#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klr n LEU 70 N 0.00 0.00 -1.30 6.15 7.99 -1.26 -4.52 117.00 124.06 2klr n LEU 70 Ca 0.00 -0.34 -0.12 0.00 -0.01 0.00 0.00 56.01 55.54 2klr n LEU 70 Cb 0.00 -0.20 -0.01 0.00 -0.11 0.00 0.00 43.42 43.09 2klr n LEU 70 CO 0.00 -0.69 -0.15 -0.62 -1.51 0.00 0.00 177.39 174.43 2klr n GLU 71 N -1.57 -0.94 -4.24 3.23 -0.58 -0.73 -4.99 120.64 110.82 2klr n GLU 71 Ca 0.04 0.64 -0.21 0.00 -0.42 0.00 0.00 57.16 57.20 2klr n GLU 71 Cb 0.12 -4.78 -0.12 0.00 -0.57 0.00 0.00 31.44 26.09 2klr n GLU 71 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2klr s LYS 72 N -4.34 1.01 0.22 3.49 2.20 -0.34 -4.78 119.74 117.20 2klr s LYS 72 Ca 0.00 -1.10 0.00 0.00 -0.36 0.00 0.00 55.97 54.51 2klr s LYS 72 Cb 0.00 -1.14 0.00 0.00 -1.51 0.00 0.00 37.83 35.18 2klr s LYS 72 CO 0.00 0.26 0.00 -3.47 -0.36 0.00 0.00 175.35 171.78 2klr n ASP 73 N 1.10 -5.28 -4.28 1.43 -0.08 -1.26 -1.10 116.55 107.07 2klr n ASP 73 Ca -0.20 0.40 -0.35 0.00 -1.51 0.00 0.00 54.79 53.14 2klr n ASP 73 Cb 0.54 -2.72 -0.14 0.00 2.34 0.00 0.00 41.12 41.14 2klr n ASP 73 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2klr s ARG 74 N -1.94 3.32 0.09 -0.67 0.52 -1.26 -3.95 118.95 115.06 2klr s ARG 74 Ca 0.00 -0.65 0.03 0.00 -0.52 0.00 0.00 55.73 54.59 2klr s ARG 74 Cb 0.00 -2.94 -0.04 0.00 0.52 0.00 0.00 34.95 32.49 2klr s ARG 74 CO 0.00 -0.19 0.09 0.12 0.02 0.00 0.00 175.30 175.34 2klr s PHE 75 N 1.43 3.19 0.01 -0.53 5.36 0.17 -4.90 117.98 122.72 2klr s PHE 75 Ca 0.05 0.07 0.01 0.00 -0.96 0.00 0.00 56.93 56.11 2klr s PHE 75 Cb -0.14 -1.61 -0.01 0.00 -0.34 0.00 0.00 43.02 40.92 2klr s PHE 75 CO -0.05 0.52 -0.05 -1.54 -1.46 0.00 0.00 175.22 172.65 2klr s SER 76 N -2.48 0.54 -0.10 6.13 1.04 -1.26 -2.17 113.70 115.40 2klr s SER 76 Ca 0.30 -0.27 0.02 0.00 0.48 0.00 0.00 55.95 56.48 2klr s SER 76 Cb -0.12 -0.00 -0.01 0.00 0.10 0.00 0.00 66.02 65.98 2klr s SER 76 CO 0.22 -0.07 -0.17 -0.69 0.98 0.00 0.00 173.24 173.51 2klr s VAL 77 N -0.66 2.72 -0.09 5.02 1.01 0.13 -4.98 120.40 123.55 2klr s VAL 77 Ca -0.04 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2klr s VAL 77 Cb -0.05 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 2klr s VAL 77 CO -0.00 0.55 -0.08 0.54 0.00 0.00 0.00 175.10 176.11 2klr s ASN 78 N 0.08 4.54 -0.12 3.32 4.22 -1.26 -0.14 114.94 125.58 2klr s ASN 78 Ca -0.07 -0.09 0.03 0.00 -2.14 0.00 0.00 52.86 50.58 2klr s ASN 78 Cb -0.15 -1.31 0.00 0.00 1.28 0.00 0.00 41.25 41.08 2klr s ASN 78 CO 0.05 0.30 -0.23 -0.76 -2.04 0.00 0.00 177.10 174.43 2klr s LEU 79 N -0.44 2.13 -0.05 3.54 1.02 0.10 -4.99 118.68 119.99 2klr s LEU 79 Ca 0.06 -0.56 0.04 0.00 0.02 0.00 0.00 54.13 53.69 2klr s LEU 79 Cb -0.12 -1.43 -0.02 0.00 0.02 0.00 0.00 46.19 44.63 2klr s LEU 79 CO 0.02 0.13 -0.17 1.51 0.02 0.00 0.00 176.35 177.86 2klr s ASP 80 N 0.52 3.75 0.17 2.29 -4.77 -1.26 -0.45 116.67 116.93 2klr s ASP 80 Ca -0.14 -0.29 -0.09 0.00 -3.30 0.00 0.00 52.55 48.74 2klr s ASP 80 Cb -0.17 -0.81 -0.01 0.00 -1.09 0.00 0.00 42.92 40.84 2klr s ASP 80 CO 0.05 0.32 0.29 -0.69 0.70 0.00 0.00 175.17 175.83 2klr s VAL 81 N -0.57 0.06 0.00 2.11 1.01 -1.25 -4.94 120.40 116.82 2klr s VAL 81 Ca 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 61.98 60.63 2klr s VAL 81 Cb -0.11 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.35 2klr s VAL 81 CO 0.01 -0.25 0.00 0.29 0.00 0.00 0.00 175.10 175.15 2klr n LYS 82 N -0.23 0.08 -2.55 2.72 5.02 -1.26 -4.43 118.16 117.51 2klr n LYS 82 Ca -0.06 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.80 2klr n LYS 82 Cb 0.63 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.62 2klr n LYS 82 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2klr s HIS 83 N -0.48 3.26 -0.19 2.13 5.65 -1.26 -3.85 115.29 120.56 2klr s HIS 83 Ca 0.00 1.34 -0.25 0.00 0.25 0.00 0.00 55.06 56.40 2klr s HIS 83 Cb 0.00 -3.34 0.06 0.00 -1.18 0.00 0.00 32.58 28.12 2klr s HIS 83 CO 0.00 -0.92 0.66 0.12 -0.65 0.00 0.00 174.74 173.94 2klr s PHE 84 N 2.45 -0.69 -0.05 3.88 5.36 -1.25 -4.94 117.98 122.73 2klr s PHE 84 Ca 0.52 1.55 -0.30 0.00 -0.96 0.00 0.00 56.93 57.74 2klr s PHE 84 Cb -0.21 0.29 -0.04 0.00 -0.34 0.00 0.00 43.02 42.72 2klr s PHE 84 CO 0.18 -0.42 1.27 -1.12 -1.46 0.00 0.00 175.22 173.66 2klr s SER 85 N -0.13 6.98 0.51 6.13 0.01 -1.26 -2.90 113.70 123.04 2klr s SER 85 Ca -0.04 1.89 0.22 0.00 1.31 0.00 0.00 55.95 59.33 2klr s SER 85 Cb -0.03 -2.56 1.30 0.00 0.21 0.00 0.00 66.02 64.94 2klr s SER 85 CO 0.04 -0.64 2.00 1.55 0.41 0.00 0.00 173.24 176.60 2klr h PRO 86 N 7.64 0.10 0.00 12.44 0.13 -1.83 -0.60 132.00 149.88 2klr h PRO 86 Ca -0.35 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.68 2klr h PRO 86 Cb 1.16 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2klr h PRO 86 CO 0.89 0.06 -0.48 0.93 -0.23 0.00 0.00 178.00 179.18 2klr h GLU 87 N 0.10 0.00 -0.03 0.86 4.39 -1.94 -3.12 114.58 114.84 2klr h GLU 87 Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 2klr h GLU 87 Cb 0.83 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 2klr h GLU 87 CO -0.02 0.48 0.00 0.39 -1.16 0.00 0.00 179.01 178.70 2klr n GLU 88 N -3.47 1.40 -4.60 2.33 1.02 -0.24 -4.75 120.64 112.32 2klr n GLU 88 Ca 0.00 -0.58 -0.29 0.00 -0.02 0.00 0.00 57.16 56.27 2klr n GLU 88 Cb 0.61 -1.46 -0.14 0.00 -0.02 0.00 0.00 31.44 30.43 2klr n GLU 88 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 2klr s LEU 89 N -1.92 2.26 -0.10 -4.62 0.05 -1.17 -1.21 118.68 111.97 2klr s LEU 89 Ca 0.40 -0.68 0.02 0.00 0.05 0.00 0.00 54.13 53.91 2klr s LEU 89 Cb 0.20 -1.23 0.01 0.00 -2.05 0.00 0.00 46.19 43.12 2klr s LEU 89 CO 0.33 0.21 -0.14 -0.54 -0.55 0.00 0.00 176.35 175.65 2klr s LYS 90 N -1.72 2.07 -0.22 1.48 -0.14 0.17 -4.93 119.74 116.45 2klr s LYS 90 Ca 0.13 -0.51 -0.11 0.00 -1.36 0.00 0.00 55.97 54.12 2klr s LYS 90 Cb -0.10 -1.76 -0.05 0.00 -1.68 0.00 0.00 37.83 34.24 2klr s LYS 90 CO 0.04 -0.05 0.18 0.54 -0.76 0.00 0.00 175.35 175.30 2klr s VAL 91 N 0.94 5.36 -0.02 3.17 0.11 -1.26 -0.71 120.40 127.99 2klr s VAL 91 Ca -0.08 0.24 0.04 0.00 -2.93 0.00 0.00 61.98 59.25 2klr s VAL 91 Cb -0.15 -3.52 -0.01 0.00 -1.53 0.00 0.00 36.38 31.18 2klr s VAL 91 CO -0.00 0.37 -0.13 -1.59 -3.33 0.00 0.00 175.10 170.41 2klr s LYS 92 N 0.85 1.18 -0.18 1.54 -2.85 0.64 -5.00 119.74 115.92 2klr s LYS 92 Ca 0.09 -0.47 0.01 0.00 -1.00 0.00 0.00 55.97 54.60 2klr s LYS 92 Cb -0.13 -1.10 0.03 0.00 -2.06 0.00 0.00 37.83 34.57 2klr s LYS 92 CO 0.03 0.25 -0.15 0.54 0.10 0.00 0.00 175.35 176.11 2klr s VAL 93 N -0.15 1.81 -0.59 1.79 0.11 -1.26 -0.59 120.40 121.52 2klr s VAL 93 Ca 0.02 -0.91 -0.00 0.00 -2.93 0.00 0.00 61.98 58.15 2klr s VAL 93 Cb -0.07 -1.74 0.15 0.00 -1.53 0.00 0.00 36.38 33.20 2klr s VAL 93 CO 0.00 0.38 0.37 -0.76 -3.33 0.00 0.00 175.10 171.76 2klr s LEU 94 N 1.36 4.91 0.00 2.54 2.01 0.96 -4.96 118.68 125.51 2klr s LEU 94 Ca 0.02 -2.90 0.00 0.00 0.01 0.00 0.00 54.13 51.26 2klr s LEU 94 Cb -0.14 -1.78 0.00 0.00 0.01 0.00 0.00 46.19 44.28 2klr s LEU 94 CO -0.10 -0.32 0.00 0.61 1.01 0.00 0.00 176.35 177.55 2klr n GLY 95 N 3.36 1.95 0.38 -3.19 0.00 -1.26 -1.16 105.19 105.27 2klr n GLY 95 Ca 0.07 0.26 0.14 0.00 0.00 0.00 0.00 46.02 46.49 2klr n GLY 95 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2klr n ASP 96 N 11.12 1.21 -4.66 1.61 5.75 -1.26 -4.26 116.55 126.06 2klr n ASP 96 Ca 0.00 -1.35 -0.35 0.00 -0.01 0.00 0.00 54.79 53.08 2klr n ASP 96 Cb 0.00 0.01 -0.10 0.00 -1.03 0.00 0.00 41.12 40.00 2klr n ASP 96 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2klr s VAL 97 N -2.06 4.50 -0.17 2.12 1.01 -0.31 0.03 120.40 125.52 2klr s VAL 97 Ca 0.38 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.21 2klr s VAL 97 Cb 0.21 -2.95 0.02 0.00 0.00 0.00 0.00 36.38 33.66 2klr s VAL 97 CO 0.36 0.55 -0.17 -0.63 0.00 0.00 0.00 175.10 175.21 2klr s ILE 98 N -0.37 1.85 -0.01 2.22 1.01 0.07 -0.03 121.20 125.93 2klr s ILE 98 Ca 0.08 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.91 2klr s ILE 98 Cb -0.12 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.65 2klr s ILE 98 CO 0.02 0.48 -0.04 -1.61 0.00 0.00 0.00 174.94 173.79 2klr s GLU 99 N 1.37 0.42 -0.15 2.79 2.02 0.24 0.02 118.70 125.42 2klr s GLU 99 Ca 0.04 -0.12 0.02 0.00 0.02 0.00 0.00 54.97 54.93 2klr s GLU 99 Cb -0.13 -0.44 0.01 0.00 0.10 0.00 0.00 34.13 33.66 2klr s GLU 99 CO -0.12 0.04 -0.20 0.08 0.02 0.00 0.00 175.26 175.08 2klr s VAL 100 N 0.20 2.22 -0.08 2.63 1.01 -0.11 -0.26 120.40 126.01 2klr s VAL 100 Ca -0.02 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.06 2klr s VAL 100 Cb -0.05 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2klr s VAL 100 CO -0.00 0.54 -0.13 -1.38 0.00 0.00 0.00 175.10 174.13 2klr s HIS 101 N 0.85 1.60 0.06 5.22 -3.43 0.11 -0.35 115.29 119.35 2klr s HIS 101 Ca -0.06 -0.63 -0.09 0.00 -0.80 0.00 0.00 55.06 53.48 2klr s HIS 101 Cb -0.15 -1.17 0.00 0.00 -1.43 0.00 0.00 32.58 29.83 2klr s HIS 101 CO -0.02 -0.33 0.19 0.20 -2.00 0.00 0.00 174.74 172.79 2klr s GLY 102 N 0.75 0.05 -0.06 -1.38 0.00 0.61 0.43 107.32 107.73 2klr s GLY 102 Ca -0.13 -0.40 -0.03 0.00 0.00 0.00 0.00 44.72 44.16 2klr s GLY 102 CO 0.03 -0.58 0.13 -1.59 0.00 0.00 0.00 173.10 171.09 2klr s LYS 103 N -3.03 0.11 -0.04 2.90 -2.85 -0.35 -0.53 119.74 115.95 2klr s LYS 103 Ca -0.01 0.28 0.00 0.00 -1.00 0.00 0.00 55.97 55.24 2klr s LYS 103 Cb 0.01 -0.08 0.03 0.00 -2.06 0.00 0.00 37.83 35.73 2klr s LYS 103 CO -0.06 -0.10 -0.01 -1.58 0.10 0.00 0.00 175.35 173.69 2klr s HIS 104 N 0.71 0.45 0.06 1.78 2.46 0.11 -4.74 115.29 116.12 2klr s HIS 104 Ca -0.05 -0.06 -0.22 0.00 0.47 0.00 0.00 55.06 55.20 2klr s HIS 104 Cb -0.07 -0.53 -0.06 0.00 -0.13 0.00 0.00 32.58 31.79 2klr s HIS 104 CO -0.03 -0.18 0.67 -1.83 -2.47 0.00 0.00 174.74 170.89 2klr s GLU 105 N 1.20 4.38 -0.15 2.88 -1.05 -1.26 -0.22 118.70 124.49 2klr s GLU 105 Ca -0.07 0.90 -0.10 0.00 -0.15 0.00 0.00 54.97 55.54 2klr s GLU 105 Cb -0.13 -3.31 -0.06 0.00 -0.44 0.00 0.00 34.13 30.19 2klr s GLU 105 CO -0.02 0.45 -0.24 0.39 0.95 0.00 0.00 175.26 176.80 2klr n GLU 106 N 2.28 0.37 -3.79 -4.83 1.02 0.46 -4.95 120.64 111.20 2klr n GLU 106 Ca -0.06 0.16 -0.12 0.00 -0.02 0.00 0.00 57.16 57.12 2klr n GLU 106 Cb 0.50 -1.14 -0.08 0.00 -0.02 0.00 0.00 31.44 30.70 2klr n GLU 106 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2klr s ARG 107 N -2.44 0.70 -0.20 3.49 1.70 -1.23 -5.01 118.95 115.95 2klr s ARG 107 Ca -0.23 -0.44 -0.03 0.00 -0.47 0.00 0.00 55.73 54.55 2klr s ARG 107 Cb 0.07 0.30 -0.01 0.00 -0.57 0.00 0.00 34.95 34.74 2klr s ARG 107 CO 0.31 -0.20 -0.05 -1.14 -1.08 0.00 0.00 175.30 173.13 2klr s GLN 108 N -2.08 3.42 -0.02 3.89 0.74 -1.26 -0.44 119.66 123.91 2klr s GLN 108 Ca -0.09 -0.62 -0.02 0.00 0.05 0.00 0.00 55.36 54.68 2klr s GLN 108 Cb -0.03 -2.96 -0.01 0.00 1.10 0.00 0.00 33.01 31.11 2klr s GLN 108 CO -0.01 -0.10 0.28 -0.44 -0.55 0.00 0.00 175.29 174.47 2klr h ASP 109 N 7.80 -0.07 -0.04 6.67 3.32 -0.76 -3.49 116.42 129.85 2klr h ASP 109 Ca -0.38 0.00 0.29 0.00 0.02 0.00 0.00 57.03 56.96 2klr h ASP 109 Cb 1.17 0.02 -0.20 0.00 0.22 0.00 0.00 39.33 40.54 2klr h ASP 109 CO 0.60 0.05 0.22 -0.70 -1.72 0.00 0.00 179.24 177.69 2klr s GLU 110 N -1.78 0.02 -1.99 3.56 2.12 -1.26 -4.91 118.70 114.46 2klr s GLU 110 Ca -0.01 0.03 0.00 0.00 0.36 0.00 0.00 54.97 55.35 2klr s GLU 110 Cb 0.00 0.02 0.00 0.00 0.26 0.00 0.00 34.13 34.41 2klr s GLU 110 CO 0.04 -0.03 0.00 0.72 -0.54 0.00 0.00 175.26 175.45 2klr n HIS 111 N 5.31 -0.53 -3.62 5.30 8.25 -1.26 -4.89 115.22 123.79 2klr n HIS 111 Ca -0.02 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.40 2klr n HIS 111 Cb 0.56 -3.75 -0.06 0.00 1.12 0.00 0.00 29.99 27.86 2klr n HIS 111 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2klr s GLY 112 N -2.40 -0.58 0.18 -1.41 0.00 -1.26 -5.14 107.32 96.71 2klr s GLY 112 Ca 0.00 1.92 0.11 0.00 0.00 0.00 0.00 44.72 46.75 2klr s GLY 112 CO 0.00 2.79 -0.23 -0.11 0.00 0.00 0.00 173.10 175.56 2klr s PHE 113 N 2.77 2.35 -0.01 1.90 -0.12 -1.26 0.05 117.98 123.65 2klr s PHE 113 Ca -0.02 -0.34 0.08 0.00 -0.05 0.00 0.00 56.93 56.59 2klr s PHE 113 Cb -0.12 -1.18 -0.02 0.00 -0.63 0.00 0.00 43.02 41.07 2klr s PHE 113 CO -0.16 0.48 -0.25 0.96 -0.05 0.00 0.00 175.22 176.20 2klr s ILE 114 N -1.58 1.96 0.10 -4.49 -4.36 0.42 -4.96 121.20 108.28 2klr s ILE 114 Ca 0.20 -1.11 0.03 0.00 -0.26 0.00 0.00 60.65 59.51 2klr s ILE 114 Cb -0.08 -1.64 -0.04 0.00 1.25 0.00 0.00 42.46 41.95 2klr s ILE 114 CO 0.10 0.51 -0.08 -0.44 0.24 0.00 0.00 174.94 175.26 2klr s SER 115 N -0.70 1.28 0.06 4.36 0.01 -1.26 -0.41 113.70 117.03 2klr s SER 115 Ca 0.10 -0.88 0.07 0.00 1.31 0.00 0.00 55.95 56.54 2klr s SER 115 Cb -0.10 0.05 -0.03 0.00 0.21 0.00 0.00 66.02 66.16 2klr s SER 115 CO -0.00 -0.35 -0.18 -0.60 0.41 0.00 0.00 173.24 172.51 2klr s ARG 116 N -3.17 1.17 0.06 12.44 3.52 0.69 -4.93 118.95 128.72 2klr s ARG 116 Ca 0.07 -0.93 0.01 0.00 -0.13 0.00 0.00 55.73 54.75 2klr s ARG 116 Cb 0.00 -1.28 -0.03 0.00 -1.56 0.00 0.00 34.95 32.08 2klr s ARG 116 CO -0.02 0.32 -0.06 -1.21 -0.81 0.00 0.00 175.30 173.51 2klr s GLU 117 N -1.35 0.59 -0.05 5.12 2.02 -1.26 0.05 118.70 123.83 2klr s GLU 117 Ca 0.05 -0.94 0.03 0.00 0.02 0.00 0.00 54.97 54.13 2klr s GLU 117 Cb -0.09 -0.17 0.00 0.00 0.10 0.00 0.00 34.13 33.98 2klr s GLU 117 CO 0.02 0.00 -0.13 -0.06 0.02 0.00 0.00 175.26 175.11 2klr s PHE 118 N -2.25 1.43 -0.09 1.61 0.40 0.31 -4.97 117.98 114.43 2klr s PHE 118 Ca -0.03 -0.44 -0.00 0.00 -0.60 0.00 0.00 56.93 55.86 2klr s PHE 118 Cb -0.04 -1.00 0.02 0.00 0.51 0.00 0.00 43.02 42.51 2klr s PHE 118 CO -0.02 -0.19 -0.06 -1.58 0.70 0.00 0.00 175.22 174.07 2klr s HIS 119 N 0.29 1.18 -0.05 0.36 2.46 -1.25 -0.28 115.29 117.99 2klr s HIS 119 Ca -0.07 -0.50 0.04 0.00 0.47 0.00 0.00 55.06 55.00 2klr s HIS 119 Cb -0.12 -1.03 -0.02 0.00 -0.13 0.00 0.00 32.58 31.27 2klr s HIS 119 CO 0.02 -0.40 -0.17 1.03 -2.47 0.00 0.00 174.74 172.75 2klr s ARG 120 N 1.54 2.54 -0.04 2.88 0.52 0.53 -4.96 118.95 121.96 2klr s ARG 120 Ca 0.00 -0.76 0.00 0.00 -0.52 0.00 0.00 55.73 54.46 2klr s ARG 120 Cb -0.13 -2.33 0.02 0.00 0.52 0.00 0.00 34.95 33.04 2klr s ARG 120 CO -0.05 0.54 -0.02 0.21 0.02 0.00 0.00 175.30 176.01 2klr s LYS 121 N -0.53 0.57 0.01 3.54 2.20 -1.26 -0.94 119.74 123.32 2klr s LYS 121 Ca 0.07 0.01 0.03 0.00 -0.36 0.00 0.00 55.97 55.72 2klr s LYS 121 Cb -0.11 -0.71 -0.01 0.00 -1.51 0.00 0.00 37.83 35.48 2klr s LYS 121 CO 0.01 -0.14 -0.11 0.71 -0.36 0.00 0.00 175.35 175.46 2klr s TYR 122 N 1.14 0.95 -0.34 4.03 1.51 0.10 -5.01 117.35 119.74 2klr s TYR 122 Ca -0.08 -0.24 0.01 0.00 -1.01 0.00 0.00 57.07 55.75 2klr s TYR 122 Cb -0.14 -0.59 0.10 0.00 -0.11 0.00 0.00 41.96 41.23 2klr s TYR 122 CO -0.01 -0.01 0.11 0.50 -1.11 0.00 0.00 175.55 175.02 2klr s ARG 123 N -0.58 1.00 -0.23 -0.62 3.52 -1.26 -0.75 118.95 120.03 2klr s ARG 123 Ca 0.02 -1.42 -0.04 0.00 -0.13 0.00 0.00 55.73 54.17 2klr s ARG 123 Cb -0.05 -2.36 0.08 0.00 -1.56 0.00 0.00 34.95 31.05 2klr s ARG 123 CO 0.00 -1.00 0.08 0.96 -0.81 0.00 0.00 175.30 174.54 2klr s ILE 124 N 1.25 0.22 -0.16 4.11 -4.36 0.10 -4.98 121.20 117.39 2klr s ILE 124 Ca 0.11 -0.59 -0.15 0.00 -0.26 0.00 0.00 60.65 59.76 2klr s ILE 124 Cb -0.19 -0.95 -0.23 0.00 1.25 0.00 0.00 42.46 42.34 2klr s ILE 124 CO -0.17 -0.42 0.32 -0.65 0.24 0.00 0.00 174.94 174.26 2klr h PRO 125 N 8.32 0.14 0.00 0.37 0.11 -1.80 -3.21 132.00 135.94 2klr h PRO 125 Ca -0.16 -0.24 -0.06 0.00 0.11 0.00 0.00 66.00 65.64 2klr h PRO 125 Cb 1.09 0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2klr h PRO 125 CO 0.36 1.12 -0.31 0.00 -0.21 0.00 0.00 178.00 178.96 2klr h ALA 126 N -0.20 1.31 0.00 -0.75 0.00 -1.95 -2.52 119.26 115.15 2klr h ALA 126 Ca -0.37 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2klr h ALA 126 Cb 1.67 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2klr h ALA 126 CO -0.05 0.39 -1.00 -0.25 0.00 0.00 0.00 179.25 178.33 2klr n ASP 127 N -3.91 0.72 -3.91 0.00 9.92 -1.26 -3.97 116.55 114.14 2klr n ASP 127 Ca -0.02 0.17 -0.22 0.00 -0.53 0.00 0.00 54.79 54.19 2klr n ASP 127 Cb 0.38 0.56 -0.17 0.00 -0.64 0.00 0.00 41.12 41.26 2klr n ASP 127 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2klr s VAL 128 N -3.31 0.69 -0.26 2.53 1.01 -0.95 -4.47 120.40 115.65 2klr s VAL 128 Ca 0.01 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2klr s VAL 128 Cb 0.11 -0.71 0.06 0.00 0.00 0.00 0.00 36.38 35.85 2klr s VAL 128 CO 0.79 0.27 -0.09 -1.81 0.00 0.00 0.00 175.10 174.26 2klr s ASP 129 N 1.06 4.29 0.15 3.32 1.01 -1.26 -4.54 116.67 120.70 2klr s ASP 129 Ca -0.08 -1.37 0.10 0.00 0.71 0.00 0.00 52.55 51.91 2klr s ASP 129 Cb -0.14 -1.45 0.55 0.00 1.01 0.00 0.00 42.92 42.89 2klr s ASP 129 CO -0.01 -0.21 1.31 -0.81 0.21 0.00 0.00 175.17 175.66 2klr n PRO 130 N 4.49 0.07 -0.28 8.23 -0.04 -1.26 -2.58 135.00 143.63 2klr n PRO 130 Ca -0.13 0.56 -0.06 0.00 -0.04 0.00 0.00 63.50 63.83 2klr n PRO 130 Cb 0.43 -1.72 0.06 0.00 -0.04 0.00 0.00 33.50 32.22 2klr n PRO 130 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2klr h LEU 131 N 0.00 1.07 -2.82 1.53 3.38 -1.95 -3.24 115.31 113.29 2klr h LEU 131 Ca 0.00 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2klr h LEU 131 Cb 0.00 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.48 2klr h LEU 131 CO 0.00 0.97 0.00 1.07 0.09 0.00 0.00 178.44 180.57 2klr n THR 132 N -4.29 0.92 -2.62 0.22 5.66 -1.06 -5.02 114.28 108.08 2klr n THR 132 Ca 0.06 -0.96 -0.39 0.00 -3.05 0.00 0.00 64.05 59.71 2klr n THR 132 Cb 0.20 0.55 -0.05 0.00 -1.55 0.00 0.00 70.33 69.48 2klr n THR 132 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2klr s ILE 133 N -0.93 3.82 0.04 1.09 2.07 -1.14 -4.06 121.20 122.10 2klr s ILE 133 Ca 0.04 1.74 0.00 0.00 -1.41 0.00 0.00 60.65 61.02 2klr s ILE 133 Cb 0.02 -4.07 -0.03 0.00 0.13 0.00 0.00 42.46 38.51 2klr s ILE 133 CO 0.03 0.34 -0.04 0.42 -1.91 0.00 0.00 174.94 173.77 2klr s THR 134 N -1.29 0.30 -0.04 4.00 -4.23 0.81 -4.96 115.64 110.23 2klr s THR 134 Ca 0.46 -1.38 0.02 0.00 -1.18 0.00 0.00 61.69 59.61 2klr s THR 134 Cb -0.27 -0.94 0.01 0.00 1.34 0.00 0.00 72.50 72.64 2klr s THR 134 CO 0.34 -0.70 -0.10 -0.55 -0.54 0.00 0.00 174.62 173.07 2klr s SER 135 N -2.19 1.41 -0.10 3.99 0.15 -1.26 -0.53 113.70 115.17 2klr s SER 135 Ca -0.03 -0.22 0.04 0.00 0.70 0.00 0.00 55.95 56.43 2klr s SER 135 Cb -0.02 -0.51 -0.00 0.00 -1.71 0.00 0.00 66.02 63.79 2klr s SER 135 CO -0.04 0.05 -0.23 -0.94 1.20 0.00 0.00 173.24 173.27 2klr s SER 136 N 0.42 3.14 -0.02 5.45 1.04 0.11 -4.97 113.70 118.87 2klr s SER 136 Ca -0.08 -0.54 0.03 0.00 0.48 0.00 0.00 55.95 55.84 2klr s SER 136 Cb -0.12 -1.39 -0.00 0.00 0.10 0.00 0.00 66.02 64.61 2klr s SER 136 CO 0.01 0.17 -0.12 -1.48 0.98 0.00 0.00 173.24 172.80 2klr s LEU 137 N 0.31 1.90 0.39 2.42 2.34 -1.26 -0.33 118.68 124.45 2klr s LEU 137 Ca -0.18 -0.24 0.07 0.00 0.06 0.00 0.00 54.13 53.85 2klr s LEU 137 Cb -0.18 -0.68 0.00 0.00 -0.56 0.00 0.00 46.19 44.78 2klr s LEU 137 CO 0.08 0.12 0.53 -0.94 -1.06 0.00 0.00 176.35 175.08 2klr s SER 138 N -0.02 5.79 0.06 1.48 1.04 -0.05 -4.99 113.70 117.01 2klr s SER 138 Ca -0.00 -0.32 0.13 0.00 0.48 0.00 0.00 55.95 56.24 2klr s SER 138 Cb -0.08 -0.90 0.56 0.00 0.10 0.00 0.00 66.02 65.70 2klr s SER 138 CO 0.00 -0.63 1.41 -1.20 0.98 0.00 0.00 173.24 173.80 2klr n SER 139 N -1.77 0.13 -1.23 7.02 7.64 -1.26 -2.22 113.62 121.93 2klr n SER 139 Ca 0.05 0.54 0.08 0.00 1.01 0.00 0.00 58.87 60.55 2klr n SER 139 Cb 0.59 -0.57 0.31 0.00 -1.01 0.00 0.00 64.21 63.53 2klr n SER 139 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2klr n ASP 140 N -1.65 4.51 0.00 6.43 2.03 -1.26 -3.92 116.55 122.68 2klr n ASP 140 Ca 0.02 -3.00 0.00 0.00 0.52 0.00 0.00 54.79 52.33 2klr n ASP 140 Cb 0.13 -0.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.94 2klr n ASP 140 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2klr n GLY 141 N -0.14 2.05 3.65 0.27 0.00 -0.94 -4.20 105.19 105.87 2klr n GLY 141 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2klr n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2klr s VAL 142 N -3.45 4.76 -0.03 1.61 1.01 -1.26 -3.97 120.40 119.07 2klr s VAL 142 Ca 0.00 1.75 0.03 0.00 0.00 0.00 0.00 61.98 63.76 2klr s VAL 142 Cb 0.00 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.17 2klr s VAL 142 CO 0.00 -0.14 -0.12 -1.48 0.00 0.00 0.00 175.10 173.36 2klr s LEU 143 N 3.02 1.83 -0.14 3.92 0.05 0.40 -0.87 118.68 126.89 2klr s LEU 143 Ca 0.39 -0.25 -0.04 0.00 0.05 0.00 0.00 54.13 54.28 2klr s LEU 143 Cb -0.15 -0.70 -0.03 0.00 -2.05 0.00 0.00 46.19 43.25 2klr s LEU 143 CO 0.07 0.10 -0.01 0.42 -0.55 0.00 0.00 176.35 176.38 2klr s THR 144 N 0.14 4.20 -0.21 5.48 -4.23 0.56 0.01 115.64 121.60 2klr s THR 144 Ca -0.03 -0.26 -0.04 0.00 -1.18 0.00 0.00 61.69 60.18 2klr s THR 144 Cb -0.10 -2.83 -0.01 0.00 1.34 0.00 0.00 72.50 70.90 2klr s THR 144 CO 0.01 0.52 -0.05 0.68 -0.54 0.00 0.00 174.62 175.24 2klr s VAL 145 N -0.03 3.40 0.15 2.29 -7.23 0.80 -0.71 120.40 119.07 2klr s VAL 145 Ca 0.03 -0.49 0.00 0.00 -1.81 0.00 0.00 61.98 59.71 2klr s VAL 145 Cb -0.13 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.24 2klr s VAL 145 CO 0.02 0.43 0.03 0.54 -0.31 0.00 0.00 175.10 175.81 2klr s ASN 146 N 1.31 0.77 0.00 4.85 2.20 0.31 0.18 114.94 124.56 2klr s ASN 146 Ca 0.04 -1.19 0.00 0.00 -0.94 0.00 0.00 52.86 50.77 2klr s ASN 146 Cb -0.14 0.20 0.00 0.00 -2.00 0.00 0.00 41.25 39.31 2klr s ASN 146 CO -0.02 -0.65 0.00 0.61 -2.94 0.00 0.00 177.10 174.10 2klr n GLY 147 N -0.16 3.67 3.51 0.45 0.00 -0.92 -0.14 105.19 111.60 2klr n GLY 147 Ca -0.06 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.81 2klr n GLY 147 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2klr s PRO 148 N 0.00 -0.86 0.17 1.61 0.04 -1.24 -4.58 135.00 130.14 2klr s PRO 148 Ca 0.00 0.77 0.05 0.00 0.04 0.00 0.00 61.00 61.86 2klr s PRO 148 Cb 0.00 -1.57 -0.04 0.00 0.04 0.00 0.00 34.50 32.94 2klr s PRO 148 CO 0.00 -3.66 0.12 -0.98 0.04 0.00 0.00 177.00 172.52 2klr s ARG 149 N -4.52 2.84 0.00 4.56 1.70 -1.26 0.44 118.95 122.71 2klr s ARG 149 Ca 0.68 -0.90 0.06 0.00 -0.47 0.00 0.00 55.73 55.11 2klr s ARG 149 Cb -0.24 -2.61 0.05 0.00 -0.57 0.00 0.00 34.95 31.57 2klr s ARG 149 CO 0.64 0.48 0.70 1.17 -1.08 0.00 0.00 175.30 177.21