#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jpt s VAL 2 N 0.00 3.46 0.01 2.62 1.01 -1.26 -4.22 120.40 122.02 1jpt s VAL 2 Ca 0.00 1.28 -0.00 0.00 0.00 0.00 0.00 61.98 63.26 1jpt s VAL 2 Cb 0.00 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 1jpt s VAL 2 CO 0.00 0.23 -0.01 -1.10 0.00 0.00 0.00 175.10 174.22 1jpt s GLN 3 N -0.57 0.12 -0.15 2.72 -0.21 0.25 -4.99 119.66 116.84 1jpt s GLN 3 Ca 0.51 -0.23 -0.01 0.00 0.02 0.00 0.00 55.36 55.66 1jpt s GLN 3 Cb -0.33 0.04 0.04 0.00 1.00 0.00 0.00 33.01 33.76 1jpt s GLN 3 CO 0.39 -0.02 -0.05 -0.51 -2.12 0.00 0.00 175.29 172.98 1jpt s LEU 4 N -0.55 1.42 -0.20 2.90 1.43 -1.26 -1.77 118.68 120.65 1jpt s LEU 4 Ca -0.06 -0.54 -0.01 0.00 -1.03 0.00 0.00 54.13 52.49 1jpt s LEU 4 Cb -0.04 -0.85 0.01 0.00 0.03 0.00 0.00 46.19 45.35 1jpt s LEU 4 CO -0.00 -0.17 -0.14 -0.69 0.23 0.00 0.00 176.35 175.57 1jpt s VAL 5 N 1.69 2.51 0.20 -1.59 1.01 -0.36 -3.87 120.40 119.97 1jpt s VAL 5 Ca 0.02 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1jpt s VAL 5 Cb -0.14 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1jpt s VAL 5 CO -0.08 0.46 0.35 -1.61 0.00 0.00 0.00 175.10 174.22 1jpt s GLU 6 N 1.34 3.47 0.23 2.72 2.02 -1.26 -0.45 118.70 126.78 1jpt s GLU 6 Ca 0.04 -0.50 -0.18 0.00 0.02 0.00 0.00 54.97 54.35 1jpt s GLU 6 Cb -0.14 -2.89 0.02 0.00 0.10 0.00 0.00 34.13 31.23 1jpt s GLU 6 CO -0.09 0.44 0.58 -1.54 0.02 0.00 0.00 175.26 174.66 1jpt s SER 7 N -3.37 -0.24 0.00 -0.19 1.04 -0.74 -4.97 113.70 105.24 1jpt s SER 7 Ca 0.36 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 56.19 1jpt s SER 7 Cb -0.11 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1jpt s SER 7 CO 0.29 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.96 1jpt n GLY 8 N -0.39 0.90 3.82 7.32 0.00 -1.26 -1.15 105.19 114.43 1jpt n GLY 8 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 1jpt n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jpt s GLY 9 N -1.30 1.70 0.00 -0.02 0.00 -1.26 -4.57 107.32 101.87 1jpt s GLY 9 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 43.68 1jpt s GLY 9 CO 0.00 -0.27 0.00 0.61 0.00 0.00 0.00 173.10 173.44 1jpt n GLY 10 N -2.83 0.73 3.72 0.20 0.00 -0.24 -5.00 105.19 101.76 1jpt n GLY 10 Ca 0.13 -2.10 -0.40 0.00 0.00 0.00 0.00 46.02 43.66 1jpt n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jpt s LEU 11 N 0.00 4.34 -0.00 0.99 2.96 -1.26 -1.03 118.68 124.67 1jpt s LEU 11 Ca 0.00 1.22 0.03 0.00 -0.22 0.00 0.00 54.13 55.16 1jpt s LEU 11 Cb 0.00 -3.10 -0.01 0.00 0.50 0.00 0.00 46.19 43.59 1jpt s LEU 11 CO 0.00 -0.09 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.15 1jpt s VAL 12 N 0.66 0.75 0.44 1.68 1.01 0.37 -4.93 120.40 120.39 1jpt s VAL 12 Ca 0.37 -0.45 -0.22 0.00 0.00 0.00 0.00 61.98 61.68 1jpt s VAL 12 Cb -0.18 -0.64 -0.08 0.00 0.00 0.00 0.00 36.38 35.48 1jpt s VAL 12 CO 0.19 0.18 1.08 -1.10 0.00 0.00 0.00 175.10 175.44 1jpt s GLN 13 N -0.32 3.92 0.31 2.72 -0.21 -1.26 -1.77 119.66 123.06 1jpt s GLN 13 Ca 0.03 1.54 -0.29 0.00 0.02 0.00 0.00 55.36 56.66 1jpt s GLN 13 Cb -0.04 -2.36 -0.12 0.00 1.00 0.00 0.00 33.01 31.48 1jpt s GLN 13 CO -0.00 -0.36 1.40 -2.30 -2.12 0.00 0.00 175.29 171.91 1jpt n PRO 14 N -0.48 2.27 -0.04 2.91 -0.02 -1.26 -0.50 135.00 137.89 1jpt n PRO 14 Ca 0.07 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1jpt n PRO 14 Cb 0.50 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1jpt n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jpt n GLY 15 N 1.38 1.79 0.00 -1.23 0.00 0.17 -4.91 105.19 102.38 1jpt n GLY 15 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1jpt n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jpt n GLY 16 N -2.00 -0.14 3.21 -0.02 0.00 0.34 -3.88 105.19 102.70 1jpt n GLY 16 Ca 0.00 -1.76 -0.22 0.00 0.00 0.00 0.00 46.02 44.04 1jpt n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jpt s SER 17 N -1.00 2.09 0.04 1.61 0.01 -1.26 -1.76 113.70 113.43 1jpt s SER 17 Ca 0.00 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1jpt s SER 17 Cb 0.00 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 1jpt s SER 17 CO 0.00 0.05 0.16 -1.48 0.41 0.00 0.00 173.24 172.38 1jpt s LEU 18 N -1.48 4.19 -0.27 2.44 0.05 0.01 -4.95 118.68 118.66 1jpt s LEU 18 Ca 0.03 0.21 -0.03 0.00 0.05 0.00 0.00 54.13 54.39 1jpt s LEU 18 Cb -0.09 -2.72 0.11 0.00 -2.05 0.00 0.00 46.19 41.44 1jpt s LEU 18 CO 0.02 0.20 0.18 -0.13 -0.55 0.00 0.00 176.35 176.07 1jpt s ARG 19 N -2.30 0.21 0.06 1.48 0.52 -1.26 -2.17 118.95 115.50 1jpt s ARG 19 Ca 0.31 -0.33 0.05 0.00 -0.52 0.00 0.00 55.73 55.23 1jpt s ARG 19 Cb -0.13 -1.09 -0.04 0.00 0.52 0.00 0.00 34.95 34.21 1jpt s ARG 19 CO 0.23 -0.96 -0.05 -0.51 0.02 0.00 0.00 175.30 174.03 1jpt s LEU 20 N 2.19 3.24 0.14 2.53 1.43 -0.06 -4.51 118.68 123.64 1jpt s LEU 20 Ca 0.08 -0.22 0.10 0.00 -1.03 0.00 0.00 54.13 53.07 1jpt s LEU 20 Cb -0.15 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1jpt s LEU 20 CO -0.32 0.22 -0.23 -0.44 0.23 0.00 0.00 176.35 175.81 1jpt s SER 21 N -1.93 3.53 -0.33 2.29 0.01 -0.30 -1.55 113.70 115.41 1jpt s SER 21 Ca 0.21 -0.72 -0.01 0.00 1.31 0.00 0.00 55.95 56.74 1jpt s SER 21 Cb -0.11 -0.33 0.11 0.00 0.21 0.00 0.00 66.02 65.90 1jpt s SER 21 CO 0.13 0.16 0.14 0.00 0.41 0.00 0.00 173.24 174.08 1jpt s ALA 23 N 1.44 3.58 0.06 0.00 0.00 0.41 -1.88 121.76 125.37 1jpt s ALA 23 Ca 0.12 -0.24 -0.05 0.00 0.00 0.00 0.00 51.96 51.79 1jpt s ALA 23 Cb -0.19 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 19.79 1jpt s ALA 23 CO -0.20 -0.72 0.30 0.00 0.00 0.00 0.00 175.76 175.14 1jpt s ALA 24 N 2.31 3.85 -0.03 0.00 0.00 -0.56 -1.23 121.76 126.11 1jpt s ALA 24 Ca 0.31 -0.60 -0.10 0.00 0.00 0.00 0.00 51.96 51.57 1jpt s ALA 24 Cb -0.16 -2.06 0.01 0.00 0.00 0.00 0.00 23.12 20.92 1jpt s ALA 24 CO 0.09 0.68 0.23 -1.54 0.00 0.00 0.00 175.76 175.22 1jpt s SER 25 N -2.03 -0.12 0.00 0.00 1.04 -0.73 -4.87 113.70 106.99 1jpt s SER 25 Ca 0.33 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1jpt s SER 25 Cb -0.13 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1jpt s SER 25 CO 0.20 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.71 1jpt n GLY 26 N 1.77 0.68 3.76 7.32 0.00 -1.26 -0.58 105.19 116.89 1jpt n GLY 26 Ca -0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 1jpt n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1jpt s PHE 27 N -2.33 -0.15 -0.30 1.61 -0.12 -1.26 -4.65 117.98 110.79 1jpt s PHE 27 Ca 0.00 -0.18 -0.10 0.00 -0.05 0.00 0.00 56.93 56.60 1jpt s PHE 27 Cb 0.00 0.65 -0.03 0.00 -0.63 0.00 0.00 43.02 43.01 1jpt s PHE 27 CO 0.00 -0.90 0.17 1.21 -0.05 0.00 0.00 175.22 175.65 1jpt s ASN 28 N -2.93 5.74 0.66 1.98 3.84 -1.26 -4.97 114.94 118.01 1jpt s ASN 28 Ca 0.12 -0.28 0.38 0.00 0.21 0.00 0.00 52.86 53.29 1jpt s ASN 28 Cb -0.02 -2.06 2.08 0.00 -0.55 0.00 0.00 41.25 40.70 1jpt s ASN 28 CO 0.03 -0.13 2.19 0.16 -2.79 0.00 0.00 177.10 176.55 1jpt h ILE 29 N 5.51 0.04 -0.01 -5.21 3.07 -1.93 -1.33 117.51 117.65 1jpt h ILE 29 Ca -0.34 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.07 1jpt h ILE 29 Cb 1.17 0.86 -0.00 0.00 -0.27 0.00 0.00 36.82 38.58 1jpt h ILE 29 CO 0.59 0.00 0.01 0.50 -1.05 0.00 0.00 178.15 178.20 1jpt h LYS 30 N 0.00 0.00 -0.02 0.16 3.11 -1.93 -2.21 116.57 115.67 1jpt h LYS 30 Ca 0.01 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1jpt h LYS 30 Cb 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 1jpt h LYS 30 CO -0.00 0.00 0.00 0.39 -2.81 0.00 0.00 179.45 177.03 1jpt n GLU 31 N -4.01 1.70 -4.21 1.90 1.02 -0.50 -3.87 120.64 112.67 1jpt n GLU 31 Ca -0.03 -1.02 -0.12 0.00 -0.02 0.00 0.00 57.16 55.97 1jpt n GLU 31 Cb 0.09 -1.48 -0.10 0.00 -0.02 0.00 0.00 31.44 29.93 1jpt n GLU 31 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1jpt s TYR 32 N -2.00 1.19 0.03 -0.32 1.51 -0.83 -5.08 117.35 111.85 1jpt s TYR 32 Ca 0.37 -1.33 -0.17 0.00 -1.01 0.00 0.00 57.07 54.93 1jpt s TYR 32 Cb 0.21 -0.60 -0.06 0.00 -0.11 0.00 0.00 41.96 41.40 1jpt s TYR 32 CO 0.33 -0.58 0.48 0.71 -1.11 0.00 0.00 175.55 175.39 1jpt s TYR 33 N -4.08 3.76 -0.11 2.71 2.02 -1.22 -4.00 117.35 116.42 1jpt s TYR 33 Ca 0.37 1.12 0.00 0.00 -0.37 0.00 0.00 57.07 58.19 1jpt s TYR 33 Cb 0.07 -2.39 -0.02 0.00 -0.40 0.00 0.00 41.96 39.22 1jpt s TYR 33 CO 0.11 0.60 -0.13 -1.64 -1.57 0.00 0.00 175.55 172.93 1jpt s MET 34 N -1.03 3.21 0.30 -0.62 -1.94 -0.52 -1.68 119.30 117.02 1jpt s MET 34 Ca 0.26 -0.68 0.11 0.00 -1.71 0.00 0.00 55.69 53.67 1jpt s MET 34 Cb -0.18 -2.59 -0.06 0.00 2.01 0.00 0.00 34.83 34.02 1jpt s MET 34 CO 0.16 0.31 -0.16 -1.01 -0.01 0.00 0.00 175.02 174.30 1jpt s HIS 35 N 0.11 2.31 -0.05 -0.03 3.76 0.13 -1.33 115.29 120.19 1jpt s HIS 35 Ca -0.06 -0.40 0.06 0.00 -0.15 0.00 0.00 55.06 54.52 1jpt s HIS 35 Cb -0.15 -1.12 -0.01 0.00 1.11 0.00 0.00 32.58 32.41 1jpt s HIS 35 CO 0.05 0.66 -0.24 -1.58 -0.85 0.00 0.00 174.74 172.78 1jpt s TRP 36 N -2.56 2.26 0.01 1.40 0.52 -0.46 -0.56 118.94 119.55 1jpt s TRP 36 Ca 0.31 -0.61 0.01 0.00 0.02 0.00 0.00 56.10 55.83 1jpt s TRP 36 Cb -0.02 -1.48 -0.01 0.00 -1.15 0.00 0.00 33.47 30.81 1jpt s TRP 36 CO 0.15 -0.17 -0.05 0.08 0.02 0.00 0.00 176.95 176.99 1jpt s VAL 37 N -0.23 0.35 0.30 4.03 1.01 -0.41 -1.00 120.40 124.44 1jpt s VAL 37 Ca -0.01 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.53 1jpt s VAL 37 Cb -0.12 -0.36 -0.06 0.00 0.00 0.00 0.00 36.38 35.84 1jpt s VAL 37 CO 0.02 -0.10 0.03 0.00 0.00 0.00 0.00 175.10 175.06 1jpt s ARG 38 N -0.62 1.57 -0.23 2.72 1.70 -0.33 -0.13 118.95 123.62 1jpt s ARG 38 Ca -0.03 -1.84 -0.03 0.00 -0.47 0.00 0.00 55.73 53.35 1jpt s ARG 38 Cb -0.05 -0.83 0.13 0.00 -0.57 0.00 0.00 34.95 33.62 1jpt s ARG 38 CO -0.00 -0.14 0.36 -1.14 -1.08 0.00 0.00 175.30 173.30 1jpt s GLN 39 N -3.87 0.33 0.60 3.89 0.74 -0.33 -0.73 119.66 120.29 1jpt s GLN 39 Ca 0.34 0.54 -0.18 0.00 0.05 0.00 0.00 55.36 56.11 1jpt s GLN 39 Cb 0.07 -0.49 -0.03 0.00 1.10 0.00 0.00 33.01 33.67 1jpt s GLN 39 CO 0.14 -0.61 1.15 0.00 -0.55 0.00 0.00 175.29 175.42 1jpt s ALA 40 N 2.53 2.55 -0.15 1.58 0.00 -1.26 -1.13 121.76 125.87 1jpt s ALA 40 Ca 0.11 0.80 -0.39 0.00 0.00 0.00 0.00 51.96 52.48 1jpt s ALA 40 Cb -0.15 -3.38 -0.16 0.00 0.00 0.00 0.00 23.12 19.42 1jpt s ALA 40 CO -0.15 -1.09 1.58 -2.30 0.00 0.00 0.00 175.76 173.80 1jpt n PRO 41 N -1.78 1.09 -0.89 0.00 -0.02 -1.26 -0.90 135.00 131.23 1jpt n PRO 41 Ca 0.12 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1jpt n PRO 41 Cb 0.51 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1jpt n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jpt n GLY 42 N 3.53 0.38 2.02 -1.23 0.00 -1.26 -5.00 105.19 103.63 1jpt n GLY 42 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.11 1jpt n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jpt n LYS 43 N -1.51 1.13 -1.93 1.61 4.76 -0.08 -5.14 118.16 116.99 1jpt n LYS 43 Ca 0.00 -1.88 -0.30 0.00 -2.87 0.00 0.00 58.31 53.26 1jpt n LYS 43 Cb 0.13 0.28 0.18 0.00 -1.84 0.00 0.00 35.03 33.78 1jpt n LYS 43 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1jpt s GLY 44 N -2.86 1.76 0.40 0.72 0.00 -1.26 -4.67 107.32 101.41 1jpt s GLY 44 Ca 0.12 -1.14 -0.24 0.00 0.00 0.00 0.00 44.72 43.47 1jpt s GLY 44 CO 0.08 -0.40 1.01 1.08 0.00 0.00 0.00 173.10 174.87 1jpt s LEU 45 N -5.86 4.12 -0.03 0.66 1.43 -1.26 -4.23 118.68 113.49 1jpt s LEU 45 Ca 0.73 1.93 -0.00 0.00 -1.03 0.00 0.00 54.13 55.76 1jpt s LEU 45 Cb -0.05 -4.25 0.03 0.00 0.03 0.00 0.00 46.19 41.95 1jpt s LEU 45 CO 0.53 -0.42 0.01 -0.70 0.23 0.00 0.00 176.35 175.99 1jpt s GLU 46 N -2.60 0.29 0.04 1.70 2.12 0.10 -4.99 118.70 115.36 1jpt s GLU 46 Ca 0.58 0.11 -0.30 0.00 0.36 0.00 0.00 54.97 55.72 1jpt s GLU 46 Cb -0.19 -0.54 -0.04 0.00 0.26 0.00 0.00 34.13 33.63 1jpt s GLU 46 CO 0.24 -0.17 0.99 -0.46 -0.54 0.00 0.00 175.26 175.31 1jpt s TRP 47 N 1.24 3.69 -0.24 5.30 -0.00 -1.26 -1.18 118.94 126.49 1jpt s TRP 47 Ca -0.07 1.71 -0.16 0.00 -0.00 0.00 0.00 56.10 57.58 1jpt s TRP 47 Cb -0.13 -3.12 -0.13 0.00 -0.00 0.00 0.00 33.47 30.09 1jpt s TRP 47 CO -0.02 -0.02 -0.17 0.28 -0.00 0.00 0.00 176.95 177.02 1jpt n VAL 48 N 3.55 1.52 -0.79 5.86 0.31 -0.17 -4.65 118.33 123.96 1jpt n VAL 48 Ca 0.05 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1jpt n VAL 48 Cb 0.50 -2.00 0.00 0.00 -0.91 0.00 0.00 33.84 31.43 1jpt n VAL 48 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jpt n GLY 49 N 1.35 -1.94 3.22 2.92 0.00 -1.14 -1.10 105.19 108.49 1jpt n GLY 49 Ca -0.42 -1.15 -0.10 0.00 0.00 0.00 0.00 46.02 44.36 1jpt n GLY 49 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1jpt s LEU 50 N 0.00 1.47 0.01 0.99 0.05 -0.13 -1.35 118.68 119.72 1jpt s LEU 50 Ca 0.00 -1.08 0.00 0.00 0.05 0.00 0.00 54.13 53.10 1jpt s LEU 50 Cb 0.00 0.64 -0.01 0.00 -2.05 0.00 0.00 46.19 44.77 1jpt s LEU 50 CO 0.00 -0.79 -0.01 -0.51 -0.55 0.00 0.00 176.35 174.49 1jpt s ILE 51 N -4.02 0.05 -0.49 1.48 2.07 -0.44 -2.01 121.20 117.84 1jpt s ILE 51 Ca 0.21 -0.36 -0.16 0.00 -1.41 0.00 0.00 60.65 58.94 1jpt s ILE 51 Cb 0.06 -0.12 0.09 0.00 0.13 0.00 0.00 42.46 42.62 1jpt s ILE 51 CO 0.01 -0.19 0.45 -0.62 -1.91 0.00 0.00 174.94 172.68 1jpt s ASP 52 N -0.57 6.17 0.44 4.50 -1.08 0.11 -1.44 116.67 124.79 1jpt s ASP 52 Ca -0.06 -1.40 0.30 0.00 -0.52 0.00 0.00 52.55 50.87 1jpt s ASP 52 Cb -0.04 -2.20 1.56 0.00 -1.46 0.00 0.00 42.92 40.78 1jpt s ASP 52 CO -0.00 -0.73 1.91 -0.65 0.52 0.00 0.00 175.17 176.22 1jpt h PRO 53 N 8.82 0.00 -0.11 4.34 0.11 -1.76 0.99 132.00 144.39 1jpt h PRO 53 Ca -0.29 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.82 1jpt h PRO 53 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1jpt h PRO 53 CO 0.93 0.00 0.07 1.49 -0.21 0.00 0.00 178.00 180.28 1jpt h GLU 54 N 0.00 0.15 0.00 1.05 4.57 -1.84 -3.35 114.58 115.16 1jpt h GLU 54 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1jpt h GLU 54 Cb 0.07 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 1jpt h GLU 54 CO 0.00 0.13 0.00 0.00 -1.18 0.00 0.00 179.01 177.96 1jpt n GLN 55 N -4.99 1.12 -0.82 1.92 0.00 -1.12 -5.03 117.38 108.46 1jpt n GLN 55 Ca -0.05 -0.88 0.00 0.00 0.00 0.00 0.00 57.00 56.07 1jpt n GLN 55 Cb 0.04 -0.80 0.00 0.00 0.00 0.00 0.00 30.24 29.48 1jpt n GLN 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1jpt n GLY 56 N -0.22 0.85 3.77 2.61 0.00 0.33 -5.02 105.19 107.50 1jpt n GLY 56 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1jpt n GLY 56 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jpt s ASN 57 N -2.81 6.06 0.11 1.61 0.01 -1.24 -4.74 114.94 113.94 1jpt s ASN 57 Ca 0.00 2.76 0.03 0.00 -0.71 0.00 0.00 52.86 54.95 1jpt s ASN 57 Cb 0.00 -2.64 -0.04 0.00 0.41 0.00 0.00 41.25 38.98 1jpt s ASN 57 CO 0.00 -1.03 -0.09 0.42 -1.51 0.00 0.00 177.10 174.88 1jpt s THR 58 N -1.25 0.93 -0.03 1.60 -4.23 -1.26 -0.72 115.64 110.69 1jpt s THR 58 Ca 0.60 -1.78 -0.01 0.00 -1.18 0.00 0.00 61.69 59.32 1jpt s THR 58 Cb -0.40 -1.52 0.02 0.00 1.34 0.00 0.00 72.50 71.94 1jpt s THR 58 CO 0.52 -0.66 0.05 -0.63 -0.54 0.00 0.00 174.62 173.35 1jpt s ILE 59 N -2.86 -0.04 0.14 2.99 1.01 -0.85 -5.00 121.20 116.58 1jpt s ILE 59 Ca 0.09 0.16 0.11 0.00 0.00 0.00 0.00 60.65 61.01 1jpt s ILE 59 Cb -0.00 -0.10 -0.04 0.00 0.01 0.00 0.00 42.46 42.33 1jpt s ILE 59 CO -0.01 0.06 -0.26 -0.31 0.00 0.00 0.00 174.94 174.43 1jpt s TYR 60 N 0.83 2.33 0.29 3.97 2.02 -1.26 -0.95 117.35 124.58 1jpt s TYR 60 Ca -0.07 -0.37 -0.29 0.00 -0.37 0.00 0.00 57.07 55.97 1jpt s TYR 60 Cb -0.10 -1.25 -0.10 0.00 -0.40 0.00 0.00 41.96 40.12 1jpt s TYR 60 CO -0.03 0.36 1.43 0.34 -1.57 0.00 0.00 175.55 176.09 1jpt s ASP 61 N -2.15 6.61 0.56 2.29 -1.08 -0.26 -4.78 116.67 117.86 1jpt s ASP 61 Ca 0.15 2.75 0.36 0.00 -0.52 0.00 0.00 52.55 55.29 1jpt s ASP 61 Cb -0.10 -2.64 1.51 0.00 -1.46 0.00 0.00 42.92 40.23 1jpt s ASP 61 CO 0.07 -0.71 1.76 -0.65 0.52 0.00 0.00 175.17 176.17 1jpt h PRO 62 N 4.40 0.00 0.00 4.34 0.11 -1.96 0.10 132.00 139.00 1jpt h PRO 62 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1jpt h PRO 62 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1jpt h PRO 62 CO 0.73 0.00 -0.11 0.87 -0.21 0.00 0.00 178.00 179.29 1jpt h LYS 63 N 0.00 0.00 -0.01 1.05 1.57 -1.96 -3.15 116.57 114.08 1jpt h LYS 63 Ca 0.53 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.31 1jpt h LYS 63 Cb 2.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.57 1jpt h LYS 63 CO -0.01 0.11 -0.22 1.19 -0.57 0.00 0.00 179.45 179.95 1jpt n PHE 64 N -3.66 0.00 -0.32 -1.35 3.72 0.32 -4.69 117.46 111.47 1jpt n PHE 64 Ca -0.02 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.56 1jpt n PHE 64 Cb 0.22 0.00 0.38 0.00 -0.94 0.00 0.00 39.48 39.14 1jpt n PHE 64 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1jpt h GLN 65 N 0.94 0.24 0.00 -1.08 5.75 -1.41 0.20 115.11 119.74 1jpt h GLN 65 Ca 0.00 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1jpt h GLN 65 Cb 0.31 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.81 1jpt h GLN 65 CO 0.00 0.16 -0.55 0.38 -2.65 0.00 0.00 178.83 176.17 1jpt h ASP 66 N 0.24 0.00 0.00 -0.69 2.03 -1.84 -3.39 116.42 112.78 1jpt h ASP 66 Ca 0.64 -0.13 0.00 0.00 -0.73 0.00 0.00 57.03 56.82 1jpt h ASP 66 Cb 1.40 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.90 1jpt h ASP 66 CO -0.65 0.06 -0.41 -2.11 -1.03 0.00 0.00 179.24 175.11 1jpt n ARG 67 N -2.32 4.30 -4.08 4.15 1.85 -0.51 -5.02 116.66 115.03 1jpt n ARG 67 Ca 0.03 -0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.57 1jpt n ARG 67 Cb 0.47 -0.72 -0.07 0.00 -1.05 0.00 0.00 32.46 31.09 1jpt n ARG 67 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1jpt s ALA 68 N -1.45 3.47 -0.07 2.89 0.00 0.58 -1.11 121.76 126.07 1jpt s ALA 68 Ca 0.00 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 1jpt s ALA 68 Cb 0.01 -1.35 0.04 0.00 0.00 0.00 0.00 23.12 21.82 1jpt s ALA 68 CO 0.05 0.73 0.05 0.99 0.00 0.00 0.00 175.76 177.58 1jpt s THR 69 N -1.36 0.01 -0.15 0.00 2.01 0.87 -4.84 115.64 112.18 1jpt s THR 69 Ca 0.28 0.23 -0.07 0.00 0.31 0.00 0.00 61.69 62.44 1jpt s THR 69 Cb -0.12 -0.33 -0.04 0.00 0.01 0.00 0.00 72.50 72.02 1jpt s THR 69 CO 0.21 0.10 0.10 -0.63 -0.69 0.00 0.00 174.62 173.71 1jpt s ILE 70 N 2.12 5.15 0.30 1.82 1.01 -1.26 -0.54 121.20 129.79 1jpt s ILE 70 Ca 0.04 0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.75 1jpt s ILE 70 Cb -0.13 -3.27 -0.01 0.00 0.01 0.00 0.00 42.46 39.06 1jpt s ILE 70 CO -0.05 0.54 0.39 -0.94 0.00 0.00 0.00 174.94 174.89 1jpt s SER 71 N -0.39 0.70 -0.03 3.58 1.04 -0.66 -4.98 113.70 112.96 1jpt s SER 71 Ca 0.10 -1.40 -0.21 0.00 0.48 0.00 0.00 55.95 54.93 1jpt s SER 71 Cb -0.12 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.63 1jpt s SER 71 CO 0.02 -1.16 0.44 0.00 0.98 0.00 0.00 173.24 173.51 1jpt s ALA 72 N -3.47 -1.13 -0.31 5.32 0.00 -1.26 0.16 121.76 121.07 1jpt s ALA 72 Ca 0.32 0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.97 1jpt s ALA 72 Cb 0.01 0.05 0.09 0.00 0.00 0.00 0.00 23.12 23.27 1jpt s ALA 72 CO 0.18 -0.30 0.03 0.34 0.00 0.00 0.00 175.76 176.01 1jpt s ASP 73 N -1.28 4.40 0.35 0.00 -1.08 0.77 -5.00 116.67 114.83 1jpt s ASP 73 Ca -0.13 -1.80 0.04 0.00 -0.52 0.00 0.00 52.55 50.15 1jpt s ASP 73 Cb -0.03 -1.35 0.65 0.00 -1.46 0.00 0.00 42.92 40.72 1jpt s ASP 73 CO 0.06 -0.35 1.92 0.78 0.52 0.00 0.00 175.17 178.10 1jpt h ASN 74 N 7.80 0.52 0.42 -0.34 2.35 -1.91 0.14 115.58 124.55 1jpt h ASN 74 Ca -0.10 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.55 1jpt h ASN 74 Cb 1.03 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.26 1jpt h ASN 74 CO 0.48 0.52 -0.13 0.77 -1.65 0.00 0.00 177.43 177.43 1jpt h SER 75 N 0.55 0.00 -0.05 5.81 4.64 -1.95 -0.46 113.55 122.09 1jpt h SER 75 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1jpt h SER 75 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1jpt h SER 75 CO -0.00 0.13 0.00 0.29 -0.87 0.00 0.00 176.83 176.38 1jpt n LYS 76 N -3.61 1.63 -3.89 4.77 5.02 -0.86 -4.97 118.16 116.23 1jpt n LYS 76 Ca -0.02 -1.64 -0.24 0.00 -2.02 0.00 0.00 58.31 54.39 1jpt n LYS 76 Cb 0.26 -1.36 -0.01 0.00 -0.02 0.00 0.00 35.03 33.90 1jpt n LYS 76 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1jpt n ASN 77 N 1.05 -0.50 -4.02 4.39 5.15 0.42 -4.71 115.26 117.04 1jpt n ASN 77 Ca 0.11 -0.97 -0.18 0.00 -0.60 0.00 0.00 54.58 52.95 1jpt n ASN 77 Cb 0.47 -3.28 -0.14 0.00 -0.53 0.00 0.00 39.78 36.30 1jpt n ASN 77 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1jpt s THR 78 N -3.90 0.67 0.16 -0.44 2.01 -0.78 -1.49 115.64 111.87 1jpt s THR 78 Ca 0.00 -0.46 0.06 0.00 0.31 0.00 0.00 61.69 61.60 1jpt s THR 78 Cb -0.00 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.89 1jpt s THR 78 CO 0.87 0.12 0.03 0.00 -0.69 0.00 0.00 174.62 174.94 1jpt s ALA 79 N -0.35 3.29 0.08 7.40 0.00 -0.79 -0.16 121.76 131.22 1jpt s ALA 79 Ca 0.02 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.70 1jpt s ALA 79 Cb -0.04 -1.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.95 1jpt s ALA 79 CO -0.00 0.52 -0.06 0.71 0.00 0.00 0.00 175.76 176.93 1jpt s TYR 80 N -1.66 0.78 -0.05 0.00 1.51 0.12 -1.03 117.35 117.02 1jpt s TYR 80 Ca 0.28 -0.82 0.01 0.00 -1.01 0.00 0.00 57.07 55.52 1jpt s TYR 80 Cb -0.10 -0.47 0.02 0.00 -0.11 0.00 0.00 41.96 41.31 1jpt s TYR 80 CO 0.19 -0.16 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.26 1jpt s LEU 81 N -2.63 1.24 -0.02 -1.29 2.96 -0.60 -1.66 118.68 116.68 1jpt s LEU 81 Ca 0.05 -0.13 0.06 0.00 -0.22 0.00 0.00 54.13 53.89 1jpt s LEU 81 Cb 0.01 -0.47 -0.01 0.00 0.50 0.00 0.00 46.19 46.23 1jpt s LEU 81 CO -0.04 -0.07 -0.19 -1.58 -1.32 0.00 0.00 176.35 173.15 1jpt s GLN 82 N 1.06 1.58 -0.02 1.98 0.74 0.29 -0.88 119.66 124.41 1jpt s GLN 82 Ca -0.09 -0.67 0.00 0.00 0.05 0.00 0.00 55.36 54.66 1jpt s GLN 82 Cb -0.14 -1.50 0.02 0.00 1.10 0.00 0.00 33.01 32.49 1jpt s GLN 82 CO -0.01 0.38 0.00 1.41 -0.55 0.00 0.00 175.29 176.53 1jpt s MET 83 N -0.37 0.22 0.51 1.67 1.75 -0.92 -0.09 119.30 122.07 1jpt s MET 83 Ca 0.05 0.07 0.05 0.00 -1.25 0.00 0.00 55.69 54.62 1jpt s MET 83 Cb -0.08 -0.39 0.01 0.00 2.84 0.00 0.00 34.83 37.22 1jpt s MET 83 CO -0.00 -0.11 0.33 0.54 -0.65 0.00 0.00 175.02 175.13 1jpt s ASN 84 N 0.84 4.59 -1.37 1.11 2.20 -0.27 -0.81 114.94 121.23 1jpt s ASN 84 Ca -0.08 -1.21 -0.06 0.00 -0.94 0.00 0.00 52.86 50.56 1jpt s ASN 84 Cb -0.11 0.20 0.03 0.00 -2.00 0.00 0.00 41.25 39.36 1jpt s ASN 84 CO -0.02 -0.95 0.92 -1.20 -2.94 0.00 0.00 177.10 172.91 1jpt n SER 85 N -1.61 -3.37 -4.76 3.54 7.64 -0.97 -4.89 113.62 109.19 1jpt n SER 85 Ca -0.03 -0.73 -0.39 0.00 1.01 0.00 0.00 58.87 58.74 1jpt n SER 85 Cb 0.64 -4.34 0.00 0.00 -1.01 0.00 0.00 64.21 59.51 1jpt n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1jpt s LEU 86 N -6.93 4.09 0.39 -3.43 1.43 -0.72 -4.63 118.68 108.87 1jpt s LEU 86 Ca 0.31 2.61 0.04 0.00 -1.03 0.00 0.00 54.13 56.06 1jpt s LEU 86 Cb -0.15 -4.06 -0.03 0.00 0.03 0.00 0.00 46.19 41.98 1jpt s LEU 86 CO 0.79 -1.03 0.12 -0.13 0.23 0.00 0.00 176.35 176.33 1jpt s ARG 87 N -2.49 1.86 0.29 1.70 0.52 -1.26 0.44 118.95 120.00 1jpt s ARG 87 Ca 0.62 -2.12 0.03 0.00 -0.52 0.00 0.00 55.73 53.74 1jpt s ARG 87 Cb -0.37 -0.62 0.63 0.00 0.52 0.00 0.00 34.95 35.11 1jpt s ARG 87 CO 0.46 -0.43 1.79 0.00 0.02 0.00 0.00 175.30 177.14 1jpt h ALA 88 N 1.87 1.53 0.00 2.13 0.00 -1.97 0.04 119.26 122.86 1jpt h ALA 88 Ca -0.36 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1jpt h ALA 88 Cb 1.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1jpt h ALA 88 CO 0.59 0.04 0.00 0.93 0.00 0.00 0.00 179.25 180.81 1jpt h GLU 89 N 0.81 0.00 -0.01 0.00 3.07 -1.96 -1.01 114.58 115.49 1jpt h GLU 89 Ca 0.52 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.38 1jpt h GLU 89 Cb 0.70 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1jpt h GLU 89 CO -0.34 0.00 -0.15 -0.25 -1.40 0.00 0.00 179.01 176.88 1jpt n ASP 90 N -2.73 0.86 -4.68 1.42 8.00 -0.00 -4.83 116.55 114.60 1jpt n ASP 90 Ca -0.02 -0.89 -0.42 0.00 0.71 0.00 0.00 54.79 54.17 1jpt n ASP 90 Cb 0.06 0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 1jpt n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1jpt s THR 91 N -2.38 3.24 -0.05 -3.53 2.01 -0.38 -4.87 115.64 109.67 1jpt s THR 91 Ca 0.29 0.57 -0.31 0.00 0.31 0.00 0.00 61.69 62.55 1jpt s THR 91 Cb 0.20 -3.37 0.13 0.00 0.01 0.00 0.00 72.50 69.47 1jpt s THR 91 CO 0.46 -0.02 1.28 0.00 -0.69 0.00 0.00 174.62 175.66 1jpt s ALA 92 N 3.10 -2.22 -0.19 7.40 0.00 -0.68 -4.36 121.76 124.80 1jpt s ALA 92 Ca 0.74 0.88 -0.19 0.00 0.00 0.00 0.00 51.96 53.39 1jpt s ALA 92 Cb -0.37 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 1jpt s ALA 92 CO 0.32 -0.97 0.54 0.08 0.00 0.00 0.00 175.76 175.72 1jpt s VAL 93 N -2.40 5.10 -0.17 0.00 1.01 -0.29 -0.77 120.40 122.88 1jpt s VAL 93 Ca 0.13 0.99 -0.07 0.00 0.00 0.00 0.00 61.98 63.04 1jpt s VAL 93 Cb 0.04 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1jpt s VAL 93 CO -0.04 0.17 0.05 -0.31 0.00 0.00 0.00 175.10 174.97 1jpt s TYR 94 N 1.63 3.23 0.07 5.22 1.51 -0.15 -1.19 117.35 127.66 1jpt s TYR 94 Ca 0.25 0.04 0.08 0.00 -1.01 0.00 0.00 57.07 56.43 1jpt s TYR 94 Cb -0.15 -2.05 -0.03 0.00 -0.11 0.00 0.00 41.96 39.61 1jpt s TYR 94 CO 0.10 0.15 -0.21 0.71 -1.11 0.00 0.00 175.55 175.19 1jpt s TYR 95 N 0.30 2.48 0.12 2.71 1.51 0.81 -1.72 117.35 123.57 1jpt s TYR 95 Ca 0.03 -0.30 0.06 0.00 -1.01 0.00 0.00 57.07 55.84 1jpt s TYR 95 Cb -0.13 -1.40 -0.04 0.00 -0.11 0.00 0.00 41.96 40.28 1jpt s TYR 95 CO 0.01 0.26 0.01 0.00 -1.11 0.00 0.00 175.55 174.72 1jpt s ALA 97 N -1.48 -0.51 -0.17 0.00 0.00 0.27 -0.74 121.76 119.12 1jpt s ALA 97 Ca 0.27 0.32 -0.18 0.00 0.00 0.00 0.00 51.96 52.37 1jpt s ALA 97 Cb -0.11 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1jpt s ALA 97 CO 0.19 -0.16 0.49 0.50 0.00 0.00 0.00 175.76 176.78 1jpt s ARG 98 N -0.61 4.23 -0.23 0.00 3.52 -0.48 -0.69 118.95 124.68 1jpt s ARG 98 Ca -0.07 0.40 -0.07 0.00 -0.13 0.00 0.00 55.73 55.86 1jpt s ARG 98 Cb -0.04 -3.52 -0.03 0.00 -1.56 0.00 0.00 34.95 29.80 1jpt s ARG 98 CO 0.01 -0.04 0.06 0.34 -0.81 0.00 0.00 175.30 174.87 1jpt s ASP 99 N 0.98 5.24 0.00 -2.12 2.15 -0.67 -1.22 116.67 121.02 1jpt s ASP 99 Ca 0.24 -0.13 0.27 0.00 0.43 0.00 0.00 52.55 53.35 1jpt s ASP 99 Cb -0.15 -1.93 0.83 0.00 -0.30 0.00 0.00 42.92 41.37 1jpt s ASP 99 CO 0.10 0.02 1.64 0.35 -0.17 0.00 0.00 175.17 177.11 1jpt n THR 100 N 4.54 0.00 0.00 1.71 -2.24 -0.43 -3.39 114.28 114.47 1jpt n THR 100 Ca -0.16 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1jpt n THR 100 Cb 0.52 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 1jpt n THR 100 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jpt n ALA 101 N -1.45 0.00 0.10 6.98 0.00 -1.26 -4.79 120.51 120.10 1jpt n ALA 101 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.30 1jpt n ALA 101 Cb 0.33 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.66 1jpt n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jpt h ALA 102 N 0.00 0.03 -1.97 0.00 0.00 -2.00 -3.48 119.26 111.82 1jpt h ALA 102 Ca 0.00 -0.81 0.23 0.00 0.00 0.00 0.00 54.91 54.33 1jpt h ALA 102 Cb 0.00 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 17.78 1jpt h ALA 102 CO 0.00 0.77 0.62 1.52 0.00 0.00 0.00 179.25 182.16 1jpt s TYR 103 N -2.87 -0.11 -0.21 0.00 1.13 -1.26 -5.13 117.35 108.91 1jpt s TYR 103 Ca -0.08 -0.10 -0.29 0.00 -1.41 0.00 0.00 57.07 55.19 1jpt s TYR 103 Cb 0.06 0.59 0.01 0.00 -1.10 0.00 0.00 41.96 41.52 1jpt s TYR 103 CO 0.92 -0.58 1.03 -0.06 -2.51 0.00 0.00 175.55 174.34 1jpt s PHE 104 N -2.93 3.37 -0.35 -3.49 0.08 -1.26 -1.32 117.98 112.09 1jpt s PHE 104 Ca 0.12 1.49 0.14 0.00 0.12 0.00 0.00 56.93 58.80 1jpt s PHE 104 Cb 0.01 -3.25 -0.18 0.00 -0.57 0.00 0.00 43.02 39.03 1jpt s PHE 104 CO -0.01 -0.43 0.45 -0.40 -0.10 0.00 0.00 175.22 174.73 1jpt n ASP 105 N 6.07 1.19 -3.89 1.36 5.75 -0.36 -4.98 116.55 121.69 1jpt n ASP 105 Ca 0.11 -0.43 -0.11 0.00 -0.01 0.00 0.00 54.79 54.35 1jpt n ASP 105 Cb 0.47 1.30 -0.12 0.00 -1.03 0.00 0.00 41.12 41.73 1jpt n ASP 105 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1jpt s TYR 106 N -2.60 0.05 0.07 2.11 2.02 -1.25 -5.02 117.35 112.73 1jpt s TYR 106 Ca 0.00 -0.10 0.05 0.00 -0.37 0.00 0.00 57.07 56.65 1jpt s TYR 106 Cb 0.10 -0.05 -0.03 0.00 -0.40 0.00 0.00 41.96 41.57 1jpt s TYR 106 CO 0.57 -0.11 -0.14 -1.58 -1.57 0.00 0.00 175.55 172.72 1jpt s TRP 107 N -0.61 1.19 1.12 2.71 0.52 -1.26 -1.39 118.94 121.21 1jpt s TRP 107 Ca -0.07 -0.48 -0.16 0.00 0.02 0.00 0.00 56.10 55.42 1jpt s TRP 107 Cb -0.04 -0.67 0.25 0.00 -1.15 0.00 0.00 33.47 31.86 1jpt s TRP 107 CO -0.00 0.05 1.10 0.20 0.02 0.00 0.00 176.95 178.32 1jpt s GLY 108 N -1.80 1.57 0.26 0.98 0.00 0.08 -4.53 107.32 103.89 1jpt s GLY 108 Ca -0.02 -0.67 0.26 0.00 0.00 0.00 0.00 44.72 44.29 1jpt s GLY 108 CO 0.02 0.10 1.75 0.06 0.00 0.00 0.00 173.10 175.03 1jpt h GLN 109 N -2.31 0.00 0.00 2.90 -0.00 -1.90 -3.45 115.11 110.35 1jpt h GLN 109 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.15 1jpt h GLN 109 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.80 1jpt h GLN 109 CO 0.46 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.70 1jpt n GLY 110 N 1.08 -0.33 2.83 0.06 0.00 -1.26 -5.05 105.19 102.51 1jpt n GLY 110 Ca 0.05 -1.35 -0.16 0.00 0.00 0.00 0.00 46.02 44.56 1jpt n GLY 110 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jpt s THR 111 N -1.28 0.14 -0.06 2.61 -1.32 -0.70 -4.91 115.64 110.11 1jpt s THR 111 Ca 0.00 0.07 -0.29 0.00 -1.21 0.00 0.00 61.69 60.26 1jpt s THR 111 Cb 0.00 -0.22 -0.02 0.00 -1.51 0.00 0.00 72.50 70.75 1jpt s THR 111 CO 0.00 0.12 0.97 -0.22 -2.21 0.00 0.00 174.62 173.27 1jpt s LEU 112 N 0.81 4.30 -0.14 9.08 2.96 -1.26 -0.98 118.68 133.45 1jpt s LEU 112 Ca -0.08 1.54 -0.02 0.00 -0.22 0.00 0.00 54.13 55.35 1jpt s LEU 112 Cb -0.11 -3.51 -0.02 0.00 0.50 0.00 0.00 46.19 43.04 1jpt s LEU 112 CO -0.02 -0.35 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.89 1jpt s VAL 113 N 1.54 3.49 -0.19 1.68 1.01 0.05 -1.08 120.40 126.90 1jpt s VAL 113 Ca 0.49 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.96 1jpt s VAL 113 Cb -0.19 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.70 1jpt s VAL 113 CO 0.22 0.51 -0.16 -0.89 0.00 0.00 0.00 175.10 174.78 1jpt s THR 114 N 0.35 2.41 -0.45 3.92 2.01 -0.20 -1.69 115.64 121.98 1jpt s THR 114 Ca -0.07 -0.82 -0.16 0.00 0.31 0.00 0.00 61.69 60.94 1jpt s THR 114 Cb -0.15 -2.04 0.05 0.00 0.01 0.00 0.00 72.50 70.37 1jpt s THR 114 CO 0.04 0.51 0.42 -0.69 -0.69 0.00 0.00 174.62 174.21 1jpt s VAL 115 N 1.32 5.16 0.01 3.82 1.01 -1.26 -0.48 120.40 129.98 1jpt s VAL 115 Ca 0.05 -0.75 -0.22 0.00 0.00 0.00 0.00 61.98 61.06 1jpt s VAL 115 Cb -0.13 -4.09 0.05 0.00 0.00 0.00 0.00 36.38 32.20 1jpt s VAL 115 CO -0.10 -0.52 0.49 -0.55 0.00 0.00 0.00 175.10 174.42 1jpt s SER 116 N 2.25 -0.40 0.00 3.32 0.15 -0.73 -4.64 113.70 113.65 1jpt s SER 116 Ca 0.07 0.26 0.26 0.00 0.70 0.00 0.00 55.95 57.25 1jpt s SER 116 Cb -0.21 0.45 0.78 0.00 -1.71 0.00 0.00 66.02 65.33 1jpt s SER 116 CO 0.10 -0.61 1.59 -1.20 1.20 0.00 0.00 173.24 174.31 1jpt n SER 117 N 0.77 0.74 -4.75 5.45 7.64 -1.26 -4.11 113.62 118.10 1jpt n SER 117 Ca -0.19 -0.60 -0.30 0.00 1.01 0.00 0.00 58.87 58.79 1jpt n SER 117 Cb 0.58 0.11 0.11 0.00 -1.01 0.00 0.00 64.21 64.00 1jpt n SER 117 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jpt s ALA 118 N -2.66 1.95 0.18 -0.43 0.00 -1.26 -5.03 121.76 114.51 1jpt s ALA 118 Ca 0.21 0.12 -0.05 0.00 0.00 0.00 0.00 51.96 52.24 1jpt s ALA 118 Cb 0.19 -3.24 -0.06 0.00 0.00 0.00 0.00 23.12 20.02 1jpt s ALA 118 CO 0.56 -2.02 0.43 -1.12 0.00 0.00 0.00 175.76 173.61 1jpt s SER 119 N -3.41 6.49 0.24 0.00 0.01 -1.26 -5.04 113.70 110.73 1jpt s SER 119 Ca 0.62 0.63 -0.30 0.00 1.31 0.00 0.00 55.95 58.21 1jpt s SER 119 Cb -0.17 -2.11 -0.09 0.00 0.21 0.00 0.00 66.02 63.86 1jpt s SER 119 CO 0.56 -0.01 1.29 -0.89 0.41 0.00 0.00 173.24 174.60 1jpt s THR 120 N -1.77 3.09 -0.03 1.44 2.01 -1.26 -4.72 115.64 114.41 1jpt s THR 120 Ca 0.42 0.97 -0.01 0.00 0.31 0.00 0.00 61.69 63.38 1jpt s THR 120 Cb -0.12 -3.62 0.03 0.00 0.01 0.00 0.00 72.50 68.80 1jpt s THR 120 CO 0.25 0.18 0.05 -0.75 -0.69 0.00 0.00 174.62 173.66 1jpt s LYS 121 N -0.72 -0.01 0.42 4.92 2.20 0.64 -4.94 119.74 122.25 1jpt s LYS 121 Ca 0.53 0.20 -0.18 0.00 -0.36 0.00 0.00 55.97 56.16 1jpt s LYS 121 Cb -0.37 -0.20 -0.10 0.00 -1.51 0.00 0.00 37.83 35.65 1jpt s LYS 121 CO 0.43 -0.15 0.89 0.20 -0.36 0.00 0.00 175.35 176.36 1jpt s GLY 122 N 0.95 2.29 0.66 5.54 0.00 -1.26 -1.33 107.32 114.17 1jpt s GLY 122 Ca -0.08 0.24 -0.11 0.00 0.00 0.00 0.00 44.72 44.77 1jpt s GLY 122 CO -0.03 0.49 1.05 2.56 0.00 0.00 0.00 173.10 177.17 1jpt s PRO 123 N -3.32 3.21 -0.08 2.90 0.04 -1.26 -4.59 135.00 131.89 1jpt s PRO 123 Ca 0.59 0.56 -0.03 0.00 0.04 0.00 0.00 61.00 62.16 1jpt s PRO 123 Cb -0.10 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1jpt s PRO 123 CO 0.18 -0.79 0.06 -1.12 0.04 0.00 0.00 177.00 175.37 1jpt s SER 124 N -4.27 5.67 -0.17 6.66 0.01 -0.28 -4.91 113.70 116.40 1jpt s SER 124 Ca 0.56 0.25 0.00 0.00 1.31 0.00 0.00 55.95 58.08 1jpt s SER 124 Cb -0.11 -1.69 0.01 0.00 0.21 0.00 0.00 66.02 64.44 1jpt s SER 124 CO 0.52 0.37 -0.16 -0.69 0.41 0.00 0.00 173.24 173.69 1jpt s VAL 125 N -0.98 2.46 0.05 3.43 1.01 -1.26 -0.83 120.40 124.28 1jpt s VAL 125 Ca 0.15 -0.82 0.09 0.00 0.00 0.00 0.00 61.98 61.40 1jpt s VAL 125 Cb -0.12 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 1jpt s VAL 125 CO 0.05 0.52 -0.25 -0.36 0.00 0.00 0.00 175.10 175.05 1jpt s PHE 126 N 1.07 2.21 0.40 5.22 0.40 0.35 -4.94 117.98 122.70 1jpt s PHE 126 Ca -0.01 -0.40 -0.23 0.00 -0.60 0.00 0.00 56.93 55.69 1jpt s PHE 126 Cb -0.14 -1.32 -0.09 0.00 0.51 0.00 0.00 43.02 41.97 1jpt s PHE 126 CO -0.05 0.12 1.02 -1.25 0.70 0.00 0.00 175.22 175.76 1jpt s PRO 127 N -1.25 4.19 -0.43 0.24 0.04 -1.26 0.40 135.00 136.92 1jpt s PRO 127 Ca 0.11 1.40 -0.02 0.00 0.04 0.00 0.00 61.00 62.54 1jpt s PRO 127 Cb -0.10 -2.46 0.12 0.00 0.04 0.00 0.00 34.50 32.10 1jpt s PRO 127 CO 0.02 -0.10 0.22 -0.51 0.04 0.00 0.00 177.00 176.67 1jpt s LEU 128 N -2.75 5.15 0.08 -3.56 1.43 0.49 -4.79 118.68 114.73 1jpt s LEU 128 Ca 0.59 -2.21 -0.21 0.00 -1.03 0.00 0.00 54.13 51.27 1jpt s LEU 128 Cb -0.19 -1.80 -0.07 0.00 0.03 0.00 0.00 46.19 44.17 1jpt s LEU 128 CO 0.24 -0.48 0.63 0.00 0.23 0.00 0.00 176.35 176.96 1jpt s ALA 129 N 0.88 3.54 0.39 4.21 0.00 -1.26 -1.32 121.76 128.19 1jpt s ALA 129 Ca 0.10 0.12 -0.27 0.00 0.00 0.00 0.00 51.96 51.91 1jpt s ALA 129 Cb -0.22 -2.74 -0.10 0.00 0.00 0.00 0.00 23.12 20.07 1jpt s ALA 129 CO -0.04 0.33 1.40 -1.25 0.00 0.00 0.00 175.76 176.20 1jpt s PRO 130 N -0.96 4.01 0.00 0.00 0.04 -1.25 -4.97 135.00 131.87 1jpt s PRO 130 Ca 0.31 2.38 0.00 0.00 0.04 0.00 0.00 61.00 63.73 1jpt s PRO 130 Cb -0.20 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.48 1jpt s PRO 130 CO 0.21 -0.54 0.12 0.45 0.04 0.00 0.00 177.00 177.28 1jpt n SER 131 N 0.28 0.00 0.00 6.66 2.88 -1.26 -4.69 113.62 117.49 1jpt n SER 131 Ca 0.02 0.12 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 1jpt n SER 131 Cb 0.41 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 1jpt n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jpt n GLY 137 N 0.83 0.36 0.21 0.46 0.00 -1.26 -5.14 105.19 100.65 1jpt n GLY 137 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1jpt n GLY 137 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jpt h GLY 138 N 0.00 0.00 -4.66 -0.02 0.00 -2.01 -3.43 103.07 92.94 1jpt h GLY 138 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 1jpt h GLY 138 CO 0.00 0.00 -0.80 -1.59 0.00 0.00 0.00 176.54 174.15 1jpt s THR 139 N -3.20 2.83 0.34 4.70 2.01 -1.26 -0.32 115.64 120.74 1jpt s THR 139 Ca 0.06 -0.98 0.04 0.00 0.31 0.00 0.00 61.69 61.13 1jpt s THR 139 Cb 0.05 -2.14 -0.06 0.00 0.01 0.00 0.00 72.50 70.37 1jpt s THR 139 CO 0.68 0.47 0.06 0.00 -0.69 0.00 0.00 174.62 175.14 1jpt s ALA 140 N -0.81 2.49 0.02 7.40 0.00 0.06 -4.74 121.76 126.18 1jpt s ALA 140 Ca 0.13 -1.96 -0.00 0.00 0.00 0.00 0.00 51.96 50.12 1jpt s ALA 140 Cb -0.10 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.63 1jpt s ALA 140 CO 0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 175.76 175.47 1jpt s ALA 141 N -3.25 0.12 0.25 0.00 0.00 -1.26 -0.76 121.76 116.86 1jpt s ALA 141 Ca 0.35 -0.60 -0.03 0.00 0.00 0.00 0.00 51.96 51.68 1jpt s ALA 141 Cb 0.08 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.33 1jpt s ALA 141 CO 0.15 -0.18 0.29 -0.48 0.00 0.00 0.00 175.76 175.54 1jpt s LEU 142 N -1.55 1.02 0.00 0.00 0.05 -0.60 -3.87 118.68 113.73 1jpt s LEU 142 Ca -0.15 -1.35 0.00 0.00 0.05 0.00 0.00 54.13 52.69 1jpt s LEU 142 Cb -0.09 0.90 0.00 0.00 -2.05 0.00 0.00 46.19 44.95 1jpt s LEU 142 CO -0.01 -1.01 0.00 0.61 -0.55 0.00 0.00 176.35 175.38 1jpt n GLY 143 N -0.39 0.75 2.91 -3.48 0.00 -0.44 -0.47 105.19 104.06 1jpt n GLY 143 Ca 0.02 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 1jpt n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jpt s LEU 145 N -0.15 3.51 -0.34 0.00 2.96 0.16 -1.49 118.68 123.33 1jpt s LEU 145 Ca -0.00 -0.22 -0.08 0.00 -0.22 0.00 0.00 54.13 53.61 1jpt s LEU 145 Cb -0.01 -1.94 0.03 0.00 0.50 0.00 0.00 46.19 44.77 1jpt s LEU 145 CO -0.00 -0.04 0.14 -0.69 -1.32 0.00 0.00 176.35 174.43 1jpt s VAL 146 N 1.62 4.08 0.06 1.68 1.01 0.10 -0.49 120.40 128.47 1jpt s VAL 146 Ca 0.06 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.15 1jpt s VAL 146 Cb -0.15 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 1jpt s VAL 146 CO 0.04 -0.16 -0.20 -0.75 0.00 0.00 0.00 175.10 174.03 1jpt s LYS 147 N 1.47 1.26 -0.85 2.72 2.20 -0.01 -0.82 119.74 125.71 1jpt s LYS 147 Ca 0.00 -1.00 -0.04 0.00 -0.36 0.00 0.00 55.97 54.57 1jpt s LYS 147 Cb -0.19 -1.42 -0.04 0.00 -1.51 0.00 0.00 37.83 34.67 1jpt s LYS 147 CO 0.04 0.35 0.74 -0.25 -0.36 0.00 0.00 175.35 175.87 1jpt n ASP 148 N 1.59 -4.99 -4.42 1.43 8.00 -0.09 -1.13 116.55 116.94 1jpt n ASP 148 Ca -0.18 -0.55 -0.21 0.00 0.71 0.00 0.00 54.79 54.56 1jpt n ASP 148 Cb 0.53 -4.22 -0.10 0.00 -0.02 0.00 0.00 41.12 37.31 1jpt n ASP 148 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1jpt s TYR 149 N -3.30 1.94 -0.28 1.24 1.13 -0.94 -4.35 117.35 112.79 1jpt s TYR 149 Ca 0.30 -0.63 -0.24 0.00 -1.41 0.00 0.00 57.07 55.08 1jpt s TYR 149 Cb -0.04 -1.03 0.11 0.00 -1.10 0.00 0.00 41.96 39.89 1jpt s TYR 149 CO 0.58 0.35 0.92 0.12 -2.51 0.00 0.00 175.55 175.01 1jpt s PHE 150 N -2.95 -0.60 0.15 -3.49 5.36 -0.44 -0.17 117.98 115.84 1jpt s PHE 150 Ca 0.28 1.44 -0.00 0.00 -0.96 0.00 0.00 56.93 57.68 1jpt s PHE 150 Cb 0.02 0.34 0.03 0.00 -0.34 0.00 0.00 43.02 43.07 1jpt s PHE 150 CO 0.11 -0.29 0.21 -0.35 -1.46 0.00 0.00 175.22 173.44 1jpt n PRO 151 N 2.51 0.41 -1.28 10.12 -0.04 -1.26 -0.26 135.00 145.20 1jpt n PRO 151 Ca -0.13 -0.53 -0.29 0.00 -0.04 0.00 0.00 63.50 62.50 1jpt n PRO 151 Cb 0.56 -0.14 0.14 0.00 -0.04 0.00 0.00 33.50 34.01 1jpt n PRO 151 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1jpt s GLU 152 N -2.98 1.15 0.47 0.54 2.02 -1.26 -4.80 118.70 113.83 1jpt s GLU 152 Ca 0.13 0.66 0.06 0.00 0.02 0.00 0.00 54.97 55.85 1jpt s GLU 152 Cb -0.01 -1.81 -0.01 0.00 0.10 0.00 0.00 34.13 32.40 1jpt s GLU 152 CO 0.09 -2.28 0.30 -1.25 0.02 0.00 0.00 175.26 172.14 1jpt s PRO 153 N -5.01 2.31 0.03 0.39 0.04 -1.26 -4.92 135.00 126.58 1jpt s PRO 153 Ca 0.64 -1.86 0.06 0.00 0.04 0.00 0.00 61.00 59.88 1jpt s PRO 153 Cb -0.17 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 1jpt s PRO 153 CO 0.56 -0.33 -0.17 0.08 0.04 0.00 0.00 177.00 177.18 1jpt s VAL 154 N -2.64 1.37 -0.06 -0.36 1.01 -1.26 -4.44 120.40 114.02 1jpt s VAL 154 Ca 0.39 -1.01 0.04 0.00 0.00 0.00 0.00 61.98 61.39 1jpt s VAL 154 Cb -0.00 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 1jpt s VAL 154 CO 0.22 0.16 -0.17 0.42 0.00 0.00 0.00 175.10 175.74 1jpt s THR 155 N -0.72 2.82 -0.04 3.92 -4.23 -0.37 -4.97 115.64 112.03 1jpt s THR 155 Ca 0.05 -0.81 0.04 0.00 -1.18 0.00 0.00 61.69 59.79 1jpt s THR 155 Cb -0.08 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.67 1jpt s THR 155 CO 0.01 0.58 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.83 1jpt s VAL 156 N -0.52 1.25 0.31 2.29 1.01 -1.26 -1.07 120.40 122.40 1jpt s VAL 156 Ca 0.07 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.48 1jpt s VAL 156 Cb -0.11 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1jpt s VAL 156 CO 0.01 0.37 0.15 -0.94 0.00 0.00 0.00 175.10 174.69 1jpt s SER 157 N 0.17 1.66 -0.02 3.32 1.04 -0.34 -4.97 113.70 114.55 1jpt s SER 157 Ca -0.05 -1.55 0.06 0.00 0.48 0.00 0.00 55.95 54.89 1jpt s SER 157 Cb -0.12 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.35 1jpt s SER 157 CO 0.02 -0.86 -0.19 0.26 0.98 0.00 0.00 173.24 173.45 1jpt s TRP 158 N -3.57 1.73 -1.43 5.02 0.52 -1.26 -0.42 118.94 119.53 1jpt s TRP 158 Ca 0.35 -0.37 -0.00 0.00 0.02 0.00 0.00 56.10 56.10 1jpt s TRP 158 Cb 0.05 -1.12 0.00 0.00 -1.15 0.00 0.00 33.47 31.25 1jpt s TRP 158 CO 0.17 -0.06 0.36 0.09 0.02 0.00 0.00 176.95 177.53 1jpt n ASN 159 N 2.73 -0.15 -1.93 2.95 3.02 0.62 -0.63 115.26 121.88 1jpt n ASN 159 Ca -0.16 -1.04 -0.19 0.00 -0.03 0.00 0.00 54.58 53.16 1jpt n ASN 159 Cb 0.53 -2.85 -0.03 0.00 -0.61 0.00 0.00 39.78 36.82 1jpt n ASN 159 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1jpt n SER 160 N -2.97 -5.36 0.00 6.41 7.64 -1.26 -2.72 113.62 115.36 1jpt n SER 160 Ca -0.31 0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.69 1jpt n SER 160 Cb 0.69 -4.44 0.00 0.00 -1.01 0.00 0.00 64.21 59.45 1jpt n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jpt n GLY 161 N -0.92 0.89 0.08 0.23 0.00 0.20 -4.93 105.19 100.74 1jpt n GLY 161 Ca -0.21 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.76 1jpt n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jpt h ALA 162 N 0.00 0.49 -2.35 4.61 0.00 -1.33 -3.43 119.26 117.26 1jpt h ALA 162 Ca 0.00 -0.81 -0.65 0.00 0.00 0.00 0.00 54.91 53.45 1jpt h ALA 162 Cb 0.00 -0.14 -0.16 0.00 0.00 0.00 0.00 17.79 17.49 1jpt h ALA 162 CO 0.00 1.11 -0.01 -1.17 0.00 0.00 0.00 179.25 179.18 1jpt s LEU 163 N -6.84 4.46 0.00 0.00 2.96 -0.99 -4.81 118.68 113.47 1jpt s LEU 163 Ca 0.01 -0.21 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 1jpt s LEU 163 Cb 0.10 -2.61 0.00 0.00 0.50 0.00 0.00 46.19 44.18 1jpt s LEU 163 CO 0.80 -0.59 0.00 0.35 -1.32 0.00 0.00 176.35 175.59 1jpt n THR 164 N 5.57 0.00 -1.72 3.68 -2.24 -1.26 -4.11 114.28 114.20 1jpt n THR 164 Ca -0.04 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.32 1jpt n THR 164 Cb 0.48 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.89 1jpt n THR 164 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1jpt s SER 165 N -1.80 6.43 0.00 3.42 0.15 -1.26 -2.34 113.70 118.30 1jpt s SER 165 Ca 0.00 2.74 0.00 0.00 0.70 0.00 0.00 55.95 59.39 1jpt s SER 165 Cb 0.00 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 1jpt s SER 165 CO 0.00 -1.00 0.00 0.61 1.20 0.00 0.00 173.24 174.05 1jpt n GLY 166 N 4.25 0.42 3.78 9.45 0.00 -1.26 -4.71 105.19 117.12 1jpt n GLY 166 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1jpt n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jpt s VAL 167 N -1.99 4.79 -0.07 1.61 1.01 -0.99 -1.55 120.40 123.21 1jpt s VAL 167 Ca 0.00 1.29 -0.02 0.00 0.00 0.00 0.00 61.98 63.25 1jpt s VAL 167 Cb 0.00 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.47 1jpt s VAL 167 CO 0.00 0.48 0.03 -1.00 0.00 0.00 0.00 175.10 174.61 1jpt s HIS 168 N -0.64 0.41 -0.21 5.22 3.76 0.19 -4.99 115.29 119.03 1jpt s HIS 168 Ca 0.31 -0.03 -0.04 0.00 -0.15 0.00 0.00 55.06 55.14 1jpt s HIS 168 Cb -0.19 -0.68 -0.01 0.00 1.11 0.00 0.00 32.58 32.81 1jpt s HIS 168 CO 0.19 -0.30 -0.03 0.99 -0.85 0.00 0.00 174.74 174.75 1jpt s THR 169 N 2.06 3.59 0.46 1.30 2.01 -1.26 -1.01 115.64 122.78 1jpt s THR 169 Ca 0.05 -0.43 -0.10 0.00 0.31 0.00 0.00 61.69 61.52 1jpt s THR 169 Cb -0.13 -2.63 -0.06 0.00 0.01 0.00 0.00 72.50 69.70 1jpt s THR 169 CO -0.05 0.42 0.83 -0.36 -0.69 0.00 0.00 174.62 174.77 1jpt s PHE 170 N 1.30 3.51 0.45 4.92 0.08 -0.46 -5.01 117.98 122.76 1jpt s PHE 170 Ca 0.04 1.07 -0.25 0.00 0.12 0.00 0.00 56.93 57.90 1jpt s PHE 170 Cb -0.14 -2.48 -0.08 0.00 -0.57 0.00 0.00 43.02 39.74 1jpt s PHE 170 CO -0.01 -0.24 1.41 -2.14 -0.10 0.00 0.00 175.22 174.14 1jpt s PRO 171 N -4.23 3.71 0.72 0.24 0.02 -1.26 -4.53 135.00 129.66 1jpt s PRO 171 Ca 0.52 2.38 -0.13 0.00 0.02 0.00 0.00 61.00 63.79 1jpt s PRO 171 Cb -0.10 -2.66 0.03 0.00 0.02 0.00 0.00 34.50 31.79 1jpt s PRO 171 CO 0.37 -0.79 1.11 0.00 -0.33 0.00 0.00 177.00 177.36 1jpt s ALA 172 N -1.21 2.31 0.08 -1.55 0.00 -1.26 -4.78 121.76 115.35 1jpt s ALA 172 Ca 0.61 0.46 0.10 0.00 0.00 0.00 0.00 51.96 53.12 1jpt s ALA 172 Cb -0.43 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.34 1jpt s ALA 172 CO 0.55 -1.58 -0.26 0.14 0.00 0.00 0.00 175.76 174.61 1jpt s VAL 173 N -2.55 2.10 -0.02 0.00 -7.23 -0.17 -4.94 120.40 107.59 1jpt s VAL 173 Ca 0.65 -1.53 -0.25 0.00 -1.81 0.00 0.00 61.98 59.04 1jpt s VAL 173 Cb -0.20 -1.83 -0.04 0.00 0.56 0.00 0.00 36.38 34.87 1jpt s VAL 173 CO 0.48 0.21 0.79 -0.22 -0.31 0.00 0.00 175.10 176.05 1jpt s LEU 174 N -1.60 4.37 0.68 1.32 2.96 -1.26 -1.73 118.68 123.42 1jpt s LEU 174 Ca 0.12 1.38 -0.00 0.00 -0.22 0.00 0.00 54.13 55.41 1jpt s LEU 174 Cb -0.10 -3.24 0.11 0.00 0.50 0.00 0.00 46.19 43.45 1jpt s LEU 174 CO 0.04 -0.11 0.95 -1.10 -1.32 0.00 0.00 176.35 174.80 1jpt s GLN 175 N 0.58 1.88 0.64 1.98 -0.21 -0.31 -4.94 119.66 119.27 1jpt s GLN 175 Ca 0.41 -1.03 0.38 0.00 0.02 0.00 0.00 55.36 55.13 1jpt s GLN 175 Cb -0.19 -2.37 2.12 0.00 1.00 0.00 0.00 33.01 33.57 1jpt s GLN 175 CO 0.22 -1.28 2.28 0.77 -2.12 0.00 0.00 175.29 175.16 1jpt h SER 176 N -0.39 0.00 0.73 5.90 0.02 -1.97 -0.28 113.55 117.56 1jpt h SER 176 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1jpt h SER 176 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1jpt h SER 176 CO 0.43 0.00 -0.24 -1.54 -1.14 0.00 0.00 176.83 174.34 1jpt n SER 177 N -3.38 0.26 0.00 3.07 3.41 -1.26 -4.92 113.62 110.81 1jpt n SER 177 Ca -0.02 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1jpt n SER 177 Cb 0.12 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 1jpt n SER 177 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jpt n GLY 178 N 1.49 0.73 3.78 5.00 0.00 -0.12 -5.05 105.19 111.02 1jpt n GLY 178 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 1jpt n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jpt s LEU 179 N 0.00 3.74 0.40 0.99 1.43 -1.26 -4.85 118.68 119.13 1jpt s LEU 179 Ca 0.00 -0.16 -0.08 0.00 -1.03 0.00 0.00 54.13 52.86 1jpt s LEU 179 Cb 0.00 -2.36 -0.05 0.00 0.03 0.00 0.00 46.19 43.81 1jpt s LEU 179 CO 0.00 0.08 0.73 -0.31 0.23 0.00 0.00 176.35 177.08 1jpt s TYR 180 N -1.72 3.50 -0.01 0.29 1.51 0.76 -1.17 117.35 120.50 1jpt s TYR 180 Ca 0.30 0.89 -0.00 0.00 -1.01 0.00 0.00 57.07 57.25 1jpt s TYR 180 Cb -0.10 -2.33 0.01 0.00 -0.11 0.00 0.00 41.96 39.43 1jpt s TYR 180 CO 0.23 -0.09 0.02 0.45 -1.11 0.00 0.00 175.55 175.04 1jpt s SER 181 N -3.42 0.01 -0.01 2.29 0.15 -0.70 -0.91 113.70 111.10 1jpt s SER 181 Ca 0.49 0.03 -0.11 0.00 0.70 0.00 0.00 55.95 57.05 1jpt s SER 181 Cb -0.10 0.00 0.01 0.00 -1.71 0.00 0.00 66.02 64.22 1jpt s SER 181 CO 0.35 -0.04 0.23 -0.22 1.20 0.00 0.00 173.24 174.76 1jpt s LEU 182 N 0.28 1.18 0.17 3.45 0.20 -0.00 -1.00 118.68 122.97 1jpt s LEU 182 Ca -0.02 -0.03 0.10 0.00 0.69 0.00 0.00 54.13 54.87 1jpt s LEU 182 Cb -0.03 0.97 -0.04 0.00 -0.43 0.00 0.00 46.19 46.66 1jpt s LEU 182 CO -0.01 -0.39 -0.21 -0.94 -0.29 0.00 0.00 176.35 174.50 1jpt s SER 183 N -1.28 3.05 -0.03 3.68 1.04 -1.26 0.02 113.70 118.91 1jpt s SER 183 Ca -0.13 -0.85 0.01 0.00 0.48 0.00 0.00 55.95 55.46 1jpt s SER 183 Cb -0.06 -0.20 0.02 0.00 0.10 0.00 0.00 66.02 65.87 1jpt s SER 183 CO 0.03 0.05 -0.05 -0.55 0.98 0.00 0.00 173.24 173.70 1jpt s SER 184 N -2.60 0.87 0.22 7.02 0.15 -0.56 -1.36 113.70 117.43 1jpt s SER 184 Ca 0.17 -0.12 0.05 0.00 0.70 0.00 0.00 55.95 56.75 1jpt s SER 184 Cb -0.07 -0.35 -0.05 0.00 -1.71 0.00 0.00 66.02 63.84 1jpt s SER 184 CO 0.08 -0.02 -0.06 0.68 1.20 0.00 0.00 173.24 175.12 1jpt s VAL 185 N 0.63 1.32 -0.05 4.45 -7.23 -0.18 -0.45 120.40 118.88 1jpt s VAL 185 Ca -0.08 -2.09 -0.03 0.00 -1.81 0.00 0.00 61.98 57.96 1jpt s VAL 185 Cb -0.12 -2.20 0.02 0.00 0.56 0.00 0.00 36.38 34.65 1jpt s VAL 185 CO 0.00 -0.47 0.12 0.54 -0.31 0.00 0.00 175.10 174.99 1jpt s VAL 186 N -3.23 -0.02 0.00 1.32 0.11 0.38 -0.63 120.40 118.32 1jpt s VAL 186 Ca 0.25 0.08 -0.05 0.00 -2.93 0.00 0.00 61.98 59.32 1jpt s VAL 186 Cb 0.03 -0.19 -0.05 0.00 -1.53 0.00 0.00 36.38 34.65 1jpt s VAL 186 CO 0.07 0.03 0.24 0.42 -3.33 0.00 0.00 175.10 172.54 1jpt s THR 187 N 0.54 5.34 0.19 5.04 -4.23 -0.60 -1.57 115.64 120.36 1jpt s THR 187 Ca -0.04 0.07 -0.10 0.00 -1.18 0.00 0.00 61.69 60.45 1jpt s THR 187 Cb -0.06 -3.56 -0.01 0.00 1.34 0.00 0.00 72.50 70.22 1jpt s THR 187 CO -0.02 0.35 0.34 0.68 -0.54 0.00 0.00 174.62 175.42 1jpt s VAL 188 N -1.31 0.04 0.22 2.29 -7.23 0.06 -4.64 120.40 109.83 1jpt s VAL 188 Ca 0.28 -1.42 -0.30 0.00 -1.81 0.00 0.00 61.98 58.72 1jpt s VAL 188 Cb -0.13 -2.00 -0.09 0.00 0.56 0.00 0.00 36.38 34.72 1jpt s VAL 188 CO 0.17 -0.17 1.40 -2.84 -0.31 0.00 0.00 175.10 173.35 1jpt s PRO 189 N -4.00 4.31 0.28 4.82 0.02 -1.26 -0.76 135.00 138.41 1jpt s PRO 189 Ca 0.20 2.21 0.02 0.00 0.02 0.00 0.00 61.00 63.46 1jpt s PRO 189 Cb 0.02 -3.15 0.64 0.00 0.02 0.00 0.00 34.50 32.04 1jpt s PRO 189 CO 0.04 -0.38 1.75 0.77 -0.33 0.00 0.00 177.00 178.84 1jpt h SER 190 N 5.37 0.53 0.09 2.53 0.02 -0.95 -0.86 113.55 120.28 1jpt h SER 190 Ca -0.45 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.60 1jpt h SER 190 Cb 1.21 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.79 1jpt h SER 190 CO 0.79 0.17 -0.07 0.77 -1.14 0.00 0.00 176.83 177.35 1jpt h SER 191 N 0.59 0.00 0.75 3.07 4.64 -1.89 -2.48 113.55 118.22 1jpt h SER 191 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1jpt h SER 191 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1jpt h SER 191 CO -0.42 0.07 0.00 -1.54 -0.87 0.00 0.00 176.83 174.07 1jpt n SER 192 N -4.30 0.56 0.25 4.97 3.41 -0.33 -2.94 113.62 115.24 1jpt n SER 192 Ca -0.03 0.63 0.08 0.00 -0.26 0.00 0.00 58.87 59.30 1jpt n SER 192 Cb 0.15 -0.75 0.64 0.00 -0.26 0.00 0.00 64.21 63.99 1jpt n SER 192 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1jpt h LEU 193 N 0.00 0.00 -1.89 1.04 3.38 -1.55 -2.37 115.31 113.92 1jpt h LEU 193 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1jpt h LEU 193 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1jpt h LEU 193 CO 0.00 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.20 1jpt n GLY 194 N -1.29 0.88 0.02 0.83 0.00 -1.15 -4.43 105.19 100.05 1jpt n GLY 194 Ca -0.03 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1jpt n GLY 194 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jpt n THR 195 N 1.27 0.39 -3.51 2.61 -2.24 -0.93 -5.05 114.28 106.81 1jpt n THR 195 Ca 0.13 -0.70 -0.11 0.00 -2.27 0.00 0.00 64.05 61.11 1jpt n THR 195 Cb 0.56 0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 69.56 1jpt n THR 195 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1jpt s GLN 196 N -0.41 0.87 -0.06 -0.78 0.74 -0.97 -5.07 119.66 113.98 1jpt s GLN 196 Ca 0.01 -0.12 -0.00 0.00 0.05 0.00 0.00 55.36 55.29 1jpt s GLN 196 Cb 0.00 0.41 -0.03 0.00 1.10 0.00 0.00 33.01 34.49 1jpt s GLN 196 CO 0.01 -0.34 -0.00 0.99 -0.55 0.00 0.00 175.29 175.39 1jpt s THR 197 N -2.40 4.21 -0.13 -0.34 2.01 -1.26 -4.67 115.64 113.06 1jpt s THR 197 Ca 0.00 -0.38 -0.01 0.00 0.31 0.00 0.00 61.69 61.61 1jpt s THR 197 Cb -0.01 -2.80 -0.02 0.00 0.01 0.00 0.00 72.50 69.68 1jpt s THR 197 CO -0.04 0.53 -0.09 -0.31 -0.69 0.00 0.00 174.62 174.02 1jpt s TYR 198 N -0.94 2.89 -0.08 4.92 1.51 -1.26 -5.02 117.35 119.36 1jpt s TYR 198 Ca 0.15 -0.44 0.01 0.00 -1.01 0.00 0.00 57.07 55.78 1jpt s TYR 198 Cb -0.11 -1.86 0.02 0.00 -0.11 0.00 0.00 41.96 39.90 1jpt s TYR 198 CO 0.05 -0.08 -0.09 0.42 -1.11 0.00 0.00 175.55 174.74 1jpt s ILE 199 N 0.19 0.98 -0.08 2.71 1.01 -1.26 -1.12 121.20 123.63 1jpt s ILE 199 Ca -0.05 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.16 1jpt s ILE 199 Cb -0.15 -0.95 -0.05 0.00 0.01 0.00 0.00 42.46 41.32 1jpt s ILE 199 CO 0.04 0.34 0.26 0.00 0.00 0.00 0.00 174.94 175.58 1jpt s ASN 201 N -0.89 4.12 -0.09 0.00 -0.87 0.44 -0.59 114.94 117.06 1jpt s ASN 201 Ca 0.19 -0.36 0.04 0.00 -1.57 0.00 0.00 52.86 51.16 1jpt s ASN 201 Cb -0.14 -1.67 -0.00 0.00 -0.02 0.00 0.00 41.25 39.42 1jpt s ASN 201 CO 0.08 0.08 -0.24 -0.69 -2.57 0.00 0.00 177.10 173.76 1jpt s VAL 202 N 0.86 2.12 -0.09 1.60 1.01 0.51 -1.20 120.40 125.22 1jpt s VAL 202 Ca -0.03 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 60.97 1jpt s VAL 202 Cb -0.15 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.44 1jpt s VAL 202 CO 0.00 0.56 -0.16 0.21 0.00 0.00 0.00 175.10 175.71 1jpt s ASN 203 N 0.16 2.34 -0.43 3.32 2.47 -0.24 -1.26 114.94 121.30 1jpt s ASN 203 Ca -0.13 -0.41 0.02 0.00 0.42 0.00 0.00 52.86 52.76 1jpt s ASN 203 Cb -0.16 -1.07 0.12 0.00 -1.45 0.00 0.00 41.25 38.69 1jpt s ASN 203 CO 0.07 0.06 0.20 -2.28 -3.72 0.00 0.00 177.10 171.43 1jpt s HIS 204 N 0.67 2.52 0.28 0.43 5.65 0.02 -1.24 115.29 123.61 1jpt s HIS 204 Ca -0.13 -2.61 0.01 0.00 0.25 0.00 0.00 55.06 52.57 1jpt s HIS 204 Cb -0.16 -2.26 0.54 0.00 -1.18 0.00 0.00 32.58 29.52 1jpt s HIS 204 CO 0.04 -0.81 1.83 0.87 -0.65 0.00 0.00 174.74 176.01 1jpt h LYS 205 N 6.99 0.92 -0.74 2.88 1.57 -1.81 -2.01 116.57 124.36 1jpt h LYS 205 Ca -0.05 -0.06 0.19 0.00 -1.87 0.00 0.00 60.65 58.86 1jpt h LYS 205 Cb 0.94 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 33.01 1jpt h LYS 205 CO 0.54 0.61 0.52 -1.35 -0.57 0.00 0.00 179.45 179.20 1jpt h PRO 206 N 0.94 0.15 -0.24 3.15 0.11 -1.92 -1.17 132.00 133.02 1jpt h PRO 206 Ca 0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.59 1jpt h PRO 206 Cb 0.50 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.58 1jpt h PRO 206 CO -0.27 0.10 0.00 -1.13 -0.21 0.00 0.00 178.00 176.49 1jpt n SER 207 N -4.39 3.04 -4.05 -2.05 3.41 -1.04 -4.97 113.62 103.58 1jpt n SER 207 Ca 0.15 -2.41 -0.32 0.00 -0.26 0.00 0.00 58.87 56.03 1jpt n SER 207 Cb 0.71 -0.31 -0.01 0.00 -0.26 0.00 0.00 64.21 64.34 1jpt n SER 207 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1jpt n ASN 208 N -0.12 -3.11 -4.70 4.04 5.15 -0.44 -4.91 115.26 111.17 1jpt n ASN 208 Ca 0.13 -0.93 -0.35 0.00 -0.60 0.00 0.00 54.58 52.84 1jpt n ASN 208 Cb 0.56 -3.24 -0.09 0.00 -0.53 0.00 0.00 39.78 36.49 1jpt n ASN 208 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1jpt s THR 209 N -3.44 5.15 -0.06 -0.44 2.01 -0.80 -4.98 115.64 113.08 1jpt s THR 209 Ca 0.54 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.63 1jpt s THR 209 Cb -0.28 -3.33 0.02 0.00 0.01 0.00 0.00 72.50 68.92 1jpt s THR 209 CO 0.88 0.46 -0.04 -0.54 -0.69 0.00 0.00 174.62 174.70 1jpt s LYS 210 N 0.26 0.87 -0.01 4.92 1.02 -1.26 -0.80 119.74 124.74 1jpt s LYS 210 Ca 0.06 -0.06 0.03 0.00 0.02 0.00 0.00 55.97 56.02 1jpt s LYS 210 Cb -0.12 -1.00 -0.01 0.00 -0.52 0.00 0.00 37.83 36.19 1jpt s LYS 210 CO -0.01 -0.17 -0.10 0.08 -0.92 0.00 0.00 175.35 174.22 1jpt s VAL 211 N 1.36 0.82 -0.22 3.17 1.01 -0.39 -4.98 120.40 121.16 1jpt s VAL 211 Ca -0.04 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 1jpt s VAL 211 Cb -0.13 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.58 1jpt s VAL 211 CO -0.03 0.23 -0.11 -1.81 0.00 0.00 0.00 175.10 173.39 1jpt s ASP 212 N -0.23 3.95 -0.18 3.32 1.01 -1.26 -0.36 116.67 122.92 1jpt s ASP 212 Ca 0.04 -0.81 -0.01 0.00 0.71 0.00 0.00 52.55 52.49 1jpt s ASP 212 Cb -0.04 -1.60 0.01 0.00 1.01 0.00 0.00 42.92 42.29 1jpt s ASP 212 CO -0.00 -0.08 -0.14 -0.75 0.21 0.00 0.00 175.17 174.40 1jpt s LYS 213 N 1.30 3.16 0.08 8.23 2.47 0.24 -4.96 119.74 130.27 1jpt s LYS 213 Ca 0.01 -0.75 -0.28 0.00 -1.56 0.00 0.00 55.97 53.39 1jpt s LYS 213 Cb -0.16 -2.71 -0.05 0.00 -1.46 0.00 0.00 37.83 33.45 1jpt s LYS 213 CO -0.07 -0.14 0.90 0.21 0.16 0.00 0.00 175.35 176.42 1jpt s LYS 214 N 1.20 4.63 -0.28 4.03 2.20 -1.26 -1.11 119.74 129.15 1jpt s LYS 214 Ca 0.02 1.33 -0.01 0.00 -0.36 0.00 0.00 55.97 56.95 1jpt s LYS 214 Cb -0.14 -3.38 0.04 0.00 -1.51 0.00 0.00 37.83 32.84 1jpt s LYS 214 CO -0.06 0.21 -0.03 0.08 -0.36 0.00 0.00 175.35 175.19 1jpt s VAL 215 N 0.06 2.91 0.19 4.02 1.01 -0.28 -4.91 120.40 123.39 1jpt s VAL 215 Ca 0.45 -1.27 0.11 0.00 0.00 0.00 0.00 61.98 61.26 1jpt s VAL 215 Cb -0.22 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1jpt s VAL 215 CO 0.28 0.00 -0.23 -1.61 0.00 0.00 0.00 175.10 173.54 1jpt s GLU 216 N 1.27 1.46 0.00 2.72 2.02 -1.26 -4.37 118.70 120.53 1jpt s GLU 216 Ca -0.04 -1.50 0.08 0.00 0.02 0.00 0.00 54.97 53.53 1jpt s GLU 216 Cb -0.19 -1.72 0.47 0.00 0.10 0.00 0.00 34.13 32.79 1jpt s GLU 216 CO -0.02 0.37 0.92 -0.35 0.02 0.00 0.00 175.26 176.20