#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kp1 h PRO 2 N 0.00 0.00 -3.91 1.61 0.13 -2.04 -3.33 132.00 124.46 2kp1 h PRO 2 Ca 0.00 0.00 -0.77 0.00 -0.87 0.00 0.00 66.00 64.36 2kp1 h PRO 2 Cb 0.00 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 30.86 2kp1 h PRO 2 CO 0.00 0.04 -0.08 -0.51 -0.23 0.00 0.00 178.00 177.22 2kp1 s LEU 3 N -6.48 6.36 0.00 1.56 1.43 -1.26 -4.46 118.68 115.82 2kp1 s LEU 3 Ca -0.02 -2.43 0.00 0.00 -1.03 0.00 0.00 54.13 50.65 2kp1 s LEU 3 Cb 0.11 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 44.18 2kp1 s LEU 3 CO 0.51 -0.63 0.00 0.61 0.23 0.00 0.00 176.35 177.07 2kp1 n GLY 4 N 4.30 1.48 3.24 -3.19 0.00 -1.25 -5.16 105.19 104.60 2kp1 n GLY 4 Ca 0.05 -0.84 -0.13 0.00 0.00 0.00 0.00 46.02 45.09 2kp1 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kp1 s SER 5 N 0.00 -0.31 -0.10 1.61 0.01 -1.26 -4.43 113.70 109.22 2kp1 s SER 5 Ca 0.00 0.52 0.18 0.00 1.31 0.00 0.00 55.95 57.97 2kp1 s SER 5 Cb 0.00 0.59 0.69 0.00 0.21 0.00 0.00 66.02 67.51 2kp1 s SER 5 CO 0.00 -0.22 1.60 -1.84 0.41 0.00 0.00 173.24 173.19 2kp1 n GLU 6 N 2.42 3.56 -4.13 12.44 0.00 -1.26 -4.94 120.64 128.72 2kp1 n GLU 6 Ca -0.15 -2.83 -0.12 0.00 0.00 0.00 0.00 57.16 54.06 2kp1 n GLU 6 Cb 0.57 -1.82 -0.08 0.00 0.00 0.00 0.00 31.44 30.11 2kp1 n GLU 6 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 2kp1 s GLY 7 N -0.97 1.23 0.37 -1.84 0.00 -1.26 -5.03 107.32 99.81 2kp1 s GLY 7 Ca 0.49 -1.45 0.08 0.00 0.00 0.00 0.00 44.72 43.84 2kp1 s GLY 7 CO 0.25 -1.12 1.88 -0.56 0.00 0.00 0.00 173.10 173.54 2kp1 h PRO 8 N 2.42 0.29 -6.60 2.90 0.13 -1.92 -3.42 132.00 125.79 2kp1 h PRO 8 Ca -0.31 -0.07 -0.53 0.00 -0.87 0.00 0.00 66.00 64.22 2kp1 h PRO 8 Cb 1.25 -0.04 0.01 0.00 0.13 0.00 0.00 31.00 32.36 2kp1 h PRO 8 CO 0.45 0.44 0.57 0.54 -0.23 0.00 0.00 178.00 179.77 2kp1 s VAL 9 N -4.69 3.70 -0.47 1.56 0.11 -1.26 -4.62 120.40 114.73 2kp1 s VAL 9 Ca -0.06 1.35 -0.28 0.00 -2.93 0.00 0.00 61.98 60.06 2kp1 s VAL 9 Cb 0.15 -3.86 0.01 0.00 -1.53 0.00 0.00 36.38 31.15 2kp1 s VAL 9 CO 0.74 0.17 1.45 -0.89 -3.33 0.00 0.00 175.10 173.25 2kp1 s THR 10 N 0.37 3.82 -0.50 5.04 2.01 -0.12 -4.77 115.64 121.49 2kp1 s THR 10 Ca 0.55 0.79 -0.29 0.00 0.31 0.00 0.00 61.69 63.05 2kp1 s THR 10 Cb -0.32 -4.25 0.02 0.00 0.01 0.00 0.00 72.50 67.97 2kp1 s THR 10 CO 0.34 -0.89 1.23 -0.69 -0.69 0.00 0.00 174.62 173.92 2kp1 s VAL 11 N 5.87 4.07 -0.33 3.82 1.01 -1.26 -1.59 120.40 131.98 2kp1 s VAL 11 Ca 0.59 1.04 -0.06 0.00 0.00 0.00 0.00 61.98 63.56 2kp1 s VAL 11 Cb -0.13 -4.54 0.04 0.00 0.00 0.00 0.00 36.38 31.74 2kp1 s VAL 11 CO 0.30 -1.06 0.09 -0.69 0.00 0.00 0.00 175.10 173.74 2kp1 s VAL 12 N 4.90 3.74 0.94 2.92 1.01 0.46 -4.56 120.40 129.82 2kp1 s VAL 12 Ca 0.50 -1.10 -0.12 0.00 0.00 0.00 0.00 61.98 61.26 2kp1 s VAL 12 Cb -0.09 -3.10 0.15 0.00 0.00 0.00 0.00 36.38 33.35 2kp1 s VAL 12 CO 0.30 -0.14 1.09 0.68 0.00 0.00 0.00 175.10 177.03 2kp1 s VAL 13 N 1.40 2.40 0.62 2.92 -7.23 -1.26 -3.71 120.40 115.55 2kp1 s VAL 13 Ca -0.01 0.13 0.34 0.00 -1.81 0.00 0.00 61.98 60.63 2kp1 s VAL 13 Cb -0.19 -2.62 0.38 0.00 0.56 0.00 0.00 36.38 34.51 2kp1 s VAL 13 CO 0.02 -0.17 2.28 0.00 -0.31 0.00 0.00 175.10 176.92 2kp1 h ALA 14 N -1.70 1.38 -0.77 1.32 0.00 -1.88 0.25 119.26 117.85 2kp1 h ALA 14 Ca -0.52 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.40 2kp1 h ALA 14 Cb 1.30 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 2kp1 h ALA 14 CO 0.56 -0.03 0.51 -0.22 0.00 0.00 0.00 179.25 180.07 2kp1 h LYS 15 N 0.00 1.01 -0.00 0.00 3.64 -1.94 -3.27 116.57 116.02 2kp1 h LYS 15 Ca 0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2kp1 h LYS 15 Cb 0.05 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 2kp1 h LYS 15 CO -0.00 0.67 -0.70 0.09 -2.27 0.00 0.00 179.45 177.23 2kp1 n ASN 16 N -4.55 0.73 0.06 4.20 3.02 0.64 -4.49 115.26 114.87 2kp1 n ASN 16 Ca 0.07 -0.87 0.20 0.00 -0.03 0.00 0.00 54.58 53.96 2kp1 n ASN 16 Cb 0.02 0.99 0.74 0.00 -0.61 0.00 0.00 39.78 40.91 2kp1 n ASN 16 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 2kp1 h TYR 17 N 0.04 0.00 -0.00 3.10 3.20 -0.95 0.27 116.97 122.63 2kp1 h TYR 17 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2kp1 h TYR 17 Cb 0.36 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.63 2kp1 h TYR 17 CO 0.00 0.00 -0.26 0.27 -1.64 0.00 0.00 178.16 176.53 2kp1 n ASN 18 N -4.00 0.44 -0.09 -2.11 6.94 -1.26 -1.91 115.26 113.26 2kp1 n ASN 18 Ca 0.08 -0.23 -0.15 0.00 -0.02 0.00 0.00 54.58 54.25 2kp1 n ASN 18 Cb 0.59 -0.01 -0.08 0.00 -2.36 0.00 0.00 39.78 37.91 2kp1 n ASN 18 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 2kp1 n GLU 19 N -1.27 0.45 -0.10 -3.83 2.13 0.54 -4.34 120.64 114.21 2kp1 n GLU 19 Ca 0.09 0.13 -0.16 0.00 0.66 0.00 0.00 57.16 57.87 2kp1 n GLU 19 Cb 0.32 -1.31 -0.07 0.00 0.27 0.00 0.00 31.44 30.65 2kp1 n GLU 19 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2kp1 n ILE 20 N -3.31 1.49 0.19 6.31 2.08 0.64 -4.10 119.36 122.67 2kp1 n ILE 20 Ca -0.35 -0.01 0.06 0.00 0.56 0.00 0.00 62.75 63.02 2kp1 n ILE 20 Cb 0.82 -2.16 0.32 0.00 -0.75 0.00 0.00 39.64 37.87 2kp1 n ILE 20 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2kp1 h VAL 21 N -1.00 0.81 -0.64 1.39 2.07 -1.56 -2.67 116.25 114.65 2kp1 h VAL 21 Ca -0.26 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 65.74 2kp1 h VAL 21 Cb 1.09 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 2kp1 h VAL 21 CO -0.16 0.35 0.00 -0.11 0.02 0.00 0.00 177.57 177.67 2kp1 n LEU 22 N -3.46 5.09 -4.86 2.57 -0.00 -0.90 -4.70 117.00 110.72 2kp1 n LEU 22 Ca 0.00 -2.57 -0.32 0.00 -0.00 0.00 0.00 56.01 53.12 2kp1 n LEU 22 Cb 0.52 -0.62 -0.05 0.00 -0.00 0.00 0.00 43.42 43.27 2kp1 n LEU 22 CO 0.36 0.76 0.36 -0.62 -0.00 0.00 0.00 177.39 178.25 2kp1 s ASP 23 N -0.86 6.69 -0.11 1.96 2.15 -1.01 -4.90 116.67 120.59 2kp1 s ASP 23 Ca 0.53 1.14 0.14 0.00 0.43 0.00 0.00 52.55 54.79 2kp1 s ASP 23 Cb 0.36 -2.32 0.34 0.00 -0.30 0.00 0.00 42.92 41.00 2kp1 s ASP 23 CO 0.22 -0.19 1.25 -0.90 -0.17 0.00 0.00 175.17 175.38 2kp1 n ASP 24 N -0.43 2.96 0.04 -0.34 5.75 -1.26 -4.51 116.55 118.76 2kp1 n ASP 24 Ca 0.02 -2.75 0.12 0.00 -0.01 0.00 0.00 54.79 52.17 2kp1 n ASP 24 Cb 0.53 -0.38 0.12 0.00 -1.03 0.00 0.00 41.12 40.36 2kp1 n ASP 24 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2kp1 n THR 25 N -0.67 0.24 -3.78 2.12 -2.24 -1.26 -4.56 114.28 104.12 2kp1 n THR 25 Ca 0.15 -0.23 -0.10 0.00 -2.27 0.00 0.00 64.05 61.60 2kp1 n THR 25 Cb 0.65 0.05 -0.06 0.00 -2.10 0.00 0.00 70.33 68.87 2kp1 n THR 25 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2kp1 s LYS 26 N -3.16 1.01 -0.07 -0.78 0.00 -1.26 -4.88 119.74 110.60 2kp1 s LYS 26 Ca 0.06 -0.90 -0.30 0.00 0.00 0.00 0.00 55.97 54.83 2kp1 s LYS 26 Cb 0.14 0.41 -0.02 0.00 0.00 0.00 0.00 37.83 38.36 2kp1 s LYS 26 CO 0.75 -0.37 1.07 -0.51 0.00 0.00 0.00 175.35 176.29 2kp1 s ASP 27 N -2.86 7.20 -0.25 0.03 1.01 -0.17 -3.79 116.67 117.84 2kp1 s ASP 27 Ca 0.06 1.65 -0.01 0.00 0.71 0.00 0.00 52.55 54.96 2kp1 s ASP 27 Cb 0.03 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.43 2kp1 s ASP 27 CO -0.09 -0.46 -0.07 -0.69 0.21 0.00 0.00 175.17 174.07 2kp1 s VAL 28 N 1.89 2.85 -0.09 -1.27 1.01 0.38 -0.20 120.40 124.97 2kp1 s VAL 28 Ca 0.51 -1.03 -0.24 0.00 0.00 0.00 0.00 61.98 61.22 2kp1 s VAL 28 Cb -0.21 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 2kp1 s VAL 28 CO 0.21 0.21 0.75 -0.76 0.00 0.00 0.00 175.10 175.50 2kp1 s LEU 29 N 1.32 4.29 0.03 3.92 1.43 -0.70 -0.09 118.68 128.89 2kp1 s LEU 29 Ca 0.00 1.21 0.07 0.00 -1.03 0.00 0.00 54.13 54.38 2kp1 s LEU 29 Cb -0.17 -3.14 -0.03 0.00 0.03 0.00 0.00 46.19 42.88 2kp1 s LEU 29 CO -0.05 -0.19 -0.18 -0.51 0.23 0.00 0.00 176.35 175.66 2kp1 s ILE 30 N 1.12 2.83 -0.21 -0.59 2.07 0.92 0.05 121.20 127.38 2kp1 s ILE 30 Ca 0.39 -1.14 0.01 0.00 -1.41 0.00 0.00 60.65 58.49 2kp1 s ILE 30 Cb -0.18 -2.18 0.05 0.00 0.13 0.00 0.00 42.46 40.28 2kp1 s ILE 30 CO 0.18 0.36 -0.07 -0.70 -1.91 0.00 0.00 174.94 172.79 2kp1 s GLU 31 N -1.39 1.76 -0.05 3.50 2.12 -0.54 -0.68 118.70 123.43 2kp1 s GLU 31 Ca 0.14 -0.89 -0.30 0.00 0.36 0.00 0.00 54.97 54.28 2kp1 s GLU 31 Cb -0.11 -2.47 -0.03 0.00 0.26 0.00 0.00 34.13 31.79 2kp1 s GLU 31 CO 0.05 -0.52 1.07 -0.06 -0.54 0.00 0.00 175.26 175.27 2kp1 s PHE 32 N 1.41 3.45 0.20 5.30 0.08 0.12 -1.45 117.98 127.09 2kp1 s PHE 32 Ca -0.04 1.48 0.02 0.00 0.12 0.00 0.00 56.93 58.52 2kp1 s PHE 32 Cb -0.18 -3.26 -0.01 0.00 -0.57 0.00 0.00 43.02 39.01 2kp1 s PHE 32 CO -0.07 -0.58 0.23 2.48 -0.10 0.00 0.00 175.22 177.17 2kp1 n TYR 33 N 4.69 -0.74 -3.82 0.36 4.11 -0.38 -2.31 117.16 119.07 2kp1 n TYR 33 Ca 0.09 -1.55 -0.12 0.00 -0.00 0.00 0.00 57.90 56.31 2kp1 n TYR 33 Cb 0.48 0.25 -0.11 0.00 -0.00 0.00 0.00 39.34 39.96 2kp1 n TYR 33 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2kp1 s ALA 34 N -2.57 -0.51 -0.56 -3.48 0.00 -1.26 -0.64 121.76 112.74 2kp1 s ALA 34 Ca 0.21 0.35 0.24 0.00 0.00 0.00 0.00 51.96 52.77 2kp1 s ALA 34 Cb 0.00 -0.16 0.53 0.00 0.00 0.00 0.00 23.12 23.49 2kp1 s ALA 34 CO 0.15 -0.15 1.67 -1.00 0.00 0.00 0.00 175.76 176.43 2kp1 h PRO 35 N 5.10 0.00 -0.05 0.00 0.13 -2.00 -2.37 132.00 132.81 2kp1 h PRO 35 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2kp1 h PRO 35 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2kp1 h PRO 35 CO 0.38 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.48 2kp1 n TRP 36 N -2.75 0.06 -2.82 1.56 4.27 -1.26 -4.83 117.44 111.66 2kp1 n TRP 36 Ca 0.05 -0.03 -0.42 0.00 -3.89 0.00 0.00 57.50 53.21 2kp1 n TRP 36 Cb 0.49 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.40 2kp1 n TRP 36 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2kp1 h GLY 38 N 9.42 1.17 1.38 0.00 0.00 -1.88 -0.85 103.07 112.32 2kp1 h GLY 38 Ca -0.22 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 46.55 2kp1 h GLY 38 CO 0.92 0.44 -0.27 0.45 0.00 0.00 0.00 176.54 178.08 2kp1 h HIS 39 N 1.13 0.81 -0.34 5.60 3.86 -1.95 -2.69 115.15 121.58 2kp1 h HIS 39 Ca 0.30 -0.19 -0.06 0.00 -1.16 0.00 0.00 60.37 59.26 2kp1 h HIS 39 Cb -0.12 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.14 2kp1 h HIS 39 CO 0.00 0.90 -0.06 0.00 0.86 0.00 0.00 177.93 179.63 2kp1 h LYS 41 N 0.52 0.00 0.00 0.00 1.57 -0.85 0.10 116.57 117.90 2kp1 h LYS 41 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2kp1 h LYS 41 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2kp1 h LYS 41 CO 0.02 0.00 -0.75 0.00 -0.57 0.00 0.00 179.45 178.15 2kp1 n ALA 42 N -1.81 4.06 0.65 3.86 0.00 -0.47 -4.00 120.51 122.80 2kp1 n ALA 42 Ca 0.02 -0.46 0.11 0.00 0.00 0.00 0.00 53.44 53.10 2kp1 n ALA 42 Cb 0.22 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.64 2kp1 n ALA 42 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kp1 n LEU 43 N -1.53 0.64 -0.05 0.00 4.77 0.22 -4.38 117.00 116.67 2kp1 n LEU 43 Ca 0.05 -0.23 -0.10 0.00 -0.03 0.00 0.00 56.01 55.70 2kp1 n LEU 43 Cb 0.34 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.35 2kp1 n LEU 43 CO 0.39 0.13 0.90 0.00 -1.33 0.00 0.00 177.39 177.48 2kp1 h ALA 44 N 2.65 0.26 0.00 -1.18 0.00 -1.32 -2.35 119.26 117.32 2kp1 h ALA 44 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2kp1 h ALA 44 Cb 0.68 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2kp1 h ALA 44 CO 0.00 -0.20 0.00 -0.35 0.00 0.00 0.00 179.25 178.70 2kp1 n PRO 45 N -4.88 0.13 -0.03 0.00 -0.04 -1.26 -0.45 135.00 128.45 2kp1 n PRO 45 Ca -0.04 0.22 -0.12 0.00 -0.04 0.00 0.00 63.50 63.53 2kp1 n PRO 45 Cb 0.08 -1.68 -0.14 0.00 -0.04 0.00 0.00 33.50 31.71 2kp1 n PRO 45 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2kp1 n LYS 46 N -1.91 0.66 0.08 0.54 2.85 -1.22 -3.38 118.16 115.78 2kp1 n LYS 46 Ca 0.05 0.23 -0.23 0.00 -1.05 0.00 0.00 58.31 57.31 2kp1 n LYS 46 Cb 0.30 -1.72 -0.15 0.00 -0.65 0.00 0.00 35.03 32.81 2kp1 n LYS 46 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 177.40 176.43 2kp1 h TYR 47 N 0.01 0.73 -0.11 5.58 3.20 -0.76 -1.46 116.97 124.17 2kp1 h TYR 47 Ca -0.37 -0.53 -0.17 0.00 3.14 0.00 0.00 58.73 60.80 2kp1 h TYR 47 Cb 2.05 -0.03 0.01 0.00 1.54 0.00 0.00 36.73 40.30 2kp1 h TYR 47 CO 0.02 1.56 -0.62 0.93 -1.64 0.00 0.00 178.16 178.41 2kp1 h GLU 48 N -0.04 0.61 -0.06 1.82 5.08 -0.97 -0.78 114.58 120.24 2kp1 h GLU 48 Ca -0.28 -0.51 -0.23 0.00 -1.00 0.00 0.00 59.36 57.34 2kp1 h GLU 48 Cb 1.98 0.11 0.01 0.00 0.50 0.00 0.00 28.75 31.35 2kp1 h GLU 48 CO 0.18 1.13 -0.90 1.49 -1.00 0.00 0.00 179.01 179.92 2kp1 h GLU 49 N 0.24 0.63 -0.19 2.33 4.81 -1.64 0.38 114.58 121.14 2kp1 h GLU 49 Ca -0.05 -0.60 -0.21 0.00 -0.13 0.00 0.00 59.36 58.37 2kp1 h GLU 49 Cb 1.26 0.15 0.01 0.00 0.63 0.00 0.00 28.75 30.80 2kp1 h GLU 49 CO 0.13 1.21 -0.70 1.25 -0.73 0.00 0.00 179.01 180.17 2kp1 h LEU 50 N 0.39 0.95 -0.94 1.64 5.85 -1.36 0.77 115.31 122.61 2kp1 h LEU 50 Ca -0.08 -0.60 0.02 0.00 0.84 0.00 0.00 57.88 58.06 2kp1 h LEU 50 Cb 1.53 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 2kp1 h LEU 50 CO 0.17 1.39 0.62 1.23 -0.34 0.00 0.00 178.44 181.51 2kp1 h GLY 51 N 0.57 1.34 0.82 3.75 0.00 -0.94 0.51 103.07 109.12 2kp1 h GLY 51 Ca -0.03 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 2kp1 h GLY 51 CO 0.15 0.46 -0.14 0.00 0.00 0.00 0.00 176.54 177.01 2kp1 h ALA 52 N 1.36 -0.39 -0.98 3.60 0.00 -0.11 0.17 119.26 122.90 2kp1 h ALA 52 Ca 0.36 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.29 2kp1 h ALA 52 Cb -0.10 0.15 -0.09 0.00 0.00 0.00 0.00 17.79 17.74 2kp1 h ALA 52 CO -0.09 -0.63 0.61 -0.07 0.00 0.00 0.00 179.25 179.08 2kp1 h LEU 53 N -0.58 0.76 0.00 0.00 3.38 0.20 0.26 115.31 119.34 2kp1 h LEU 53 Ca -0.04 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2kp1 h LEU 53 Cb 0.42 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2kp1 h LEU 53 CO 0.07 0.32 -0.02 1.88 0.09 0.00 0.00 178.44 180.78 2kp1 h TYR 54 N 0.77 0.01 0.00 1.13 -1.99 0.09 -1.69 116.97 115.29 2kp1 h TYR 54 Ca 0.54 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.26 2kp1 h TYR 54 Cb 0.82 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.55 2kp1 h TYR 54 CO -0.00 0.90 0.00 0.00 -0.00 0.00 0.00 178.16 179.05 2kp1 n ALA 55 N -2.55 2.35 0.00 3.88 0.00 0.57 -0.48 120.51 124.28 2kp1 n ALA 55 Ca -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2kp1 n ALA 55 Cb 0.44 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2kp1 n ALA 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2kp1 n LYS 56 N -0.65 0.00 -0.56 0.00 4.01 0.82 -4.82 118.16 116.95 2kp1 n LYS 56 Ca 0.06 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.86 2kp1 n LYS 56 Cb 0.03 -0.79 0.00 0.00 -0.51 0.00 0.00 35.03 33.76 2kp1 n LYS 56 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2kp1 n SER 57 N -2.68 0.00 -0.95 4.39 2.88 -0.64 -4.91 113.62 111.72 2kp1 n SER 57 Ca 0.00 -0.96 0.00 0.00 -1.33 0.00 0.00 58.87 56.58 2kp1 n SER 57 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2kp1 n SER 57 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2kp1 n GLU 58 N -0.96 0.84 0.00 -1.46 -0.58 -1.26 -1.80 120.64 115.42 2kp1 n GLU 58 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2kp1 n GLU 58 Cb 0.00 -1.12 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 2kp1 n GLU 58 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2kp1 n PHE 59 N 0.53 0.00 0.30 -0.32 3.72 -1.24 -4.76 117.46 115.68 2kp1 n PHE 59 Ca 0.00 -0.18 0.15 0.00 -0.05 0.00 0.00 57.45 57.36 2kp1 n PHE 59 Cb 0.40 -0.02 0.68 0.00 -0.94 0.00 0.00 39.48 39.60 2kp1 n PHE 59 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2kp1 h LYS 60 N 0.00 0.00 -0.01 -1.08 2.10 0.03 0.28 116.57 117.88 2kp1 h LYS 60 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2kp1 h LYS 60 Cb 0.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.60 2kp1 h LYS 60 CO 0.00 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.20 2kp1 n ASP 61 N -2.55 1.57 -0.10 7.07 8.00 -1.26 -4.71 116.55 124.57 2kp1 n ASP 61 Ca -0.00 -1.53 -0.23 0.00 0.71 0.00 0.00 54.79 53.74 2kp1 n ASP 61 Cb 0.16 -0.01 -0.12 0.00 -0.02 0.00 0.00 41.12 41.14 2kp1 n ASP 61 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2kp1 n ARG 62 N -0.20 0.63 -4.19 -1.24 0.63 0.79 -4.64 116.66 108.45 2kp1 n ARG 62 Ca 0.01 0.32 -0.16 0.00 -0.92 0.00 0.00 57.85 57.09 2kp1 n ARG 62 Cb 0.14 -1.61 -0.14 0.00 0.45 0.00 0.00 32.46 31.31 2kp1 n ARG 62 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2kp1 s VAL 63 N -2.48 0.55 -0.19 5.15 1.01 -0.07 -1.00 120.40 123.36 2kp1 s VAL 63 Ca -0.32 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.14 2kp1 s VAL 63 Cb 0.09 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.98 2kp1 s VAL 63 CO 0.60 -0.00 -0.18 -0.69 0.00 0.00 0.00 175.10 174.83 2kp1 s VAL 64 N -0.51 2.19 -0.33 2.92 1.01 0.72 -4.49 120.40 121.92 2kp1 s VAL 64 Ca -0.01 -0.93 -0.24 0.00 0.00 0.00 0.00 61.98 60.81 2kp1 s VAL 64 Cb -0.05 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.39 2kp1 s VAL 64 CO 0.00 0.50 0.80 -0.63 0.00 0.00 0.00 175.10 175.77 2kp1 s ILE 65 N 1.30 4.76 0.21 2.22 -1.09 -1.26 -1.71 121.20 125.62 2kp1 s ILE 65 Ca 0.04 1.10 0.07 0.00 -2.23 0.00 0.00 60.65 59.64 2kp1 s ILE 65 Cb -0.13 -4.18 -0.05 0.00 -1.58 0.00 0.00 42.46 36.52 2kp1 s ILE 65 CO -0.12 -0.33 -0.12 0.00 -1.23 0.00 0.00 174.94 173.14 2kp1 s ALA 66 N 3.04 1.98 -0.10 9.38 0.00 0.11 -0.95 121.76 135.21 2kp1 s ALA 66 Ca 0.33 -1.67 -0.19 0.00 0.00 0.00 0.00 51.96 50.42 2kp1 s ALA 66 Cb -0.14 -0.02 0.05 0.00 0.00 0.00 0.00 23.12 23.01 2kp1 s ALA 66 CO 0.14 0.02 0.48 -1.59 0.00 0.00 0.00 175.76 174.81 2kp1 s LYS 67 N -3.67 0.71 -0.01 0.00 -2.85 -0.62 -1.46 119.74 111.84 2kp1 s LYS 67 Ca 0.23 0.33 0.06 0.00 -1.00 0.00 0.00 55.97 55.58 2kp1 s LYS 67 Cb 0.00 0.33 -0.02 0.00 -2.06 0.00 0.00 37.83 36.09 2kp1 s LYS 67 CO 0.07 -0.16 -0.19 0.54 0.10 0.00 0.00 175.35 175.71 2kp1 s VAL 68 N -0.53 1.51 -0.48 1.79 0.11 -0.53 -0.40 120.40 121.87 2kp1 s VAL 68 Ca -0.07 -0.87 -0.26 0.00 -2.93 0.00 0.00 61.98 57.86 2kp1 s VAL 68 Cb -0.03 -1.27 0.03 0.00 -1.53 0.00 0.00 36.38 33.58 2kp1 s VAL 68 CO 0.04 0.39 0.96 -0.62 -3.33 0.00 0.00 175.10 172.53 2kp1 s ASP 69 N -0.56 6.48 0.07 3.54 -1.08 -1.26 -1.25 116.67 122.61 2kp1 s ASP 69 Ca 0.07 0.07 0.21 0.00 -0.52 0.00 0.00 52.55 52.38 2kp1 s ASP 69 Cb -0.08 -2.46 0.86 0.00 -1.46 0.00 0.00 42.92 39.78 2kp1 s ASP 69 CO -0.00 -1.12 1.66 0.00 0.52 0.00 0.00 175.17 176.23 2kp1 n ALA 70 N 7.33 1.89 0.08 3.66 0.00 0.18 -0.55 120.51 133.10 2kp1 n ALA 70 Ca 0.06 -0.03 0.05 0.00 0.00 0.00 0.00 53.44 53.51 2kp1 n ALA 70 Cb 0.48 -1.34 -0.07 0.00 0.00 0.00 0.00 19.45 18.52 2kp1 n ALA 70 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2kp1 n THR 71 N -1.71 0.00 -0.07 0.00 5.66 -1.25 -3.52 114.28 113.38 2kp1 n THR 71 Ca 0.04 -0.23 -0.10 0.00 -3.05 0.00 0.00 64.05 60.72 2kp1 n THR 71 Cb 0.25 0.42 -0.15 0.00 -1.55 0.00 0.00 70.33 69.30 2kp1 n THR 71 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2kp1 n ALA 72 N -1.71 1.49 -3.63 1.79 0.00 -1.16 -4.58 120.51 112.72 2kp1 n ALA 72 Ca -0.01 -1.13 -0.28 0.00 0.00 0.00 0.00 53.44 52.02 2kp1 n ALA 72 Cb 0.23 -0.41 -0.12 0.00 0.00 0.00 0.00 19.45 19.15 2kp1 n ALA 72 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2kp1 s ASN 73 N -5.74 3.08 0.18 0.00 0.01 0.28 -5.05 114.94 107.70 2kp1 s ASN 73 Ca -0.09 -3.12 -0.31 0.00 -0.71 0.00 0.00 52.86 48.63 2kp1 s ASN 73 Cb 0.07 -0.93 -0.10 0.00 0.41 0.00 0.00 41.25 40.70 2kp1 s ASN 73 CO 0.82 -0.18 1.48 1.51 -1.51 0.00 0.00 177.10 179.23 2kp1 s ASP 74 N -0.24 6.67 0.26 -1.22 -4.77 -1.23 -4.06 116.67 112.08 2kp1 s ASP 74 Ca 0.26 2.56 0.00 0.00 -3.30 0.00 0.00 52.55 52.06 2kp1 s ASP 74 Cb -0.08 -2.60 -0.04 0.00 -1.09 0.00 0.00 42.92 39.11 2kp1 s ASP 74 CO -0.12 -0.74 0.45 0.68 0.70 0.00 0.00 175.17 176.13 2kp1 s VAL 75 N 0.79 5.17 -1.26 2.11 -7.23 -1.26 -4.90 120.40 113.81 2kp1 s VAL 75 Ca 0.65 -0.44 0.29 0.00 -1.81 0.00 0.00 61.98 60.67 2kp1 s VAL 75 Cb -0.41 -3.79 0.33 0.00 0.56 0.00 0.00 36.38 33.07 2kp1 s VAL 75 CO 0.34 -0.32 1.88 -0.81 -0.31 0.00 0.00 175.10 175.88 2kp1 n PRO 76 N -1.11 0.27 -1.80 4.82 -0.04 -1.26 -4.90 135.00 130.98 2kp1 n PRO 76 Ca -0.05 -0.05 -0.34 0.00 -0.04 0.00 0.00 63.50 63.02 2kp1 n PRO 76 Cb 0.55 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.56 2kp1 n PRO 76 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2kp1 s ASP 77 N -2.77 5.01 -0.18 3.54 -1.08 -1.26 -4.99 116.67 114.94 2kp1 s ASP 77 Ca 0.21 2.17 -0.16 0.00 -0.52 0.00 0.00 52.55 54.24 2kp1 s ASP 77 Cb 0.19 -2.57 -0.04 0.00 -1.46 0.00 0.00 42.92 39.04 2kp1 s ASP 77 CO 0.52 -1.70 0.41 -0.70 0.52 0.00 0.00 175.17 174.22 2kp1 s GLU 78 N -3.81 4.22 -0.09 4.34 2.12 -1.26 -5.06 118.70 119.17 2kp1 s GLU 78 Ca 0.71 0.25 0.03 0.00 0.36 0.00 0.00 54.97 56.32 2kp1 s GLU 78 Cb -0.24 -3.50 0.01 0.00 0.26 0.00 0.00 34.13 30.65 2kp1 s GLU 78 CO 0.39 0.03 -0.17 0.42 -0.54 0.00 0.00 175.26 175.39 2kp1 s ILE 79 N 1.07 1.58 -0.02 -3.70 1.01 -1.26 -5.01 121.20 114.88 2kp1 s ILE 79 Ca 0.20 -0.73 0.11 0.00 0.00 0.00 0.00 60.65 60.24 2kp1 s ILE 79 Cb -0.15 -1.41 -0.09 0.00 0.01 0.00 0.00 42.46 40.82 2kp1 s ILE 79 CO 0.08 0.45 1.29 0.06 0.00 0.00 0.00 174.94 176.83 2kp1 h GLN 80 N 6.99 0.00 0.00 2.79 -0.00 -1.97 -3.45 115.11 119.47 2kp1 h GLN 80 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.38 2kp1 h GLN 80 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.68 2kp1 h GLN 80 CO 0.48 0.73 0.00 0.41 -0.00 0.00 0.00 178.83 180.45 2kp1 n GLY 81 N 1.31 1.25 1.67 0.06 0.00 -1.26 -5.11 105.19 103.12 2kp1 n GLY 81 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kp1 n GLY 81 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2kp1 n PHE 82 N 0.00 -1.44 -3.24 1.61 7.35 -1.26 -5.06 117.46 115.42 2kp1 n PHE 82 Ca 0.00 0.25 -0.33 0.00 -0.76 0.00 0.00 57.45 56.62 2kp1 n PHE 82 Cb 0.00 0.38 -0.06 0.00 0.35 0.00 0.00 39.48 40.16 2kp1 n PHE 82 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2kp1 s PRO 83 N -2.00 3.95 -0.08 -7.13 0.05 -1.26 -4.78 135.00 123.75 2kp1 s PRO 83 Ca 0.00 0.54 -0.31 0.00 0.05 0.00 0.00 61.00 61.29 2kp1 s PRO 83 Cb 0.00 -2.56 0.09 0.00 0.05 0.00 0.00 34.50 32.08 2kp1 s PRO 83 CO 0.00 0.24 0.77 0.99 0.05 0.00 0.00 177.00 179.05 2kp1 s THR 84 N -1.87 0.00 -0.08 1.26 2.01 -0.98 -4.94 115.64 111.04 2kp1 s THR 84 Ca 0.50 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.50 2kp1 s THR 84 Cb -0.11 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.37 2kp1 s THR 84 CO 0.19 0.00 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.42 2kp1 s ILE 85 N -1.17 3.71 -0.04 1.82 1.01 0.12 0.12 121.20 126.78 2kp1 s ILE 85 Ca -0.08 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.10 2kp1 s ILE 85 Cb -0.00 -2.53 0.03 0.00 0.01 0.00 0.00 42.46 39.96 2kp1 s ILE 85 CO 0.08 0.58 -0.00 -0.54 0.00 0.00 0.00 174.94 175.05 2kp1 s LYS 86 N -0.58 0.38 -0.34 2.79 1.02 0.15 0.39 119.74 123.56 2kp1 s LYS 86 Ca 0.09 0.07 -0.12 0.00 0.02 0.00 0.00 55.97 56.03 2kp1 s LYS 86 Cb -0.12 -0.58 -0.01 0.00 -0.52 0.00 0.00 37.83 36.60 2kp1 s LYS 86 CO 0.02 -0.15 0.22 -1.17 -0.92 0.00 0.00 175.35 173.34 2kp1 s LEU 87 N 1.15 4.44 -0.63 3.17 1.98 -0.86 -0.05 118.68 127.87 2kp1 s LEU 87 Ca -0.08 -0.49 -0.16 0.00 -2.89 0.00 0.00 54.13 50.51 2kp1 s LEU 87 Cb -0.13 -2.10 0.14 0.00 0.66 0.00 0.00 46.19 44.76 2kp1 s LEU 87 CO -0.02 -0.24 0.62 -0.31 -1.89 0.00 0.00 176.35 174.51 2kp1 s TYR 88 N 1.69 3.31 0.77 5.38 1.51 0.87 -1.75 117.35 129.13 2kp1 s TYR 88 Ca 0.05 -1.39 -0.12 0.00 -1.01 0.00 0.00 57.07 54.61 2kp1 s TYR 88 Cb -0.17 -3.86 0.06 0.00 -0.11 0.00 0.00 41.96 37.88 2kp1 s TYR 88 CO 0.09 -1.08 1.12 -1.25 -1.11 0.00 0.00 175.55 173.33 2kp1 s PRO 89 N 1.52 2.08 -1.31 -1.71 0.04 -1.26 -0.47 135.00 133.89 2kp1 s PRO 89 Ca 0.09 1.39 -0.16 0.00 0.04 0.00 0.00 61.00 62.35 2kp1 s PRO 89 Cb -0.24 -1.86 0.09 0.00 0.04 0.00 0.00 34.50 32.53 2kp1 s PRO 89 CO 0.01 -1.81 1.78 0.00 0.04 0.00 0.00 177.00 177.02 2kp1 n ALA 90 N -3.33 4.01 0.00 8.56 0.00 -1.25 -2.70 120.51 125.80 2kp1 n ALA 90 Ca 0.11 -3.94 0.00 0.00 0.00 0.00 0.00 53.44 49.61 2kp1 n ALA 90 Cb 0.52 -3.48 0.00 0.00 0.00 0.00 0.00 19.45 16.49 2kp1 n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kp1 n GLY 91 N 4.86 0.22 2.25 0.00 0.00 -1.26 -4.71 105.19 106.55 2kp1 n GLY 91 Ca 0.47 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.30 2kp1 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kp1 n ALA 92 N 0.00 2.26 1.78 4.61 0.00 -1.10 -4.91 120.51 123.15 2kp1 n ALA 92 Ca 0.00 -3.51 0.07 0.00 0.00 0.00 0.00 53.44 50.00 2kp1 n ALA 92 Cb 0.00 -0.90 0.40 0.00 0.00 0.00 0.00 19.45 18.95 2kp1 n ALA 92 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2kp1 n LYS 93 N 0.36 0.89 -0.00 0.00 2.85 -1.23 -2.76 118.16 118.27 2kp1 n LYS 93 Ca 0.25 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.58 2kp1 n LYS 93 Cb 0.62 -1.24 -0.09 0.00 -0.65 0.00 0.00 35.03 33.68 2kp1 n LYS 93 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2kp1 n GLY 94 N 0.57 -0.40 2.56 2.58 0.00 -1.26 -4.46 105.19 104.78 2kp1 n GLY 94 Ca 0.10 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.57 2kp1 n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kp1 n GLN 95 N -1.46 2.28 -1.39 1.61 10.64 -1.11 -5.12 117.38 122.84 2kp1 n GLN 95 Ca 0.02 -3.83 -0.38 0.00 -1.83 0.00 0.00 57.00 50.97 2kp1 n GLN 95 Cb 0.25 -1.75 0.03 0.00 -0.86 0.00 0.00 30.24 27.91 2kp1 n GLN 95 CO 0.00 0.00 0.00 -2.30 -1.83 0.00 0.00 177.06 172.93 2kp1 n PRO 96 N -0.33 0.34 -3.08 2.61 -0.02 -1.25 -4.85 135.00 128.44 2kp1 n PRO 96 Ca 0.23 0.14 -0.45 0.00 -2.02 0.00 0.00 63.50 61.40 2kp1 n PRO 96 Cb 0.77 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.71 2kp1 n PRO 96 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2kp1 s VAL 97 N -1.81 4.79 -0.08 -1.45 1.01 -0.72 -4.78 120.40 117.35 2kp1 s VAL 97 Ca 0.65 -1.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 2kp1 s VAL 97 Cb -0.45 -4.53 -0.03 0.00 0.00 0.00 0.00 36.38 31.36 2kp1 s VAL 97 CO 0.58 -1.19 1.29 0.28 0.00 0.00 0.00 175.10 176.06 2kp1 s THR 98 N 2.75 4.12 0.07 3.92 -1.32 -1.26 -2.03 115.64 121.89 2kp1 s THR 98 Ca 0.14 1.42 -0.00 0.00 -1.21 0.00 0.00 61.69 62.04 2kp1 s THR 98 Cb -0.21 -3.91 -0.04 0.00 -1.51 0.00 0.00 72.50 66.82 2kp1 s THR 98 CO 0.05 -0.05 -0.04 -0.47 -2.21 0.00 0.00 174.62 171.89 2kp1 s TYR 99 N 2.83 0.65 -0.14 9.09 6.14 0.16 -4.98 117.35 131.12 2kp1 s TYR 99 Ca 0.58 -1.01 -0.09 0.00 0.64 0.00 0.00 57.07 57.19 2kp1 s TYR 99 Cb -0.25 -0.44 -0.05 0.00 0.42 0.00 0.00 41.96 41.64 2kp1 s TYR 99 CO 0.21 -0.30 -0.07 0.66 0.64 0.00 0.00 175.55 176.69 2kp1 h SER 100 N 3.08 0.00 0.00 4.32 4.64 -1.94 0.38 113.55 124.04 2kp1 h SER 100 Ca -0.34 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2kp1 h SER 100 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2kp1 h SER 100 CO 0.66 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 178.00 2kp1 n GLY 101 N 1.64 2.16 0.65 -0.77 0.00 -1.26 -4.47 105.19 103.14 2kp1 n GLY 101 Ca -0.08 -1.19 -0.00 0.00 0.00 0.00 0.00 46.02 44.75 2kp1 n GLY 101 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kp1 n SER 102 N 0.00 1.56 -1.76 1.61 7.64 -1.26 -4.81 113.62 116.60 2kp1 n SER 102 Ca 0.00 -2.03 -0.20 0.00 1.01 0.00 0.00 58.87 57.65 2kp1 n SER 102 Cb 0.00 -0.51 -0.07 0.00 -1.01 0.00 0.00 64.21 62.62 2kp1 n SER 102 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2kp1 n ARG 103 N 0.12 -1.50 -4.12 1.43 1.74 -1.26 -4.95 116.66 108.11 2kp1 n ARG 103 Ca 0.01 1.16 -0.09 0.00 -0.77 0.00 0.00 57.85 58.16 2kp1 n ARG 103 Cb 0.33 -5.60 -0.10 0.00 -1.02 0.00 0.00 32.46 26.08 2kp1 n ARG 103 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2kp1 s THR 104 N -2.79 0.47 0.15 0.55 -1.32 -1.26 -4.86 115.64 106.57 2kp1 s THR 104 Ca 0.00 -1.80 0.09 0.00 -1.21 0.00 0.00 61.69 58.77 2kp1 s THR 104 Cb 0.00 -1.51 -0.11 0.00 -1.51 0.00 0.00 72.50 69.37 2kp1 s THR 104 CO 0.00 -0.89 1.42 0.58 -2.21 0.00 0.00 174.62 173.52 2kp1 h VAL 105 N 3.18 1.52 -0.45 5.08 2.07 -1.92 -3.22 116.25 122.51 2kp1 h VAL 105 Ca -0.35 -2.83 0.02 0.00 0.82 0.00 0.00 66.70 64.36 2kp1 h VAL 105 Cb 1.16 2.55 -0.03 0.00 -1.52 0.00 0.00 31.29 33.45 2kp1 h VAL 105 CO 0.63 0.79 0.28 -0.33 0.02 0.00 0.00 177.57 178.96 2kp1 h GLU 106 N 0.00 0.55 -0.52 1.57 5.08 -1.98 0.14 114.58 119.41 2kp1 h GLU 106 Ca -0.01 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2kp1 h GLU 106 Cb 1.48 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.58 2kp1 h GLU 106 CO 0.11 0.36 0.22 0.22 -1.00 0.00 0.00 179.01 178.92 2kp1 h ASP 107 N 0.56 0.67 -0.03 1.42 3.58 -1.95 -1.72 116.42 118.96 2kp1 h ASP 107 Ca 0.18 -0.07 -0.17 0.00 0.42 0.00 0.00 57.03 57.39 2kp1 h ASP 107 Cb -0.01 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 40.88 2kp1 h ASP 107 CO -0.07 0.60 -0.63 -0.07 -2.88 0.00 0.00 179.24 176.20 2kp1 h LEU 108 N 0.74 0.60 -0.09 2.28 3.38 -1.14 -0.47 115.31 120.62 2kp1 h LEU 108 Ca 0.18 -0.72 0.04 0.00 0.09 0.00 0.00 57.88 57.46 2kp1 h LEU 108 Cb 0.13 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2kp1 h LEU 108 CO -0.02 1.24 -0.15 0.40 0.09 0.00 0.00 178.44 180.00 2kp1 h ILE 109 N 0.02 0.60 0.00 1.22 2.04 -0.45 -1.28 117.51 119.67 2kp1 h ILE 109 Ca -0.07 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 2kp1 h ILE 109 Cb 1.31 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2kp1 h ILE 109 CO 0.12 0.00 -0.09 0.11 0.00 0.00 0.00 178.15 178.30 2kp1 h LYS 110 N -0.21 0.00 0.40 2.37 1.79 -1.30 0.43 116.57 120.05 2kp1 h LYS 110 Ca 0.08 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.53 2kp1 h LYS 110 Cb 0.32 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 2kp1 h LYS 110 CO -0.21 0.09 -0.19 0.35 -1.08 0.00 0.00 179.45 178.40 2kp1 h PHE 111 N 0.00 -0.50 0.00 -1.35 3.04 0.02 0.31 116.94 118.46 2kp1 h PHE 111 Ca -0.00 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.94 2kp1 h PHE 111 Cb 0.37 0.17 0.00 0.00 2.56 0.00 0.00 35.95 39.04 2kp1 h PHE 111 CO 0.00 -0.31 0.00 -0.89 -2.02 0.00 0.00 178.31 175.09 2kp1 n ILE 112 N -4.10 0.70 -0.04 1.41 5.41 -0.69 -0.25 119.36 121.80 2kp1 n ILE 112 Ca -0.07 0.18 -0.07 0.00 1.00 0.00 0.00 62.75 63.79 2kp1 n ILE 112 Cb 0.21 -0.88 -0.14 0.00 -0.71 0.00 0.00 39.64 38.12 2kp1 n ILE 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2kp1 n ALA 113 N -1.43 1.61 -0.13 -1.39 0.00 0.11 -1.29 120.51 118.00 2kp1 n ALA 113 Ca 0.06 -0.91 -0.23 0.00 0.00 0.00 0.00 53.44 52.36 2kp1 n ALA 113 Cb 0.18 -0.64 -0.11 0.00 0.00 0.00 0.00 19.45 18.88 2kp1 n ALA 113 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2kp1 n GLU 114 N -2.89 0.63 0.01 0.00 -0.58 0.08 -4.44 120.64 113.45 2kp1 n GLU 114 Ca -0.21 0.21 -0.08 0.00 -0.42 0.00 0.00 57.16 56.67 2kp1 n GLU 114 Cb 1.04 -1.53 -0.13 0.00 -0.57 0.00 0.00 31.44 30.25 2kp1 n GLU 114 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 2kp1 h ASN 115 N -0.39 0.00 -4.22 1.62 2.35 -0.77 -3.45 115.58 110.71 2kp1 h ASN 115 Ca -0.61 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 54.64 2kp1 h ASN 115 Cb 1.79 0.00 0.07 0.00 0.05 0.00 0.00 38.32 40.23 2kp1 h ASN 115 CO -0.21 0.99 0.37 -0.83 -1.65 0.00 0.00 177.43 176.11 2kp1 s GLY 116 N -4.93 2.03 0.03 2.83 0.00 -0.41 -4.74 107.32 102.13 2kp1 s GLY 116 Ca -0.02 0.34 0.20 0.00 0.00 0.00 0.00 44.72 45.24 2kp1 s GLY 116 CO 0.82 0.66 0.65 0.28 0.00 0.00 0.00 173.10 175.51 2kp1 n LYS 117 N -2.27 0.64 0.00 2.90 4.76 -1.26 -3.30 118.16 119.63 2kp1 n LYS 117 Ca 0.09 0.03 0.14 0.00 -2.87 0.00 0.00 58.31 55.69 2kp1 n LYS 117 Cb 0.53 -1.68 0.55 0.00 -1.84 0.00 0.00 35.03 32.59 2kp1 n LYS 117 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2kp1 n TYR 118 N -2.61 0.00 -3.76 2.13 4.01 -1.26 -4.93 117.16 110.74 2kp1 n TYR 118 Ca -0.09 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.41 2kp1 n TYR 118 Cb 0.73 -0.43 0.02 0.00 -0.31 0.00 0.00 39.34 39.35 2kp1 n TYR 118 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2kp1 n LYS 119 N -1.48 -3.76 -2.31 -0.72 4.76 -1.21 -4.80 118.16 108.64 2kp1 n LYS 119 Ca 0.07 0.54 -0.34 0.00 -2.87 0.00 0.00 58.31 55.71 2kp1 n LYS 119 Cb 0.33 -4.84 -0.04 0.00 -1.84 0.00 0.00 35.03 28.64 2kp1 n LYS 119 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kp1 s ALA 120 N -3.72 2.22 0.00 7.82 0.00 -1.12 -4.78 121.76 122.18 2kp1 s ALA 120 Ca 0.09 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.19 2kp1 s ALA 120 Cb -0.03 -4.53 0.00 0.00 0.00 0.00 0.00 23.12 18.56 2kp1 s ALA 120 CO 0.84 -4.17 0.14 0.00 0.00 0.00 0.00 175.76 172.57