00 173.24 172.61 3knp s GLN 88 N 1.44 0.52 0.00 5.44 2.00 0.15 -4.90 119.66 124.31 3knp s GLN 88 Ca 0.57 -1.22 0.23 0.00 -2.00 0.00 0.00 55.36 52.94 3knp s GLN 88 Cb -0.26 -1.32 1.05 0.00 0.80 0.00 0.00 33.01 33.27 3knp s GLN 88 CO 0.26 -1.18 1.75 1.97 -0.50 0.00 0.00 175.29 177.60 3knp n PHE 89 N 4.23 0.00 0.31 1.67 1.16 -1.26 -2.89 117.46 120.67 3knp n PHE 89 Ca 0.09 0.00 0.16 0.00 -1.87 0.00 0.00 57.45 55.83 3knp n PHE 89 Cb 0.38 -0.44 0.71 0.00 -1.61 0.00 0.00 39.48 38.52 3knp n PHE 89 CO 0.00 0.00 0.00 1.79 -1.87 0.00 0.00 176.76 176.68 3knp h THR 90 N 0.00 0.00 0.00 1.97 1.35 -1.95 -2.28 112.91 112.00 3knp h THR 90 Ca 0.00 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 3knp h THR 90 Cb 0.35 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 3knp h THR 90 CO 0.00 0.00 0.00 -0.07 -0.25 0.00 0.00 175.52 175.20 3knp h LEU 91 N 0.00 0.00 -3.67 3.87 3.38 -1.93 0.24 115.31 117.21 3knp h LEU 91 Ca 0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 3knp h LEU 91 Cb 0.38 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.98 3knp h LEU 91 CO 0.00 0.00 0.26 0.49 0.09 0.00 0.00 178.44 179.28 3knp n PHE 92 N -2.42 2.18 -2.44 1.13 3.72 -0.86 -4.93 117.46 113.84 3knp n PHE 92 Ca -0.02 -1.36 -0.43 0.00 -0.05 0.00 0.00 57.45 55.59 3knp n PHE 92 Cb 0.04 -0.67 -0.02 0.00 -0.94 0.00 0.00 39.48 37.89 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 -1.46 1.80 -0.42 1.37 0.00 0.85 -4.26 107.32 105.21 3knp s GLY 93 Ca 0.52 0.51 -0.27 0.00 0.00 0.00 0.00 44.72 45.49 3knp s GLY 93 CO 0.10 2.39 0.99 0.21 0.00 0.00 0.00 173.10 176.79 3knp s ASN 94 N 1.79 6.63 0.00 1.64 3.84 0.26 -4.75 114.94 124.35 3knp s ASN 94 Ca 0.55 0.44 0.25 0.00 0.21 0.00 0.00 52.86 54.31 3knp s ASN 94 Cb -0.23 -2.49 0.54 0.00 -0.55 0.00 0.00 41.25 38.53 3knp s ASN 94 CO 0.17 -1.02 1.43 0.35 -2.79 0.00 0.00 177.10 175.25 3knp n THR 95 N 6.32 0.00 -0.02 -5.21 -2.24 -1.26 -2.78 114.28 109.09 3knp n THR 95 Ca 0.08 -0.18 -0.16 0.00 -2.27 0.00 0.00 64.05 61.52 3knp n THR 95 Cb 0.48 0.67 -0.09 0.00 -2.10 0.00 0.00 70.33 69.30 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 1.68 0.56 -0.83 -0.78 1.57 -1.99 -3.34 116.57 113.44 3knp h LYS 96 Ca 0.00 -0.47 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3knp h LYS 96 Cb 0.59 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3knp h LYS 96 CO 0.00 1.10 0.00 0.36 -0.57 0.00 0.00 179.45 180.34 3knp n LYS 97 N -4.18 1.77 -0.00 3.15 2.85 -1.26 -4.98 118.16 115.51 3knp n LYS 97 Ca -0.08 -0.65 0.00 0.00 -1.05 0.00 0.00 58.31 56.53 3knp n LYS 97 Cb 0.64 -1.60 0.00 0.00 -0.65 0.00 0.00 35.03 33.41 3knp n LYS 97 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3knp n GLY 98 N 0.20 0.68 0.00 2.58 0.00 -1.26 -4.92 105.19 102.47 3knp n GLY 98 Ca 0.06 -1.56 0.05 0.00 0.00 0.00 0.00 46.02 44.57 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 0.00 1.58 -4.42 1.61 3.02 -1.26 -4.81 115.26 110.98 3knp n ASN 99 Ca 0.00 -0.37 -0.44 0.00 -0.03 0.00 0.00 54.58 53.74 3knp n ASN 99 Cb 0.00 1.22 -0.04 0.00 -0.61 0.00 0.00 39.78 40.36 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 -2.29 3.24 0.77 3.52 2.20 -1.26 -5.01 119.74 120.91 3knp s LYS 100 Ca 0.00 -1.35 -0.17 0.00 -0.36 0.00 0.00 55.97 54.09 3knp s LYS 100 Cb 0.07 -4.43 -0.14 0.00 -1.51 0.00 0.00 37.83 31.82 3knp s LYS 100 CO 0.40 -1.68 -0.42 -0.35 -0.36 0.00 0.00 175.35 172.94 3knp n PRO 101 N 6.69 0.01 -4.75 4.03 -0.04 -1.26 -4.96 135.00 134.73 3knp n PRO 101 Ca 0.02 0.01 -0.25 0.00 -0.04 0.00 0.00 63.50 63.24 3knp n PRO 101 Cb 0.45 -1.06 -0.16 0.00 -0.04 0.00 0.00 33.50 32.69 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 -1.05 1.95 -0.35 3.54 2.15 -1.12 -4.78 116.67 117.02 3knp s ASP 102 Ca 0.49 -0.31 0.06 0.00 0.43 0.00 0.00 52.55 53.21 3knp s ASP 102 Cb -0.33 -0.49 0.45 0.00 -0.30 0.00 0.00 42.92 42.26 3knp s ASP 102 CO 0.74 0.14 1.29 0.49 -0.17 0.00 0.00 175.17 177.67 3knp n PHE 103 N 3.10 2.87 0.40 -5.34 3.72 -1.26 0.90 117.46 121.85 3knp n PHE 103 Ca -0.18 -2.39 0.14 0.00 -0.05 0.00 0.00 57.45 54.97 3knp n PHE 103 Cb 0.53 -0.45 0.47 0.00 -0.94 0.00 0.00 39.48 39.09 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 2.20 0.00 -0.56 1.38 3.86 -1.98 -2.59 115.15 117.47 3knp h HIS 104 Ca 0.39 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.44 3knp h HIS 104 Cb 1.38 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 29.76 3knp h HIS 104 CO 0.92 0.00 0.20 1.28 0.86 0.00 0.00 177.93 181.19 3knp n LEU 105 N -2.58 5.05 -4.22 2.43 4.32 -1.26 -4.82 117.00 115.92 3knp n LEU 105 Ca 0.03 -2.62 -0.36 0.00 -0.02 0.00 0.00 56.01 53.04 3knp n LEU 105 Cb 0.34 -0.69 -0.13 0.00 -1.62 0.00 0.00 43.42 41.32 3knp n LEU 105 CO 0.26 0.69 -0.33 0.00 -1.22 0.00 0.00 177.39 176.79 3knp s ALA 106 N -2.37 2.88 -0.12 -1.18 0.00 -0.98 -2.77 121.76 117.23 3knp s ALA 106 Ca 0.41 -1.67 -0.37 0.00 0.00 0.00 0.00 51.96 50.33 3knp s ALA 106 Cb 0.33 -2.00 -0.15 0.00 0.00 0.00 0.00 23.12 21.30 3knp s ALA 106 CO 0.10 -1.17 1.68 1.17 0.00 0.00 0.00 175.76 177.55 3knp n LYS 107 N 4.71 1.50 -1.45 0.00 4.81 -1.18 -4.71 118.16 121.84 3knp n LYS 107 Ca -0.14 0.55 -0.39 0.00 -0.87 0.00 0.00 58.31 57.46 3knp n LYS 107 Cb 0.45 -2.27 0.03 0.00 0.02 0.00 0.00 35.03 33.26 3knp n LYS 107 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 3knp n GLU 108 N 4.95 0.48 -0.28 1.64 0.00 -1.26 -4.69 120.64 121.48 3knp n GLU 108 Ca 0.23 0.19 -0.02 0.00 0.00 0.00 0.00 57.16 57.55 3knp n GLU 108 Cb 0.20 -1.62 0.01 0.00 0.00 0.00 0.00 31.44 30.03 3knp n GLU 108 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 3knp n PRO 109 N 0.17 -0.20 0.00 3.44 -0.02 -1.26 -3.15 135.00 133.98 3knp n PRO 109 Ca 0.11 1.08 0.00 0.00 -2.02 0.00 0.00 63.50 62.68 3knp n PRO 109 Cb 0.47 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 3knp n PRO 109 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3knp n ASN 110 N -5.01 0.00 0.21 2.55 3.02 -1.26 0.10 115.26 114.87 3knp n ASN 110 Ca 0.06 0.39 0.08 0.00 -0.03 0.00 0.00 54.58 55.08 3knp n ASN 110 Cb 0.26 0.00 0.41 0.00 -0.61 0.00 0.00 39.78 39.84 3knp n ASN 110 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3knp h GLU 111 N 0.00 0.00 0.13 3.52 3.07 -1.93 1.32 114.58 120.69 3knp h GLU 111 Ca 0.00 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.65 3knp h GLU 111 Cb 0.00 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 27.93 3knp h GLU 111 CO 0.00 0.00 -0.96 0.00 -1.40 0.00 0.00 179.01 176.65 3knp h ALA 112 N 1.08 -0.03 -2.92 3.43 0.00 -1.39 -2.74 119.26 116.68 3knp h ALA 112 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.12 3knp h ALA 112 Cb 0.75 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3knp h ALA 112 CO 0.00 0.48 0.00 -0.11 0.00 0.00 0.00 179.25 179.62 3knp n LEU 113 N -4.08 0.00 -0.34 0.00 7.94 0.45 0.34 117.00 121.31 3knp n LEU 113 Ca -0.17 0.51 0.04 0.00 -1.11 0.00 0.00 56.01 55.29 3knp n LEU 113 Cb 0.84 -0.01 0.12 0.00 0.53 0.00 0.00 43.42 44.90 3knp n LEU 113 CO 0.46 -0.01 0.67 -0.29 -1.11 0.00 0.00 177.39 177.11 3knp h ILE 114 N 0.00 0.06 -0.14 1.96 6.09 -1.71 1.46 117.51 125.24 3knp h ILE 114 Ca 0.00 0.00 0.03 0.00 -1.37 0.00 0.00 64.86 63.52 3knp h ILE 114 Cb 0.00 0.06 -0.06 0.00 0.47 0.00 0.00 36.82 37.29 3knp h ILE 114 CO 0.00 0.00 -0.49 0.15 -3.07 0.00 0.00 178.15 174.74 3knp h PHE 115 N -0.00 -1.45 -0.27 2.19 3.57 -1.13 0.64 116.94 120.49 3knp h PHE 115 Ca 0.44 0.06 0.03 0.00 3.53 0.00 0.00 57.97 62.03 3knp h PHE 115 Cb 0.68 0.65 -0.05 0.00 2.79 0.00 0.00 35.95 40.02 3knp h PHE 115 CO -0.74 -0.48 -0.36 -0.92 -2.23 0.00 0.00 178.31 173.58 3knp h TYR 116 N -0.51 -1.10 -0.42 0.41 3.20 1.57 0.96 116.97 121.08 3knp h TYR 116 Ca 0.03 0.05 0.06 0.00 3.14 0.00 0.00 58.73 62.01 3knp h TYR 116 Cb 0.60 0.51 -0.09 0.00 1.54 0.00 0.00 36.73 39.30 3knp h TYR 116 CO -0.58 -0.31 -0.53 -0.91 -1.64 0.00 0.00 178.16 174.19 3knp h ASN 117 N -0.25 -1.77 -1.00 -2.11 2.35 0.11 0.37 115.58 113.28 3knp h ASN 117 Ca 0.05 0.24 0.19 0.00 -0.55 0.00 0.00 56.30 56.23 3knp h ASN 117 Cb 0.38 0.73 -0.10 0.00 0.05 0.00 0.00 38.32 39.38 3knp h ASN 117 CO -0.39 -0.40 0.61 0.11 -1.65 0.00 0.00 177.43 175.72 3knp h LYS 118 N -0.38 0.70 -0.37 0.81 1.57 0.76 0.28 116.57 119.94 3knp h LYS 118 Ca 0.09 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3knp h LYS 118 Cb 0.59 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 3knp h LYS 118 CO -0.60 0.46 0.24 0.82 -0.57 0.00 0.00 179.45 179.80 3knp h ILE 119 N 0.72 1.10 0.37 1.86 5.03 0.21 -2.00 117.51 124.79 3knp h ILE 119 Ca 0.57 -0.17 -0.02 0.00 -0.12 0.00 0.00 64.86 65.12 3knp h ILE 119 Cb 0.95 0.55 0.00 0.00 -3.03 0.00 0.00 36.82 35.30 3knp h ILE 119 CO -0.36 0.09 -0.18 0.40 -0.68 0.00 0.00 178.15 177.43 3knp h ILE 120 N 0.50 0.64 0.00 -0.67 5.03 0.21 -0.28 117.51 122.94 3knp h ILE 120 Ca 0.14 -0.31 0.00 0.00 -0.12 0.00 0.00 64.86 64.57 3knp h ILE 120 Cb -0.06 0.80 0.00 0.00 -3.03 0.00 0.00 36.82 34.53 3knp h ILE 120 CO -0.03 0.06 0.03 0.47 -0.68 0.00 0.00 178.15 178.00 3knp n ASP 121 N -5.23 0.02 -0.09 1.72 8.00 0.52 0.91 116.55 122.40 3knp n ASP 121 Ca -0.10 0.49 -0.08 0.00 0.71 0.00 0.00 54.79 55.80 3knp n ASP 121 Cb 0.26 -0.49 -0.16 0.00 -0.02 0.00 0.00 41.12 40.71 3knp n ASP 121 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3knp n GLU 122 N -1.51 0.69 -0.35 -1.24 4.07 -0.76 -3.27 120.64 118.27 3knp n GLU 122 Ca -0.00 -0.02 -0.02 0.00 -0.06 0.00 0.00 57.16 57.06 3knp n GLU 122 Cb 0.03 -1.53 0.10 0.00 -0.06 0.00 0.00 31.44 29.98 3knp n GLU 122 CO 0.00 0.00 0.00 0.74 -0.06 0.00 0.00 177.13 177.81 3knp h PHE 123 N 0.00 1.18 0.77 4.31 0.04 0.23 -2.23 116.94 121.24 3knp h PHE 123 Ca -0.49 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.27 3knp h PHE 123 Cb 2.13 -0.40 0.01 0.00 2.20 0.00 0.00 35.95 39.89 3knp h PHE 123 CO 0.00 0.73 -0.37 0.87 -0.60 0.00 0.00 178.31 178.94 3knp h LYS 124 N 1.26 -0.99 -0.52 1.51 1.57 -1.34 -2.78 116.57 115.27 3knp h LYS 124 Ca 0.35 0.07 0.15 0.00 -1.87 0.00 0.00 60.65 59.35 3knp h LYS 124 Cb -0.12 0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3knp h LYS 124 CO -0.08 -0.66 0.83 -0.22 -0.57 0.00 0.00 179.45 178.75 3knp h LYS 125 N -1.26 0.00 -0.01 3.15 3.64 -1.49 1.84 116.57 122.44 3knp h LYS 125 Ca -0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3knp h LYS 125 Cb 0.79 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3knp h LYS 125 CO 0.17 0.00 -0.19 1.04 -2.27 0.00 0.00 179.45 178.20 3knp n GLN 126 N -3.18 1.12 0.00 1.90 6.02 -0.86 -4.91 117.38 117.48 3knp n GLN 126 Ca 0.11 -0.69 0.00 0.00 -0.01 0.00 0.00 57.00 56.41 3knp n GLN 126 Cb 1.01 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.79 3knp n GLN 126 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 3knp n TYR 127 N -0.34 0.00 -3.33 1.08 9.36 0.62 -5.09 117.16 119.47 3knp n TYR 127 Ca 0.14 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.27 3knp n TYR 127 Cb 0.36 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.00 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 1.57 0.27 0.35 2.98 3.84 -1.16 -5.01 114.94 117.79 3knp s ASN 128 Ca 0.00 0.01 0.31 0.00 0.21 0.00 0.00 52.86 53.39 3knp s ASN 128 Cb 0.00 1.13 1.06 0.00 -0.55 0.00 0.00 41.25 42.89 3knp s ASN 128 CO 0.00 -0.32 0.97 -0.67 -2.79 0.00 0.00 177.10 174.29 3knp n ASP 129 N 5.36 0.00 -0.10 -4.21 4.64 -1.26 0.89 116.55 121.87 3knp n ASP 129 Ca -0.02 0.62 -0.10 0.00 -1.38 0.00 0.00 54.79 53.90 3knp n ASP 129 Cb 0.50 -0.30 -0.16 0.00 -1.04 0.00 0.00 41.12 40.12 3knp n ASP 129 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 3knp n ASP 130 N -3.16 0.20 -0.32 1.67 8.00 -1.26 -4.46 116.55 117.22 3knp n ASP 130 Ca 0.27 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.76 3knp n ASP 130 Cb 1.26 0.90 0.00 0.00 -0.02 0.00 0.00 41.12 43.26 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 -2.77 0.86 -3.80 -1.24 4.76 0.26 -4.44 118.16 111.79 3knp n LYS 131 Ca -0.33 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 54.81 3knp n LYS 131 Cb 1.14 -1.28 -0.14 0.00 -1.84 0.00 0.00 35.03 32.91 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 -1.36 1.55 -0.04 -0.18 1.09 -1.21 -1.25 121.20 119.80 3knp s ILE 132 Ca 0.00 -2.30 -0.04 0.00 -1.10 0.00 0.00 60.65 57.21 3knp s ILE 132 Cb 0.00 -2.11 -0.04 0.00 -1.06 0.00 0.00 42.46 39.25 3knp s ILE 132 CO 0.00 -0.78 0.18 -0.75 -0.10 0.00 0.00 174.94 173.49 3knp s LYS 133 N 0.71 3.44 0.00 2.79 2.47 -0.83 -5.01 119.74 123.31 3knp s LYS 133 Ca 0.14 -0.27 0.00 0.00 -1.56 0.00 0.00 55.97 54.29 3knp s LYS 133 Cb -0.22 -3.12 0.00 0.00 -1.46 0.00 0.00 37.83 33.03 3knp s LYS 133 CO -0.08 0.70 0.00 0.44 0.16 0.00 0.00 175.35 176.57 3knp n ILE 134 N 1.19 0.00 -4.06 5.43 -0.00 -1.26 -2.43 119.36 118.23 3knp n ILE 134 Ca -0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.51 3knp n ILE 134 Cb 0.53 0.00 -0.11 0.00 -0.00 0.00 0.00 39.64 40.06 3knp n ILE 134 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 3knp s GLY 135 N -0.84 0.47 -0.75 3.28 0.00 -1.26 -4.80 107.32 103.41 3knp s GLY 135 Ca 0.00 -0.88 -0.24 0.00 0.00 0.00 0.00 44.72 43.60 3knp s GLY 135 CO 0.00 -0.95 2.40 0.28 0.00 0.00 0.00 173.10 174.83 3knp n LYS 136 N 1.06 0.57 -0.94 2.90 5.02 -1.26 -4.90 118.16 120.61 3knp n LYS 136 Ca -0.20 -0.48 -0.36 0.00 -2.02 0.00 0.00 58.31 55.25 3knp n LYS 136 Cb 0.57 -3.16 0.06 0.00 -0.02 0.00 0.00 35.03 32.47 3knp n LYS 136 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3knp n PHE 137 N 15.89 -3.46 -3.69 2.13 7.35 -1.26 -3.48 117.46 130.95 3knp n PHE 137 Ca 0.48 0.18 -0.21 0.00 -0.76 0.00 0.00 57.45 57.15 3knp n PHE 137 Cb 0.40 -1.49 0.01 0.00 0.35 0.00 0.00 39.48 38.75 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 3.07 -0.50 3.61 7.13 0.00 -1.26 -4.91 105.19 112.33 3knp n GLY 138 Ca -0.00 0.21 -0.07 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.72 -0.26 0.26 1.61 0.01 -1.23 -5.14 114.94 106.47 3knp s ASN 139 Ca 0.18 0.34 -0.31 0.00 -0.71 0.00 0.00 52.86 52.36 3knp s ASN 139 Cb -0.10 0.28 -0.12 0.00 0.41 0.00 0.00 41.25 41.73 3knp s ASN 139 CO 0.48 -0.21 1.66 -0.47 -1.51 0.00 0.00 177.10 177.06 3knp s TYR 140 N -0.83 2.81 0.24 2.20 5.04 -1.26 -4.95 117.35 120.60 3knp s TYR 140 Ca 0.02 0.57 0.00 0.00 -2.44 0.00 0.00 57.07 55.22 3knp s TYR 140 Cb -0.02 -4.12 -0.00 0.00 0.35 0.00 0.00 41.96 38.18 3knp s TYR 140 CO -0.03 -3.98 0.01 -1.33 -1.34 0.00 0.00 175.55 168.88 3knp n MET 141 N 3.00 1.28 -3.15 4.97 2.81 -1.26 -4.16 117.12 120.60 3knp n MET 141 Ca 0.12 -1.81 0.04 0.00 -1.81 0.00 0.00 57.70 54.23 3knp n MET 141 Cb 0.36 0.57 -0.01 0.00 -0.71 0.00 0.00 33.22 33.43 3knp n MET 141 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3knp s ASN 142 N -2.36 -1.39 -0.23 7.83 2.47 -0.94 -4.89 114.94 115.43 3knp s ASN 142 Ca 0.02 0.83 0.02 0.00 0.42 0.00 0.00 52.86 54.14 3knp s ASN 142 Cb 0.00 2.15 0.04 0.00 -1.45 0.00 0.00 41.25 41.99 3knp s ASN 142 CO 0.01 -0.26 -0.13 -0.63 -3.72 0.00 0.00 177.10 172.38 3knp s ILE 143 N 2.86 2.26 -0.03 -5.21 1.09 -1.26 0.11 121.20 121.02 3knp s ILE 143 Ca 0.20 -1.32 -0.20 0.00 -1.10 0.00 0.00 60.65 58.23 3knp s ILE 143 Cb -0.15 -2.19 -0.05 0.00 -1.06 0.00 0.00 42.46 39.02 3knp s ILE 143 CO -0.21 0.18 0.57 -1.81 -0.10 0.00 0.00 174.94 173.57 3knp s ASP 144 N 1.20 6.91 0.03 3.58 1.11 -1.02 -4.86 116.67 123.62 3knp s ASP 144 Ca -0.03 1.08 0.05 0.00 0.18 0.00 0.00 52.55 53.83 3knp s ASP 144 Cb -0.17 -2.35 -0.02 0.00 1.07 0.00 0.00 42.92 41.45 3knp s ASP 144 CO -0.07 0.07 -0.15 -0.69 1.18 0.00 0.00 175.17 175.51 3knp s VAL 145 N 0.02 1.20 -0.88 -1.27 1.01 -1.26 0.28 120.40 119.50 3knp s VAL 145 Ca 0.30 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 3knp s VAL 145 Cb -0.17 -1.07 0.23 0.00 0.00 0.00 0.00 36.38 35.36 3knp s VAL 145 CO 0.16 0.08 0.81 0.41 0.00 0.00 0.00 175.10 176.56 3knp n THR 146 N 2.01 3.03 -1.54 3.92 -1.04 -0.01 -4.99 114.28 115.66 3knp n THR 146 Ca -0.17 -5.17 -0.46 0.00 -2.04 0.00 0.00 64.05 56.21 3knp n THR 146 Cb 0.55 -2.32 -0.05 0.00 -1.82 0.00 0.00 70.33 66.69 3knp n THR 146 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3knp n ASN 147 N 2.07 2.85 -4.60 8.00 3.02 -1.26 -1.85 115.26 123.48 3knp n ASN 147 Ca 0.23 0.29 -0.42 0.00 -0.03 0.00 0.00 54.58 54.65 3knp n ASN 147 Cb 0.37 -1.44 -0.05 0.00 -0.61 0.00 0.00 39.78 38.05 3knp n ASN 147 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3knp s ASP 148 N 7.88 6.64 0.00 6.41 2.15 -0.94 -4.47 116.67 134.33 3knp s ASP 148 Ca 1.04 0.56 0.00 0.00 0.43 0.00 0.00 52.55 54.58 3knp s ASP 148 Cb -0.54 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 39.66 3knp s ASP 148 CO 0.41 -0.71 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 3knp n GLY 149 N 4.33 2.10 3.92 2.66 0.00 -1.26 -2.87 105.19 114.06 3knp n GLY 149 Ca 0.05 -0.58 -0.27 0.00 0.00 0.00 0.00 46.02 45.22 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 2.72 -0.12 1.61 0.04 -1.26 -5.17 135.00 132.83 3knp s PRO 150 Ca 0.00 -0.01 -0.03 0.00 0.04 0.00 0.00 61.00 61.00 3knp s PRO 150 Cb 0.00 -2.21 0.04 0.00 0.04 0.00 0.00 34.50 32.37 3knp s PRO 150 CO 0.00 -0.88 0.04 0.08 0.04 0.00 0.00 177.00 176.28 3knp s VAL 151 N -3.10 0.19 -0.09 -0.36 1.01 -1.14 -5.04 120.40 111.86 3knp s VAL 151 Ca 0.56 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.53 3knp s VAL 151 Cb -0.11 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.70 3knp s VAL 151 CO 0.46 -0.01 -0.21 -0.89 0.00 0.00 0.00 175.10 174.45 3knp s THR 152 N 2.03 1.81 0.17 3.92 2.01 -1.26 -1.37 115.64 122.95 3knp s THR 152 Ca 0.03 -0.88 0.11 0.00 0.31 0.00 0.00 61.69 61.26 3knp s THR 152 Cb -0.14 -1.58 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 3knp s THR 152 CO -0.06 0.50 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.52 3knp s ILE 153 N 0.42 2.50 -0.03 1.82 1.09 0.17 -4.96 121.20 122.22 3knp s ILE 153 Ca -0.18 -1.85 0.02 0.00 -1.10 0.00 0.00 60.65 57.55 3knp s ILE 153 Cb -0.17 -2.18 0.00 0.00 -1.06 0.00 0.00 42.46 39.05 3knp s ILE 153 CO 0.08 -0.04 -0.09 -0.47 -0.10 0.00 0.00 174.94 174.32 3knp s TYR 154 N -1.46 0.95 -0.03 3.97 5.04 -1.26 -0.22 117.35 124.34 3knp s TYR 154 Ca 0.19 -0.24 -0.06 0.00 -2.44 0.00 0.00 57.07 54.52 3knp s TYR 154 Cb -0.09 -0.68 0.01 0.00 0.35 0.00 0.00 41.96 41.55 3knp s TYR 154 CO 0.10 -0.10 0.15 0.42 -1.34 0.00 0.00 175.55 174.77 3knp s ILE 155 N 0.21 0.04 0.29 3.14 1.09 -0.36 -5.01 121.20 120.60 3knp s ILE 155 Ca -0.03 -0.33 0.11 0.00 -1.10 0.00 0.00 60.65 59.30 3knp s ILE 155 Cb -0.09 -0.32 -0.05 0.00 -1.06 0.00 0.00 42.46 40.94 3knp s ILE 155 CO 0.01 -0.18 -0.17 -0.62 -0.10 0.00 0.00 174.94 173.87 3knp s ASP 156 N -0.61 3.57 -0.37 3.58 -1.08 -1.26 -0.07 116.67 120.42 3knp s ASP 156 Ca -0.07 -1.07 0.06 0.00 -0.52 0.00 0.00 52.55 50.95 3knp s ASP 156 Cb -0.04 -0.30 0.45 0.00 -1.46 0.00 0.00 42.92 41.56 3knp s ASP 156 CO 0.01 -0.02 1.27 0.35 0.52 0.00 0.00 175.17 177.29 3knp n THR 157 N -0.64 2.62 0.00 1.71 -2.24 0.97 -4.55 114.28 112.14 3knp n THR 157 Ca -0.05 -4.29 0.00 0.00 -2.27 0.00 0.00 64.05 57.44 3knp n THR 157 Cb 0.61 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 3knp n THR 157 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3knp n HIS 158 N -0.67 0.00 0.00 4.78 8.25 -1.26 -4.29 115.22 122.03 3knp n HIS 158 Ca 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.91 3knp n HIS 158 Cb 0.85 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.96 3knp n HIS 158 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73