#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kc0 n GLY 15 N 0.00 -0.12 0.27 0.00 0.00 -1.26 -2.93 105.19 101.16 2kc0 n GLY 15 Ca 0.00 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.03 2kc0 n GLY 15 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2kc0 h LEU 16 N 0.00 0.40 -0.31 0.99 3.38 -1.96 -1.23 115.31 116.58 2kc0 h LEU 16 Ca 0.00 0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 2kc0 h LEU 16 Cb 0.00 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2kc0 h LEU 16 CO 0.00 0.20 -0.14 0.00 0.09 0.00 0.00 178.44 178.59 2kc0 h ALA 17 N 1.48 0.44 -0.41 1.53 0.00 -1.70 -3.06 119.26 117.54 2kc0 h ALA 17 Ca 0.38 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2kc0 h ALA 17 Cb 0.48 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2kc0 h ALA 17 CO -0.32 0.33 -0.24 0.22 0.00 0.00 0.00 179.25 179.24 2kc0 h ASP 18 N 0.41 0.91 0.50 0.00 3.58 -1.73 -2.54 116.42 117.55 2kc0 h ASP 18 Ca 0.07 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 57.10 2kc0 h ASP 18 Cb 0.67 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.47 2kc0 h ASP 18 CO 0.04 1.13 0.00 0.00 -2.88 0.00 0.00 179.24 177.54 2kc0 n ALA 19 N -2.50 1.63 -0.03 -0.78 0.00 -0.49 -1.76 120.51 116.58 2kc0 n ALA 19 Ca -0.01 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.45 2kc0 n ALA 19 Cb 0.46 -1.24 -0.16 0.00 0.00 0.00 0.00 19.45 18.51 2kc0 n ALA 19 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kc0 n LEU 20 N -1.59 0.00 -0.01 0.00 7.99 -0.99 -4.46 117.00 117.94 2kc0 n LEU 20 Ca 0.03 0.00 -0.09 0.00 -0.01 0.00 0.00 56.01 55.94 2kc0 n LEU 20 Cb 0.17 0.12 -0.14 0.00 -0.11 0.00 0.00 43.42 43.46 2kc0 n LEU 20 CO 0.14 0.12 -0.48 0.71 -1.51 0.00 0.00 177.39 176.36 2kc0 h THR 21 N 0.00 0.90 -3.79 -5.08 1.35 -1.28 -3.46 112.91 101.55 2kc0 h THR 21 Ca -0.13 -2.74 -0.09 0.00 -0.55 0.00 0.00 66.41 62.90 2kc0 h THR 21 Cb 1.27 2.45 -0.14 0.00 -1.73 0.00 0.00 68.15 70.01 2kc0 h THR 21 CO 0.01 0.53 -0.33 0.00 -0.25 0.00 0.00 175.52 175.47 2kc0 s ALA 22 N -2.60 -0.23 0.67 6.62 0.00 -0.72 -5.12 121.76 120.37 2kc0 s ALA 22 Ca -0.05 -0.63 -0.11 0.00 0.00 0.00 0.00 51.96 51.17 2kc0 s ALA 22 Cb 0.08 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.78 2kc0 s ALA 22 CO 0.82 -0.55 1.07 -1.25 0.00 0.00 0.00 175.76 175.85 2kc0 s PRO 23 N -3.88 3.15 -0.07 0.00 0.04 -1.26 -3.89 135.00 129.09 2kc0 s PRO 23 Ca 0.08 0.61 -0.16 0.00 0.04 0.00 0.00 61.00 61.57 2kc0 s PRO 23 Cb 0.04 -2.04 -0.29 0.00 0.04 0.00 0.00 34.50 32.25 2kc0 s PRO 23 CO -0.09 -0.86 0.68 -0.07 0.04 0.00 0.00 177.00 176.70 2kc0 h LEU 24 N -0.53 0.49 -6.82 -3.56 4.07 -1.92 -3.46 115.31 103.59 2kc0 h LEU 24 Ca -0.45 -0.90 -0.37 0.00 0.08 0.00 0.00 57.88 56.25 2kc0 h LEU 24 Cb 1.23 -0.16 -0.37 0.00 1.08 0.00 0.00 40.66 42.43 2kc0 h LEU 24 CO 0.63 1.63 -0.67 -1.81 -1.08 0.00 0.00 178.44 177.14 2kc0 s ASP 25 N -7.13 1.77 -0.30 -0.43 1.01 -1.26 -4.97 116.67 105.36 2kc0 s ASP 25 Ca -0.17 -0.43 -0.29 0.00 0.71 0.00 0.00 52.55 52.37 2kc0 s ASP 25 Cb 0.04 0.20 0.01 0.00 1.01 0.00 0.00 42.92 44.18 2kc0 s ASP 25 CO 0.81 -0.35 1.22 -1.00 0.21 0.00 0.00 175.17 176.07 2kc0 s HIS 26 N 2.27 2.85 0.00 4.23 3.76 -1.26 -4.59 115.29 122.54 2kc0 s HIS 26 Ca 0.06 0.98 0.00 0.00 -0.15 0.00 0.00 55.06 55.95 2kc0 s HIS 26 Cb -0.16 -3.81 0.00 0.00 1.11 0.00 0.00 32.58 29.72 2kc0 s HIS 26 CO -0.15 -1.41 0.00 1.17 -0.85 0.00 0.00 174.74 173.50 2kc0 n LYS 27 N 7.12 0.00 0.26 1.40 0.00 -1.26 -4.90 118.16 120.78 2kc0 n LYS 27 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 58.31 58.34 2kc0 n LYS 27 Cb 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.45 2kc0 n LYS 27 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2kc0 h ASP 28 N 0.10 -0.59 0.00 3.14 3.58 -1.96 -3.47 116.42 117.22 2kc0 h ASP 28 Ca 0.00 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2kc0 h ASP 28 Cb 0.00 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.20 2kc0 h ASP 28 CO 0.00 -0.28 0.00 2.29 -2.88 0.00 0.00 179.24 178.37 2kc0 n LYS 29 N -4.65 0.00 0.00 0.28 2.85 -1.26 -5.16 118.16 110.22 2kc0 n LYS 29 Ca -0.09 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.17 2kc0 n LYS 29 Cb 0.27 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.65 2kc0 n LYS 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2kc0 n GLY 30 N -0.30 5.47 3.75 2.58 0.00 -1.26 -5.14 105.19 110.29 2kc0 n GLY 30 Ca 0.00 -1.22 -0.40 0.00 0.00 0.00 0.00 46.02 44.40 2kc0 n GLY 30 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kc0 s LEU 31 N 0.00 4.55 0.00 0.99 0.20 -1.26 -4.97 118.68 118.20 2kc0 s LEU 31 Ca 0.00 2.08 0.00 0.00 0.69 0.00 0.00 54.13 56.90 2kc0 s LEU 31 Cb 0.00 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 42.15 2kc0 s LEU 31 CO 0.00 -0.07 0.00 0.00 -0.29 0.00 0.00 176.35 175.99 2kc0 n GLN 32 N 1.80 3.10 -3.89 1.98 1.13 -1.26 -4.73 117.38 115.51 2kc0 n GLN 32 Ca 0.00 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.97 2kc0 n GLN 32 Cb 0.46 -0.74 -0.06 0.00 0.11 0.00 0.00 30.24 30.01 2kc0 n GLN 32 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2kc0 s SER 33 N -0.98 -0.04 -0.31 1.08 1.04 -1.26 -1.17 113.70 112.07 2kc0 s SER 33 Ca 0.00 -0.74 -0.18 0.00 0.48 0.00 0.00 55.95 55.51 2kc0 s SER 33 Cb 0.00 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.57 2kc0 s SER 33 CO 0.00 -0.92 0.54 -0.22 0.98 0.00 0.00 173.24 173.62 2kc0 s LEU 34 N -2.93 4.18 0.08 2.42 1.98 0.32 -4.88 118.68 119.84 2kc0 s LEU 34 Ca 0.14 0.29 -0.31 0.00 -2.89 0.00 0.00 54.13 51.36 2kc0 s LEU 34 Cb 0.02 -2.67 -0.08 0.00 0.66 0.00 0.00 46.19 44.12 2kc0 s LEU 34 CO -0.02 -0.41 1.58 -0.89 -1.89 0.00 0.00 176.35 174.73 2kc0 s THR 35 N 2.42 3.08 -0.71 3.68 2.01 -1.26 -2.11 115.64 122.75 2kc0 s THR 35 Ca 0.21 0.60 -0.06 0.00 0.31 0.00 0.00 61.69 62.75 2kc0 s THR 35 Cb -0.15 -3.39 0.18 0.00 0.01 0.00 0.00 72.50 69.16 2kc0 s THR 35 CO 0.11 0.01 0.56 -0.76 -0.69 0.00 0.00 174.62 173.86 2kc0 s LEU 36 N 2.24 5.66 -0.07 4.42 1.02 -0.59 -4.87 118.68 126.49 2kc0 s LEU 36 Ca 0.71 -2.92 -0.09 0.00 0.02 0.00 0.00 54.13 51.86 2kc0 s LEU 36 Cb -0.39 -1.95 -0.04 0.00 0.02 0.00 0.00 46.19 43.83 2kc0 s LEU 36 CO 0.31 -0.40 -0.18 -0.67 0.02 0.00 0.00 176.35 175.43 2kc0 n ASP 37 N 3.47 1.37 0.10 2.29 2.03 -1.26 -3.08 116.55 121.48 2kc0 n ASP 37 Ca 0.11 0.22 0.06 0.00 0.52 0.00 0.00 54.79 55.70 2kc0 n ASP 37 Cb 0.40 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.30 2kc0 n ASP 37 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2kc0 h GLN 38 N -0.51 0.00 -0.56 -0.67 7.50 -2.02 -3.40 115.11 115.45 2kc0 h GLN 38 Ca -0.11 0.00 0.10 0.00 0.50 0.00 0.00 58.65 59.14 2kc0 h GLN 38 Cb 0.76 0.00 -0.11 0.00 0.05 0.00 0.00 27.48 28.18 2kc0 h GLN 38 CO -0.07 0.19 -0.29 0.66 -1.50 0.00 0.00 178.83 177.81 2kc0 h SER 39 N 0.00 -1.01 -4.85 1.46 4.64 -1.91 -3.44 113.55 108.44 2kc0 h SER 39 Ca -0.05 0.21 -0.19 0.00 -0.47 0.00 0.00 61.79 61.29 2kc0 h SER 39 Cb 1.26 0.52 -0.15 0.00 -0.31 0.00 0.00 62.40 63.72 2kc0 h SER 39 CO 0.03 -0.29 -0.69 0.54 -0.87 0.00 0.00 176.83 175.55 2kc0 s VAL 40 N -6.05 0.51 0.90 0.95 0.11 -1.26 -5.18 120.40 110.37 2kc0 s VAL 40 Ca -0.14 -1.90 -0.13 0.00 -2.93 0.00 0.00 61.98 56.88 2kc0 s VAL 40 Cb 0.16 -1.67 0.20 0.00 -1.53 0.00 0.00 36.38 33.54 2kc0 s VAL 40 CO 0.70 -0.87 1.22 0.54 -3.33 0.00 0.00 175.10 173.36 2kc0 n ARG 41 N -0.01 -1.02 -0.20 1.54 5.12 -1.26 -4.79 116.66 116.04 2kc0 n ARG 41 Ca -0.12 -2.12 0.11 0.00 -1.93 0.00 0.00 57.85 53.79 2kc0 n ARG 41 Cb 0.61 -1.18 0.27 0.00 -1.16 0.00 0.00 32.46 31.00 2kc0 n ARG 41 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2kc0 n LYS 42 N -3.53 2.26 -0.02 5.56 5.02 -1.26 -2.47 118.16 123.72 2kc0 n LYS 42 Ca 0.16 -1.92 -0.02 0.00 -2.02 0.00 0.00 58.31 54.50 2kc0 n LYS 42 Cb 0.56 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 34.08 2kc0 n LYS 42 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2kc0 n ASN 43 N 1.10 3.91 -4.91 4.39 3.02 -1.26 -4.87 115.26 116.65 2kc0 n ASN 43 Ca 0.19 -0.01 -0.31 0.00 -0.03 0.00 0.00 54.58 54.42 2kc0 n ASN 43 Cb 0.50 0.37 -0.04 0.00 -0.61 0.00 0.00 39.78 39.99 2kc0 n ASN 43 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2kc0 s GLU 44 N -2.09 3.55 -0.10 3.52 8.01 -1.26 -4.94 118.70 125.39 2kc0 s GLU 44 Ca -0.03 -0.24 -0.09 0.00 0.01 0.00 0.00 54.97 54.62 2kc0 s GLU 44 Cb 0.01 -2.92 -0.04 0.00 -4.31 0.00 0.00 34.13 26.87 2kc0 s GLU 44 CO 0.14 0.51 0.20 0.21 0.01 0.00 0.00 175.26 176.33 2kc0 s LYS 45 N -2.65 3.56 -0.04 1.61 2.20 0.80 -4.29 119.74 120.93 2kc0 s LYS 45 Ca 0.39 -0.02 0.05 0.00 -0.36 0.00 0.00 55.97 56.03 2kc0 s LYS 45 Cb -0.12 -3.20 -0.01 0.00 -1.51 0.00 0.00 37.83 32.99 2kc0 s LYS 45 CO 0.26 0.75 -0.19 -1.17 -0.36 0.00 0.00 175.35 174.64 2kc0 s LEU 46 N -1.01 1.98 -0.18 5.43 0.20 -0.05 -0.48 118.68 124.57 2kc0 s LEU 46 Ca 0.17 -0.39 0.01 0.00 0.69 0.00 0.00 54.13 54.61 2kc0 s LEU 46 Cb -0.13 -1.06 0.02 0.00 -0.43 0.00 0.00 46.19 44.58 2kc0 s LEU 46 CO 0.06 0.20 -0.19 -0.54 -0.29 0.00 0.00 176.35 175.59 2kc0 s LYS 47 N -0.15 3.01 -0.07 1.98 1.02 -0.28 -1.23 119.74 124.02 2kc0 s LYS 47 Ca -0.00 -0.82 0.05 0.00 0.02 0.00 0.00 55.97 55.22 2kc0 s LYS 47 Cb -0.11 -2.60 -0.01 0.00 -0.52 0.00 0.00 37.83 34.60 2kc0 s LYS 47 CO 0.02 -0.21 -0.23 -1.17 -0.92 0.00 0.00 175.35 172.83 2kc0 s LEU 48 N 1.30 2.04 -0.07 3.17 1.98 -0.60 -0.96 118.68 125.55 2kc0 s LEU 48 Ca 0.05 -0.50 -0.20 0.00 -2.89 0.00 0.00 54.13 50.59 2kc0 s LEU 48 Cb -0.13 -1.31 0.04 0.00 0.66 0.00 0.00 46.19 45.45 2kc0 s LEU 48 CO -0.12 0.20 0.47 0.00 -1.89 0.00 0.00 176.35 175.01 2kc0 s ALA 49 N 0.02 -1.19 -0.13 5.97 0.00 -0.68 -0.37 121.76 125.38 2kc0 s ALA 49 Ca -0.08 0.88 -0.29 0.00 0.00 0.00 0.00 51.96 52.47 2kc0 s ALA 49 Cb -0.15 -0.15 0.08 0.00 0.00 0.00 0.00 23.12 22.90 2kc0 s ALA 49 CO 0.05 -0.29 0.76 0.00 0.00 0.00 0.00 175.76 176.28 2kc0 s ALA 50 N -0.91 -1.81 -1.51 0.00 0.00 -0.50 -1.36 121.76 115.67 2kc0 s ALA 50 Ca -0.10 1.55 -0.11 0.00 0.00 0.00 0.00 51.96 53.30 2kc0 s ALA 50 Cb -0.03 -0.45 0.07 0.00 0.00 0.00 0.00 23.12 22.71 2kc0 s ALA 50 CO 0.05 -0.35 0.89 0.94 0.00 0.00 0.00 175.76 177.30 2kc0 n GLN 51 N 1.35 -5.13 0.00 0.00 7.27 -1.26 -1.88 117.38 117.74 2kc0 n GLN 51 Ca -0.16 0.57 0.00 0.00 0.07 0.00 0.00 57.00 57.48 2kc0 n GLN 51 Cb 0.57 -5.36 0.00 0.00 2.41 0.00 0.00 30.24 27.86 2kc0 n GLN 51 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2kc0 n GLY 52 N -1.67 2.60 3.92 1.69 0.00 -1.26 -4.61 105.19 105.87 2kc0 n GLY 52 Ca -0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 2kc0 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kc0 s ALA 53 N -2.30 3.71 -0.17 4.61 0.00 -0.79 -5.12 121.76 121.71 2kc0 s ALA 53 Ca 0.00 -0.75 -0.20 0.00 0.00 0.00 0.00 51.96 51.01 2kc0 s ALA 53 Cb 0.00 -2.15 0.05 0.00 0.00 0.00 0.00 23.12 21.02 2kc0 s ALA 53 CO 0.00 0.22 0.55 -1.83 0.00 0.00 0.00 175.76 174.70 2kc0 s GLU 54 N -3.72 0.70 -0.03 0.00 -1.05 -1.26 -1.42 118.70 111.92 2kc0 s GLU 54 Ca 0.41 0.63 0.03 0.00 -0.15 0.00 0.00 54.97 55.88 2kc0 s GLU 54 Cb -0.10 0.34 0.00 0.00 -0.44 0.00 0.00 34.13 33.93 2kc0 s GLU 54 CO 0.32 -0.12 -0.11 0.21 0.95 0.00 0.00 175.26 176.51 2kc0 s LYS 55 N -0.03 1.16 -0.37 -4.83 2.47 0.51 -4.98 119.74 113.67 2kc0 s LYS 55 Ca -0.03 -0.36 -0.25 0.00 -1.56 0.00 0.00 55.97 53.78 2kc0 s LYS 55 Cb -0.04 -1.05 0.01 0.00 -1.46 0.00 0.00 37.83 35.29 2kc0 s LYS 55 CO 0.02 0.12 0.86 0.95 0.16 0.00 0.00 175.35 177.46 2kc0 s THR 56 N 0.24 4.65 0.22 3.43 -4.23 -1.26 -1.56 115.64 117.13 2kc0 s THR 56 Ca -0.05 1.02 -0.06 0.00 -1.18 0.00 0.00 61.69 61.42 2kc0 s THR 56 Cb -0.10 -4.28 -0.02 0.00 1.34 0.00 0.00 72.50 69.44 2kc0 s THR 56 CO 0.01 -0.50 0.29 -0.72 -0.54 0.00 0.00 174.62 173.15 2kc0 s TYR 57 N 3.31 0.78 -0.57 3.99 -0.85 -0.37 -5.02 117.35 118.63 2kc0 s TYR 57 Ca 0.35 -1.07 0.00 0.00 -0.52 0.00 0.00 57.07 55.83 2kc0 s TYR 57 Cb -0.12 -0.21 0.00 0.00 0.38 0.00 0.00 41.96 42.00 2kc0 s TYR 57 CO 0.18 -0.80 0.00 0.41 -1.52 0.00 0.00 175.55 173.82 2kc0 n GLY 58 N -0.32 -1.26 4.48 5.49 0.00 -1.26 -0.87 105.19 111.45 2kc0 n GLY 58 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2kc0 n GLY 58 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kc0 n ASN 59 N 0.34 0.00 0.00 1.61 3.02 -1.03 -4.29 115.26 114.91 2kc0 n ASN 59 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2kc0 n ASN 59 Cb 0.00 -0.75 0.00 0.00 -0.61 0.00 0.00 39.78 38.42 2kc0 n ASN 59 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kc0 n GLY 60 N -1.12 2.10 0.00 7.41 0.00 -1.26 -4.61 105.19 107.71 2kc0 n GLY 60 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2kc0 n GLY 60 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kc0 n ASP 61 N 0.00 0.00 -3.64 1.61 2.03 -1.18 -5.01 116.55 110.36 2kc0 n ASP 61 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 2kc0 n ASP 61 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 2kc0 n ASP 61 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2kc0 s SER 62 N 1.45 -0.85 -0.01 1.67 1.04 -1.26 -1.54 113.70 114.20 2kc0 s SER 62 Ca 0.00 1.48 -0.20 0.00 0.48 0.00 0.00 55.95 57.71 2kc0 s SER 62 Cb 0.00 1.42 -0.05 0.00 0.10 0.00 0.00 66.02 67.49 2kc0 s SER 62 CO 0.00 -0.24 0.59 -0.22 0.98 0.00 0.00 173.24 174.34 2kc0 s LEU 63 N 1.03 4.41 0.02 2.42 0.20 -0.90 -4.77 118.68 121.09 2kc0 s LEU 63 Ca -0.05 1.14 -0.30 0.00 0.69 0.00 0.00 54.13 55.60 2kc0 s LEU 63 Cb -0.05 -2.91 -0.06 0.00 -0.43 0.00 0.00 46.19 42.74 2kc0 s LEU 63 CO -0.10 0.09 1.36 0.20 -0.29 0.00 0.00 176.35 177.61 2kc0 s ASN 64 N -0.14 6.89 0.00 3.68 0.01 -1.26 -0.52 114.94 123.60 2kc0 s ASN 64 Ca 0.31 2.11 0.00 0.00 -0.71 0.00 0.00 52.86 54.57 2kc0 s ASN 64 Cb -0.18 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 38.91 2kc0 s ASN 64 CO 0.17 -0.67 0.00 0.35 -1.51 0.00 0.00 177.10 175.44 2kc0 n THR 65 N 4.45 0.00 -1.45 1.60 -2.24 -0.85 -4.92 114.28 110.87 2kc0 n THR 65 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2kc0 n THR 65 Cb 0.44 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 2kc0 n THR 65 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kc0 n GLY 66 N 3.06 0.86 2.75 3.38 0.00 -0.31 -4.07 105.19 110.86 2kc0 n GLY 66 Ca 0.00 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 2kc0 n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kc0 n LYS 67 N 0.00 4.01 0.00 1.61 5.02 -1.26 -4.92 118.16 122.61 2kc0 n LYS 67 Ca 0.00 -4.43 0.00 0.00 -2.02 0.00 0.00 58.31 51.86 2kc0 n LYS 67 Cb 0.00 -2.34 0.00 0.00 -0.02 0.00 0.00 35.03 32.67 2kc0 n LYS 67 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2kc0 n LEU 68 N -0.28 0.00 -3.68 -0.35 7.94 -1.26 -4.96 117.00 114.41 2kc0 n LEU 68 Ca 0.44 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 55.24 2kc0 n LEU 68 Cb 0.34 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.19 2kc0 n LEU 68 CO 0.45 0.00 0.04 -0.75 -1.11 0.00 0.00 177.39 176.02 2kc0 s LYS 69 N 0.00 0.37 0.00 1.96 2.36 -1.26 -5.12 119.74 118.04 2kc0 s LYS 69 Ca 0.00 0.87 0.00 0.00 -2.55 0.00 0.00 55.97 54.29 2kc0 s LYS 69 Cb 0.00 0.09 0.00 0.00 -1.05 0.00 0.00 37.83 36.87 2kc0 s LYS 69 CO 0.00 -0.19 0.00 0.09 1.55 0.00 0.00 175.35 176.80 2kc0 n ASN 70 N 4.67 0.00 -3.52 1.43 3.02 -1.26 -4.42 115.26 115.18 2kc0 n ASN 70 Ca -0.18 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.17 2kc0 n ASN 70 Cb 0.53 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.56 2kc0 n ASN 70 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 2kc0 s ASP 71 N -2.52 1.68 0.15 6.41 -4.77 -1.26 -4.47 116.67 111.89 2kc0 s ASP 71 Ca 0.00 -0.36 -0.13 0.00 -3.30 0.00 0.00 52.55 48.76 2kc0 s ASP 71 Cb 0.00 0.21 0.01 0.00 -1.09 0.00 0.00 42.92 42.05 2kc0 s ASP 71 CO 0.00 -0.34 0.35 -1.59 0.70 0.00 0.00 175.17 174.29 2kc0 s LYS 72 N 2.28 1.14 -0.14 2.11 -2.85 -0.20 -4.97 119.74 117.10 2kc0 s LYS 72 Ca 0.06 -0.96 -0.21 0.00 -1.00 0.00 0.00 55.97 53.87 2kc0 s LYS 72 Cb -0.16 0.43 -0.03 0.00 -2.06 0.00 0.00 37.83 36.01 2kc0 s LYS 72 CO -0.13 -0.43 0.60 0.14 0.10 0.00 0.00 175.35 175.63 2kc0 s VAL 73 N -3.89 5.08 0.16 1.79 -7.23 -1.26 -0.30 120.40 114.75 2kc0 s VAL 73 Ca 0.10 1.17 -0.11 0.00 -1.81 0.00 0.00 61.98 61.33 2kc0 s VAL 73 Cb 0.02 -3.93 -0.07 0.00 0.56 0.00 0.00 36.38 32.97 2kc0 s VAL 73 CO -0.05 0.21 0.51 -0.44 -0.31 0.00 0.00 175.10 175.01 2kc0 s SER 74 N 0.94 6.69 -0.13 4.85 0.01 0.45 -4.96 113.70 121.56 2kc0 s SER 74 Ca 0.30 0.93 -0.03 0.00 1.31 0.00 0.00 55.95 58.45 2kc0 s SER 74 Cb -0.16 -2.23 -0.03 0.00 0.21 0.00 0.00 66.02 63.81 2kc0 s SER 74 CO 0.12 0.05 -0.02 0.00 0.41 0.00 0.00 173.24 173.80 2kc0 s ARG 75 N -2.30 3.46 -0.01 12.44 1.70 -1.26 -2.13 118.95 130.85 2kc0 s ARG 75 Ca 0.40 -0.48 -0.02 0.00 -0.47 0.00 0.00 55.73 55.16 2kc0 s ARG 75 Cb -0.13 -2.88 -0.00 0.00 -0.57 0.00 0.00 34.95 31.37 2kc0 s ARG 75 CO 0.20 0.39 0.05 -0.06 -1.08 0.00 0.00 175.30 174.80 2kc0 s PHE 76 N -0.03 0.02 0.08 5.89 0.08 -0.98 -4.88 117.98 118.16 2kc0 s PHE 76 Ca 0.02 -0.04 -0.20 0.00 0.12 0.00 0.00 56.93 56.83 2kc0 s PHE 76 Cb -0.13 -0.04 -0.07 0.00 -0.57 0.00 0.00 43.02 42.22 2kc0 s PHE 76 CO 0.02 -0.11 0.59 0.34 -0.10 0.00 0.00 175.22 175.97 2kc0 s ASP 77 N -0.51 7.09 -0.06 1.36 -1.08 -0.47 -2.46 116.67 120.54 2kc0 s ASP 77 Ca -0.06 1.30 -0.01 0.00 -0.52 0.00 0.00 52.55 53.26 2kc0 s ASP 77 Cb -0.04 -2.37 0.03 0.00 -1.46 0.00 0.00 42.92 39.08 2kc0 s ASP 77 CO 0.00 0.27 0.01 0.12 0.52 0.00 0.00 175.17 176.09 2kc0 s PHE 78 N -1.12 0.56 -0.04 -5.34 2.19 -0.58 -1.69 117.98 111.95 2kc0 s PHE 78 Ca 0.30 -0.09 0.04 0.00 0.33 0.00 0.00 56.93 57.51 2kc0 s PHE 78 Cb -0.20 -0.74 -0.00 0.00 -1.31 0.00 0.00 43.02 40.77 2kc0 s PHE 78 CO 0.20 -0.30 -0.16 0.42 1.83 0.00 0.00 175.22 177.21 2kc0 s ILE 79 N 1.97 1.37 -0.21 3.12 1.01 -0.13 -1.20 121.20 127.12 2kc0 s ILE 79 Ca 0.04 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 59.98 2kc0 s ILE 79 Cb -0.12 -1.18 0.07 0.00 0.01 0.00 0.00 42.46 41.23 2kc0 s ILE 79 CO -0.05 0.40 0.06 0.00 0.00 0.00 0.00 174.94 175.35 2kc0 s ARG 80 N 0.08 0.50 0.35 2.79 1.70 -0.73 -1.13 118.95 122.51 2kc0 s ARG 80 Ca -0.04 -0.45 0.04 0.00 -0.47 0.00 0.00 55.73 54.80 2kc0 s ARG 80 Cb -0.11 -1.95 -0.05 0.00 -0.57 0.00 0.00 34.95 32.27 2kc0 s ARG 80 CO 0.02 -0.73 0.08 1.14 -1.08 0.00 0.00 175.30 174.73 2kc0 s GLN 81 N 1.91 1.74 0.15 3.89 1.03 0.37 -4.64 119.66 124.11 2kc0 s GLN 81 Ca 0.02 -2.00 -0.16 0.00 0.04 0.00 0.00 55.36 53.26 2kc0 s GLN 81 Cb -0.17 -0.80 0.03 0.00 0.03 0.00 0.00 33.01 32.10 2kc0 s GLN 81 CO -0.13 -0.28 0.43 -1.50 -2.54 0.00 0.00 175.29 171.27 2kc0 s ILE 82 N -3.28 0.05 -0.87 3.63 2.07 -1.26 -0.14 121.20 121.41 2kc0 s ILE 82 Ca 0.32 -0.69 -0.25 0.00 -1.41 0.00 0.00 60.65 58.62 2kc0 s ILE 82 Cb 0.07 -1.34 0.01 0.00 0.13 0.00 0.00 42.46 41.33 2kc0 s ILE 82 CO 0.15 -0.25 1.58 -1.61 -1.91 0.00 0.00 174.94 172.90 2kc0 s GLU 83 N -3.84 3.13 -0.60 3.50 2.02 -1.26 -3.99 118.70 117.66 2kc0 s GLU 83 Ca 0.06 -0.48 -0.27 0.00 0.02 0.00 0.00 54.97 54.29 2kc0 s GLU 83 Cb 0.01 -4.88 0.00 0.00 0.10 0.00 0.00 34.13 29.36 2kc0 s GLU 83 CO -0.08 -2.53 1.60 0.08 0.02 0.00 0.00 175.26 174.34 2kc0 s VAL 84 N 6.88 3.58 -1.31 2.63 1.01 0.31 -3.13 120.40 130.37 2kc0 s VAL 84 Ca 0.52 0.42 -0.05 0.00 0.00 0.00 0.00 61.98 62.86 2kc0 s VAL 84 Cb -0.05 -4.27 0.03 0.00 0.00 0.00 0.00 36.38 32.09 2kc0 s VAL 84 CO 0.02 -1.14 0.35 0.47 0.00 0.00 0.00 175.10 174.80 2kc0 n ASP 85 N 10.87 -4.48 0.00 3.32 8.00 -1.26 -0.97 116.55 132.03 2kc0 n ASP 85 Ca 0.15 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.47 2kc0 n ASP 85 Cb 0.50 -3.71 0.00 0.00 -0.02 0.00 0.00 41.12 37.89 2kc0 n ASP 85 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kc0 n GLY 86 N -1.15 0.79 3.64 0.44 0.00 -1.18 -5.06 105.19 102.67 2kc0 n GLY 86 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 2kc0 n GLY 86 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kc0 s GLN 87 N -0.20 3.06 -0.33 1.61 -0.21 -0.14 -5.02 119.66 118.43 2kc0 s GLN 87 Ca 0.00 -0.45 -0.23 0.00 0.02 0.00 0.00 55.36 54.70 2kc0 s GLN 87 Cb 0.00 -2.78 0.00 0.00 1.00 0.00 0.00 33.01 31.23 2kc0 s GLN 87 CO 0.00 0.62 0.79 -0.51 -2.12 0.00 0.00 175.29 174.07 2kc0 s LEU 88 N -0.67 4.10 -0.09 2.90 1.02 -1.26 -0.53 118.68 124.15 2kc0 s LEU 88 Ca 0.11 0.55 0.03 0.00 0.02 0.00 0.00 54.13 54.83 2kc0 s LEU 88 Cb -0.12 -3.06 -0.01 0.00 0.02 0.00 0.00 46.19 43.03 2kc0 s LEU 88 CO 0.02 -0.66 -0.19 -0.63 0.02 0.00 0.00 176.35 174.91 2kc0 s ILE 89 N 3.01 2.52 -0.43 -0.59 1.01 -1.26 -5.01 121.20 120.46 2kc0 s ILE 89 Ca 0.32 -0.87 0.06 0.00 0.00 0.00 0.00 60.65 60.15 2kc0 s ILE 89 Cb -0.14 -1.99 0.17 0.00 0.01 0.00 0.00 42.46 40.51 2kc0 s ILE 89 CO 0.14 0.55 0.54 -0.89 0.00 0.00 0.00 174.94 175.28 2kc0 s THR 90 N 0.10 -0.60 0.00 2.92 2.01 -1.26 -4.24 115.64 114.57 2kc0 s THR 90 Ca -0.09 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 60.94 2kc0 s THR 90 Cb -0.15 -0.39 0.00 0.00 0.01 0.00 0.00 72.50 71.97 2kc0 s THR 90 CO 0.06 -0.36 0.38 0.18 -0.69 0.00 0.00 174.62 174.18 2kc0 n LEU 91 N 3.72 0.52 -4.26 4.42 7.99 -1.26 -5.07 117.00 123.06 2kc0 n LEU 91 Ca 0.16 -0.52 -0.42 0.00 -0.01 0.00 0.00 56.01 55.22 2kc0 n LEU 91 Cb 0.52 0.00 -0.08 0.00 -0.11 0.00 0.00 43.42 43.75 2kc0 n LEU 91 CO 0.04 0.13 0.01 -1.61 -1.51 0.00 0.00 177.39 174.45 2kc0 s GLU 92 N -0.14 2.67 0.03 3.23 8.01 -1.26 -4.30 118.70 126.94 2kc0 s GLU 92 Ca 0.00 -1.67 0.03 0.00 0.01 0.00 0.00 54.97 53.35 2kc0 s GLU 92 Cb 0.00 -4.01 -0.02 0.00 -4.31 0.00 0.00 34.13 25.79 2kc0 s GLU 92 CO 0.00 -1.17 -0.10 -1.12 0.01 0.00 0.00 175.26 172.88 2kc0 s SER 93 N 2.81 1.12 0.00 -0.19 0.01 -0.10 -1.78 113.70 115.58 2kc0 s SER 93 Ca 0.04 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.92 2kc0 s SER 93 Cb -0.26 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 65.91 2kc0 s SER 93 CO 0.01 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2kc0 n GLY 94 N 2.06 2.83 3.73 3.44 0.00 -0.34 -2.75 105.19 114.16 2kc0 n GLY 94 Ca -0.18 -0.60 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 2kc0 n GLY 94 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kc0 s GLU 95 N 1.44 2.28 -0.18 1.61 8.01 -0.29 -1.52 118.70 130.05 2kc0 s GLU 95 Ca 0.00 -1.71 -0.04 0.00 0.01 0.00 0.00 54.97 53.23 2kc0 s GLU 95 Cb 0.00 -2.07 0.09 0.00 -4.31 0.00 0.00 34.13 27.84 2kc0 s GLU 95 CO 0.00 -0.01 0.25 0.12 0.01 0.00 0.00 175.26 175.63 2kc0 s PHE 96 N -2.52 -0.37 -0.31 1.61 5.36 -1.03 -2.09 117.98 118.64 2kc0 s PHE 96 Ca 0.40 0.53 -0.03 0.00 -0.96 0.00 0.00 56.93 56.87 2kc0 s PHE 96 Cb 0.01 -0.22 0.05 0.00 -0.34 0.00 0.00 43.02 42.51 2kc0 s PHE 96 CO 0.23 -0.52 0.02 -0.65 -1.46 0.00 0.00 175.22 172.83 2kc0 s GLN 97 N 2.37 2.48 -0.26 10.12 1.11 -0.38 -2.33 119.66 132.77 2kc0 s GLN 97 Ca 0.06 -1.24 0.03 0.00 0.01 0.00 0.00 55.36 54.22 2kc0 s GLN 97 Cb -0.14 -3.22 0.06 0.00 -1.01 0.00 0.00 33.01 28.70 2kc0 s GLN 97 CO -0.11 -0.62 -0.09 0.08 0.01 0.00 0.00 175.29 174.56 2kc0 s VAL 98 N 1.28 2.12 -0.16 1.09 1.01 -0.90 -0.99 120.40 123.85 2kc0 s VAL 98 Ca -0.04 -1.66 -0.24 0.00 0.00 0.00 0.00 61.98 60.04 2kc0 s VAL 98 Cb -0.20 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 2kc0 s VAL 98 CO -0.00 -0.08 0.75 -0.47 0.00 0.00 0.00 175.10 175.29 2kc0 s TYR 99 N 1.11 3.44 -0.14 5.22 6.14 -0.06 -0.41 117.35 132.65 2kc0 s TYR 99 Ca -0.07 1.16 -0.19 0.00 0.64 0.00 0.00 57.07 58.61 2kc0 s TYR 99 Cb -0.20 -2.91 -0.04 0.00 0.42 0.00 0.00 41.96 39.23 2kc0 s TYR 99 CO -0.05 -0.16 0.54 0.21 0.64 0.00 0.00 175.55 176.73 2kc0 s LYS 100 N 1.81 4.31 0.16 4.97 2.36 0.59 -2.39 119.74 131.55 2kc0 s LYS 100 Ca 0.35 0.53 0.02 0.00 -2.55 0.00 0.00 55.97 54.32 2kc0 s LYS 100 Cb -0.17 -3.48 -0.01 0.00 -1.05 0.00 0.00 37.83 33.12 2kc0 s LYS 100 CO 0.13 0.03 0.07 1.04 1.55 0.00 0.00 175.35 178.17 2kc0 n GLN 101 N 4.10 0.64 -0.03 4.03 6.02 -0.52 -1.03 117.38 130.60 2kc0 n GLN 101 Ca -0.05 -1.38 -0.15 0.00 -0.01 0.00 0.00 57.00 55.41 2kc0 n GLN 101 Cb 0.51 0.84 -0.11 0.00 1.02 0.00 0.00 30.24 32.51 2kc0 n GLN 101 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 2kc0 h SER 102 N 0.70 0.27 0.00 1.08 0.02 -1.94 -3.39 113.55 110.29 2kc0 h SER 102 Ca -0.12 -0.71 0.00 0.00 -0.84 0.00 0.00 61.79 60.12 2kc0 h SER 102 Cb 0.49 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.95 2kc0 h SER 102 CO 0.19 0.94 0.00 1.41 -1.14 0.00 0.00 176.83 178.23 2kc0 n HIS 103 N -4.50 0.00 -4.06 3.45 8.25 -1.26 -4.97 115.22 112.13 2kc0 n HIS 103 Ca -0.09 -0.33 -0.09 0.00 -0.26 0.00 0.00 57.72 56.95 2kc0 n HIS 103 Cb 0.49 -0.03 -0.09 0.00 1.12 0.00 0.00 29.99 31.47 2kc0 n HIS 103 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2kc0 s SER 104 N -0.66 0.29 -0.24 0.41 1.04 -1.26 -0.78 113.70 112.50 2kc0 s SER 104 Ca 0.00 -1.02 -0.26 0.00 0.48 0.00 0.00 55.95 55.15 2kc0 s SER 104 Cb 0.00 0.30 0.08 0.00 0.10 0.00 0.00 66.02 66.50 2kc0 s SER 104 CO 0.00 -0.72 0.78 0.00 0.98 0.00 0.00 173.24 174.28 2kc0 s ALA 105 N -3.97 -1.82 0.09 5.32 0.00 -0.05 -1.44 121.76 119.89 2kc0 s ALA 105 Ca 0.15 1.90 0.05 0.00 0.00 0.00 0.00 51.96 54.06 2kc0 s ALA 105 Cb 0.07 -1.07 -0.03 0.00 0.00 0.00 0.00 23.12 22.09 2kc0 s ALA 105 CO -0.04 -0.32 -0.14 -0.48 0.00 0.00 0.00 175.76 174.78 2kc0 s LEU 106 N 0.11 2.32 0.18 0.00 0.05 -1.01 -1.95 118.68 118.38 2kc0 s LEU 106 Ca -0.01 -0.68 0.06 0.00 0.05 0.00 0.00 54.13 53.55 2kc0 s LEU 106 Cb -0.04 -0.50 -0.04 0.00 -2.05 0.00 0.00 46.19 43.56 2kc0 s LEU 106 CO 0.01 -0.11 0.09 0.28 -0.55 0.00 0.00 176.35 176.07 2kc0 s THR 107 N -1.61 4.18 0.02 5.48 -1.32 -1.24 -0.88 115.64 120.26 2kc0 s THR 107 Ca 0.01 -1.27 0.00 0.00 -1.21 0.00 0.00 61.69 59.23 2kc0 s THR 107 Cb -0.08 -3.14 -0.01 0.00 -1.51 0.00 0.00 72.50 67.75 2kc0 s THR 107 CO 0.02 -0.15 -0.03 0.00 -2.21 0.00 0.00 174.62 172.25 2kc0 s ALA 108 N -1.81 0.18 0.01 11.08 0.00 -0.16 -0.68 121.76 130.38 2kc0 s ALA 108 Ca 0.30 -0.42 -0.00 0.00 0.00 0.00 0.00 51.96 51.84 2kc0 s ALA 108 Cb -0.09 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 2kc0 s ALA 108 CO 0.22 -0.07 0.11 -0.06 0.00 0.00 0.00 175.76 175.95 2kc0 s PHE 109 N -0.93 3.34 -0.01 0.00 0.40 0.10 -1.25 117.98 119.63 2kc0 s PHE 109 Ca -0.09 0.22 -0.01 0.00 -0.60 0.00 0.00 56.93 56.45 2kc0 s PHE 109 Cb -0.07 -1.74 0.01 0.00 0.51 0.00 0.00 43.02 41.74 2kc0 s PHE 109 CO -0.00 0.57 0.03 -1.14 0.70 0.00 0.00 175.22 175.37 2kc0 s GLN 110 N -1.93 0.02 -0.04 0.44 0.74 -0.89 -1.69 119.66 116.30 2kc0 s GLN 110 Ca 0.26 0.09 -0.01 0.00 0.05 0.00 0.00 55.36 55.74 2kc0 s GLN 110 Cb -0.12 -0.06 0.03 0.00 1.10 0.00 0.00 33.01 33.96 2kc0 s GLN 110 CO 0.17 -0.05 0.05 -0.08 -0.55 0.00 0.00 175.29 174.83 2kc0 s THR 111 N 0.33 -0.05 0.00 -0.34 -1.32 -0.24 -1.14 115.64 112.88 2kc0 s THR 111 Ca -0.03 0.35 0.00 0.00 -1.21 0.00 0.00 61.69 60.80 2kc0 s THR 111 Cb -0.04 -0.17 0.00 0.00 -1.51 0.00 0.00 72.50 70.78 2kc0 s THR 111 CO -0.01 0.17 0.00 -0.62 -2.21 0.00 0.00 174.62 171.95 2kc0 n GLU 112 N 5.01 0.00 -2.48 7.08 -0.58 -1.25 -1.74 120.64 126.68 2kc0 n GLU 112 Ca -0.09 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.23 2kc0 n GLU 112 Cb 0.50 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.34 2kc0 n GLU 112 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2kc0 s GLN 113 N 0.00 4.47 -0.16 3.49 -2.07 -1.11 -2.59 119.66 121.69 2kc0 s GLN 113 Ca 0.00 1.70 -0.19 0.00 -1.82 0.00 0.00 55.36 55.04 2kc0 s GLN 113 Cb 0.00 -3.36 0.05 0.00 -1.09 0.00 0.00 33.01 28.61 2kc0 s GLN 113 CO 0.00 -0.19 0.52 -1.50 -1.32 0.00 0.00 175.29 172.80 2kc0 s ILE 114 N 0.94 0.01 0.82 3.63 2.07 -0.85 -0.92 121.20 126.91 2kc0 s ILE 114 Ca 0.57 -0.06 -0.12 0.00 -1.41 0.00 0.00 60.65 59.63 2kc0 s ILE 114 Cb -0.28 -0.75 0.09 0.00 0.13 0.00 0.00 42.46 41.64 2kc0 s ILE 114 CO 0.29 -0.03 1.14 0.00 -1.91 0.00 0.00 174.94 174.43 2kc0 s GLN 115 N -0.10 1.87 -0.11 3.50 1.03 -1.26 -1.48 119.66 123.12 2kc0 s GLN 115 Ca -0.03 0.30 -0.03 0.00 0.04 0.00 0.00 55.36 55.64 2kc0 s GLN 115 Cb -0.03 -1.92 -0.03 0.00 0.03 0.00 0.00 33.01 31.05 2kc0 s GLN 115 CO 0.02 -1.69 0.02 0.34 -2.54 0.00 0.00 175.29 171.44 2kc0 s ASP 116 N -4.28 5.40 -0.26 12.60 2.15 -1.25 -4.87 116.67 126.17 2kc0 s ASP 116 Ca 0.62 0.15 0.02 0.00 0.43 0.00 0.00 52.55 53.77 2kc0 s ASP 116 Cb -0.13 -1.65 0.40 0.00 -0.30 0.00 0.00 42.92 41.24 2kc0 s ASP 116 CO 0.52 0.34 1.54 -1.20 -0.17 0.00 0.00 175.17 176.19 2kc0 n SER 117 N 2.44 3.44 -0.04 -0.34 7.64 -1.26 -3.43 113.62 122.08 2kc0 n SER 117 Ca -0.18 -2.95 -0.05 0.00 1.01 0.00 0.00 58.87 56.70 2kc0 n SER 117 Cb 0.53 -0.70 -0.04 0.00 -1.01 0.00 0.00 64.21 62.99 2kc0 n SER 117 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kc0 n GLU 118 N -0.47 1.19 -0.20 1.43 1.02 -1.26 -4.53 120.64 117.82 2kc0 n GLU 118 Ca 0.35 0.03 0.09 0.00 -0.02 0.00 0.00 57.16 57.61 2kc0 n GLU 118 Cb 1.19 -1.16 0.17 0.00 -0.02 0.00 0.00 31.44 31.63 2kc0 n GLU 118 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2kc0 n HIS 119 N -2.56 0.35 -0.24 -0.32 -0.00 -1.26 -5.02 115.22 106.17 2kc0 n HIS 119 Ca -0.13 -0.91 0.00 0.00 0.46 0.00 0.00 57.72 57.14 2kc0 n HIS 119 Cb 0.67 -0.20 0.00 0.00 -0.12 0.00 0.00 29.99 30.34 2kc0 n HIS 119 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2kc0 n SER 120 N -0.99 0.00 -2.35 0.26 7.64 -1.22 -4.41 113.62 112.55 2kc0 n SER 120 Ca 0.17 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 60.02 2kc0 n SER 120 Cb 0.70 -1.62 0.09 0.00 -1.01 0.00 0.00 64.21 62.37 2kc0 n SER 120 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kc0 n GLY 121 N -1.37 1.73 1.01 0.23 0.00 -1.24 -4.92 105.19 100.63 2kc0 n GLY 121 Ca 0.00 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 2kc0 n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kc0 n LYS 122 N -1.25 -1.06 -3.70 1.61 5.02 -1.24 -4.92 118.16 112.62 2kc0 n LYS 122 Ca -0.19 -0.52 -0.14 0.00 -2.02 0.00 0.00 58.31 55.43 2kc0 n LYS 122 Cb 0.84 -0.42 -0.09 0.00 -0.02 0.00 0.00 35.03 35.34 2kc0 n LYS 122 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 2kc0 s MET 123 N -3.74 0.66 0.05 1.97 -2.45 -1.26 -3.82 119.30 110.71 2kc0 s MET 123 Ca 0.20 0.38 -0.00 0.00 -1.25 0.00 0.00 55.69 55.02 2kc0 s MET 123 Cb -0.01 0.31 -0.03 0.00 1.25 0.00 0.00 34.83 36.34 2kc0 s MET 123 CO 0.15 -0.14 -0.04 0.14 1.05 0.00 0.00 175.02 176.19 2kc0 s VAL 124 N -0.37 0.26 -0.16 10.11 -7.23 -0.55 -4.92 120.40 117.54 2kc0 s VAL 124 Ca -0.05 -1.53 0.01 0.00 -1.81 0.00 0.00 61.98 58.59 2kc0 s VAL 124 Cb -0.03 -1.14 0.02 0.00 0.56 0.00 0.00 36.38 35.79 2kc0 s VAL 124 CO 0.03 -0.81 -0.16 0.00 -0.31 0.00 0.00 175.10 173.84 2kc0 s ALA 125 N -3.06 2.03 -0.11 1.32 0.00 -1.26 -2.00 121.76 118.68 2kc0 s ALA 125 Ca 0.00 -1.02 0.16 0.00 0.00 0.00 0.00 51.96 51.10 2kc0 s ALA 125 Cb 0.02 -1.10 0.37 0.00 0.00 0.00 0.00 23.12 22.41 2kc0 s ALA 125 CO -0.06 -0.37 1.18 0.36 0.00 0.00 0.00 175.76 176.86 2kc0 n LYS 126 N 4.72 0.89 -2.33 0.00 2.85 -1.07 -4.98 118.16 118.23 2kc0 n LYS 126 Ca -0.18 -2.59 -0.03 0.00 -1.05 0.00 0.00 58.31 54.46 2kc0 n LYS 126 Cb 0.50 -0.97 -0.00 0.00 -0.65 0.00 0.00 35.03 33.90 2kc0 n LYS 126 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2kc0 n ARG 127 N -0.53 -2.61 -2.98 -1.58 5.12 -1.18 -4.88 116.66 108.02 2kc0 n ARG 127 Ca 0.13 0.15 -0.44 0.00 -1.93 0.00 0.00 57.85 55.76 2kc0 n ARG 127 Cb 0.84 -4.63 -0.04 0.00 -1.16 0.00 0.00 32.46 27.47 2kc0 n ARG 127 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2kc0 s GLN 128 N -4.70 3.15 0.00 5.56 -0.21 -0.71 -4.91 119.66 117.84 2kc0 s GLN 128 Ca 0.00 -1.18 -0.17 0.00 0.02 0.00 0.00 55.36 54.02 2kc0 s GLN 128 Cb 0.00 -4.33 -0.06 0.00 1.00 0.00 0.00 33.01 29.62 2kc0 s GLN 128 CO 0.00 -1.69 0.49 0.12 -2.12 0.00 0.00 175.29 172.09 2kc0 s PHE 129 N 3.25 3.71 0.04 0.91 2.19 -1.26 -1.08 117.98 125.74 2kc0 s PHE 129 Ca 0.19 1.09 -0.09 0.00 0.33 0.00 0.00 56.93 58.45 2kc0 s PHE 129 Cb -0.18 -2.44 0.00 0.00 -1.31 0.00 0.00 43.02 39.09 2kc0 s PHE 129 CO 0.06 0.51 0.18 0.50 1.83 0.00 0.00 175.22 178.30 2kc0 s ARG 130 N -0.69 0.69 0.68 10.12 6.06 -0.68 -4.72 118.95 130.41 2kc0 s ARG 130 Ca 0.27 -0.67 -0.11 0.00 -2.50 0.00 0.00 55.73 52.72 2kc0 s ARG 130 Cb -0.17 0.28 0.00 0.00 0.06 0.00 0.00 34.95 35.12 2kc0 s ARG 130 CO 0.15 -0.20 1.07 -1.50 -2.50 0.00 0.00 175.30 172.32 2kc0 s ILE 131 N -2.67 3.91 0.07 4.11 1.10 -1.26 -0.72 121.20 125.75 2kc0 s ILE 131 Ca -0.04 0.62 0.00 0.00 -0.51 0.00 0.00 60.65 60.72 2kc0 s ILE 131 Cb -0.01 -3.57 -0.00 0.00 0.15 0.00 0.00 42.46 39.04 2kc0 s ILE 131 CO -0.04 -0.81 0.00 0.61 -2.11 0.00 0.00 174.94 172.59 2kc0 n GLY 132 N -2.75 4.08 3.77 1.50 0.00 0.14 -4.65 105.19 107.29 2kc0 n GLY 132 Ca 0.07 -2.19 -0.38 0.00 0.00 0.00 0.00 46.02 43.52 2kc0 n GLY 132 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kc0 s ASP 133 N -1.42 6.94 -0.92 1.61 2.15 -1.26 -4.76 116.67 119.01 2kc0 s ASP 133 Ca 0.01 2.15 -0.16 0.00 0.43 0.00 0.00 52.55 54.97 2kc0 s ASP 133 Cb 0.00 -2.60 0.18 0.00 -0.30 0.00 0.00 42.92 40.19 2kc0 s ASP 133 CO 0.00 -0.37 1.02 -0.63 -0.17 0.00 0.00 175.17 175.02 2kc0 s ILE 134 N -1.44 5.16 0.26 4.11 -1.09 -1.26 -3.72 121.20 123.22 2kc0 s ILE 134 Ca 0.52 -2.10 -0.30 0.00 -2.23 0.00 0.00 60.65 56.55 2kc0 s ILE 134 Cb -0.27 -4.66 -0.09 0.00 -1.58 0.00 0.00 42.46 35.86 2kc0 s ILE 134 CO 0.34 -1.32 1.00 0.00 -1.23 0.00 0.00 174.94 173.73 2kc0 s ALA 135 N 1.43 3.36 0.00 9.38 0.00 -0.82 -4.96 121.76 130.14 2kc0 s ALA 135 Ca 0.28 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2kc0 s ALA 135 Cb -0.07 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2kc0 s ALA 135 CO -0.09 0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.15 2kc0 n GLY 136 N 1.32 2.22 3.57 0.00 0.00 -1.26 -0.87 105.19 110.17 2kc0 n GLY 136 Ca -0.01 -0.99 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 2kc0 n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kc0 s GLU 137 N -2.00 3.96 0.30 1.61 2.02 0.04 -4.98 118.70 119.66 2kc0 s GLU 137 Ca 0.00 -1.96 -0.29 0.00 0.02 0.00 0.00 54.97 52.73 2kc0 s GLU 137 Cb 0.00 -5.50 -0.11 0.00 0.10 0.00 0.00 34.13 28.62 2kc0 s GLU 137 CO 0.00 -2.23 1.51 -1.01 0.02 0.00 0.00 175.26 173.55 2kc0 s HIS 138 N 4.15 2.80 0.11 1.61 3.76 -1.26 -2.06 115.29 124.40 2kc0 s HIS 138 Ca 0.53 0.97 0.06 0.00 -0.15 0.00 0.00 55.06 56.46 2kc0 s HIS 138 Cb 0.03 -3.97 -0.04 0.00 1.11 0.00 0.00 32.58 29.71 2kc0 s HIS 138 CO 0.06 -3.12 -0.02 0.95 -0.85 0.00 0.00 174.74 171.76 2kc0 s THR 139 N -0.33 3.80 -0.25 1.30 -4.23 -1.16 -4.80 115.64 109.98 2kc0 s THR 139 Ca 0.59 -1.16 -0.29 0.00 -1.18 0.00 0.00 61.69 59.65 2kc0 s THR 139 Cb -0.46 -2.83 0.01 0.00 1.34 0.00 0.00 72.50 70.56 2kc0 s THR 139 CO 0.50 0.06 1.12 -0.44 -0.54 0.00 0.00 174.62 175.32 2kc0 s SER 140 N -2.45 6.98 0.37 3.99 0.01 -1.22 -2.85 113.70 118.54 2kc0 s SER 140 Ca 0.25 1.33 0.20 0.00 1.31 0.00 0.00 55.95 59.04 2kc0 s SER 140 Cb -0.11 -2.54 0.52 0.00 0.21 0.00 0.00 66.02 64.10 2kc0 s SER 140 CO 0.17 -0.79 1.65 2.19 0.41 0.00 0.00 173.24 176.88 2kc0 h PHE 141 N 7.95 0.00 0.00 2.43 -0.00 -1.91 -3.23 116.94 122.17 2kc0 h PHE 141 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.76 2kc0 h PHE 141 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.02 2kc0 h PHE 141 CO 0.80 0.32 0.00 -3.47 -0.00 0.00 0.00 178.31 175.96 2kc0 n ASP 142 N -3.30 0.00 -0.28 -0.68 2.03 -1.26 -1.78 116.55 111.27 2kc0 n ASP 142 Ca 0.01 -1.36 0.04 0.00 0.52 0.00 0.00 54.79 54.00 2kc0 n ASP 142 Cb 0.56 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.99 2kc0 n ASP 142 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2kc0 n LYS 143 N -0.54 0.36 -2.87 -0.67 4.76 -1.22 -5.00 118.16 112.98 2kc0 n LYS 143 Ca 0.01 -0.88 -0.38 0.00 -2.87 0.00 0.00 58.31 54.20 2kc0 n LYS 143 Cb 0.01 -1.12 -0.06 0.00 -1.84 0.00 0.00 35.03 32.01 2kc0 n LYS 143 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2kc0 s LEU 144 N -0.74 4.44 0.37 -0.35 1.02 -0.74 -5.06 118.68 117.63 2kc0 s LEU 144 Ca 0.08 1.74 -0.26 0.00 0.02 0.00 0.00 54.13 55.72 2kc0 s LEU 144 Cb 0.06 -3.73 -0.09 0.00 0.02 0.00 0.00 46.19 42.45 2kc0 s LEU 144 CO 0.11 0.04 1.08 -2.16 0.02 0.00 0.00 176.35 175.44 2kc0 s PRO 145 N -1.72 4.27 0.00 1.29 0.04 -1.26 -4.97 135.00 132.64 2kc0 s PRO 145 Ca 0.45 1.63 0.32 0.00 0.04 0.00 0.00 61.00 63.43 2kc0 s PRO 145 Cb -0.20 -2.72 1.83 0.00 0.04 0.00 0.00 34.50 33.44 2kc0 s PRO 145 CO 0.25 -0.08 2.19 -1.91 0.04 0.00 0.00 177.00 177.49 2kc0 n GLU 146 N 0.27 0.99 0.33 4.56 2.13 -1.26 -4.49 120.64 123.16 2kc0 n GLU 146 Ca 0.03 -0.05 -0.14 0.00 0.66 0.00 0.00 57.16 57.66 2kc0 n GLU 146 Cb 0.48 -1.50 -0.07 0.00 0.27 0.00 0.00 31.44 30.62 2kc0 n GLU 146 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2kc0 h GLY 147 N 4.99 -0.91 0.00 8.31 0.00 -1.93 -3.35 103.07 110.18 2kc0 h GLY 147 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.67 2kc0 h GLY 147 CO 0.00 -0.33 0.00 0.61 0.00 0.00 0.00 176.54 176.82 2kc0 n GLY 148 N -0.47 1.68 3.14 4.60 0.00 -1.26 -4.76 105.19 108.12 2kc0 n GLY 148 Ca -0.11 0.31 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 2kc0 n GLY 148 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2kc0 s ARG 149 N 2.69 0.75 -0.08 1.61 1.70 -1.26 -1.14 118.95 123.21 2kc0 s ARG 149 Ca 0.00 -1.16 0.04 0.00 -0.47 0.00 0.00 55.73 54.13 2kc0 s ARG 149 Cb 0.00 -0.25 -0.01 0.00 -0.57 0.00 0.00 34.95 34.12 2kc0 s ARG 149 CO 0.00 0.01 -0.20 0.00 -1.08 0.00 0.00 175.30 174.03 2kc0 s ALA 150 N -2.92 2.38 0.32 7.88 0.00 -0.74 -4.95 121.76 123.73 2kc0 s ALA 150 Ca 0.05 -0.98 -0.28 0.00 0.00 0.00 0.00 51.96 50.76 2kc0 s ALA 150 Cb 0.01 -0.90 -0.09 0.00 0.00 0.00 0.00 23.12 22.14 2kc0 s ALA 150 CO -0.03 0.38 1.09 -0.08 0.00 0.00 0.00 175.76 177.12 2kc0 s THR 151 N -0.05 3.53 0.10 0.00 -1.32 -1.26 -2.44 115.64 114.20 2kc0 s THR 151 Ca -0.05 1.41 -0.05 0.00 -1.21 0.00 0.00 61.69 61.78 2kc0 s THR 151 Cb -0.14 -3.84 -0.02 0.00 -1.51 0.00 0.00 72.50 66.98 2kc0 s THR 151 CO 0.04 0.24 0.13 -0.31 -2.21 0.00 0.00 174.62 172.51 2kc0 s TYR 152 N -1.33 0.42 0.28 9.09 2.02 -0.15 -4.68 117.35 123.00 2kc0 s TYR 152 Ca 0.49 -0.86 0.04 0.00 -0.37 0.00 0.00 57.07 56.37 2kc0 s TYR 152 Cb -0.29 -0.22 -0.06 0.00 -0.40 0.00 0.00 41.96 41.00 2kc0 s TYR 152 CO 0.37 -0.53 0.03 0.50 -1.57 0.00 0.00 175.55 174.34 2kc0 s ARG 153 N -3.93 1.50 -0.06 -0.62 6.06 -1.26 -1.32 118.95 119.32 2kc0 s ARG 153 Ca 0.11 -1.80 -0.20 0.00 -2.50 0.00 0.00 55.73 51.34 2kc0 s ARG 153 Cb 0.06 -0.75 0.04 0.00 0.06 0.00 0.00 34.95 34.37 2kc0 s ARG 153 CO -0.06 -0.14 0.47 0.20 -2.50 0.00 0.00 175.30 173.27 2kc0 s GLY 154 N -3.40 -0.34 -0.04 8.12 0.00 -0.67 -4.40 107.32 106.60 2kc0 s GLY 154 Ca 0.33 0.87 -0.22 0.00 0.00 0.00 0.00 44.72 45.71 2kc0 s GLY 154 CO 0.12 0.62 0.63 -1.59 0.00 0.00 0.00 173.10 172.89 2kc0 s THR 155 N -0.94 5.00 -0.11 0.90 2.01 -0.00 -1.95 115.64 120.54 2kc0 s THR 155 Ca -0.10 1.31 -0.05 0.00 0.31 0.00 0.00 61.69 63.17 2kc0 s THR 155 Cb -0.03 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 2kc0 s THR 155 CO 0.05 0.33 0.07 0.00 -0.69 0.00 0.00 174.62 174.38 2kc0 s ALA 156 N 0.36 3.54 -0.26 7.40 0.00 -1.26 -2.75 121.76 128.78 2kc0 s ALA 156 Ca 0.34 -0.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.54 2kc0 s ALA 156 Cb -0.18 -1.74 0.12 0.00 0.00 0.00 0.00 23.12 21.32 2kc0 s ALA 156 CO 0.17 0.54 0.24 -0.59 0.00 0.00 0.00 175.76 176.12 2kc0 s PHE 157 N -0.75 -0.27 0.32 0.00 -0.71 -0.95 -2.88 117.98 112.73 2kc0 s PHE 157 Ca 0.12 -0.17 0.04 0.00 -1.04 0.00 0.00 56.93 55.88 2kc0 s PHE 157 Cb -0.12 -0.51 -0.04 0.00 -1.21 0.00 0.00 43.02 41.15 2kc0 s PHE 157 CO 0.03 -0.81 0.17 0.20 -1.34 0.00 0.00 175.22 173.47 2kc0 s GLY 158 N 2.31 2.14 -0.38 1.99 0.00 -1.26 -1.36 107.32 110.75 2kc0 s GLY 158 Ca 0.09 -1.75 -0.05 0.00 0.00 0.00 0.00 44.72 43.01 2kc0 s GLY 158 CO -0.27 -1.59 3.08 -1.26 0.00 0.00 0.00 173.10 173.06 2kc0 n SER 159 N -1.03 6.20 0.00 1.64 2.88 -1.26 -2.15 113.62 119.90 2kc0 n SER 159 Ca 0.01 -2.90 0.00 0.00 -1.33 0.00 0.00 58.87 54.65 2kc0 n SER 159 Cb 0.65 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.78 2kc0 n SER 159 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2kc0 n ASP 160 N 1.65 0.00 -0.12 -3.46 2.03 -1.26 -4.98 116.55 110.42 2kc0 n ASP 160 Ca 0.49 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.54 2kc0 n ASP 160 Cb 0.66 0.08 -0.11 0.00 -0.72 0.00 0.00 41.12 41.03 2kc0 n ASP 160 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2kc0 n ASP 161 N -1.64 1.96 -1.90 1.67 5.75 -1.24 -5.02 116.55 116.12 2kc0 n ASP 161 Ca 0.00 0.26 -0.14 0.00 -0.01 0.00 0.00 54.79 54.90 2kc0 n ASP 161 Cb 0.00 -0.78 -0.03 0.00 -1.03 0.00 0.00 41.12 39.28 2kc0 n ASP 161 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2kc0 n ALA 162 N -3.78 -0.47 0.00 2.12 0.00 -0.91 -4.53 120.51 112.94 2kc0 n ALA 162 Ca -0.47 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2kc0 n ALA 162 Cb 0.88 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2kc0 n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kc0 n GLY 163 N -0.54 0.00 2.57 0.00 0.00 -1.14 -4.92 105.19 101.16 2kc0 n GLY 163 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 2kc0 n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kc0 n GLY 164 N 0.00 4.06 3.76 -0.02 0.00 -1.23 -4.79 105.19 106.97 2kc0 n GLY 164 Ca 0.00 -1.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.19 2kc0 n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kc0 s LYS 165 N 2.95 3.49 0.16 1.61 1.02 -1.26 -4.28 119.74 123.44 2kc0 s LYS 165 Ca 0.57 2.06 0.06 0.00 0.02 0.00 0.00 55.97 58.69 2kc0 s LYS 165 Cb 0.15 -2.39 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 2kc0 s LYS 165 CO -0.05 -0.85 -0.14 -0.48 -0.92 0.00 0.00 175.35 172.91 2kc0 s LEU 166 N -3.17 2.50 -0.01 3.17 -0.00 -0.82 -2.54 118.68 117.80 2kc0 s LEU 166 Ca 0.66 -0.95 0.01 0.00 -0.00 0.00 0.00 54.13 53.85 2kc0 s LEU 166 Cb -0.36 -0.57 -0.04 0.00 -0.00 0.00 0.00 46.19 45.22 2kc0 s LEU 166 CO 0.43 -0.19 0.03 -0.89 -0.00 0.00 0.00 176.35 175.73 2kc0 s THR 167 N -2.75 4.36 0.01 5.48 2.01 0.01 -1.66 115.64 123.09 2kc0 s THR 167 Ca 0.17 -0.50 -0.05 0.00 0.31 0.00 0.00 61.69 61.61 2kc0 s THR 167 Cb -0.02 -2.95 -0.00 0.00 0.01 0.00 0.00 72.50 69.54 2kc0 s THR 167 CO 0.04 0.39 0.09 -0.47 -0.69 0.00 0.00 174.62 173.99 2kc0 s TYR 168 N -1.10 0.11 0.00 4.92 6.14 -0.44 -1.22 117.35 125.76 2kc0 s TYR 168 Ca 0.20 -0.26 -0.02 0.00 0.64 0.00 0.00 57.07 57.63 2kc0 s TYR 168 Cb -0.12 -0.09 -0.01 0.00 0.42 0.00 0.00 41.96 42.17 2kc0 s TYR 168 CO 0.10 -0.27 0.04 -0.08 0.64 0.00 0.00 175.55 175.98 2kc0 s THR 169 N -1.49 0.06 -0.27 4.34 -1.32 -0.58 -0.98 115.64 115.40 2kc0 s THR 169 Ca -0.14 -0.52 0.03 0.00 -1.21 0.00 0.00 61.69 59.85 2kc0 s THR 169 Cb -0.08 -0.23 0.07 0.00 -1.51 0.00 0.00 72.50 70.75 2kc0 s THR 169 CO 0.01 -0.28 -0.07 -0.51 -2.21 0.00 0.00 174.62 171.56 2kc0 s ILE 170 N -0.88 2.07 -1.33 5.08 2.07 -1.02 -1.60 121.20 125.59 2kc0 s ILE 170 Ca -0.10 -1.71 -0.15 0.00 -1.41 0.00 0.00 60.65 57.29 2kc0 s ILE 170 Cb -0.06 -2.27 0.10 0.00 0.13 0.00 0.00 42.46 40.36 2kc0 s ILE 170 CO -0.00 -0.16 1.85 0.47 -1.91 0.00 0.00 174.94 175.18 2kc0 n ASP 171 N 4.44 4.70 -0.36 4.50 9.92 -0.29 -1.80 116.55 137.66 2kc0 n ASP 171 Ca -0.10 -2.94 0.26 0.00 -0.53 0.00 0.00 54.79 51.48 2kc0 n ASP 171 Cb 0.42 -1.65 0.52 0.00 -0.64 0.00 0.00 41.12 39.77 2kc0 n ASP 171 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 2kc0 h PHE 172 N 6.75 0.76 -0.39 1.24 0.04 -1.42 0.98 116.94 124.90 2kc0 h PHE 172 Ca 0.45 0.03 0.11 0.00 2.80 0.00 0.00 57.97 61.37 2kc0 h PHE 172 Cb 0.77 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.69 2kc0 h PHE 172 CO 1.35 -0.09 0.30 0.00 -0.60 0.00 0.00 178.31 179.27 2kc0 h ALA 173 N 1.71 2.30 -0.05 2.45 0.00 -1.49 -0.96 119.26 123.22 2kc0 h ALA 173 Ca 0.71 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.60 2kc0 h ALA 173 Cb 1.80 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.62 2kc0 h ALA 173 CO -0.46 -0.51 0.00 0.00 0.00 0.00 0.00 179.25 178.28 2kc0 n ALA 174 N -2.56 2.07 -2.40 0.00 0.00 -0.12 -5.01 120.51 112.49 2kc0 n ALA 174 Ca 0.06 -0.97 -0.13 0.00 0.00 0.00 0.00 53.44 52.40 2kc0 n ALA 174 Cb 0.49 -0.07 -0.01 0.00 0.00 0.00 0.00 19.45 19.87 2kc0 n ALA 174 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2kc0 n LYS 175 N -0.30 -2.16 -3.87 0.00 5.02 0.15 -4.97 118.16 112.03 2kc0 n LYS 175 Ca 0.02 0.63 -0.36 0.00 -2.02 0.00 0.00 58.31 56.58 2kc0 n LYS 175 Cb 0.25 -5.22 -0.12 0.00 -0.02 0.00 0.00 35.03 29.92 2kc0 n LYS 175 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2kc0 s GLN 176 N -4.96 3.70 -0.45 1.97 -0.21 -1.06 -3.62 119.66 115.03 2kc0 s GLN 176 Ca 0.00 -0.47 -0.16 0.00 0.02 0.00 0.00 55.36 54.75 2kc0 s GLN 176 Cb 0.00 -3.25 0.05 0.00 1.00 0.00 0.00 33.01 30.80 2kc0 s GLN 176 CO 0.00 -0.07 0.41 0.20 -2.12 0.00 0.00 175.29 173.71 2kc0 s GLY 177 N 1.29 1.97 0.38 3.09 0.00 0.28 -1.14 107.32 113.19 2kc0 s GLY 177 Ca 0.05 -1.83 0.06 0.00 0.00 0.00 0.00 44.72 42.99 2kc0 s GLY 177 CO 0.03 1.10 0.02 0.21 0.00 0.00 0.00 173.10 174.45 2kc0 s ASN 178 N 2.20 3.45 0.00 1.64 3.04 -0.63 -2.64 114.94 122.01 2kc0 s ASN 178 Ca 0.07 -1.36 -0.00 0.00 0.04 0.00 0.00 52.86 51.61 2kc0 s ASN 178 Cb -0.21 -0.31 0.00 0.00 -1.54 0.00 0.00 41.25 39.20 2kc0 s ASN 178 CO 0.10 -0.48 0.02 0.61 -3.04 0.00 0.00 177.10 174.31 2kc0 n GLY 179 N -0.88 1.20 3.64 1.21 0.00 -1.26 -1.53 105.19 107.57 2kc0 n GLY 179 Ca -0.04 -0.91 -0.04 0.00 0.00 0.00 0.00 46.02 45.03 2kc0 n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kc0 s LYS 180 N -2.00 0.23 0.36 1.61 -2.85 -0.36 -3.66 119.74 113.08 2kc0 s LYS 180 Ca 0.00 0.30 -0.24 0.00 -1.00 0.00 0.00 55.97 55.04 2kc0 s LYS 180 Cb -0.00 0.10 -0.10 0.00 -2.06 0.00 0.00 37.83 35.76 2kc0 s LYS 180 CO 0.00 -0.03 0.95 0.42 0.10 0.00 0.00 175.35 176.78 2kc0 s ILE 181 N 0.38 4.28 -0.01 3.79 -1.09 -1.04 -0.81 121.20 126.70 2kc0 s ILE 181 Ca 0.02 1.69 0.08 0.00 -2.23 0.00 0.00 60.65 60.22 2kc0 s ILE 181 Cb -0.04 -3.85 0.14 0.00 -1.58 0.00 0.00 42.46 37.13 2kc0 s ILE 181 CO -0.12 -0.04 1.07 1.21 -1.23 0.00 0.00 174.94 175.83 2kc0 n GLU 182 N 0.09 0.05 -0.26 2.79 2.13 -1.05 -4.43 120.64 119.95 2kc0 n GLU 182 Ca 0.04 -1.33 0.07 0.00 0.66 0.00 0.00 57.16 56.60 2kc0 n GLU 182 Cb 0.52 0.33 0.18 0.00 0.27 0.00 0.00 31.44 32.74 2kc0 n GLU 182 CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 2kc0 n HIS 183 N 0.11 0.56 -2.87 4.31 -0.00 -1.24 -4.99 115.22 111.10 2kc0 n HIS 183 Ca -0.17 -0.74 -0.27 0.00 0.46 0.00 0.00 57.72 57.00 2kc0 n HIS 183 Cb 0.84 -0.18 -0.01 0.00 -0.12 0.00 0.00 29.99 30.53 2kc0 n HIS 183 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 2kc0 s LEU 184 N -2.09 3.76 0.56 0.27 2.01 -1.26 -4.78 118.68 117.15 2kc0 s LEU 184 Ca 0.30 0.83 0.25 0.00 0.01 0.00 0.00 54.13 55.52 2kc0 s LEU 184 Cb 0.23 -3.74 1.56 0.00 0.01 0.00 0.00 46.19 44.25 2kc0 s LEU 184 CO 0.09 -0.47 2.15 0.07 1.01 0.00 0.00 176.35 179.19 2kc0 h LYS 185 N 0.53 0.00 -4.79 1.70 2.10 -1.99 -3.43 116.57 110.69 2kc0 h LYS 185 Ca -0.48 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 57.85 2kc0 h LYS 185 Cb 1.21 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 32.32 2kc0 h LYS 185 CO 0.62 0.00 -0.75 -1.12 -2.00 0.00 0.00 179.45 176.20 2kc0 s SER 186 N -6.31 1.10 0.17 7.07 0.01 -1.26 -5.08 113.70 109.40 2kc0 s SER 186 Ca -0.05 -0.55 -0.13 0.00 1.31 0.00 0.00 55.95 56.54 2kc0 s SER 186 Cb 0.16 0.00 0.07 0.00 0.21 0.00 0.00 66.02 66.47 2kc0 s SER 186 CO 0.60 -0.15 1.76 1.55 0.41 0.00 0.00 173.24 177.41 2kc0 h PRO 187 N 4.51 0.82 -0.52 12.44 0.13 -1.99 -2.94 132.00 144.44 2kc0 h PRO 187 Ca -0.37 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2kc0 h PRO 187 Cb 1.20 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2kc0 h PRO 187 CO 0.41 0.66 0.00 -1.91 -0.23 0.00 0.00 178.00 176.93 2kc0 n GLU 188 N -4.55 0.73 -0.00 0.86 2.13 -1.26 -1.98 120.64 116.57 2kc0 n GLU 188 Ca 0.03 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.91 2kc0 n GLU 188 Cb 0.12 -1.26 -0.08 0.00 0.27 0.00 0.00 31.44 30.49 2kc0 n GLU 188 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2kc0 n LEU 189 N -0.04 0.18 -4.59 4.31 4.77 -1.11 -4.29 117.00 116.23 2kc0 n LEU 189 Ca 0.00 -0.18 -0.42 0.00 -0.03 0.00 0.00 56.01 55.38 2kc0 n LEU 189 Cb 0.13 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 2kc0 n LEU 189 CO 0.00 0.05 0.61 0.20 -1.33 0.00 0.00 177.39 176.91 2kc0 s ASN 190 N -2.85 6.56 0.20 -1.43 0.01 -0.84 -4.18 114.94 112.42 2kc0 s ASN 190 Ca -0.01 0.36 -0.09 0.00 -0.71 0.00 0.00 52.86 52.41 2kc0 s ASN 190 Cb 0.08 -2.41 -0.07 0.00 0.41 0.00 0.00 41.25 39.26 2kc0 s ASN 190 CO 0.46 -0.77 0.51 0.68 -1.51 0.00 0.00 177.10 176.47 2kc0 s VAL 191 N 3.18 4.99 0.32 1.60 -7.23 -1.26 -4.86 120.40 117.14 2kc0 s VAL 191 Ca 0.32 0.39 -0.28 0.00 -1.81 0.00 0.00 61.98 60.61 2kc0 s VAL 191 Cb -0.13 -3.62 -0.09 0.00 0.56 0.00 0.00 36.38 33.09 2kc0 s VAL 191 CO 0.18 -0.02 1.13 -1.81 -0.31 0.00 0.00 175.10 174.27 2kc0 s ASP 192 N -2.32 7.00 -0.18 4.85 1.01 -1.26 -2.50 116.67 123.27 2kc0 s ASP 192 Ca 0.45 2.30 -0.05 0.00 0.71 0.00 0.00 52.55 55.96 2kc0 s ASP 192 Cb -0.12 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 41.16 2kc0 s ASP 192 CO 0.22 -0.34 0.01 -0.22 0.21 0.00 0.00 175.17 175.05 2kc0 s LEU 193 N -1.85 3.42 -0.33 1.23 0.20 -1.24 -4.05 118.68 116.07 2kc0 s LEU 193 Ca 0.49 -0.09 -0.29 0.00 0.69 0.00 0.00 54.13 54.93 2kc0 s LEU 193 Cb -0.31 -1.85 0.01 0.00 -0.43 0.00 0.00 46.19 43.60 2kc0 s LEU 193 CO 0.40 0.13 1.23 0.00 -0.29 0.00 0.00 176.35 177.82 2kc0 s ALA 194 N 0.60 3.36 0.12 5.97 0.00 -0.34 -4.31 121.76 127.16 2kc0 s ALA 194 Ca -0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 51.96 51.59 2kc0 s ALA 194 Cb -0.14 -3.77 -0.16 0.00 0.00 0.00 0.00 23.12 19.05 2kc0 s ALA 194 CO 0.02 -1.79 1.39 0.00 0.00 0.00 0.00 175.76 175.39 2kc0 n ALA 195 N 7.52 -0.18 -2.50 0.00 0.00 -1.26 -3.95 120.51 120.13 2kc0 n ALA 195 Ca 0.14 0.49 -0.09 0.00 0.00 0.00 0.00 53.44 53.97 2kc0 n ALA 195 Cb 0.47 -2.16 -0.11 0.00 0.00 0.00 0.00 19.45 17.66 2kc0 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kc0 s ALA 196 N 0.51 0.51 0.36 0.00 0.00 -1.08 -4.93 121.76 117.12 2kc0 s ALA 196 Ca 0.81 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 51.83 2kc0 s ALA 196 Cb -0.85 0.17 0.04 0.00 0.00 0.00 0.00 23.12 22.48 2kc0 s ALA 196 CO 0.45 -0.22 0.34 -0.40 0.00 0.00 0.00 175.76 175.93 2kc0 n ASP 197 N 0.75 1.90 -4.72 0.00 5.75 -1.26 -0.55 116.55 118.42 2kc0 n ASP 197 Ca -0.18 -2.15 -0.42 0.00 -0.01 0.00 0.00 54.79 52.03 2kc0 n ASP 197 Cb 0.58 -0.10 -0.03 0.00 -1.03 0.00 0.00 41.12 40.54 2kc0 n ASP 197 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2kc0 s ILE 198 N -1.63 3.46 0.30 2.12 -1.09 -1.24 -4.16 121.20 118.96 2kc0 s ILE 198 Ca 0.26 1.05 -0.14 0.00 -2.23 0.00 0.00 60.65 59.59 2kc0 s ILE 198 Cb -0.02 -3.67 -0.09 0.00 -1.58 0.00 0.00 42.46 37.10 2kc0 s ILE 198 CO 0.16 0.08 0.69 -1.59 -1.23 0.00 0.00 174.94 173.06 2kc0 s LYS 199 N 1.05 3.95 0.05 2.79 -2.85 -0.50 -5.00 119.74 119.22 2kc0 s LYS 199 Ca 0.63 0.57 -0.31 0.00 -1.00 0.00 0.00 55.97 55.87 2kc0 s LYS 199 Cb -0.35 -2.48 -0.05 0.00 -2.06 0.00 0.00 37.83 32.88 2kc0 s LYS 199 CO 0.30 0.20 1.22 -1.25 0.10 0.00 0.00 175.35 175.92 2kc0 s PRO 200 N -2.94 4.41 0.29 1.78 0.04 -1.26 -4.42 135.00 132.90 2kc0 s PRO 200 Ca 0.52 1.79 0.00 0.00 0.04 0.00 0.00 61.00 63.35 2kc0 s PRO 200 Cb -0.10 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 31.06 2kc0 s PRO 200 CO 0.18 -0.31 0.00 -3.47 0.04 0.00 0.00 177.00 173.45 2kc0 n ASP 201 N 4.16 -1.72 -3.87 6.66 -0.08 -1.26 -5.09 116.55 115.36 2kc0 n ASP 201 Ca 0.10 0.53 -0.12 0.00 -1.51 0.00 0.00 54.79 53.79 2kc0 n ASP 201 Cb 0.46 1.74 -0.12 0.00 2.34 0.00 0.00 41.12 45.54 2kc0 n ASP 201 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 2kc0 s GLY 202 N -3.19 -0.00 0.65 0.27 0.00 -1.22 -5.04 107.32 98.79 2kc0 s GLY 202 Ca 0.00 0.06 0.31 0.00 0.00 0.00 0.00 44.72 45.08 2kc0 s GLY 202 CO 0.00 -0.01 1.94 0.07 0.00 0.00 0.00 173.10 175.10 2kc0 h LYS 203 N 5.45 0.00 0.00 2.90 2.10 -2.01 -0.86 116.57 124.15 2kc0 h LYS 203 Ca -0.27 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.38 2kc0 h LYS 203 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 2kc0 h LYS 203 CO 0.43 0.00 -0.32 2.89 -2.00 0.00 0.00 179.45 180.45 2kc0 n ARG 204 N -2.87 0.06 -3.84 0.07 -4.01 -1.26 -4.77 116.66 100.04 2kc0 n ARG 204 Ca -0.02 -0.88 -0.32 0.00 -1.04 0.00 0.00 57.85 55.59 2kc0 n ARG 204 Cb 0.35 -0.53 -0.11 0.00 -3.04 0.00 0.00 32.46 29.13 2kc0 n ARG 204 CO 0.00 0.00 0.00 -1.01 -3.04 0.00 0.00 177.63 173.58 2kc0 s HIS 205 N -0.08 3.41 0.30 2.89 3.76 -0.33 -3.01 115.29 122.24 2kc0 s HIS 205 Ca 0.01 -3.08 -0.05 0.00 -0.15 0.00 0.00 55.06 51.79 2kc0 s HIS 205 Cb 0.01 -2.95 -0.05 0.00 1.11 0.00 0.00 32.58 30.70 2kc0 s HIS 205 CO 0.00 -0.72 0.57 0.00 -0.85 0.00 0.00 174.74 173.73 2kc0 s ALA 206 N -0.63 3.61 -0.05 -1.40 0.00 -1.13 -3.44 121.76 118.72 2kc0 s ALA 206 Ca 0.20 -0.55 -0.10 0.00 0.00 0.00 0.00 51.96 51.51 2kc0 s ALA 206 Cb -0.17 -2.32 0.02 0.00 0.00 0.00 0.00 23.12 20.64 2kc0 s ALA 206 CO -0.06 0.22 0.23 0.08 0.00 0.00 0.00 175.76 176.23 2kc0 s VAL 207 N -2.11 0.04 -0.18 0.00 1.01 -1.26 -4.28 120.40 113.62 2kc0 s VAL 207 Ca 0.44 -0.31 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 2kc0 s VAL 207 Cb -0.11 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.82 2kc0 s VAL 207 CO 0.30 -0.17 -0.04 -0.63 0.00 0.00 0.00 175.10 174.56 2kc0 s ILE 208 N -0.66 3.67 -0.21 2.22 -1.09 0.07 -1.42 121.20 123.79 2kc0 s ILE 208 Ca -0.08 -0.42 -0.03 0.00 -2.23 0.00 0.00 60.65 57.90 2kc0 s ILE 208 Cb -0.04 -2.63 0.07 0.00 -1.58 0.00 0.00 42.46 38.27 2kc0 s ILE 208 CO 0.02 0.46 0.06 -0.94 -1.23 0.00 0.00 174.94 173.30 2kc0 s SER 209 N 0.85 3.01 0.16 3.58 1.04 -1.26 -1.42 113.70 119.66 2kc0 s SER 209 Ca -0.01 -0.92 0.04 0.00 0.48 0.00 0.00 55.95 55.54 2kc0 s SER 209 Cb -0.15 -0.55 -0.01 0.00 0.10 0.00 0.00 66.02 65.41 2kc0 s SER 209 CO 0.02 -0.34 0.13 0.61 0.98 0.00 0.00 173.24 174.64 2kc0 n GLY 210 N 5.08 3.50 3.77 7.32 0.00 -0.88 -4.84 105.19 119.14 2kc0 n GLY 210 Ca -0.08 -1.78 -0.26 0.00 0.00 0.00 0.00 46.02 43.90 2kc0 n GLY 210 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kc0 s SER 211 N -2.12 5.32 -0.09 1.61 0.01 -1.25 -1.55 113.70 115.63 2kc0 s SER 211 Ca 0.19 -0.22 -0.07 0.00 1.31 0.00 0.00 55.95 57.16 2kc0 s SER 211 Cb 0.01 -1.32 0.03 0.00 0.21 0.00 0.00 66.02 64.95 2kc0 s SER 211 CO 0.13 0.06 0.23 -0.69 0.41 0.00 0.00 173.24 173.38 2kc0 s VAL 212 N -1.80 -0.02 0.56 3.43 1.01 -1.12 -1.20 120.40 121.27 2kc0 s VAL 212 Ca 0.30 0.07 -0.10 0.00 0.00 0.00 0.00 61.98 62.26 2kc0 s VAL 212 Cb -0.10 -0.34 0.13 0.00 0.00 0.00 0.00 36.38 36.08 2kc0 s VAL 212 CO 0.22 0.03 0.64 0.18 0.00 0.00 0.00 175.10 176.17 2kc0 n LEU 213 N 3.56 0.00 -3.68 3.92 4.77 -1.26 -0.17 117.00 124.14 2kc0 n LEU 213 Ca -0.19 -0.69 -0.12 0.00 -0.03 0.00 0.00 56.01 54.98 2kc0 n LEU 213 Cb 0.56 -0.52 -0.13 0.00 -2.33 0.00 0.00 43.42 41.00 2kc0 n LEU 213 CO 0.17 -1.26 -0.10 -0.47 -1.33 0.00 0.00 177.39 174.40 2kc0 s TYR 214 N -2.30 -0.45 -1.46 -1.77 5.04 0.06 -4.39 117.35 112.08 2kc0 s TYR 214 Ca 0.38 1.01 -0.11 0.00 -2.44 0.00 0.00 57.07 55.91 2kc0 s TYR 214 Cb -0.02 0.05 0.06 0.00 0.35 0.00 0.00 41.96 42.40 2kc0 s TYR 214 CO 0.28 -0.34 0.78 0.09 -1.34 0.00 0.00 175.55 175.02 2kc0 n ASN 215 N 4.97 -4.87 -2.53 4.32 4.13 -1.26 -0.83 115.26 119.19 2kc0 n ASN 215 Ca -0.13 -0.56 -0.12 0.00 1.68 0.00 0.00 54.58 55.45 2kc0 n ASN 215 Cb 0.51 -3.92 -0.00 0.00 -1.54 0.00 0.00 39.78 34.82 2kc0 n ASN 215 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kc0 n GLN 216 N -4.30 -2.41 0.00 3.52 1.13 -1.26 -4.84 117.38 109.21 2kc0 n GLN 216 Ca -0.01 0.55 0.00 0.00 -1.94 0.00 0.00 57.00 55.60 2kc0 n GLN 216 Cb 0.55 -5.15 0.00 0.00 0.11 0.00 0.00 30.24 25.75 2kc0 n GLN 216 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2kc0 n ALA 217 N -2.36 0.00 -0.77 -1.58 0.00 -0.01 -5.12 120.51 110.66 2kc0 n ALA 217 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2kc0 n ALA 217 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2kc0 n ALA 217 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2kc0 n GLU 218 N 0.00 0.00 -3.20 0.00 4.07 -1.25 -0.76 120.64 119.50 2kc0 n GLU 218 Ca 0.00 0.00 -0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2kc0 n GLU 218 Cb 0.00 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.36 2kc0 n GLU 218 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2kc0 s LYS 219 N 0.00 0.54 0.00 5.31 2.20 -1.26 -4.60 119.74 121.93 2kc0 s LYS 219 Ca 0.00 0.33 0.00 0.00 -0.36 0.00 0.00 55.97 55.94 2kc0 s LYS 219 Cb 0.00 0.06 0.00 0.00 -1.51 0.00 0.00 37.83 36.38 2kc0 s LYS 219 CO 0.00 -1.06 0.00 0.41 -0.36 0.00 0.00 175.35 174.34 2kc0 n GLY 220 N 5.29 2.51 3.30 5.54 0.00 0.76 -3.76 105.19 118.83 2kc0 n GLY 220 Ca 0.04 -2.12 -0.12 0.00 0.00 0.00 0.00 46.02 43.83 2kc0 n GLY 220 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kc0 s SER 221 N -0.91 -0.21 0.05 1.61 1.04 -0.04 -2.78 113.70 112.46 2kc0 s SER 221 Ca 0.00 -0.15 -0.05 0.00 0.48 0.00 0.00 55.95 56.23 2kc0 s SER 221 Cb 0.00 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.52 2kc0 s SER 221 CO 0.00 -0.69 0.08 -0.72 0.98 0.00 0.00 173.24 172.89 2kc0 s TYR 222 N -2.84 0.26 -0.11 5.02 1.13 -0.60 -1.63 117.35 118.59 2kc0 s TYR 222 Ca -0.03 -0.63 -0.05 0.00 -1.41 0.00 0.00 57.07 54.95 2kc0 s TYR 222 Cb 0.00 -0.18 0.05 0.00 -1.10 0.00 0.00 41.96 40.73 2kc0 s TYR 222 CO -0.05 -0.39 0.25 -1.12 -2.51 0.00 0.00 175.55 171.73 2kc0 s SER 223 N -2.39 -0.27 0.16 -0.18 0.01 0.04 -2.07 113.70 109.00 2kc0 s SER 223 Ca -0.01 0.53 0.04 0.00 1.31 0.00 0.00 55.95 57.82 2kc0 s SER 223 Cb 0.01 0.42 -0.05 0.00 0.21 0.00 0.00 66.02 66.62 2kc0 s SER 223 CO -0.07 -0.17 -0.08 -0.76 0.41 0.00 0.00 173.24 172.58 2kc0 s LEU 224 N 1.27 2.45 0.31 2.44 1.02 -0.50 -1.41 118.68 124.26 2kc0 s LEU 224 Ca -0.09 -1.05 0.07 0.00 0.02 0.00 0.00 54.13 53.07 2kc0 s LEU 224 Cb -0.10 -0.31 -0.06 0.00 0.02 0.00 0.00 46.19 45.74 2kc0 s LEU 224 CO -0.09 -0.38 -0.04 -0.83 0.02 0.00 0.00 176.35 175.04 2kc0 s GLY 225 N -3.18 2.01 -0.19 -3.19 0.00 -0.66 -0.75 107.32 101.35 2kc0 s GLY 225 Ca 0.19 -2.00 -0.09 0.00 0.00 0.00 0.00 44.72 42.81 2kc0 s GLY 225 CO 0.02 -1.90 0.11 -0.42 0.00 0.00 0.00 173.10 170.91 2kc0 s ILE 226 N -2.95 5.26 0.15 0.90 -1.09 -1.26 -3.59 121.20 118.62 2kc0 s ILE 226 Ca 0.32 0.14 0.10 0.00 -2.23 0.00 0.00 60.65 58.97 2kc0 s ILE 226 Cb 0.05 -3.39 -0.04 0.00 -1.58 0.00 0.00 42.46 37.50 2kc0 s ILE 226 CO 0.14 0.45 -0.23 -0.36 -1.23 0.00 0.00 174.94 173.71 2kc0 s PHE 227 N 0.33 2.06 0.00 3.97 0.40 -1.18 -2.97 117.98 120.59 2kc0 s PHE 227 Ca 0.07 -0.40 0.00 0.00 -0.60 0.00 0.00 56.93 56.00 2kc0 s PHE 227 Cb -0.11 -1.07 0.00 0.00 0.51 0.00 0.00 43.02 42.34 2kc0 s PHE 227 CO -0.01 0.35 0.00 0.41 0.70 0.00 0.00 175.22 176.66 2kc0 n GLY 228 N 0.64 -2.15 0.19 4.36 0.00 -0.88 -1.79 105.19 105.56 2kc0 n GLY 228 Ca -0.16 -1.48 0.09 0.00 0.00 0.00 0.00 46.02 44.47 2kc0 n GLY 228 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kc0 h GLY 229 N 0.00 0.00 0.00 -0.02 0.00 -1.99 -3.39 103.07 97.68 2kc0 h GLY 229 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2kc0 h GLY 229 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.71 2kc0 n LYS 230 N -2.23 0.00 -2.26 4.80 4.81 -1.26 -5.04 118.16 116.98 2kc0 n LYS 230 Ca -0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.41 2kc0 n LYS 230 Cb 0.25 0.00 0.08 0.00 0.02 0.00 0.00 35.03 35.38 2kc0 n LYS 230 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kc0 n ALA 231 N -1.50 1.16 -0.02 3.14 0.00 -1.26 -4.84 120.51 117.19 2kc0 n ALA 231 Ca 0.00 -0.65 -0.13 0.00 0.00 0.00 0.00 53.44 52.66 2kc0 n ALA 231 Cb 0.00 -0.71 -0.09 0.00 0.00 0.00 0.00 19.45 18.65 2kc0 n ALA 231 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2kc0 h GLN 232 N 0.65 0.08 -3.40 0.00 5.75 -1.64 -3.49 115.11 113.06 2kc0 h GLN 232 Ca -0.29 -0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.06 2kc0 h GLN 232 Cb 1.19 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.72 2kc0 h GLN 232 CO -0.12 0.56 0.11 -1.83 -2.65 0.00 0.00 178.83 174.89 2kc0 s GLU 233 N -4.20 2.12 0.12 1.69 -1.05 -1.25 -4.17 118.70 111.97 2kc0 s GLU 233 Ca -0.16 -1.55 0.08 0.00 -0.15 0.00 0.00 54.97 53.19 2kc0 s GLU 233 Cb 0.02 0.56 -0.04 0.00 -0.44 0.00 0.00 34.13 34.24 2kc0 s GLU 233 CO 0.69 -0.96 -0.18 0.08 0.95 0.00 0.00 175.26 175.85 2kc0 s VAL 234 N -2.59 1.61 0.02 1.83 1.01 -1.25 -3.13 120.40 117.90 2kc0 s VAL 234 Ca 0.21 -1.68 -0.26 0.00 0.00 0.00 0.00 61.98 60.25 2kc0 s VAL 234 Cb -0.03 -1.59 0.06 0.00 0.00 0.00 0.00 36.38 34.81 2kc0 s VAL 234 CO 0.15 -0.23 0.59 0.00 0.00 0.00 0.00 175.10 175.61 2kc0 s ALA 235 N -1.66 -1.54 0.00 5.51 0.00 -1.24 -3.23 121.76 119.61 2kc0 s ALA 235 Ca 0.09 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2kc0 s ALA 235 Cb -0.08 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.34 2kc0 s ALA 235 CO 0.05 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.73 2kc0 n GLY 236 N 0.52 -0.74 3.41 0.00 0.00 -0.52 -1.65 105.19 106.21 2kc0 n GLY 236 Ca -0.18 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.49 2kc0 n GLY 236 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kc0 s SER 237 N -4.00 -0.48 -0.07 1.61 1.04 -0.50 -1.54 113.70 109.76 2kc0 s SER 237 Ca 0.00 0.60 -0.01 0.00 0.48 0.00 0.00 55.95 57.03 2kc0 s SER 237 Cb 0.00 0.60 0.03 0.00 0.10 0.00 0.00 66.02 66.75 2kc0 s SER 237 CO 0.00 -0.46 -0.02 0.00 0.98 0.00 0.00 173.24 173.75 2kc0 s ALA 238 N -0.88 0.73 0.03 5.32 0.00 -0.16 -0.78 121.76 126.01 2kc0 s ALA 238 Ca -0.09 -0.13 0.08 0.00 0.00 0.00 0.00 51.96 51.81 2kc0 s ALA 238 Cb -0.03 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 2kc0 s ALA 238 CO 0.06 -0.31 -0.22 -1.21 0.00 0.00 0.00 175.76 174.08 2kc0 s GLU 239 N 1.61 2.02 -0.00 0.00 0.41 -0.64 -0.62 118.70 121.48 2kc0 s GLU 239 Ca -0.00 -0.99 0.00 0.00 -0.41 0.00 0.00 54.97 53.57 2kc0 s GLU 239 Cb -0.13 -2.12 -0.00 0.00 -1.78 0.00 0.00 34.13 30.11 2kc0 s GLU 239 CO -0.04 0.54 -0.01 0.54 -0.49 0.00 0.00 175.26 175.80 2kc0 s VAL 240 N -0.82 0.11 0.22 2.63 0.11 -0.20 -0.86 120.40 121.58 2kc0 s VAL 240 Ca 0.13 -0.05 -0.16 0.00 -2.93 0.00 0.00 61.98 58.96 2kc0 s VAL 240 Cb -0.10 -0.10 -0.08 0.00 -1.53 0.00 0.00 36.38 34.57 2kc0 s VAL 240 CO 0.03 0.03 0.66 -0.54 -3.33 0.00 0.00 175.10 171.95 2kc0 s LYS 241 N -0.00 4.08 0.17 1.54 1.02 -1.25 -0.55 119.74 124.75 2kc0 s LYS 241 Ca 0.00 0.66 -0.06 0.00 0.02 0.00 0.00 55.97 56.59 2kc0 s LYS 241 Cb -0.01 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.50 2kc0 s LYS 241 CO -0.00 0.36 0.23 -0.08 -0.92 0.00 0.00 175.35 174.94 2kc0 s THR 242 N -1.63 0.05 0.63 2.17 -1.32 -0.24 -4.54 115.64 110.77 2kc0 s THR 242 Ca 0.44 -1.63 0.30 0.00 -1.21 0.00 0.00 61.69 59.59 2kc0 s THR 242 Cb -0.14 -2.07 0.34 0.00 -1.51 0.00 0.00 72.50 69.12 2kc0 s THR 242 CO 0.20 -0.24 1.97 -0.37 -2.21 0.00 0.00 174.62 173.97 2kc0 h VAL 243 N 2.59 0.17 -0.00 5.08 -1.51 -2.01 0.10 116.25 120.68 2kc0 h VAL 243 Ca -0.33 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 2kc0 h VAL 243 Cb 1.23 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 2kc0 h VAL 243 CO 0.50 0.00 -0.28 0.59 -1.23 0.00 0.00 177.57 177.14 2kc0 n ASN 244 N -3.26 0.74 0.00 4.19 3.02 -1.26 -5.05 115.26 113.65 2kc0 n ASN 244 Ca 0.01 -0.60 0.00 0.00 -0.03 0.00 0.00 54.58 53.96 2kc0 n ASN 244 Cb 0.42 0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 2kc0 n ASN 244 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kc0 n GLY 245 N 1.38 1.33 3.12 7.41 0.00 0.36 -5.07 105.19 113.72 2kc0 n GLY 245 Ca 0.11 -0.75 -0.16 0.00 0.00 0.00 0.00 46.02 45.22 2kc0 n GLY 245 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kc0 s ILE 246 N 0.00 0.84 0.02 -0.61 1.10 -1.26 -1.08 121.20 120.21 2kc0 s ILE 246 Ca 0.00 -1.22 0.06 0.00 -0.51 0.00 0.00 60.65 58.98 2kc0 s ILE 246 Cb 0.00 -0.87 -0.02 0.00 0.15 0.00 0.00 42.46 41.72 2kc0 s ILE 246 CO 0.00 -0.31 -0.17 -0.60 -2.11 0.00 0.00 174.94 171.74 2kc0 s ARG 247 N -1.72 1.24 -0.06 3.50 6.06 0.28 -4.92 118.95 123.33 2kc0 s ARG 247 Ca -0.05 -0.76 0.03 0.00 -2.50 0.00 0.00 55.73 52.45 2kc0 s ARG 247 Cb -0.10 -1.26 -0.03 0.00 0.06 0.00 0.00 34.95 33.62 2kc0 s ARG 247 CO 0.01 0.33 -0.13 -1.01 -2.50 0.00 0.00 175.30 172.01 2kc0 s HIS 248 N -0.66 2.76 -0.04 5.12 3.76 -1.26 -1.04 115.29 123.93 2kc0 s HIS 248 Ca 0.05 -0.15 0.01 0.00 -0.15 0.00 0.00 55.06 54.82 2kc0 s HIS 248 Cb -0.08 -1.66 0.02 0.00 1.11 0.00 0.00 32.58 31.97 2kc0 s HIS 248 CO 0.01 0.19 -0.04 0.42 -0.85 0.00 0.00 174.74 174.46 2kc0 s ILE 249 N -0.66 0.51 0.19 0.60 1.01 0.21 -4.15 121.20 118.91 2kc0 s ILE 249 Ca 0.10 -0.11 -0.23 0.00 0.00 0.00 0.00 60.65 60.41 2kc0 s ILE 249 Cb -0.11 -0.53 -0.08 0.00 0.01 0.00 0.00 42.46 41.75 2kc0 s ILE 249 CO 0.01 0.21 0.75 -0.83 0.00 0.00 0.00 174.94 175.08 2kc0 s GLY 250 N 0.86 2.77 -0.12 6.18 0.00 -0.46 -0.99 107.32 115.57 2kc0 s GLY 250 Ca -0.11 0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.87 2kc0 s GLY 250 CO 0.00 0.71 -0.12 1.08 0.00 0.00 0.00 173.10 174.76 2kc0 s LEU 251 N -1.52 2.78 -0.30 0.66 2.01 -0.59 -2.24 118.68 119.49 2kc0 s LEU 251 Ca 0.39 -0.28 -0.25 0.00 0.01 0.00 0.00 54.13 54.00 2kc0 s LEU 251 Cb -0.20 -1.62 0.18 0.00 0.01 0.00 0.00 46.19 44.56 2kc0 s LEU 251 CO 0.23 0.20 1.38 0.00 1.01 0.00 0.00 176.35 179.17 2kc0 s ALA 252 N 0.15 -2.21 0.00 4.21 0.00 -1.11 -1.43 121.76 121.37 2kc0 s ALA 252 Ca -0.06 1.72 0.00 0.00 0.00 0.00 0.00 51.96 53.62 2kc0 s ALA 252 Cb -0.15 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.23 2kc0 s ALA 252 CO 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 175.76 175.68 2kc0 n ALA 253 N 1.75 0.00 -3.21 0.00 0.00 -1.20 -0.82 120.51 117.03 2kc0 n ALA 253 Ca -0.11 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.24 2kc0 n ALA 253 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.97 2kc0 n ALA 253 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2kc0 s LYS 254 N 3.20 1.45 0.00 0.00 2.20 -1.26 -3.90 119.74 121.43 2kc0 s LYS 254 Ca 0.00 -1.08 0.11 0.00 -0.36 0.00 0.00 55.97 54.64 2kc0 s LYS 254 Cb 0.00 0.49 0.66 0.00 -1.51 0.00 0.00 37.83 37.46 2kc0 s LYS 254 CO 0.00 -0.61 1.09 0.00 -0.36 0.00 0.00 175.35 175.48