#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jpr s TYR 2 N 0.00 3.43 0.02 0.00 5.04 -1.26 -5.02 117.35 119.55 1jpr s TYR 2 Ca 0.00 1.20 0.01 0.00 -2.44 0.00 0.00 57.07 55.84 1jpr s TYR 2 Cb 0.00 -2.51 -0.01 0.00 0.35 0.00 0.00 41.96 39.79 1jpr s TYR 2 CO 0.00 0.16 -0.05 -0.08 -1.34 0.00 0.00 175.55 174.25 1jpr s THR 3 N -1.87 0.33 -0.87 4.34 -1.32 -1.26 -5.02 115.64 109.97 1jpr s THR 3 Ca 0.51 -0.58 0.24 0.00 -1.21 0.00 0.00 61.69 60.65 1jpr s THR 3 Cb -0.11 -0.36 0.22 0.00 -1.51 0.00 0.00 72.50 70.74 1jpr s THR 3 CO 0.18 -0.17 1.75 0.35 -2.21 0.00 0.00 174.62 174.52 1jpr n THR 4 N 2.25 0.50 -3.24 5.08 -2.24 -1.26 -4.48 114.28 110.90 1jpr n THR 4 Ca -0.18 0.04 -0.04 0.00 -2.27 0.00 0.00 64.05 61.60 1jpr n THR 4 Cb 0.57 -0.74 -0.03 0.00 -2.10 0.00 0.00 70.33 68.02 1jpr n THR 4 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1jpr s PHE 5 N -3.07 -1.36 0.06 4.78 2.19 -1.26 -4.89 117.98 114.44 1jpr s PHE 5 Ca 0.10 0.32 -0.31 0.00 0.33 0.00 0.00 56.93 57.37 1jpr s PHE 5 Cb 0.14 0.08 -0.08 0.00 -1.31 0.00 0.00 43.02 41.85 1jpr s PHE 5 CO 0.46 -1.07 1.57 -1.54 1.83 0.00 0.00 175.22 176.47 1jpr s SER 6 N 2.22 6.67 0.00 6.13 1.04 -1.26 -4.90 113.70 123.60 1jpr s SER 6 Ca 0.13 2.40 0.19 0.00 0.48 0.00 0.00 55.95 59.14 1jpr s SER 6 Cb -0.10 -2.57 0.73 0.00 0.10 0.00 0.00 66.02 64.19 1jpr s SER 6 CO -0.17 -0.83 1.52 0.00 0.98 0.00 0.00 173.24 174.74 1jpr n GLN 7 N 5.36 1.61 -3.15 4.02 10.64 -1.26 -4.72 117.38 129.88 1jpr n GLN 7 Ca 0.15 -0.92 -0.40 0.00 -1.83 0.00 0.00 57.00 54.00 1jpr n GLN 7 Cb 0.41 -1.35 -0.06 0.00 -0.86 0.00 0.00 30.24 28.38 1jpr n GLN 7 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 1jpr s THR 8 N -1.80 5.06 -0.09 -0.39 2.01 -1.26 -5.02 115.64 114.15 1jpr s THR 8 Ca 0.30 1.16 -0.30 0.00 0.31 0.00 0.00 61.69 63.16 1jpr s THR 8 Cb 0.16 -3.93 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 1jpr s THR 8 CO 0.24 0.17 1.36 -0.75 -0.69 0.00 0.00 174.62 174.95 1jpr s LYS 9 N 1.53 4.25 0.14 4.92 2.20 -1.26 -4.97 119.74 126.55 1jpr s LYS 9 Ca 0.29 1.84 0.04 0.00 -0.36 0.00 0.00 55.97 57.78 1jpr s LYS 9 Cb -0.16 -3.74 -0.04 0.00 -1.51 0.00 0.00 37.83 32.38 1jpr s LYS 9 CO 0.11 -0.67 -0.10 0.54 -0.36 0.00 0.00 175.35 174.88 1jpr s ASN 10 N 2.16 1.70 -0.58 1.43 4.22 -1.26 -5.09 114.94 117.53 1jpr s ASN 10 Ca 0.61 -1.01 -0.23 0.00 -2.14 0.00 0.00 52.86 50.09 1jpr s ASN 10 Cb -0.27 0.00 0.06 0.00 1.28 0.00 0.00 41.25 42.33 1jpr s ASN 10 CO 0.21 -0.35 0.89 -0.62 -2.04 0.00 0.00 177.10 175.19 1jpr s ASP 11 N -3.15 6.25 0.42 3.54 -1.08 -1.26 -4.91 116.67 116.48 1jpr s ASP 11 Ca 0.16 -0.71 0.29 0.00 -0.52 0.00 0.00 52.55 51.77 1jpr s ASP 11 Cb 0.03 -2.40 1.38 0.00 -1.46 0.00 0.00 42.92 40.47 1jpr s ASP 11 CO -0.00 -1.24 1.89 1.56 0.52 0.00 0.00 175.17 177.89 1jpr h GLN 12 N 9.35 0.00 0.00 4.34 4.20 -1.97 -1.55 115.11 129.48 1jpr h GLN 12 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1jpr h GLN 12 Cb 1.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.86 1jpr h GLN 12 CO 1.10 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 180.54 1jpr n LEU 13 N -2.61 0.61 -0.35 1.46 4.77 -1.26 -3.67 117.00 115.96 1jpr n LEU 13 Ca 0.00 0.58 0.06 0.00 -0.03 0.00 0.00 56.01 56.62 1jpr n LEU 13 Cb 0.18 -0.41 0.02 0.00 -2.33 0.00 0.00 43.42 40.87 1jpr n LEU 13 CO 0.19 -0.24 0.31 0.29 -1.33 0.00 0.00 177.39 176.61 1jpr n LYS 14 N -2.10 1.46 -2.03 3.23 5.02 -0.59 -4.74 118.16 118.42 1jpr n LYS 14 Ca 0.05 -0.88 -0.32 0.00 -2.02 0.00 0.00 58.31 55.14 1jpr n LYS 14 Cb 0.36 -1.17 0.01 0.00 -0.02 0.00 0.00 35.03 34.20 1jpr n LYS 14 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1jpr s GLU 15 N -1.29 3.45 0.82 1.97 0.41 -1.21 -5.05 118.70 117.80 1jpr s GLU 15 Ca 0.11 1.03 -0.12 0.00 -0.41 0.00 0.00 54.97 55.59 1jpr s GLU 15 Cb 0.10 -2.06 0.08 0.00 -1.78 0.00 0.00 34.13 30.47 1jpr s GLU 15 CO 0.23 -0.69 1.14 -1.25 -0.49 0.00 0.00 175.26 174.21 1jpr s PRO 16 N -4.39 1.92 0.23 0.39 0.04 -1.26 -4.90 135.00 127.03 1jpr s PRO 16 Ca 0.60 0.29 -0.08 0.00 0.04 0.00 0.00 61.00 61.85 1jpr s PRO 16 Cb -0.13 -1.93 0.22 0.00 0.04 0.00 0.00 34.50 32.69 1jpr s PRO 16 CO 0.41 -1.66 1.90 0.52 0.04 0.00 0.00 177.00 178.21 1jpr h MET 17 N -1.11 1.14 -4.94 4.56 2.86 -1.91 -3.38 114.93 112.15 1jpr h MET 17 Ca -0.47 -0.07 -0.32 0.00 -2.06 0.00 0.00 59.70 56.78 1jpr h MET 17 Cb 1.31 -0.26 -0.18 0.00 0.06 0.00 0.00 31.60 32.53 1jpr h MET 17 CO 0.64 0.76 -0.73 -0.06 1.06 0.00 0.00 176.91 178.57 1jpr s PHE 18 N -6.12 1.04 0.00 -0.22 0.08 -1.26 -0.73 117.98 110.77 1jpr s PHE 18 Ca -0.13 -0.65 0.00 0.00 0.12 0.00 0.00 56.93 56.27 1jpr s PHE 18 Cb 0.17 -0.57 0.00 0.00 -0.57 0.00 0.00 43.02 42.04 1jpr s PHE 18 CO 0.80 -0.01 0.00 1.19 -0.10 0.00 0.00 175.22 177.10 1jpr n PHE 19 N 0.60 0.00 -0.14 0.36 3.72 -0.17 -4.86 117.46 116.97 1jpr n PHE 19 Ca -0.16 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 1jpr n PHE 19 Cb 0.58 -0.55 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 1jpr n PHE 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1jpr n GLY 20 N -1.95 -0.55 3.74 1.37 0.00 -1.26 -4.99 105.19 101.55 1jpr n GLY 20 Ca 0.00 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 1jpr n GLY 20 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1jpr s GLN 21 N 0.21 4.37 0.55 1.61 0.74 -1.26 -4.82 119.66 121.06 1jpr s GLN 21 Ca 0.00 2.10 -0.20 0.00 0.05 0.00 0.00 55.36 57.31 1jpr s GLN 21 Cb 0.00 -3.17 -0.06 0.00 1.10 0.00 0.00 33.01 30.87 1jpr s GLN 21 CO 0.00 -0.28 1.01 -2.30 -0.55 0.00 0.00 175.29 173.17 1jpr n PRO 22 N 2.51 1.10 -2.04 1.67 -0.02 -1.26 -4.47 135.00 132.49 1jpr n PRO 22 Ca 0.06 0.41 -0.42 0.00 -2.02 0.00 0.00 63.50 61.54 1jpr n PRO 22 Cb 0.42 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.70 1jpr n PRO 22 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1jpr s VAL 23 N -1.44 2.84 0.00 -1.45 1.01 -1.25 -4.52 120.40 115.59 1jpr s VAL 23 Ca 0.72 0.65 0.00 0.00 0.00 0.00 0.00 61.98 63.35 1jpr s VAL 23 Cb -0.45 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.52 1jpr s VAL 23 CO 0.50 0.08 0.00 -0.46 0.00 0.00 0.00 175.10 175.22 1jpr n ASN 24 N 3.20 0.00 -4.71 3.32 0.23 -1.26 -4.51 115.26 111.53 1jpr n ASN 24 Ca 0.10 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.73 1jpr n ASN 24 Cb 0.40 -0.07 -0.03 0.00 -2.08 0.00 0.00 39.78 38.00 1jpr n ASN 24 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1jpr s VAL 25 N -0.15 4.53 -0.51 3.53 1.01 -1.26 -4.93 120.40 122.62 1jpr s VAL 25 Ca 0.00 1.83 -0.22 0.00 0.00 0.00 0.00 61.98 63.59 1jpr s VAL 25 Cb 0.00 -4.17 0.04 0.00 0.00 0.00 0.00 36.38 32.25 1jpr s VAL 25 CO 0.00 0.15 0.79 0.00 0.00 0.00 0.00 175.10 176.04 1jpr s ALA 26 N 0.98 3.27 0.10 5.51 0.00 -1.26 -4.85 121.76 125.51 1jpr s ALA 26 Ca 0.54 -1.36 0.06 0.00 0.00 0.00 0.00 51.96 51.20 1jpr s ALA 26 Cb -0.24 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.31 1jpr s ALA 26 CO 0.29 -2.14 -0.14 -0.98 0.00 0.00 0.00 175.76 172.78 1jpr s ARG 27 N 3.33 0.95 -0.06 0.00 1.70 -1.26 -5.06 118.95 118.54 1jpr s ARG 27 Ca 0.25 -1.13 0.10 0.00 -0.47 0.00 0.00 55.73 54.48 1jpr s ARG 27 Cb -0.15 -0.89 0.18 0.00 -0.57 0.00 0.00 34.95 33.53 1jpr s ARG 27 CO 0.17 0.18 1.09 0.66 -1.08 0.00 0.00 175.30 176.32 1jpr n TYR 28 N 0.83 0.00 1.08 5.89 4.01 -1.26 -4.67 117.16 123.04 1jpr n TYR 28 Ca -0.18 -0.53 0.13 0.00 -0.16 0.00 0.00 57.90 57.16 1jpr n TYR 28 Cb 0.56 -0.11 0.36 0.00 -0.31 0.00 0.00 39.34 39.83 1jpr n TYR 28 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1jpr n ASP 29 N -0.56 0.52 -3.54 7.72 5.75 -1.26 -4.89 116.55 120.29 1jpr n ASP 29 Ca 0.08 -0.30 -0.14 0.00 -0.01 0.00 0.00 54.79 54.42 1jpr n ASP 29 Cb 0.72 0.10 -0.05 0.00 -1.03 0.00 0.00 41.12 40.87 1jpr n ASP 29 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jpr s GLN 30 N -2.86 1.09 0.06 0.11 -2.07 -1.26 -5.18 119.66 109.55 1jpr s GLN 30 Ca 0.15 -0.24 -0.14 0.00 -1.82 0.00 0.00 55.36 53.31 1jpr s GLN 30 Cb 0.18 0.50 0.02 0.00 -1.09 0.00 0.00 33.01 32.63 1jpr s GLN 30 CO 0.62 -0.41 0.33 1.14 -1.32 0.00 0.00 175.29 175.65 1jpr s GLN 31 N -2.60 0.87 0.04 9.60 0.00 -1.26 -4.92 119.66 121.38 1jpr s GLN 31 Ca -0.04 -0.54 -0.19 0.00 -0.00 0.00 0.00 55.36 54.58 1jpr s GLN 31 Cb -0.01 0.38 -0.16 0.00 0.00 0.00 0.00 33.01 33.22 1jpr s GLN 31 CO -0.03 -0.29 1.27 -0.22 0.00 0.00 0.00 175.29 176.01 1jpr h LYS 32 N 3.02 0.44 -4.40 9.60 3.64 -1.85 -3.41 116.57 123.61 1jpr h LYS 32 Ca -0.32 -0.31 -0.63 0.00 -1.27 0.00 0.00 60.65 58.12 1jpr h LYS 32 Cb 1.21 0.05 -0.39 0.00 -0.41 0.00 0.00 32.23 32.68 1jpr h LYS 32 CO 0.46 0.92 -0.75 0.71 -2.27 0.00 0.00 179.45 178.52 1jpr s TYR 33 N -3.90 2.95 -0.38 1.91 2.02 -1.26 -4.99 117.35 113.69 1jpr s TYR 33 Ca -0.14 -2.35 0.24 0.00 -0.37 0.00 0.00 57.07 54.46 1jpr s TYR 33 Cb 0.05 -2.21 1.06 0.00 -0.40 0.00 0.00 41.96 40.46 1jpr s TYR 33 CO 0.79 -0.88 1.74 0.38 -1.57 0.00 0.00 175.55 176.01 1jpr h ASP 34 N 7.81 0.00 -0.95 2.29 3.04 -1.99 -2.77 116.42 123.85 1jpr h ASP 34 Ca -0.11 0.00 0.17 0.00 -3.24 0.00 0.00 57.03 53.85 1jpr h ASP 34 Cb 1.03 0.00 -0.08 0.00 -1.04 0.00 0.00 39.33 39.24 1jpr h ASP 34 CO 0.47 0.00 0.60 -0.29 -2.04 0.00 0.00 179.24 177.99 1jpr h ILE 35 N 0.00 0.77 -0.17 4.15 6.09 -1.99 -0.87 117.51 125.49 1jpr h ILE 35 Ca 0.00 -0.24 -0.13 0.00 -1.37 0.00 0.00 64.86 63.12 1jpr h ILE 35 Cb 0.32 0.00 -0.01 0.00 0.47 0.00 0.00 36.82 37.60 1jpr h ILE 35 CO 0.00 0.13 -0.44 -0.26 -3.07 0.00 0.00 178.15 174.51 1jpr h PHE 36 N 0.70 0.49 -0.43 2.19 0.04 -1.83 -0.40 116.94 117.71 1jpr h PHE 36 Ca 0.51 -0.15 -0.13 0.00 2.80 0.00 0.00 57.97 61.00 1jpr h PHE 36 Cb 0.85 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.88 1jpr h PHE 36 CO -0.00 0.78 -0.24 1.49 -0.60 0.00 0.00 178.31 179.74 1jpr h GLU 37 N 0.33 0.92 -0.73 1.51 4.57 -1.52 -1.14 114.58 118.53 1jpr h GLU 37 Ca 0.02 -0.42 -0.02 0.00 -1.18 0.00 0.00 59.36 57.76 1jpr h GLU 37 Cb 0.91 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.45 1jpr h GLU 37 CO 0.08 1.07 0.36 0.87 -1.18 0.00 0.00 179.01 180.21 1jpr h LYS 38 N 0.75 1.03 -0.30 1.92 6.56 -0.86 -1.13 116.57 124.55 1jpr h LYS 38 Ca 0.09 -0.14 -0.06 0.00 -1.06 0.00 0.00 60.65 59.48 1jpr h LYS 38 Cb 0.82 -0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 32.28 1jpr h LYS 38 CO 0.07 0.79 -0.05 -0.07 -2.06 0.00 0.00 179.45 178.13 1jpr h LEU 39 N 1.03 0.56 -0.31 2.94 3.38 -0.89 -0.08 115.31 121.94 1jpr h LEU 39 Ca 0.25 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1jpr h LEU 39 Cb 0.09 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1jpr h LEU 39 CO -0.03 0.77 0.06 0.40 0.09 0.00 0.00 178.44 179.73 1jpr h ILE 40 N 0.33 0.85 -0.59 1.22 2.04 -0.85 0.77 117.51 121.29 1jpr h ILE 40 Ca 0.08 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1jpr h ILE 40 Cb 0.52 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1jpr h ILE 40 CO 0.02 0.03 0.33 -0.33 0.00 0.00 0.00 178.15 178.21 1jpr h GLU 41 N 0.17 0.81 -0.38 2.37 5.08 -1.04 -0.65 114.58 120.94 1jpr h GLU 41 Ca 0.14 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 1jpr h GLU 41 Cb 0.16 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1jpr h GLU 41 CO -0.19 0.61 -0.20 0.87 -1.00 0.00 0.00 179.01 179.10 1jpr h LYS 42 N 0.79 0.74 -0.54 2.33 1.79 -0.57 -1.33 116.57 119.78 1jpr h LYS 42 Ca 0.21 -0.28 -0.10 0.00 -2.18 0.00 0.00 60.65 58.30 1jpr h LYS 42 Cb 0.02 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 1jpr h LYS 42 CO -0.04 0.88 -0.05 0.37 -1.08 0.00 0.00 179.45 179.54 1jpr h GLN 43 N 0.65 0.99 -0.73 3.15 5.75 -0.47 -1.71 115.11 122.74 1jpr h GLN 43 Ca 0.10 -0.34 -0.06 0.00 -0.15 0.00 0.00 58.65 58.20 1jpr h GLN 43 Cb 0.69 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.13 1jpr h GLN 43 CO 0.05 1.01 0.21 -0.07 -2.65 0.00 0.00 178.83 177.39 1jpr h LEU 44 N 0.86 1.06 -1.97 -2.39 3.38 -0.94 -2.09 115.31 113.23 1jpr h LEU 44 Ca 0.15 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1jpr h LEU 44 Cb 0.60 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1jpr h LEU 44 CO 0.04 0.99 -0.08 0.77 0.09 0.00 0.00 178.44 180.25 1jpr h SER 45 N 1.09 0.00 -0.18 -0.43 4.64 -0.64 -2.55 113.55 115.47 1jpr h SER 45 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1jpr h SER 45 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1jpr h SER 45 CO -0.01 0.08 0.00 0.49 -0.87 0.00 0.00 176.83 176.53 1jpr n PHE 46 N -3.45 0.23 -1.60 4.77 3.72 -0.70 -4.98 117.46 115.45 1jpr n PHE 46 Ca -0.01 -0.12 -0.54 0.00 -0.05 0.00 0.00 57.45 56.73 1jpr n PHE 46 Cb 0.23 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.71 1jpr n PHE 46 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1jpr n PHE 47 N 0.53 1.50 -4.11 1.38 7.35 -0.96 -4.98 117.46 118.17 1jpr n PHE 47 Ca 0.17 0.69 -0.08 0.00 -0.76 0.00 0.00 57.45 57.46 1jpr n PHE 47 Cb 0.38 -2.32 -0.10 0.00 0.35 0.00 0.00 39.48 37.79 1jpr n PHE 47 CO 0.00 0.00 0.00 1.67 -0.76 0.00 0.00 176.76 177.67 1jpr s TRP 48 N 1.00 0.65 -0.18 -5.13 1.48 -1.26 -5.14 118.94 110.37 1jpr s TRP 48 Ca 0.88 -1.12 0.01 0.00 -1.06 0.00 0.00 56.10 54.81 1jpr s TRP 48 Cb -1.03 -0.41 0.03 0.00 -1.16 0.00 0.00 33.47 30.90 1jpr s TRP 48 CO 0.52 -0.45 -0.14 1.03 -4.06 0.00 0.00 176.95 173.85 1jpr s ARG 49 N -3.97 2.41 0.29 3.25 0.52 -1.26 -5.01 118.95 115.17 1jpr s ARG 49 Ca 0.14 -0.78 0.05 0.00 -0.52 0.00 0.00 55.73 54.61 1jpr s ARG 49 Cb 0.08 -2.39 0.72 0.00 0.52 0.00 0.00 34.95 33.87 1jpr s ARG 49 CO -0.05 -0.31 1.75 -1.35 0.02 0.00 0.00 175.30 175.35 1jpr h PRO 50 N 7.97 0.59 0.00 3.54 0.11 -1.95 0.52 132.00 142.79 1jpr h PRO 50 Ca -0.36 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1jpr h PRO 50 Cb 1.12 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1jpr h PRO 50 CO 0.54 0.39 0.00 0.93 -0.21 0.00 0.00 178.00 179.65 1jpr h GLU 51 N 0.61 0.00 0.00 1.05 3.07 -1.95 0.05 114.58 117.42 1jpr h GLU 51 Ca 0.56 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.42 1jpr h GLU 51 Cb 0.95 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 1jpr h GLU 51 CO -0.43 0.00 0.00 -1.91 -1.40 0.00 0.00 179.01 175.27 1jpr n GLU 52 N -2.76 0.53 -4.19 2.33 2.13 0.17 -4.74 120.64 114.11 1jpr n GLU 52 Ca -0.02 0.01 -0.34 0.00 0.66 0.00 0.00 57.16 57.47 1jpr n GLU 52 Cb 0.09 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.18 1jpr n GLU 52 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1jpr s VAL 53 N -2.44 4.19 -0.31 6.31 1.01 0.00 -5.06 120.40 124.10 1jpr s VAL 53 Ca 0.31 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.76 1jpr s VAL 53 Cb 0.20 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.71 1jpr s VAL 53 CO 0.42 0.46 1.25 -0.62 0.00 0.00 0.00 175.10 176.61 1jpr s ASP 54 N 0.55 6.73 -0.08 3.32 2.15 -1.26 -4.85 116.67 123.23 1jpr s ASP 54 Ca -0.00 1.16 0.12 0.00 0.43 0.00 0.00 52.55 54.25 1jpr s ASP 54 Cb -0.14 -2.54 0.27 0.00 -0.30 0.00 0.00 42.92 40.21 1jpr s ASP 54 CO 0.02 -1.04 1.19 1.33 -0.17 0.00 0.00 175.17 176.50 1jpr n VAL 55 N 6.15 1.58 0.19 1.11 0.24 -1.26 -4.27 118.33 122.08 1jpr n VAL 55 Ca 0.14 -1.61 0.17 0.00 -2.04 0.00 0.00 64.34 61.00 1jpr n VAL 55 Cb 0.47 0.09 0.81 0.00 -1.47 0.00 0.00 33.84 33.74 1jpr n VAL 55 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1jpr h SER 56 N 0.79 0.00 0.03 -1.34 4.64 -1.92 -1.83 113.55 113.93 1jpr h SER 56 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jpr h SER 56 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1jpr h SER 56 CO 0.05 0.00 -0.37 0.54 -0.87 0.00 0.00 176.83 176.18 1jpr n ARG 57 N -3.87 1.27 0.11 4.77 1.74 -1.26 -4.30 116.66 115.11 1jpr n ARG 57 Ca 0.02 -0.99 -0.02 0.00 -0.77 0.00 0.00 57.85 56.09 1jpr n ARG 57 Cb 0.34 -1.48 0.22 0.00 -1.02 0.00 0.00 32.46 30.52 1jpr n ARG 57 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1jpr h ASP 58 N 2.42 0.19 0.03 0.55 5.19 -1.65 -2.63 116.42 120.52 1jpr h ASP 58 Ca 0.00 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 1jpr h ASP 58 Cb 0.72 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.17 1jpr h ASP 58 CO 0.00 0.62 -0.04 -0.09 -3.12 0.00 0.00 179.24 176.61 1jpr h ARG 59 N 0.15 -0.09 -0.39 3.56 2.43 -1.73 -0.14 114.38 118.17 1jpr h ARG 59 Ca 0.01 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 1jpr h ARG 59 Cb 0.87 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.42 1jpr h ARG 59 CO 0.07 -0.06 -0.03 -0.84 -1.51 0.00 0.00 179.97 177.61 1jpr h ILE 60 N -0.09 1.22 -0.20 1.20 3.07 -1.81 -1.30 117.51 119.60 1jpr h ILE 60 Ca 0.01 -0.93 -0.02 0.00 1.55 0.00 0.00 64.86 65.46 1jpr h ILE 60 Cb 0.09 0.96 -0.01 0.00 -0.27 0.00 0.00 36.82 37.59 1jpr h ILE 60 CO -0.02 0.32 0.03 0.44 -1.05 0.00 0.00 178.15 177.87 1jpr h ASP 61 N 0.60 0.32 -0.77 2.16 3.32 -1.18 -2.42 116.42 118.45 1jpr h ASP 61 Ca 0.12 -0.27 0.04 0.00 0.02 0.00 0.00 57.03 56.94 1jpr h ASP 61 Cb 0.42 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 39.83 1jpr h ASP 61 CO 0.02 0.50 0.48 0.22 -1.72 0.00 0.00 179.24 178.74 1jpr h TYR 62 N 0.12 0.90 -0.37 4.55 3.20 -0.77 -2.27 116.97 122.34 1jpr h TYR 62 Ca 0.06 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 1jpr h TYR 62 Cb 0.32 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1jpr h TYR 62 CO 0.02 0.50 -0.08 0.37 -1.64 0.00 0.00 178.16 177.34 1jpr h GLN 63 N 0.93 0.62 0.00 1.82 5.75 -1.15 -2.72 115.11 120.36 1jpr h GLN 63 Ca 0.31 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 1jpr h GLN 63 Cb 0.05 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.53 1jpr h GLN 63 CO -0.12 0.70 0.00 0.00 -2.65 0.00 0.00 178.83 176.75 1jpr n ALA 64 N -2.48 2.30 -1.77 3.38 0.00 -0.92 -4.84 120.51 116.18 1jpr n ALA 64 Ca 0.01 -0.06 -0.37 0.00 0.00 0.00 0.00 53.44 53.02 1jpr n ALA 64 Cb 0.32 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1jpr n ALA 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jpr s LEU 65 N -3.78 3.93 0.67 0.00 1.43 -0.89 -4.96 118.68 115.08 1jpr s LEU 65 Ca 0.12 2.38 -0.17 0.00 -1.03 0.00 0.00 54.13 55.43 1jpr s LEU 65 Cb 0.16 -4.31 0.01 0.00 0.03 0.00 0.00 46.19 42.07 1jpr s LEU 65 CO 0.56 -1.12 1.24 -2.84 0.23 0.00 0.00 176.35 174.43 1jpr s PRO 66 N -2.85 2.45 0.30 1.29 0.02 -1.26 -4.66 135.00 130.29 1jpr s PRO 66 Ca 0.67 1.89 0.04 0.00 0.02 0.00 0.00 61.00 63.62 1jpr s PRO 66 Cb -0.30 -1.86 0.67 0.00 0.02 0.00 0.00 34.50 33.03 1jpr s PRO 66 CO 0.36 -1.63 1.81 1.49 -0.33 0.00 0.00 177.00 178.70 1jpr h GLU 67 N 0.24 0.84 -0.08 5.54 4.57 -1.95 0.07 114.58 123.80 1jpr h GLU 67 Ca -0.49 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 57.52 1jpr h GLU 67 Cb 1.31 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 1jpr h GLU 67 CO 0.52 0.55 -0.46 1.12 -1.18 0.00 0.00 179.01 179.56 1jpr h HIS 68 N 0.86 0.23 -0.17 0.92 2.07 -1.90 -1.38 115.15 115.78 1jpr h HIS 68 Ca 0.54 -0.07 -0.20 0.00 -2.85 0.00 0.00 60.37 57.79 1jpr h HIS 68 Cb 0.72 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 30.65 1jpr h HIS 68 CO -0.00 0.62 -0.70 0.93 -3.07 0.00 0.00 177.93 175.71 1jpr h GLU 69 N 0.16 0.72 -0.50 5.12 5.08 -1.55 -1.26 114.58 122.34 1jpr h GLU 69 Ca 0.01 -0.54 0.03 0.00 -1.00 0.00 0.00 59.36 57.86 1jpr h GLU 69 Cb 0.88 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 1jpr h GLU 69 CO 0.07 1.16 0.27 0.87 -1.00 0.00 0.00 179.01 180.39 1jpr h LYS 70 N 0.51 0.52 -0.50 2.33 1.57 -0.78 -0.83 116.57 119.40 1jpr h LYS 70 Ca -0.03 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1jpr h LYS 70 Cb 1.31 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 33.45 1jpr h LYS 70 CO 0.14 0.35 0.24 1.25 -0.57 0.00 0.00 179.45 180.86 1jpr h HIS 71 N 0.54 0.43 0.38 -1.35 2.76 -1.09 0.31 115.15 117.14 1jpr h HIS 71 Ca 0.21 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.38 1jpr h HIS 71 Cb 0.08 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 28.92 1jpr h HIS 71 CO -0.08 0.20 -0.18 0.82 -1.30 0.00 0.00 177.93 177.38 1jpr h ILE 72 N 0.47 0.63 -0.05 6.26 2.04 -0.98 -0.81 117.51 125.06 1jpr h ILE 72 Ca 0.22 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1jpr h ILE 72 Cb 0.15 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 1jpr h ILE 72 CO -0.17 0.02 -0.12 0.15 0.00 0.00 0.00 178.15 178.04 1jpr h PHE 73 N -0.58 -0.30 -0.18 1.37 3.57 -0.89 -1.99 116.94 117.95 1jpr h PHE 73 Ca -0.05 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.34 1jpr h PHE 73 Cb 0.43 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 1jpr h PHE 73 CO -0.03 -0.18 -0.43 0.97 -2.23 0.00 0.00 178.31 176.41 1jpr h ILE 74 N -0.17 1.31 -0.55 1.41 6.09 -0.94 -1.37 117.51 123.29 1jpr h ILE 74 Ca 0.06 -1.59 -0.06 0.00 -1.37 0.00 0.00 64.86 61.90 1jpr h ILE 74 Cb 0.26 1.64 -0.02 0.00 0.47 0.00 0.00 36.82 39.16 1jpr h ILE 74 CO -0.16 0.49 0.11 0.28 -3.07 0.00 0.00 178.15 175.81 1jpr h SER 75 N 0.35 0.84 -0.17 2.19 0.02 -0.99 -0.18 113.55 115.61 1jpr h SER 75 Ca 0.03 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.72 1jpr h SER 75 Cb 0.89 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1jpr h SER 75 CO 0.08 0.87 0.04 -1.13 -1.14 0.00 0.00 176.83 175.55 1jpr h ASN 76 N 0.78 0.25 -0.69 3.07 -0.00 -1.24 -2.16 115.58 115.58 1jpr h ASN 76 Ca 0.17 -0.22 -0.02 0.00 -0.00 0.00 0.00 56.30 56.23 1jpr h ASN 76 Cb 0.37 -0.07 -0.03 0.00 -0.00 0.00 0.00 38.32 38.59 1jpr h ASN 76 CO 0.01 0.41 0.38 0.25 -0.00 0.00 0.00 177.43 178.47 1jpr h LEU 77 N 0.08 0.89 -1.21 0.34 5.85 -1.04 -1.41 115.31 118.81 1jpr h LEU 77 Ca 0.05 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 1jpr h LEU 77 Cb 0.25 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1jpr h LEU 77 CO -0.00 0.73 0.10 0.11 -0.34 0.00 0.00 178.44 179.03 1jpr h LYS 78 N 1.00 0.65 -0.18 1.25 1.57 -0.81 0.08 116.57 120.12 1jpr h LYS 78 Ca 0.25 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.79 1jpr h LYS 78 Cb 0.05 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1jpr h LYS 78 CO -0.04 0.60 -0.37 -0.92 -0.57 0.00 0.00 179.45 178.15 1jpr h TYR 79 N 0.63 0.72 -0.87 -1.35 3.20 -0.89 -0.36 116.97 118.05 1jpr h TYR 79 Ca 0.14 -0.26 0.07 0.00 3.14 0.00 0.00 58.73 61.82 1jpr h TYR 79 Cb 0.25 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.32 1jpr h TYR 79 CO 0.01 1.01 0.54 1.96 -1.64 0.00 0.00 178.16 180.03 1jpr h GLN 80 N 0.24 0.94 -0.45 1.82 4.20 -0.97 0.07 115.11 120.96 1jpr h GLN 80 Ca 0.01 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1jpr h GLN 80 Cb 0.96 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.51 1jpr h GLN 80 CO 0.08 0.62 0.15 1.15 -0.67 0.00 0.00 178.83 180.16 1jpr h THR 81 N 0.97 1.22 0.00 -0.54 2.02 -0.77 -1.69 112.91 114.12 1jpr h THR 81 Ca 0.38 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 1jpr h THR 81 Cb 0.19 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1jpr h THR 81 CO -0.18 0.26 -0.00 0.25 0.37 0.00 0.00 175.52 176.21 1jpr h LEU 82 N 0.58 -0.01 -0.43 2.58 5.85 -0.61 -1.11 115.31 122.16 1jpr h LEU 82 Ca 0.14 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.87 1jpr h LEU 82 Cb 0.25 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 1jpr h LEU 82 CO -0.01 0.02 0.22 -0.07 -0.34 0.00 0.00 178.44 178.26 1jpr h LEU 83 N -0.03 0.32 -0.45 2.25 3.38 -0.88 -2.31 115.31 117.59 1jpr h LEU 83 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1jpr h LEU 83 Cb 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1jpr h LEU 83 CO 0.00 0.23 0.00 0.44 0.09 0.00 0.00 178.44 179.20 1jpr h ASP 84 N 0.44 0.00 -0.28 -0.43 3.32 -1.24 0.35 116.42 118.58 1jpr h ASP 84 Ca 0.18 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.18 1jpr h ASP 84 Cb 0.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1jpr h ASP 84 CO -0.12 0.00 -0.05 0.28 -1.72 0.00 0.00 179.24 177.63 1jpr h SER 85 N 0.00 0.52 -0.42 6.45 0.02 -0.81 0.81 113.55 120.11 1jpr h SER 85 Ca 0.00 -0.35 -0.06 0.00 -0.84 0.00 0.00 61.79 60.54 1jpr h SER 85 Cb 0.74 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 1jpr h SER 85 CO 0.00 0.75 0.02 0.40 -1.14 0.00 0.00 176.83 176.86 1jpr h ILE 86 N 0.28 1.26 0.00 3.27 2.04 -1.20 -3.07 117.51 120.09 1jpr h ILE 86 Ca 0.07 -0.99 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1jpr h ILE 86 Cb 0.51 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1jpr h ILE 86 CO 0.02 0.34 -0.05 1.56 0.00 0.00 0.00 178.15 180.02 1jpr h GLN 87 N 0.57 0.00 -0.36 2.37 1.08 -0.75 -0.62 115.11 117.40 1jpr h GLN 87 Ca 0.12 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.22 1jpr h GLN 87 Cb 0.46 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 1jpr h GLN 87 CO 0.02 0.05 -0.17 0.78 -0.95 0.00 0.00 178.83 178.56 1jpr h GLY 88 N 1.89 0.81 0.28 3.46 0.00 -0.74 -3.37 103.07 105.41 1jpr h GLY 88 Ca -0.00 -0.72 -0.35 0.00 0.00 0.00 0.00 47.33 46.26 1jpr h GLY 88 CO 0.01 0.66 -2.20 -0.96 0.00 0.00 0.00 176.54 174.04 1jpr n ARG 89 N -4.31 0.67 -0.13 4.80 1.85 -1.14 -4.69 116.66 113.72 1jpr n ARG 89 Ca -0.02 0.10 -0.12 0.00 -1.00 0.00 0.00 57.85 56.80 1jpr n ARG 89 Cb 0.40 -1.60 -0.01 0.00 -1.05 0.00 0.00 32.46 30.20 1jpr n ARG 89 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1jpr h SER 90 N 0.00 1.01 -0.68 2.89 0.02 -1.26 -1.50 113.55 114.02 1jpr h SER 90 Ca -0.48 -0.43 -0.00 0.00 -0.84 0.00 0.00 61.79 60.04 1jpr h SER 90 Cb 2.15 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 64.37 1jpr h SER 90 CO 0.03 1.23 0.41 -0.65 -1.14 0.00 0.00 176.83 176.72 1jpr h PRO 91 N 0.80 0.93 -0.03 3.45 0.11 -1.80 0.24 132.00 135.70 1jpr h PRO 91 Ca 0.08 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 1jpr h PRO 91 Cb 0.90 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.81 1jpr h PRO 91 CO 0.08 0.65 -0.01 -0.91 -0.21 0.00 0.00 178.00 177.61 1jpr h ASN 92 N 0.95 0.06 0.50 -2.05 2.35 -1.75 0.35 115.58 115.99 1jpr h ASN 92 Ca 0.25 -0.37 -0.19 0.00 -0.55 0.00 0.00 56.30 55.43 1jpr h ASN 92 Cb -0.04 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1jpr h ASN 92 CO -0.05 0.42 -0.84 0.58 -1.65 0.00 0.00 177.43 175.90 1jpr h VAL 93 N -0.30 1.46 0.15 2.81 2.07 -0.99 -2.82 116.25 118.63 1jpr h VAL 93 Ca 0.01 -2.48 -0.34 0.00 0.82 0.00 0.00 66.70 64.71 1jpr h VAL 93 Cb 0.39 2.37 -0.00 0.00 -1.52 0.00 0.00 31.29 32.53 1jpr h VAL 93 CO 0.00 0.73 -1.76 0.00 0.02 0.00 0.00 177.57 176.56 1jpr h ALA 94 N 0.97 0.29 0.01 1.67 0.00 -0.62 -3.43 119.26 118.15 1jpr h ALA 94 Ca -0.04 -1.21 -0.37 0.00 0.00 0.00 0.00 54.91 53.28 1jpr h ALA 94 Cb 1.45 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 19.65 1jpr h ALA 94 CO 0.13 1.15 -2.32 1.28 0.00 0.00 0.00 179.25 179.49 1jpr n LEU 95 N -3.50 1.63 -0.34 0.00 4.77 0.10 -4.53 117.00 115.13 1jpr n LEU 95 Ca -0.24 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.85 1jpr n LEU 95 Cb 1.06 -0.30 0.28 0.00 -2.33 0.00 0.00 43.42 42.13 1jpr n LEU 95 CO 0.49 0.71 1.17 -0.07 -1.33 0.00 0.00 177.39 178.37 1jpr h LEU 96 N 0.01 0.74 -0.12 2.23 3.38 -1.33 0.86 115.31 121.07 1jpr h LEU 96 Ca -0.52 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1jpr h LEU 96 Cb 2.06 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.76 1jpr h LEU 96 CO -0.01 0.29 0.00 -2.65 0.09 0.00 0.00 178.44 176.16 1jpr n PRO 97 N -4.77 0.03 -0.02 1.13 -0.02 -1.26 -2.68 135.00 127.40 1jpr n PRO 97 Ca 0.21 0.33 0.05 0.00 -2.02 0.00 0.00 63.50 62.07 1jpr n PRO 97 Cb 0.50 -1.56 0.05 0.00 -0.02 0.00 0.00 33.50 32.48 1jpr n PRO 97 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1jpr n LEU 98 N -1.61 1.95 -4.80 2.45 4.77 0.28 -4.98 117.00 115.06 1jpr n LEU 98 Ca 0.02 -1.12 -0.38 0.00 -0.03 0.00 0.00 56.01 54.50 1jpr n LEU 98 Cb 0.14 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 1jpr n LEU 98 CO 0.11 0.40 0.36 -0.63 -1.33 0.00 0.00 177.39 176.30 1jpr s ILE 99 N -0.84 4.60 -0.02 -0.08 1.01 -1.09 -1.00 121.20 123.78 1jpr s ILE 99 Ca 0.13 1.34 0.03 0.00 0.00 0.00 0.00 60.65 62.15 1jpr s ILE 99 Cb 0.09 -3.95 0.05 0.00 0.01 0.00 0.00 42.46 38.66 1jpr s ILE 99 CO 0.13 0.45 0.92 -1.54 0.00 0.00 0.00 174.94 174.89 1jpr n SER 100 N 1.39 1.52 -4.14 3.58 3.41 0.10 -3.79 113.62 115.69 1jpr n SER 100 Ca -0.07 -1.97 -0.22 0.00 -0.26 0.00 0.00 58.87 56.34 1jpr n SER 100 Cb 0.50 -0.08 -0.15 0.00 -0.26 0.00 0.00 64.21 64.22 1jpr n SER 100 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1jpr s ILE 101 N -1.04 1.19 0.25 -1.33 -4.36 -1.25 -4.63 121.20 110.03 1jpr s ILE 101 Ca 0.05 -0.76 -0.05 0.00 -0.26 0.00 0.00 60.65 59.63 1jpr s ILE 101 Cb 0.05 -1.02 0.16 0.00 1.25 0.00 0.00 42.46 42.90 1jpr s ILE 101 CO 0.00 0.24 1.80 1.55 0.24 0.00 0.00 174.94 178.78 1jpr h PRO 102 N 5.50 1.02 -0.33 0.37 0.13 -1.88 -2.45 132.00 134.37 1jpr h PRO 102 Ca -0.36 -0.20 -0.05 0.00 -0.87 0.00 0.00 66.00 64.52 1jpr h PRO 102 Cb 1.16 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1jpr h PRO 102 CO 0.47 0.86 -0.02 1.05 -0.23 0.00 0.00 178.00 180.13 1jpr h GLU 103 N 0.99 0.52 -0.12 0.86 9.09 -1.91 -1.26 114.58 122.75 1jpr h GLU 103 Ca 0.22 -0.12 -0.21 0.00 0.05 0.00 0.00 59.36 59.31 1jpr h GLU 103 Cb 0.25 -0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 1jpr h GLU 103 CO -0.01 0.56 -0.76 1.25 0.05 0.00 0.00 179.01 180.10 1jpr h LEU 104 N 0.49 0.74 -0.08 3.06 5.85 -1.87 -0.69 115.31 122.81 1jpr h LEU 104 Ca 0.10 -0.48 0.01 0.00 0.84 0.00 0.00 57.88 58.35 1jpr h LEU 104 Cb 0.36 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 1jpr h LEU 104 CO 0.01 1.26 0.02 -0.08 -0.34 0.00 0.00 178.44 179.31 1jpr h GLU 105 N 0.42 0.05 -0.20 1.25 4.81 -1.03 0.39 114.58 120.27 1jpr h GLU 105 Ca -0.04 -0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.03 1jpr h GLU 105 Cb 1.37 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.73 1jpr h GLU 105 CO 0.15 0.04 -0.53 1.15 -0.73 0.00 0.00 179.01 179.08 1jpr h THR 106 N 0.06 1.32 -0.36 0.32 2.02 -1.28 -2.27 112.91 112.72 1jpr h THR 106 Ca 0.03 -1.76 0.02 0.00 0.77 0.00 0.00 66.41 65.48 1jpr h THR 106 Cb 0.02 1.73 -0.03 0.00 -1.74 0.00 0.00 68.15 68.14 1jpr h THR 106 CO -0.04 0.55 0.19 -0.25 0.37 0.00 0.00 175.52 176.34 1jpr h TRP 107 N 0.45 0.36 -0.74 3.16 -0.00 -0.83 0.57 115.95 118.92 1jpr h TRP 107 Ca 0.01 0.01 0.04 0.00 -0.00 0.00 0.00 58.89 58.95 1jpr h TRP 107 Cb 1.07 -0.11 -0.05 0.00 -0.00 0.00 0.00 29.16 30.07 1jpr h TRP 107 CO 0.05 0.20 0.46 0.28 -0.00 0.00 0.00 178.44 179.43 1jpr h VAL 108 N 0.40 1.08 -0.12 2.65 2.07 -0.69 0.24 116.25 121.87 1jpr h VAL 108 Ca 0.15 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 1jpr h VAL 108 Cb 0.04 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.91 1jpr h VAL 108 CO -0.09 0.16 -0.21 -0.33 0.02 0.00 0.00 177.57 177.12 1jpr h GLU 109 N 0.89 0.20 -0.06 1.57 5.08 -0.90 -0.71 114.58 120.65 1jpr h GLU 109 Ca 0.30 -0.06 -0.19 0.00 -1.00 0.00 0.00 59.36 58.42 1jpr h GLU 109 Cb 0.05 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.29 1jpr h GLU 109 CO -0.12 0.41 -0.70 1.15 -1.00 0.00 0.00 179.01 178.75 1jpr h THR 110 N 0.19 1.35 0.38 1.13 2.02 -0.03 -1.97 112.91 115.99 1jpr h THR 110 Ca 0.03 -2.02 -0.02 0.00 0.77 0.00 0.00 66.41 65.18 1jpr h THR 110 Cb 0.49 2.32 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 1jpr h THR 110 CO 0.03 0.61 -0.20 -0.25 0.37 0.00 0.00 175.52 176.09 1jpr h TRP 111 N 0.19 -0.51 -0.75 3.16 7.01 -0.44 -0.61 115.95 124.00 1jpr h TRP 111 Ca -0.07 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 60.97 1jpr h TRP 111 Cb 1.36 0.17 -0.05 0.00 -2.10 0.00 0.00 29.16 28.54 1jpr h TRP 111 CO 0.12 -0.31 0.46 0.00 -2.79 0.00 0.00 178.44 175.91 1jpr h ALA 112 N 0.09 1.00 -0.72 2.65 0.00 -1.18 -2.05 119.26 119.05 1jpr h ALA 112 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1jpr h ALA 112 Cb 0.42 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1jpr h ALA 112 CO 0.08 0.21 0.43 0.35 0.00 0.00 0.00 179.25 180.31 1jpr h PHE 113 N 0.87 0.95 0.00 0.00 3.57 -1.09 -1.95 116.94 119.28 1jpr h PHE 113 Ca 0.32 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.78 1jpr h PHE 113 Cb 0.10 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 1jpr h PHE 113 CO -0.05 0.64 -0.15 0.66 -2.23 0.00 0.00 178.31 177.19 1jpr h SER 114 N 0.98 0.00 0.25 0.41 4.64 -0.43 -0.70 113.55 118.70 1jpr h SER 114 Ca 0.26 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.45 1jpr h SER 114 Cb -0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1jpr h SER 114 CO -0.05 0.15 -0.48 -0.33 -0.87 0.00 0.00 176.83 175.25 1jpr h GLU 115 N 0.00 0.28 -0.20 4.77 4.39 -0.84 -2.62 114.58 120.37 1jpr h GLU 115 Ca -0.00 -0.16 -0.07 0.00 0.34 0.00 0.00 59.36 59.47 1jpr h GLU 115 Cb 0.29 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1jpr h GLU 115 CO 0.02 0.71 -0.19 1.79 -1.16 0.00 0.00 179.01 180.17 1jpr h THR 116 N 0.23 1.23 -0.61 1.13 1.35 -0.86 -0.37 112.91 115.01 1jpr h THR 116 Ca 0.01 -1.06 -0.04 0.00 -0.55 0.00 0.00 66.41 64.77 1jpr h THR 116 Cb 0.94 1.29 -0.03 0.00 -1.73 0.00 0.00 68.15 68.63 1jpr h THR 116 CO 0.08 0.33 0.22 0.40 -0.25 0.00 0.00 175.52 176.30 1jpr h ILE 117 N 0.32 1.24 -0.22 6.82 1.08 -1.19 -0.56 117.51 124.99 1jpr h ILE 117 Ca 0.06 -0.76 0.03 0.00 -0.39 0.00 0.00 64.86 63.79 1jpr h ILE 117 Cb 0.53 0.59 -0.03 0.00 -3.07 0.00 0.00 36.82 34.84 1jpr h ILE 117 CO 0.03 0.30 0.05 0.45 -0.69 0.00 0.00 178.15 178.29 1jpr h HIS 118 N 0.86 0.08 -0.78 1.37 3.86 -0.97 0.25 115.15 119.83 1jpr h HIS 118 Ca 0.20 0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.47 1jpr h HIS 118 Cb 0.24 -0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.65 1jpr h HIS 118 CO 0.01 0.03 0.49 0.77 0.86 0.00 0.00 177.93 180.09 1jpr h SER 119 N 0.14 0.79 -0.97 2.45 0.02 -0.88 -0.33 113.55 114.76 1jpr h SER 119 Ca 0.10 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1jpr h SER 119 Cb 0.09 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.42 1jpr h SER 119 CO -0.13 0.53 0.64 -0.09 -1.14 0.00 0.00 176.83 176.64 1jpr h ARG 120 N 0.93 1.25 -0.13 3.45 2.43 -0.52 -2.55 114.38 119.22 1jpr h ARG 120 Ca 0.32 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.34 1jpr h ARG 120 Cb 0.07 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 1jpr h ARG 120 CO -0.13 0.83 -0.29 0.66 -1.51 0.00 0.00 179.97 179.53 1jpr h SER 121 N 1.29 0.25 -0.21 -3.80 4.64 0.73 -1.81 113.55 114.64 1jpr h SER 121 Ca 0.36 -0.08 -0.11 0.00 -0.47 0.00 0.00 61.79 61.49 1jpr h SER 121 Cb -0.11 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 1jpr h SER 121 CO -0.09 0.54 -0.25 1.88 -0.87 0.00 0.00 176.83 178.04 1jpr h TYR 122 N 0.22 0.77 -0.60 4.77 0.05 -0.94 -0.60 116.97 120.65 1jpr h TYR 122 Ca 0.03 -0.18 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 1jpr h TYR 122 Cb 0.63 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 38.15 1jpr h TYR 122 CO 0.01 0.86 0.31 1.15 -1.05 0.00 0.00 178.16 179.45 1jpr h THR 123 N 0.59 1.20 -0.76 -2.88 2.02 -1.12 0.11 112.91 112.07 1jpr h THR 123 Ca 0.08 -0.52 0.04 0.00 0.77 0.00 0.00 66.41 66.78 1jpr h THR 123 Cb 0.73 0.45 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 1jpr h THR 123 CO 0.06 0.22 0.47 -0.74 0.37 0.00 0.00 175.52 175.90 1jpr h HIS 124 N 0.81 0.87 0.25 3.16 -0.00 -0.80 0.79 115.15 120.23 1jpr h HIS 124 Ca 0.21 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.59 1jpr h HIS 124 Cb 0.07 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.20 1jpr h HIS 124 CO -0.01 0.47 -0.12 0.82 -0.00 0.00 0.00 177.93 179.10 1jpr h ILE 125 N 0.89 0.76 -0.83 6.26 2.04 -0.77 -2.91 117.51 122.95 1jpr h ILE 125 Ca 0.32 -0.77 0.09 0.00 1.00 0.00 0.00 64.86 65.50 1jpr h ILE 125 Cb 0.08 1.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 1jpr h ILE 125 CO -0.14 0.15 0.48 0.40 0.00 0.00 0.00 178.15 179.05 1jpr h ILE 126 N -0.77 0.92 0.00 -0.67 2.04 -0.62 0.61 117.51 119.02 1jpr h ILE 126 Ca -0.03 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 1jpr h ILE 126 Cb 0.50 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1jpr h ILE 126 CO 0.06 0.15 -0.16 0.03 0.00 0.00 0.00 178.15 178.23 1jpr h ARG 127 N 0.81 0.00 -0.03 2.37 2.47 -0.89 -2.54 114.38 116.57 1jpr h ARG 127 Ca 0.40 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.12 1jpr h ARG 127 Cb 0.35 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.67 1jpr h ARG 127 CO -0.24 0.16 0.00 0.09 0.56 0.00 0.00 179.97 180.54 1jpr n ASN 128 N -3.66 2.44 0.00 7.04 4.13 0.15 -4.43 115.26 120.92 1jpr n ASN 128 Ca -0.02 -1.81 0.00 0.00 1.68 0.00 0.00 54.58 54.43 1jpr n ASN 128 Cb 0.28 -0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.51 1jpr n ASN 128 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 1jpr n ILE 129 N 0.91 0.00 -4.23 2.41 -5.35 -0.84 -3.92 119.36 108.34 1jpr n ILE 129 Ca 0.16 -0.36 -0.18 0.00 -0.27 0.00 0.00 62.75 62.11 1jpr n ILE 129 Cb 0.51 0.88 -0.11 0.00 -1.74 0.00 0.00 39.64 39.17 1jpr n ILE 129 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1jpr s VAL 130 N -1.13 1.28 0.07 7.28 1.01 -1.07 -4.81 120.40 123.03 1jpr s VAL 130 Ca 0.00 -1.70 -0.19 0.00 0.00 0.00 0.00 61.98 60.10 1jpr s VAL 130 Cb 0.00 -1.50 -0.10 0.00 0.00 0.00 0.00 36.38 34.78 1jpr s VAL 130 CO 0.00 -0.43 1.44 0.78 0.00 0.00 0.00 175.10 176.89 1jpr h ASN 131 N 3.55 0.46 -3.67 3.32 -0.26 -1.90 -3.41 115.58 113.67 1jpr h ASN 131 Ca -0.40 -0.40 -0.65 0.00 -0.56 0.00 0.00 56.30 54.29 1jpr h ASN 131 Cb 1.19 -0.13 -0.39 0.00 -1.06 0.00 0.00 38.32 37.93 1jpr h ASN 131 CO 0.51 0.75 -0.74 -0.62 -1.06 0.00 0.00 177.43 176.27 1jpr s ASP 132 N -6.10 4.62 0.53 5.81 2.15 -1.26 -4.99 116.67 117.43 1jpr s ASP 132 Ca -0.14 -1.96 0.23 0.00 0.43 0.00 0.00 52.55 51.11 1jpr s ASP 132 Cb 0.07 -1.53 1.38 0.00 -0.30 0.00 0.00 42.92 42.54 1jpr s ASP 132 CO 0.76 -0.35 2.04 -0.65 -0.17 0.00 0.00 175.17 176.81 1jpr h PRO 133 N 7.69 0.00 -0.12 4.34 0.11 -1.86 -2.27 132.00 139.89 1jpr h PRO 133 Ca -0.08 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.07 1jpr h PRO 133 Cb 1.02 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1jpr h PRO 133 CO 0.50 0.00 0.09 0.77 -0.21 0.00 0.00 178.00 179.15 1jpr h SER 134 N 0.00 0.00 -0.37 -2.05 0.02 -1.99 -0.03 113.55 109.13 1jpr h SER 134 Ca 0.17 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1jpr h SER 134 Cb 0.70 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 1jpr h SER 134 CO -0.00 0.00 0.15 0.58 -1.14 0.00 0.00 176.83 176.42 1jpr h VAL 135 N 0.00 1.19 0.06 2.27 2.07 -1.85 -2.18 116.25 117.81 1jpr h VAL 135 Ca 0.06 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 1jpr h VAL 135 Cb 0.24 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1jpr h VAL 135 CO -0.00 0.21 -0.03 0.58 0.02 0.00 0.00 177.57 178.35 1jpr h VAL 136 N 0.45 1.14 -0.89 2.57 2.07 -1.21 -3.08 116.25 117.30 1jpr h VAL 136 Ca 0.12 -0.72 0.02 0.00 0.82 0.00 0.00 66.70 66.94 1jpr h VAL 136 Cb 0.18 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 1jpr h VAL 136 CO -0.01 0.18 0.58 -0.26 0.02 0.00 0.00 177.57 178.08 1jpr h PHE 137 N -0.41 1.10 -0.21 1.57 0.04 -1.20 -2.82 116.94 115.01 1jpr h PHE 137 Ca -0.01 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.71 1jpr h PHE 137 Cb 0.36 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.13 1jpr h PHE 137 CO 0.03 0.68 -0.22 -0.44 -0.60 0.00 0.00 178.31 177.76 1jpr h ASP 138 N 1.18 0.36 0.46 2.17 3.32 -1.47 -2.61 116.42 119.84 1jpr h ASP 138 Ca 0.33 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1jpr h ASP 138 Cb -0.10 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1jpr h ASP 138 CO -0.08 0.59 0.00 -0.67 -1.72 0.00 0.00 179.24 177.36 1jpr n ASP 139 N -4.16 0.00 0.01 6.45 2.03 -1.07 -2.90 116.55 116.91 1jpr n ASP 139 Ca -0.00 0.44 -0.18 0.00 0.52 0.00 0.00 54.79 55.56 1jpr n ASP 139 Cb 0.36 -0.47 -0.09 0.00 -0.72 0.00 0.00 41.12 40.20 1jpr n ASP 139 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1jpr h ILE 140 N 0.00 1.32 -0.42 5.18 2.04 -1.49 -1.33 117.51 122.81 1jpr h ILE 140 Ca 0.00 -2.07 -0.02 0.00 1.00 0.00 0.00 64.86 63.76 1jpr h ILE 140 Cb 0.23 2.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 1jpr h ILE 140 CO 0.00 0.64 0.17 0.58 0.00 0.00 0.00 178.15 179.54 1jpr h VAL 141 N 0.30 1.20 -0.21 1.67 2.07 -1.68 -3.29 116.25 116.31 1jpr h VAL 141 Ca -0.08 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1jpr h VAL 141 Cb 1.46 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 1jpr h VAL 141 CO 0.16 0.22 0.00 0.35 0.02 0.00 0.00 177.57 178.33 1jpr n THR 142 N -4.63 0.47 -1.72 2.57 -2.24 -1.25 -4.90 114.28 102.58 1jpr n THR 142 Ca 0.00 -0.73 -0.42 0.00 -2.27 0.00 0.00 64.05 60.63 1jpr n THR 142 Cb 0.15 0.92 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 1jpr n THR 142 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1jpr s ASN 143 N -1.07 6.30 0.17 3.42 3.84 -0.50 -4.87 114.94 122.23 1jpr s ASN 143 Ca 0.22 2.44 -0.14 0.00 0.21 0.00 0.00 52.86 55.59 1jpr s ASN 143 Cb 0.13 -2.53 0.11 0.00 -0.55 0.00 0.00 41.25 38.41 1jpr s ASN 143 CO 0.18 -1.21 1.75 -0.08 -2.79 0.00 0.00 177.10 174.96 1jpr h GLU 144 N 11.26 0.32 -0.07 0.43 4.81 -1.93 -0.66 114.58 128.74 1jpr h GLU 144 Ca -0.46 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 58.62 1jpr h GLU 144 Cb 1.23 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1jpr h GLU 144 CO 0.95 0.21 -0.52 1.96 -0.73 0.00 0.00 179.01 180.88 1jpr h GLN 145 N 0.33 0.18 -0.07 1.92 1.08 -1.98 -1.49 115.11 115.08 1jpr h GLN 145 Ca 0.20 -0.11 -0.02 0.00 -1.45 0.00 0.00 58.65 57.27 1jpr h GLN 145 Cb 0.18 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.62 1jpr h GLN 145 CO -0.20 0.67 -0.05 0.82 -0.95 0.00 0.00 178.83 179.12 1jpr h ILE 146 N 0.15 1.34 -0.75 2.54 1.08 -1.85 -0.47 117.51 119.54 1jpr h ILE 146 Ca 0.00 -1.11 0.07 0.00 -0.39 0.00 0.00 64.86 63.43 1jpr h ILE 146 Cb 0.98 1.93 -0.06 0.00 -3.07 0.00 0.00 36.82 36.60 1jpr h ILE 146 CO 0.08 0.31 0.44 1.56 -0.69 0.00 0.00 178.15 179.84 1jpr h GLN 147 N -0.24 0.77 -0.68 2.37 4.20 -1.04 -1.35 115.11 119.13 1jpr h GLN 147 Ca 0.01 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 1jpr h GLN 147 Cb 0.51 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.09 1jpr h GLN 147 CO 0.01 0.51 0.19 0.87 -0.67 0.00 0.00 178.83 179.74 1jpr h LYS 148 N 0.79 1.08 -0.09 1.46 1.57 -1.12 0.68 116.57 120.94 1jpr h LYS 148 Ca 0.34 -0.25 -0.16 0.00 -1.87 0.00 0.00 60.65 58.71 1jpr h LYS 148 Cb 0.21 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1jpr h LYS 148 CO -0.19 0.95 -0.61 -0.09 -0.57 0.00 0.00 179.45 178.94 1jpr h ARG 149 N 1.02 0.33 -0.55 3.15 2.43 -0.51 -3.10 114.38 117.14 1jpr h ARG 149 Ca 0.22 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1jpr h ARG 149 Cb 0.34 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1jpr h ARG 149 CO -0.00 0.84 0.00 0.00 -1.51 0.00 0.00 179.97 179.30 1jpr n ALA 150 N -2.49 2.41 -1.65 2.80 0.00 -0.56 -4.80 120.51 116.22 1jpr n ALA 150 Ca -0.03 -1.11 -0.47 0.00 0.00 0.00 0.00 53.44 51.83 1jpr n ALA 150 Cb 0.63 -0.92 -0.04 0.00 0.00 0.00 0.00 19.45 19.12 1jpr n ALA 150 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1jpr n GLU 151 N 1.50 1.89 0.00 0.00 0.00 0.22 -2.24 120.64 122.02 1jpr n GLU 151 Ca 0.22 0.68 0.00 0.00 0.00 0.00 0.00 57.16 58.06 1jpr n GLU 151 Cb 0.59 -2.38 0.00 0.00 0.00 0.00 0.00 31.44 29.66 1jpr n GLU 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1jpr n GLY 152 N 2.80 3.09 0.43 8.31 0.00 -1.26 -4.94 105.19 113.62 1jpr n GLY 152 Ca 0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 1jpr n GLY 152 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1jpr h ILE 153 N 0.00 0.18 -0.08 -0.61 2.04 -1.85 -2.15 117.51 115.04 1jpr h ILE 153 Ca 0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1jpr h ILE 153 Cb 0.00 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.26 1jpr h ILE 153 CO 0.00 0.00 -0.04 0.77 0.00 0.00 0.00 178.15 178.88 1jpr h SER 154 N -0.96 0.10 -0.20 1.72 4.64 -1.92 -2.64 113.55 114.29 1jpr h SER 154 Ca -0.07 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.14 1jpr h SER 154 Cb 0.79 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.84 1jpr h SER 154 CO 0.05 0.16 -0.20 0.77 -0.87 0.00 0.00 176.83 176.74 1jpr h SER 155 N 0.11 0.64 -0.49 4.97 4.64 -1.86 0.22 113.55 121.78 1jpr h SER 155 Ca 0.03 -0.21 -0.03 0.00 -0.47 0.00 0.00 61.79 61.11 1jpr h SER 155 Cb 0.14 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1jpr h SER 155 CO 0.01 0.84 0.18 1.88 -0.87 0.00 0.00 176.83 178.87 1jpr h TYR 156 N 0.57 0.75 -0.31 4.77 0.05 -1.02 -0.85 116.97 120.92 1jpr h TYR 156 Ca 0.09 -0.06 -0.06 0.00 0.05 0.00 0.00 58.73 58.75 1jpr h TYR 156 Cb 0.66 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 1jpr h TYR 156 CO 0.03 0.64 -0.03 1.88 -1.05 0.00 0.00 178.16 179.63 1jpr h TYR 157 N 0.65 0.62 -0.75 4.88 0.05 -1.40 -2.30 116.97 118.71 1jpr h TYR 157 Ca 0.16 -0.12 -0.00 0.00 0.05 0.00 0.00 58.73 58.82 1jpr h TYR 157 Cb 0.21 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 37.76 1jpr h TYR 157 CO 0.01 0.72 0.45 -0.44 -1.05 0.00 0.00 178.16 177.84 1jpr h ASP 158 N 0.35 0.90 -0.37 3.88 5.19 -0.41 -0.51 116.42 125.45 1jpr h ASP 158 Ca 0.08 -0.06 -0.14 0.00 -0.62 0.00 0.00 57.03 56.29 1jpr h ASP 158 Cb 0.49 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.77 1jpr h ASP 158 CO 0.02 0.70 -0.32 -0.33 -3.12 0.00 0.00 179.24 176.19 1jpr h GLU 159 N 1.02 0.87 -0.41 3.56 5.08 -1.17 -0.76 114.58 122.78 1jpr h GLU 159 Ca 0.27 -0.44 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1jpr h GLU 159 Cb -0.03 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1jpr h GLU 159 CO -0.05 1.09 0.25 1.25 -1.00 0.00 0.00 179.01 180.55 1jpr h LEU 160 N 0.68 0.41 -0.26 1.33 5.85 -0.98 -0.48 115.31 121.84 1jpr h LEU 160 Ca 0.06 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1jpr h LEU 160 Cb 0.91 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1jpr h LEU 160 CO 0.08 0.29 0.16 0.40 -0.34 0.00 0.00 178.44 179.03 1jpr h ILE 161 N 0.50 1.10 -0.24 4.05 2.04 -0.95 0.57 117.51 124.58 1jpr h ILE 161 Ca 0.16 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.79 1jpr h ILE 161 Cb -0.01 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1jpr h ILE 161 CO -0.06 0.10 0.13 -0.08 0.00 0.00 0.00 178.15 178.23 1jpr h GLU 162 N 0.33 0.26 -0.09 2.37 4.81 -0.93 -1.30 114.58 120.03 1jpr h GLU 162 Ca 0.09 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1jpr h GLU 162 Cb 0.02 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 1jpr h GLU 162 CO -0.02 0.17 -0.21 1.98 -0.73 0.00 0.00 179.01 180.20 1jpr h MET 163 N 0.26 0.14 -0.53 1.92 4.05 -0.81 -1.93 114.93 118.04 1jpr h MET 163 Ca 0.09 -0.04 -0.09 0.00 -0.28 0.00 0.00 59.70 59.38 1jpr h MET 163 Cb 0.01 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 30.78 1jpr h MET 163 CO -0.06 0.36 -0.03 1.15 0.23 0.00 0.00 176.91 178.56 1jpr h THR 164 N 0.13 1.27 -0.48 -0.77 2.02 -0.44 -1.48 112.91 113.16 1jpr h THR 164 Ca 0.02 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.03 1jpr h THR 164 Cb 0.46 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1jpr h THR 164 CO 0.03 0.41 0.22 0.28 0.37 0.00 0.00 175.52 176.83 1jpr h SER 165 N 0.82 0.63 -0.68 4.18 0.02 -0.70 0.02 113.55 117.84 1jpr h SER 165 Ca 0.14 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1jpr h SER 165 Cb 0.57 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1jpr h SER 165 CO 0.03 0.59 0.38 1.88 -1.14 0.00 0.00 176.83 178.57 1jpr h TYR 166 N 0.63 0.92 -0.19 3.45 0.05 -1.21 -0.42 116.97 120.21 1jpr h TYR 166 Ca 0.16 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.92 1jpr h TYR 166 Cb 0.13 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 37.56 1jpr h TYR 166 CO -0.01 0.65 0.10 2.35 -1.05 0.00 0.00 178.16 180.20 1jpr h TRP 167 N 0.93 0.27 -0.35 4.88 7.01 -0.93 0.26 115.95 128.01 1jpr h TRP 167 Ca 0.24 -0.01 -0.08 0.00 2.11 0.00 0.00 58.89 61.14 1jpr h TRP 167 Cb 0.03 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 26.99 1jpr h TRP 167 CO -0.01 0.27 -0.13 0.45 -2.79 0.00 0.00 178.44 176.23 1jpr h HIS 168 N 0.18 0.68 -0.00 2.65 3.86 -0.76 0.36 115.15 122.12 1jpr h HIS 168 Ca 0.07 -0.12 -0.07 0.00 -1.16 0.00 0.00 60.37 59.09 1jpr h HIS 168 Cb 0.10 -0.18 0.01 0.00 1.06 0.00 0.00 27.41 28.40 1jpr h HIS 168 CO -0.03 0.72 -0.27 -0.07 0.86 0.00 0.00 177.93 179.15 1jpr h LEU 169 N 0.57 0.24 0.00 2.43 4.07 -0.92 0.91 115.31 122.61 1jpr h LEU 169 Ca 0.10 -0.77 0.00 0.00 0.08 0.00 0.00 57.88 57.29 1jpr h LEU 169 Cb 0.56 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.22 1jpr h LEU 169 CO 0.04 0.98 -1.46 0.18 -1.08 0.00 0.00 178.44 177.10 1jpr n LEU 170 N -4.49 0.01 -0.11 1.67 4.32 0.90 -4.83 117.00 114.47 1jpr n LEU 170 Ca -0.10 -0.01 0.01 0.00 -0.02 0.00 0.00 56.01 55.90 1jpr n LEU 170 Cb 0.51 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.31 1jpr n LEU 170 CO 0.40 0.00 -0.02 0.61 -1.22 0.00 0.00 177.39 177.16 1jpr n GLY 171 N 1.89 -1.42 3.76 -0.72 0.00 0.12 -4.85 105.19 103.97 1jpr n GLY 171 Ca -0.02 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.13 1jpr n GLY 171 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jpr s GLU 172 N -1.25 3.27 0.00 1.61 2.12 -1.26 -4.70 118.70 118.49 1jpr s GLU 172 Ca 0.00 1.87 0.00 0.00 0.36 0.00 0.00 54.97 57.20 1jpr s GLU 172 Cb 0.00 -2.14 0.00 0.00 0.26 0.00 0.00 34.13 32.25 1jpr s GLU 172 CO 0.00 -0.98 0.00 0.41 -0.54 0.00 0.00 175.26 174.15 1jpr n GLY 173 N 0.50 0.95 3.38 -1.50 0.00 -0.53 -4.95 105.19 103.04 1jpr n GLY 173 Ca 0.11 -1.97 -0.39 0.00 0.00 0.00 0.00 46.02 43.77 1jpr n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jpr s THR 174 N -1.44 4.32 0.43 2.61 2.01 -1.26 -0.44 115.64 121.86 1jpr s THR 174 Ca 0.00 -0.69 0.07 0.00 0.31 0.00 0.00 61.69 61.38 1jpr s THR 174 Cb 0.00 -3.29 -0.05 0.00 0.01 0.00 0.00 72.50 69.17 1jpr s THR 174 CO 0.00 -0.03 0.13 -1.00 -0.69 0.00 0.00 174.62 173.03 1jpr s HIS 175 N 1.54 2.48 0.01 4.92 3.76 0.11 -4.95 115.29 123.17 1jpr s HIS 175 Ca 0.03 -0.65 0.05 0.00 -0.15 0.00 0.00 55.06 54.33 1jpr s HIS 175 Cb -0.18 -1.88 -0.02 0.00 1.11 0.00 0.00 32.58 31.61 1jpr s HIS 175 CO 0.05 0.23 -0.15 0.95 -0.85 0.00 0.00 174.74 174.97 1jpr s THR 176 N -2.66 1.15 -0.10 1.30 -4.23 -1.26 -0.07 115.64 109.77 1jpr s THR 176 Ca 0.36 -0.81 -0.03 0.00 -1.18 0.00 0.00 61.69 60.03 1jpr s THR 176 Cb 0.05 -1.00 0.04 0.00 1.34 0.00 0.00 72.50 72.93 1jpr s THR 176 CO 0.20 0.18 0.06 -0.69 -0.54 0.00 0.00 174.62 173.82 1jpr s VAL 177 N -0.58 0.04 -1.52 2.29 1.01 0.42 -4.89 120.40 117.18 1jpr s VAL 177 Ca 0.04 0.09 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 1jpr s VAL 177 Cb -0.07 -0.44 0.05 0.00 0.00 0.00 0.00 36.38 35.93 1jpr s VAL 177 CO 0.00 0.01 0.52 0.59 0.00 0.00 0.00 175.10 176.23 1jpr n ASN 178 N 5.24 -1.32 0.00 3.32 3.02 -1.26 -1.63 115.26 122.63 1jpr n ASN 178 Ca -0.06 -1.02 0.00 0.00 -0.03 0.00 0.00 54.58 53.47 1jpr n ASN 178 Cb 0.49 -2.88 0.00 0.00 -0.61 0.00 0.00 39.78 36.78 1jpr n ASN 178 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jpr n GLY 179 N -1.83 0.93 3.37 7.41 0.00 -1.26 -5.04 105.19 108.77 1jpr n GLY 179 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 1jpr n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jpr s LYS 180 N -0.46 1.36 0.11 1.61 0.00 -0.65 -5.11 119.74 116.59 1jpr s LYS 180 Ca 0.00 -1.36 -0.30 0.00 0.00 0.00 0.00 55.97 54.31 1jpr s LYS 180 Cb 0.00 -1.71 -0.06 0.00 0.00 0.00 0.00 37.83 36.06 1jpr s LYS 180 CO 0.00 0.39 0.96 0.99 0.00 0.00 0.00 175.35 177.69 1jpr s THR 181 N -1.35 4.52 -0.18 3.79 2.01 -1.26 -0.44 115.64 122.73 1jpr s THR 181 Ca 0.14 2.06 -0.01 0.00 0.31 0.00 0.00 61.69 64.20 1jpr s THR 181 Cb -0.09 -4.32 0.05 0.00 0.01 0.00 0.00 72.50 68.15 1jpr s THR 181 CO 0.07 0.31 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.60 1jpr s VAL 182 N 0.03 0.91 -0.20 3.82 1.01 0.90 -4.92 120.40 121.94 1jpr s VAL 182 Ca 0.47 -0.63 -0.12 0.00 0.00 0.00 0.00 61.98 61.70 1jpr s VAL 182 Cb -0.23 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 1jpr s VAL 182 CO 0.30 -0.01 0.22 -0.89 0.00 0.00 0.00 175.10 174.71 1jpr s THR 183 N 1.70 5.34 -0.19 3.92 2.01 -1.26 0.07 115.64 127.23 1jpr s THR 183 Ca -0.01 0.36 -0.03 0.00 0.31 0.00 0.00 61.69 62.32 1jpr s THR 183 Cb -0.16 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 1jpr s THR 183 CO -0.07 0.37 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.47 1jpr s VAL 184 N 0.71 3.25 -0.09 3.82 1.01 0.42 -4.99 120.40 124.52 1jpr s VAL 184 Ca 0.12 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1jpr s VAL 184 Cb -0.13 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.82 1jpr s VAL 184 CO 0.03 0.46 -0.16 -0.55 0.00 0.00 0.00 175.10 174.87 1jpr s SER 185 N 1.13 2.38 0.25 3.32 0.15 -1.26 -1.45 113.70 118.22 1jpr s SER 185 Ca 0.01 -0.42 -0.03 0.00 0.70 0.00 0.00 55.95 56.22 1jpr s SER 185 Cb -0.14 -1.08 0.32 0.00 -1.71 0.00 0.00 66.02 63.40 1jpr s SER 185 CO -0.02 0.06 1.76 0.25 1.20 0.00 0.00 173.24 176.49 1jpr h LEU 186 N 7.11 0.79 -0.39 3.45 6.46 -1.98 -1.42 115.31 129.32 1jpr h LEU 186 Ca -0.28 -0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.29 1jpr h LEU 186 Cb 1.19 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.90 1jpr h LEU 186 CO 0.48 0.85 0.25 -0.09 -0.62 0.00 0.00 178.44 179.30 1jpr h ARG 187 N 0.77 0.53 -0.29 1.25 2.43 -1.99 0.71 114.38 117.79 1jpr h ARG 187 Ca 0.15 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 1jpr h ARG 187 Cb 0.44 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1jpr h ARG 187 CO 0.02 0.38 -0.11 1.49 -1.51 0.00 0.00 179.97 180.24 1jpr h GLU 188 N 0.52 0.48 -0.29 0.20 4.57 -1.89 -0.95 114.58 117.23 1jpr h GLU 188 Ca 0.14 -0.13 -0.14 0.00 -1.18 0.00 0.00 59.36 58.05 1jpr h GLU 188 Cb -0.02 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.51 1jpr h GLU 188 CO -0.03 0.59 -0.39 1.25 -1.18 0.00 0.00 179.01 179.25 1jpr h LEU 189 N 0.45 0.72 -0.65 1.64 6.46 -0.72 -0.57 115.31 122.64 1jpr h LEU 189 Ca 0.09 -0.32 -0.04 0.00 -0.12 0.00 0.00 57.88 57.48 1jpr h LEU 189 Cb 0.46 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.16 1jpr h LEU 189 CO 0.03 1.03 0.24 0.11 -0.62 0.00 0.00 178.44 179.23 1jpr h LYS 190 N 0.56 0.98 -0.36 1.25 1.57 -0.55 -0.37 116.57 119.64 1jpr h LYS 190 Ca 0.05 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1jpr h LYS 190 Cb 0.92 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1jpr h LYS 190 CO 0.08 0.83 0.22 -0.22 -0.57 0.00 0.00 179.45 179.80 1jpr h LYS 191 N 0.92 0.49 -0.71 3.15 3.64 -0.93 0.10 116.57 123.23 1jpr h LYS 191 Ca 0.21 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 1jpr h LYS 191 Cb 0.23 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1jpr h LYS 191 CO -0.01 0.36 0.45 0.87 -2.27 0.00 0.00 179.45 178.84 1jpr h LYS 192 N 0.48 0.85 -0.29 1.90 1.79 -0.64 -1.33 116.57 119.33 1jpr h LYS 192 Ca 0.13 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 1jpr h LYS 192 Cb -0.01 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.44 1jpr h LYS 192 CO -0.03 0.56 0.13 1.25 -1.08 0.00 0.00 179.45 180.29 1jpr h LEU 193 N 0.88 0.38 -0.31 2.94 5.85 -0.85 -1.14 115.31 123.05 1jpr h LEU 193 Ca 0.28 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.92 1jpr h LEU 193 Cb 0.01 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 1jpr h LEU 193 CO -0.11 0.41 0.03 0.22 -0.34 0.00 0.00 178.44 178.66 1jpr h TYR 194 N 0.33 0.05 -0.22 1.25 5.03 -0.64 -0.57 116.97 122.19 1jpr h TYR 194 Ca 0.10 0.02 -0.10 0.00 2.58 0.00 0.00 58.73 61.33 1jpr h TYR 194 Cb 0.14 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.43 1jpr h TYR 194 CO -0.02 -0.02 -0.29 -0.07 -1.32 0.00 0.00 178.16 176.45 1jpr h LEU 195 N 0.13 0.45 -0.55 2.82 3.38 -1.22 -1.62 115.31 118.70 1jpr h LEU 195 Ca 0.15 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1jpr h LEU 195 Cb 0.18 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1jpr h LEU 195 CO -0.22 0.73 0.25 0.00 0.09 0.00 0.00 178.44 179.29 1jpr h LEU 197 N 0.75 0.98 -0.68 0.00 3.38 -0.99 0.34 115.31 119.09 1jpr h LEU 197 Ca 0.19 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1jpr h LEU 197 Cb 0.14 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1jpr h LEU 197 CO -0.02 1.09 0.35 -0.03 0.09 0.00 0.00 178.44 179.91 1jpr h MET 198 N 0.88 0.97 -0.39 1.13 4.05 -1.15 0.11 114.93 120.53 1jpr h MET 198 Ca 0.14 -0.13 -0.08 0.00 -0.28 0.00 0.00 59.70 59.35 1jpr h MET 198 Cb 0.66 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 31.26 1jpr h MET 198 CO 0.05 0.76 -0.09 0.77 0.23 0.00 0.00 176.91 178.62 1jpr h SER 199 N 0.94 0.65 -0.01 1.39 0.02 -0.55 -0.76 113.55 115.24 1jpr h SER 199 Ca 0.24 -0.18 -0.13 0.00 -0.84 0.00 0.00 61.79 60.88 1jpr h SER 199 Cb 0.09 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 1jpr h SER 199 CO -0.03 0.78 -0.41 0.58 -1.14 0.00 0.00 176.83 176.61 1jpr h VAL 200 N 0.62 1.30 -0.79 2.27 2.07 -0.39 -0.32 116.25 121.00 1jpr h VAL 200 Ca 0.11 -1.58 -0.05 0.00 0.82 0.00 0.00 66.70 66.01 1jpr h VAL 200 Cb 0.52 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1jpr h VAL 200 CO 0.03 0.49 0.31 -1.13 0.02 0.00 0.00 177.57 177.29 1jpr h ASN 201 N 0.43 1.10 0.12 0.57 -0.73 -0.31 -1.63 115.58 115.14 1jpr h ASN 201 Ca 0.04 -0.18 -0.11 0.00 1.87 0.00 0.00 56.30 57.92 1jpr h ASN 201 Cb 0.90 -0.29 -0.01 0.00 0.27 0.00 0.00 38.32 39.19 1jpr h ASN 201 CO 0.08 0.98 -0.39 0.00 -0.37 0.00 0.00 177.43 177.73 1jpr h ALA 202 N 1.17 1.04 -0.03 1.57 0.00 -0.66 -0.82 119.26 121.53 1jpr h ALA 202 Ca 0.26 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1jpr h ALA 202 Cb 0.23 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1jpr h ALA 202 CO -0.02 0.60 0.01 1.25 0.00 0.00 0.00 179.25 181.09 1jpr h LEU 203 N 0.30 0.04 0.09 0.00 6.46 -0.65 -0.22 115.31 121.33 1jpr h LEU 203 Ca 0.03 -0.21 -0.26 0.00 -0.12 0.00 0.00 57.88 57.32 1jpr h LEU 203 Cb 0.82 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.74 1jpr h LEU 203 CO 0.07 0.23 -1.24 -0.33 -0.62 0.00 0.00 178.44 176.55 1jpr h GLU 204 N -0.16 0.19 0.00 1.25 5.08 -1.31 -1.35 114.58 118.28 1jpr h GLU 204 Ca 0.01 -0.33 -0.16 0.00 -1.00 0.00 0.00 59.36 57.89 1jpr h GLU 204 Cb 0.21 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1jpr h GLU 204 CO -0.00 1.12 -1.28 0.00 -1.00 0.00 0.00 179.01 177.85 1jpr h ALA 205 N 0.69 0.65 0.00 3.43 0.00 -1.21 -3.38 119.26 119.43 1jpr h ALA 205 Ca -0.13 -0.78 -0.01 0.00 0.00 0.00 0.00 54.91 53.99 1jpr h ALA 205 Cb 1.93 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.94 1jpr h ALA 205 CO 0.17 0.87 -1.04 1.51 0.00 0.00 0.00 179.25 180.76 1jpr n ILE 206 N -2.94 0.04 -0.13 0.00 3.06 -0.19 -4.52 119.36 114.69 1jpr n ILE 206 Ca -0.08 -0.01 -0.09 0.00 -2.50 0.00 0.00 62.75 60.07 1jpr n ILE 206 Cb 0.82 -1.46 -0.01 0.00 0.54 0.00 0.00 39.64 39.54 1jpr n ILE 206 CO 0.00 0.00 0.00 0.03 -2.50 0.00 0.00 176.55 174.08 1jpr h ARG 207 N -0.03 0.56 -0.55 9.51 3.08 -1.11 -1.38 114.38 124.47 1jpr h ARG 207 Ca -0.02 -0.08 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 1jpr h ARG 207 Cb 1.02 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.94 1jpr h ARG 207 CO -0.01 0.48 0.02 0.74 -1.07 0.00 0.00 179.97 180.13 1jpr h PHE 208 N 0.49 0.98 -0.37 3.04 0.04 -1.43 -2.65 116.94 117.05 1jpr h PHE 208 Ca 0.13 -0.14 -0.10 0.00 2.80 0.00 0.00 57.97 60.66 1jpr h PHE 208 Cb 0.11 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 37.97 1jpr h PHE 208 CO -0.02 0.87 -0.17 1.88 -0.60 0.00 0.00 178.31 180.27 1jpr h TYR 209 N 0.85 0.76 -0.77 -0.55 -1.99 -1.62 0.40 116.97 114.05 1jpr h TYR 209 Ca 0.16 -0.15 -0.02 0.00 2.00 0.00 0.00 58.73 60.72 1jpr h TYR 209 Cb 0.47 -0.19 -0.04 0.00 2.00 0.00 0.00 36.73 38.98 1jpr h TYR 209 CO 0.03 0.81 0.40 0.28 -0.00 0.00 0.00 178.16 179.68 1jpr h VAL 210 N 0.61 1.24 -0.45 -2.88 2.07 -1.06 -1.97 116.25 113.80 1jpr h VAL 210 Ca 0.10 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 1jpr h VAL 210 Cb 0.64 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1jpr h VAL 210 CO 0.05 0.27 0.14 0.77 0.02 0.00 0.00 177.57 178.81 1jpr h SER 211 N 1.07 0.60 -0.03 0.57 4.64 -0.90 -2.44 113.55 117.06 1jpr h SER 211 Ca 0.27 -0.08 -0.05 0.00 -0.47 0.00 0.00 61.79 61.46 1jpr h SER 211 Cb 0.06 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 1jpr h SER 211 CO -0.04 0.58 -0.09 -0.26 -0.87 0.00 0.00 176.83 176.15 1jpr h PHE 212 N 0.65 0.29 -0.42 4.77 0.04 -0.24 -1.83 116.94 120.19 1jpr h PHE 212 Ca 0.15 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.88 1jpr h PHE 212 Cb 0.20 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 1jpr h PHE 212 CO 0.01 0.38 0.23 0.00 -0.60 0.00 0.00 178.31 178.33 1jpr h ALA 213 N 1.64 0.54 0.03 2.45 0.00 -0.92 0.46 119.26 123.45 1jpr h ALA 213 Ca 0.06 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1jpr h ALA 213 Cb 0.34 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1jpr h ALA 213 CO 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 179.25 179.32 1jpr h SER 215 N -0.04 0.59 1.24 0.00 0.02 -1.07 -2.79 113.55 111.50 1jpr h SER 215 Ca -0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1jpr h SER 215 Cb 0.03 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1jpr h SER 215 CO 0.01 0.47 0.00 -0.26 -1.14 0.00 0.00 176.83 175.91 1jpr h PHE 216 N 0.65 0.00 -0.35 3.45 0.04 -0.84 -2.66 116.94 117.24 1jpr h PHE 216 Ca 0.17 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.89 1jpr h PHE 216 Cb -0.00 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.13 1jpr h PHE 216 CO -0.03 0.00 -0.02 0.00 -0.60 0.00 0.00 178.31 177.66 1jpr h ALA 217 N 2.19 1.32 -0.26 2.45 0.00 -1.00 0.64 119.26 124.60 1jpr h ALA 217 Ca 0.00 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1jpr h ALA 217 Cb 0.62 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1jpr h ALA 217 CO 0.00 0.46 -0.26 0.74 0.00 0.00 0.00 179.25 180.19 1jpr h PHE 218 N 0.52 0.77 -0.52 0.00 0.04 -1.52 -2.96 116.94 113.28 1jpr h PHE 218 Ca 0.11 -0.23 0.03 0.00 2.80 0.00 0.00 57.97 60.68 1jpr h PHE 218 Cb 0.37 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 1jpr h PHE 218 CO 0.01 0.96 0.35 0.00 -0.60 0.00 0.00 178.31 179.03 1jpr h ALA 219 N 0.69 1.75 -0.32 2.45 0.00 -1.22 0.71 119.26 123.31 1jpr h ALA 219 Ca 0.04 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1jpr h ALA 219 Cb 0.83 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1jpr h ALA 219 CO 0.07 0.20 0.00 0.93 0.00 0.00 0.00 179.25 180.44 1jpr h GLU 220 N 0.60 0.50 -0.46 0.00 4.39 -0.74 -0.66 114.58 118.20 1jpr h GLU 220 Ca 0.21 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1jpr h GLU 220 Cb 0.10 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 1jpr h GLU 220 CO -0.05 0.52 0.00 0.54 -1.16 0.00 0.00 179.01 178.86 1jpr n ARG 221 N -4.29 1.64 -1.68 2.33 1.74 0.09 -4.86 116.66 111.63 1jpr n ARG 221 Ca 0.01 -0.72 -0.13 0.00 -0.77 0.00 0.00 57.85 56.24 1jpr n ARG 221 Cb 0.23 -1.35 -0.04 0.00 -1.02 0.00 0.00 32.46 30.28 1jpr n ARG 221 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1jpr n GLU 222 N 0.09 -0.97 -4.37 5.56 0.00 -0.25 -5.00 120.64 115.69 1jpr n GLU 222 Ca 0.07 0.86 -0.27 0.00 0.00 0.00 0.00 57.16 57.81 1jpr n GLU 222 Cb 0.28 -4.98 -0.11 0.00 0.00 0.00 0.00 31.44 26.64 1jpr n GLU 222 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1jpr s LEU 223 N -3.30 2.62 -1.28 4.31 1.43 -0.33 -4.69 118.68 117.45 1jpr s LEU 223 Ca 0.00 -0.76 -0.03 0.00 -1.03 0.00 0.00 54.13 52.31 1jpr s LEU 223 Cb 0.00 -1.35 -0.01 0.00 0.03 0.00 0.00 46.19 44.87 1jpr s LEU 223 CO 0.00 0.12 0.70 0.23 0.23 0.00 0.00 176.35 177.62 1jpr n MET 224 N 0.22 -4.12 0.17 1.70 2.81 -1.26 -2.97 117.12 113.67 1jpr n MET 224 Ca -0.12 0.59 0.05 0.00 -1.81 0.00 0.00 57.70 56.42 1jpr n MET 224 Cb 0.56 -5.02 0.17 0.00 -0.71 0.00 0.00 33.22 28.21 1jpr n MET 224 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1jpr h GLU 225 N -1.82 0.00 -0.08 0.03 5.08 -1.92 -1.56 114.58 114.31 1jpr h GLU 225 Ca -0.62 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.71 1jpr h GLU 225 Cb 1.36 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 1jpr h GLU 225 CO 0.55 0.38 -0.05 0.78 -1.00 0.00 0.00 179.01 179.67 1jpr h GLY 226 N 3.05 0.19 0.55 -3.84 0.00 -1.90 -2.15 103.07 98.97 1jpr h GLY 226 Ca -0.00 -0.18 0.06 0.00 0.00 0.00 0.00 47.33 47.21 1jpr h GLY 226 CO 0.05 0.16 0.18 -0.57 0.00 0.00 0.00 176.54 176.36 1jpr h ASN 227 N -0.22 0.19 -0.75 0.19 -0.73 -1.86 -2.22 115.58 110.18 1jpr h ASN 227 Ca 0.02 0.06 0.09 0.00 1.87 0.00 0.00 56.30 58.33 1jpr h ASN 227 Cb 0.52 0.04 -0.07 0.00 0.27 0.00 0.00 38.32 39.08 1jpr h ASN 227 CO 0.01 0.14 0.40 0.00 -0.37 0.00 0.00 177.43 177.62 1jpr h ALA 228 N 1.32 1.06 -0.70 1.57 0.00 -1.15 0.19 119.26 121.54 1jpr h ALA 228 Ca 0.23 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 1jpr h ALA 228 Cb 0.24 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1jpr h ALA 228 CO -0.23 0.02 0.16 0.87 0.00 0.00 0.00 179.25 180.07 1jpr h LYS 229 N 0.68 1.12 -0.18 0.00 1.57 -0.83 0.77 116.57 119.70 1jpr h LYS 229 Ca 0.37 -0.27 -0.08 0.00 -1.87 0.00 0.00 60.65 58.80 1jpr h LYS 229 Cb 0.36 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 1jpr h LYS 229 CO -0.26 0.99 -0.19 0.82 -0.57 0.00 0.00 179.45 180.24 1jpr h ILE 230 N 1.06 1.34 -0.30 1.86 2.04 -0.83 -2.82 117.51 119.85 1jpr h ILE 230 Ca 0.22 -1.37 -0.04 0.00 1.00 0.00 0.00 64.86 64.67 1jpr h ILE 230 Cb 0.38 1.81 -0.02 0.00 -0.74 0.00 0.00 36.82 38.25 1jpr h ILE 230 CO 0.00 0.41 0.01 0.40 0.00 0.00 0.00 178.15 178.97 1jpr h ILE 231 N 0.11 1.18 -0.56 -0.67 1.08 -0.38 -1.65 117.51 116.63 1jpr h ILE 231 Ca 0.03 -0.69 0.04 0.00 -0.39 0.00 0.00 64.86 63.84 1jpr h ILE 231 Cb 0.74 0.94 -0.04 0.00 -3.07 0.00 0.00 36.82 35.39 1jpr h ILE 231 CO 0.05 0.24 0.32 -0.09 -0.69 0.00 0.00 178.15 177.97 1jpr h ARG 232 N 0.45 0.60 -0.56 2.37 2.43 -0.76 0.12 114.38 119.02 1jpr h ARG 232 Ca 0.10 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 1jpr h ARG 232 Cb 0.28 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1jpr h ARG 232 CO 0.01 0.39 -0.02 -0.07 -1.51 0.00 0.00 179.97 178.77 1jpr h LEU 233 N 0.61 0.98 -0.39 3.80 3.38 -1.21 -2.04 115.31 120.44 1jpr h LEU 233 Ca 0.24 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1jpr h LEU 233 Cb 0.09 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1jpr h LEU 233 CO -0.13 1.06 0.18 0.40 0.09 0.00 0.00 178.44 180.04 1jpr h ILE 234 N 0.88 1.17 -0.43 1.22 2.04 -1.07 -2.24 117.51 119.09 1jpr h ILE 234 Ca 0.16 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1jpr h ILE 234 Cb 0.56 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1jpr h ILE 234 CO 0.03 0.19 0.22 0.00 0.00 0.00 0.00 178.15 178.59 1jpr h ALA 235 N 1.03 1.59 -0.58 1.87 0.00 -0.60 0.20 119.26 122.77 1jpr h ALA 235 Ca 0.13 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1jpr h ALA 235 Cb 0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1jpr h ALA 235 CO -0.02 0.34 0.05 -0.09 0.00 0.00 0.00 179.25 179.54 1jpr h ARG 236 N 0.60 0.99 -0.13 0.00 2.43 -1.14 -2.01 114.38 115.12 1jpr h ARG 236 Ca 0.15 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1jpr h ARG 236 Cb 0.04 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1jpr h ARG 236 CO -0.02 0.96 0.04 -0.44 -1.51 0.00 0.00 179.97 178.99 1jpr h ASP 237 N 0.88 0.20 -0.54 -3.80 3.32 -0.70 -3.16 116.42 112.62 1jpr h ASP 237 Ca 0.17 -0.22 0.09 0.00 0.02 0.00 0.00 57.03 57.09 1jpr h ASP 237 Cb 0.48 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 1jpr h ASP 237 CO 0.02 0.37 0.37 -0.33 -1.72 0.00 0.00 179.24 177.94 1jpr h GLU 238 N 0.02 0.33 -0.89 3.56 4.39 -0.42 -0.79 114.58 120.78 1jpr h GLU 238 Ca 0.04 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1jpr h GLU 238 Cb 0.25 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.78 1jpr h GLU 238 CO -0.00 0.22 0.58 0.00 -1.16 0.00 0.00 179.01 178.64 1jpr h ALA 239 N 1.72 1.33 -0.35 3.43 0.00 -1.33 -0.30 119.26 123.77 1jpr h ALA 239 Ca 0.25 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1jpr h ALA 239 Cb 0.54 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1jpr h ALA 239 CO -0.06 0.60 -0.10 -0.07 0.00 0.00 0.00 179.25 179.62 1jpr h LEU 240 N 1.22 0.70 -0.77 0.00 3.38 -1.21 -2.20 115.31 116.43 1jpr h LEU 240 Ca 0.33 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1jpr h LEU 240 Cb -0.11 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.41 1jpr h LEU 240 CO -0.07 0.91 0.51 0.45 0.09 0.00 0.00 178.44 180.33 1jpr h HIS 241 N 0.48 0.97 0.00 1.13 3.86 -0.51 0.63 115.15 121.71 1jpr h HIS 241 Ca 0.09 0.02 -0.09 0.00 -1.16 0.00 0.00 60.37 59.23 1jpr h HIS 241 Cb 0.62 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 1jpr h HIS 241 CO 0.05 0.61 -0.44 1.37 0.86 0.00 0.00 177.93 180.38 1jpr h LEU 242 N 1.04 0.00 -0.81 2.43 8.10 -1.12 -1.91 115.31 123.04 1jpr h LEU 242 Ca 0.28 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 58.19 1jpr h LEU 242 Cb -0.12 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.08 1jpr h LEU 242 CO -0.06 0.44 0.03 0.74 -4.11 0.00 0.00 178.44 175.48 1jpr h THR 243 N 0.00 1.25 -0.17 0.15 2.02 -0.62 -1.20 112.91 114.34 1jpr h THR 243 Ca -0.00 -1.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.11 1jpr h THR 243 Cb 1.11 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 1jpr h THR 243 CO 0.06 0.38 0.03 1.23 0.37 0.00 0.00 175.52 177.58 1jpr h GLY 244 N 1.00 0.30 1.75 2.16 0.00 -0.38 -2.05 103.07 105.85 1jpr h GLY 244 Ca 0.16 -0.20 -0.11 0.00 0.00 0.00 0.00 47.33 47.19 1jpr h GLY 244 CO 0.02 0.18 -0.42 -0.91 0.00 0.00 0.00 176.54 175.41 1jpr h THR 245 N 0.07 1.31 -0.39 4.70 1.35 -1.24 -1.17 112.91 117.54 1jpr h THR 245 Ca 0.05 -1.54 -0.00 0.00 -0.55 0.00 0.00 66.41 64.36 1jpr h THR 245 Cb 0.30 1.68 -0.02 0.00 -1.73 0.00 0.00 68.15 68.38 1jpr h THR 245 CO 0.00 0.46 0.23 1.56 -0.25 0.00 0.00 175.52 177.53 1jpr h GLN 246 N 0.23 0.53 -0.54 4.72 4.20 -1.16 0.02 115.11 123.11 1jpr h GLN 246 Ca 0.02 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 1jpr h GLN 246 Cb 0.84 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 1jpr h GLN 246 CO 0.07 0.40 0.04 0.45 -0.67 0.00 0.00 178.83 179.12 1jpr h HIS 247 N 0.51 1.00 -0.08 2.96 3.86 -1.18 0.45 115.15 122.67 1jpr h HIS 247 Ca 0.14 -0.16 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1jpr h HIS 247 Cb 0.01 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.19 1jpr h HIS 247 CO -0.03 0.90 -0.03 0.52 0.86 0.00 0.00 177.93 180.14 1jpr h MET 248 N 0.81 -0.02 -0.55 2.45 2.86 -0.96 -1.19 114.93 118.34 1jpr h MET 248 Ca 0.16 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.77 1jpr h MET 248 Cb 0.48 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 1jpr h MET 248 CO 0.02 -0.02 0.23 -0.07 1.06 0.00 0.00 176.91 178.14 1jpr h LEU 249 N -0.02 0.74 -0.89 1.22 3.38 -0.88 -0.81 115.31 118.04 1jpr h LEU 249 Ca 0.04 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 1jpr h LEU 249 Cb 0.09 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1jpr h LEU 249 CO -0.10 0.70 -0.21 0.78 0.09 0.00 0.00 178.44 179.70 1jpr h ASN 250 N 0.74 0.58 -0.20 -0.43 2.35 -0.82 -0.77 115.58 117.03 1jpr h ASN 250 Ca 0.18 -0.19 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 1jpr h ASN 250 Cb 0.18 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1jpr h ASN 250 CO -0.02 0.79 -0.27 -0.07 -1.65 0.00 0.00 177.43 176.21 1jpr h LEU 251 N 0.52 0.70 -0.40 1.61 3.38 -0.97 -1.33 115.31 118.82 1jpr h LEU 251 Ca 0.08 -0.27 -0.16 0.00 0.09 0.00 0.00 57.88 57.62 1jpr h LEU 251 Cb 0.65 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1jpr h LEU 251 CO 0.05 0.94 -0.43 -0.07 0.09 0.00 0.00 178.44 179.02 1jpr h LEU 252 N 0.59 0.95 -0.02 1.67 3.38 -0.89 -3.30 115.31 117.69 1jpr h LEU 252 Ca 0.08 -0.46 -0.23 0.00 0.09 0.00 0.00 57.88 57.36 1jpr h LEU 252 Cb 0.77 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1jpr h LEU 252 CO 0.06 1.24 -1.05 0.08 0.09 0.00 0.00 178.44 178.86 1jpr h ARG 253 N 0.71 0.11 0.00 1.13 0.11 -1.03 -2.75 114.38 112.65 1jpr h ARG 253 Ca 0.05 -0.18 -0.00 0.00 0.10 0.00 0.00 59.98 59.95 1jpr h ARG 253 Cb 1.02 0.06 -0.00 0.00 1.11 0.00 0.00 29.97 32.17 1jpr h ARG 253 CO 0.10 1.05 -0.02 0.66 0.10 0.00 0.00 179.97 181.86 1jpr h SER 254 N 0.04 0.00 0.00 0.08 4.64 -1.33 -3.41 113.55 113.57 1jpr h SER 254 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1jpr h SER 254 Cb 1.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.87 1jpr h SER 254 CO 0.15 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 1jpr n GLY 255 N -0.87 1.17 0.24 -0.77 0.00 -1.23 -4.93 105.19 98.80 1jpr n GLY 255 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 1jpr n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jpr h ALA 256 N 0.00 1.09 0.01 4.61 0.00 -1.88 -3.35 119.26 119.74 1jpr h ALA 256 Ca 0.00 -0.17 -0.40 0.00 0.00 0.00 0.00 54.91 54.34 1jpr h ALA 256 Cb 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 1jpr h ALA 256 CO 0.00 0.23 -2.42 -3.47 0.00 0.00 0.00 179.25 173.59 1jpr n ASP 257 N -3.44 1.98 -3.40 0.00 2.03 -1.24 -4.94 116.55 107.55 1jpr n ASP 257 Ca -0.00 0.03 -0.10 0.00 0.52 0.00 0.00 54.79 55.24 1jpr n ASP 257 Cb 0.37 -0.58 -0.09 0.00 -0.72 0.00 0.00 41.12 40.10 1jpr n ASP 257 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1jpr s ASP 258 N -6.83 0.35 0.38 1.67 2.15 -1.26 -4.70 116.67 108.43 1jpr s ASP 258 Ca -0.35 0.24 0.11 0.00 0.43 0.00 0.00 52.55 52.98 1jpr s ASP 258 Cb 0.10 1.03 0.90 0.00 -0.30 0.00 0.00 42.92 44.66 1jpr s ASP 258 CO 0.59 -0.30 1.90 -0.65 -0.17 0.00 0.00 175.17 176.54 1jpr h PRO 259 N 8.20 0.57 -0.43 4.34 0.11 -1.92 -1.77 132.00 141.10 1jpr h PRO 259 Ca -0.19 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.81 1jpr h PRO 259 Cb 1.15 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1jpr h PRO 259 CO 0.26 0.38 -0.05 1.49 -0.21 0.00 0.00 178.00 179.87 1jpr h GLU 260 N 0.59 0.74 -0.35 1.05 4.81 -1.95 -2.30 114.58 117.17 1jpr h GLU 260 Ca 0.40 -0.21 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1jpr h GLU 260 Cb 0.72 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1jpr h GLU 260 CO -0.16 0.78 -0.05 1.98 -0.73 0.00 0.00 179.01 180.84 1jpr h MET 261 N 0.68 0.56 -0.43 1.92 4.05 -1.60 0.23 114.93 120.34 1jpr h MET 261 Ca 0.13 -0.14 -0.06 0.00 -0.28 0.00 0.00 59.70 59.35 1jpr h MET 261 Cb 0.50 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.21 1jpr h MET 261 CO 0.03 0.62 0.05 0.00 0.23 0.00 0.00 176.91 177.84 1jpr h ALA 262 N 1.43 0.57 -0.76 0.39 0.00 -1.11 0.00 119.26 119.78 1jpr h ALA 262 Ca 0.11 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1jpr h ALA 262 Cb 0.41 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1jpr h ALA 262 CO 0.02 0.31 0.28 0.93 0.00 0.00 0.00 179.25 180.79 1jpr h GLU 263 N 0.58 1.15 -0.45 0.00 5.08 -1.00 -2.64 114.58 117.29 1jpr h GLU 263 Ca 0.13 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1jpr h GLU 263 Cb 0.40 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1jpr h GLU 263 CO 0.01 0.95 0.16 0.82 -1.00 0.00 0.00 179.01 179.96 1jpr h ILE 264 N 1.11 1.21 -0.20 3.13 2.04 -0.62 -1.91 117.51 122.26 1jpr h ILE 264 Ca 0.25 -0.67 0.02 0.00 1.00 0.00 0.00 64.86 65.46 1jpr h ILE 264 Cb 0.25 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1jpr h ILE 264 CO -0.02 0.24 0.06 0.00 0.00 0.00 0.00 178.15 178.43 1jpr h ALA 265 N 1.01 0.21 -0.35 1.87 0.00 -0.84 -1.19 119.26 119.97 1jpr h ALA 265 Ca 0.15 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1jpr h ALA 265 Cb 0.22 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1jpr h ALA 265 CO -0.01 -0.37 0.23 1.49 0.00 0.00 0.00 179.25 180.59 1jpr h GLU 266 N 0.14 0.45 -0.79 0.00 4.57 -1.41 -2.13 114.58 115.42 1jpr h GLU 266 Ca 0.09 -0.03 0.08 0.00 -1.18 0.00 0.00 59.36 58.32 1jpr h GLU 266 Cb 0.07 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 28.50 1jpr h GLU 266 CO -0.10 0.30 0.52 1.49 -1.18 0.00 0.00 179.01 180.03 1jpr h GLU 267 N 0.47 0.76 -0.66 1.92 4.81 -0.84 -2.10 114.58 118.93 1jpr h GLU 267 Ca 0.13 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 59.14 1jpr h GLU 267 Cb -0.04 -0.17 -0.10 0.00 0.63 0.00 0.00 28.75 29.06 1jpr h GLU 267 CO -0.04 0.50 0.20 0.00 -0.73 0.00 0.00 179.01 178.95 1jpr h LYS 269 N 2.65 0.30 -0.38 0.00 3.64 -0.76 -0.19 116.57 121.84 1jpr h LYS 269 Ca 0.22 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.51 1jpr h LYS 269 Cb 2.20 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.94 1jpr h LYS 269 CO 0.66 0.20 -0.03 0.37 -2.27 0.00 0.00 179.45 178.38 1jpr h GLN 270 N 0.31 0.69 -0.36 1.90 5.75 -1.83 -2.00 115.11 119.57 1jpr h GLN 270 Ca 0.34 -0.23 0.01 0.00 -0.15 0.00 0.00 58.65 58.61 1jpr h GLN 270 Cb 0.50 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.97 1jpr h GLN 270 CO -0.40 0.81 0.23 1.49 -2.65 0.00 0.00 178.83 178.31 1jpr h GLU 271 N 0.50 0.45 -0.68 1.69 4.81 -1.74 -1.25 114.58 118.37 1jpr h GLU 271 Ca 0.10 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1jpr h GLU 271 Cb 0.52 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1jpr h GLU 271 CO 0.03 0.30 0.45 0.00 -0.73 0.00 0.00 179.01 179.06 1jpr h TYR 273 N 0.93 0.20 -0.06 0.00 5.03 -0.96 -1.46 116.97 120.65 1jpr h TYR 273 Ca 0.25 0.00 -0.07 0.00 2.58 0.00 0.00 58.73 61.49 1jpr h TYR 273 Cb -0.10 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.10 1jpr h TYR 273 CO -0.02 0.14 -0.30 -0.44 -1.32 0.00 0.00 178.16 176.21 1jpr h ASP 274 N 0.21 0.12 -0.06 -2.11 3.32 -0.81 -0.87 116.42 116.21 1jpr h ASP 274 Ca 0.06 -0.04 -0.15 0.00 0.02 0.00 0.00 57.03 56.92 1jpr h ASP 274 Cb -0.01 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1jpr h ASP 274 CO -0.01 0.42 -0.49 0.17 -1.72 0.00 0.00 179.24 177.61 1jpr h LEU 275 N 0.11 0.67 -0.37 1.55 8.10 -0.79 0.62 115.31 125.20 1jpr h LEU 275 Ca 0.01 -0.33 -0.01 0.00 0.11 0.00 0.00 57.88 57.66 1jpr h LEU 275 Cb 0.59 -0.19 -0.02 0.00 -0.44 0.00 0.00 40.66 40.60 1jpr h LEU 275 CO 0.04 1.05 0.18 -0.26 -4.11 0.00 0.00 178.44 175.34 1jpr h PHE 276 N 0.49 0.54 -0.50 0.17 0.04 -0.61 0.18 116.94 117.24 1jpr h PHE 276 Ca 0.02 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 1jpr h PHE 276 Cb 1.03 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.99 1jpr h PHE 276 CO 0.05 0.46 0.19 0.28 -0.60 0.00 0.00 178.31 178.68 1jpr h VAL 277 N 0.46 1.19 -0.45 -0.55 2.07 -0.92 -1.53 116.25 116.52 1jpr h VAL 277 Ca 0.13 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 67.00 1jpr h VAL 277 Cb 0.12 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1jpr h VAL 277 CO -0.02 0.23 0.10 -0.61 0.02 0.00 0.00 177.57 177.30 1jpr h GLN 278 N 0.72 0.73 -0.76 1.57 5.75 -0.10 0.17 115.11 123.19 1jpr h GLN 278 Ca 0.17 -0.18 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1jpr h GLN 278 Cb 0.16 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.58 1jpr h GLN 278 CO -0.02 0.74 0.44 0.00 -2.65 0.00 0.00 178.83 177.34 1jpr h ALA 279 N 0.96 0.97 -0.76 3.38 0.00 -0.51 -0.82 119.26 122.49 1jpr h ALA 279 Ca 0.14 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1jpr h ALA 279 Cb 0.34 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1jpr h ALA 279 CO 0.00 0.45 0.31 0.00 0.00 0.00 0.00 179.25 180.02 1jpr h ALA 280 N 1.23 0.99 -0.73 0.00 0.00 -0.93 -1.76 119.26 118.05 1jpr h ALA 280 Ca 0.27 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1jpr h ALA 280 Cb -0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1jpr h ALA 280 CO -0.05 0.60 0.26 0.37 0.00 0.00 0.00 179.25 180.44 1jpr h GLN 281 N 1.09 1.11 -0.55 0.00 5.75 -0.37 -1.24 115.11 120.90 1jpr h GLN 281 Ca 0.25 -0.21 -0.08 0.00 -0.15 0.00 0.00 58.65 58.46 1jpr h GLN 281 Cb 0.20 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 1jpr h GLN 281 CO -0.02 0.92 0.02 1.96 -2.65 0.00 0.00 178.83 179.05 1jpr h GLN 282 N 1.08 0.93 -0.42 1.69 4.20 -0.73 -0.97 115.11 120.89 1jpr h GLN 282 Ca 0.24 -0.27 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 1jpr h GLN 282 Cb 0.25 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1jpr h GLN 282 CO -0.01 0.91 -0.12 0.93 -0.67 0.00 0.00 178.83 179.87 1jpr h GLU 283 N 0.86 0.75 -0.35 1.46 4.39 -0.66 -1.58 114.58 119.45 1jpr h GLU 283 Ca 0.16 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.57 1jpr h GLU 283 Cb 0.49 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1jpr h GLU 283 CO 0.02 0.84 0.07 0.87 -1.16 0.00 0.00 179.01 179.65 1jpr h LYS 284 N 0.68 0.57 -0.76 2.33 1.79 -0.72 -2.14 116.57 118.31 1jpr h LYS 284 Ca 0.11 -0.15 0.07 0.00 -2.18 0.00 0.00 60.65 58.51 1jpr h LYS 284 Cb 0.59 -0.07 -0.05 0.00 -1.58 0.00 0.00 32.23 31.13 1jpr h LYS 284 CO 0.04 0.63 0.50 -0.44 -1.08 0.00 0.00 179.45 179.10 1jpr h ASP 285 N 0.41 0.70 -0.35 0.86 3.32 -1.00 0.13 116.42 120.48 1jpr h ASP 285 Ca 0.11 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 1jpr h ASP 285 Cb 0.33 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1jpr h ASP 285 CO 0.00 0.44 -0.07 -0.25 -1.72 0.00 0.00 179.24 177.65 1jpr h TRP 286 N 0.79 0.75 -0.14 4.55 7.01 -0.95 -2.42 115.95 125.55 1jpr h TRP 286 Ca 0.33 -0.16 -0.00 0.00 2.11 0.00 0.00 58.89 61.17 1jpr h TRP 286 Cb 0.28 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.15 1jpr h TRP 286 CO -0.00 0.82 0.07 0.00 -2.79 0.00 0.00 178.44 176.55 1jpr h ALA 287 N 0.82 0.17 -0.97 2.65 0.00 -0.63 -0.11 119.26 121.20 1jpr h ALA 287 Ca 0.09 -0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.10 1jpr h ALA 287 Cb 0.57 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 1jpr h ALA 287 CO 0.03 -0.29 0.61 -0.44 0.00 0.00 0.00 179.25 179.16 1jpr h ASP 288 N 0.12 0.79 -0.01 0.00 3.32 -0.66 -1.35 116.42 118.63 1jpr h ASP 288 Ca 0.05 0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 1jpr h ASP 288 Cb 0.07 -0.09 0.01 0.00 0.22 0.00 0.00 39.33 39.54 1jpr h ASP 288 CO -0.01 0.37 -0.35 0.22 -1.72 0.00 0.00 179.24 177.76 1jpr h TYR 289 N 0.82 0.37 -0.48 4.55 3.20 -1.01 -3.23 116.97 121.19 1jpr h TYR 289 Ca 0.51 -0.19 0.08 0.00 3.14 0.00 0.00 58.73 62.26 1jpr h TYR 289 Cb 0.70 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.90 1jpr h TYR 289 CO -0.00 0.99 0.33 1.25 -1.64 0.00 0.00 178.16 179.08 1jpr h LEU 290 N -0.35 0.30 -3.70 2.82 5.85 -0.61 -2.14 115.31 117.48 1jpr h LEU 290 Ca -0.04 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.39 1jpr h LEU 290 Cb 1.08 -0.06 -0.17 0.00 0.37 0.00 0.00 40.66 41.87 1jpr h LEU 290 CO 0.07 0.19 0.30 0.49 -0.34 0.00 0.00 178.44 179.15 1jpr n PHE 291 N -4.47 2.22 0.03 1.25 3.01 -0.55 -4.48 117.46 114.49 1jpr n PHE 291 Ca 0.07 -1.48 -0.19 0.00 1.01 0.00 0.00 57.45 56.86 1jpr n PHE 291 Cb 0.31 -0.70 -0.14 0.00 -0.01 0.00 0.00 39.48 38.94 1jpr n PHE 291 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1jpr h ARG 292 N 1.66 0.26 0.00 -1.08 2.43 -1.39 -3.23 114.38 113.02 1jpr h ARG 292 Ca 0.36 -0.44 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1jpr h ARG 292 Cb 2.29 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 32.00 1jpr h ARG 292 CO 0.74 1.21 0.00 -0.40 -1.51 0.00 0.00 179.97 180.01 1jpr n ASP 293 N -4.20 0.00 0.00 -3.80 5.68 -1.26 -4.91 116.55 108.06 1jpr n ASP 293 Ca -0.13 -0.15 0.00 0.00 -0.50 0.00 0.00 54.79 54.01 1jpr n ASP 293 Cb 0.77 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.53 1jpr n ASP 293 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jpr n GLY 294 N 0.42 4.90 3.74 6.12 0.00 -1.22 -4.89 105.19 114.27 1jpr n GLY 294 Ca 0.11 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 1jpr n GLY 294 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jpr s SER 295 N 0.00 3.03 0.42 1.61 0.01 -1.26 -4.66 113.70 112.86 1jpr s SER 295 Ca 0.00 0.98 0.07 0.00 1.31 0.00 0.00 55.95 58.30 1jpr s SER 295 Cb 0.00 -1.54 -0.06 0.00 0.21 0.00 0.00 66.02 64.63 1jpr s SER 295 CO 0.00 -2.85 0.09 -0.32 0.41 0.00 0.00 173.24 170.57 1jpr s MET 296 N -5.21 2.10 -0.48 12.44 1.75 -0.84 -4.94 119.30 124.11 1jpr s MET 296 Ca 0.65 -2.02 -0.28 0.00 -1.25 0.00 0.00 55.69 52.78 1jpr s MET 296 Cb -0.15 -1.78 0.01 0.00 2.84 0.00 0.00 34.83 35.74 1jpr s MET 296 CO 0.55 -0.12 1.41 0.42 -0.65 0.00 0.00 175.02 176.63 1jpr s ILE 297 N -2.68 3.85 0.00 10.11 1.01 -1.26 -3.02 121.20 129.22 1jpr s ILE 297 Ca 0.35 0.81 0.00 0.00 0.00 0.00 0.00 60.65 61.81 1jpr s ILE 297 Cb 0.06 -4.31 0.00 0.00 0.01 0.00 0.00 42.46 38.22 1jpr s ILE 297 CO 0.19 -0.94 0.00 0.61 0.00 0.00 0.00 174.94 174.80 1jpr n GLY 298 N 5.16 0.74 3.43 6.18 0.00 -1.26 -4.92 105.19 114.51 1jpr n GLY 298 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 1jpr n GLY 298 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jpr s LEU 299 N 0.00 -0.03 0.35 0.99 2.96 -1.17 -5.05 118.68 116.74 1jpr s LEU 299 Ca 0.00 0.90 -0.12 0.00 -0.22 0.00 0.00 54.13 54.69 1jpr s LEU 299 Cb 0.00 1.88 0.03 0.00 0.50 0.00 0.00 46.19 48.60 1jpr s LEU 299 CO 0.00 -0.28 0.67 0.54 -1.32 0.00 0.00 176.35 175.96 1jpr s ASN 300 N -0.15 0.23 0.39 3.68 2.20 -1.26 -1.99 114.94 118.04 1jpr s ASN 300 Ca -0.03 -1.18 0.09 0.00 -0.94 0.00 0.00 52.86 50.80 1jpr s ASN 300 Cb -0.03 0.77 0.78 0.00 -2.00 0.00 0.00 41.25 40.76 1jpr s ASN 300 CO 0.03 -1.51 1.91 0.07 -2.94 0.00 0.00 177.10 174.65 1jpr h LYS 301 N 2.05 0.24 -0.03 3.55 2.10 -1.89 -2.21 116.57 120.37 1jpr h LYS 301 Ca -0.29 -0.05 -0.20 0.00 -2.00 0.00 0.00 60.65 58.10 1jpr h LYS 301 Cb 1.25 -0.03 0.01 0.00 -0.90 0.00 0.00 32.23 32.56 1jpr h LYS 301 CO 0.38 0.38 -0.77 -0.44 -2.00 0.00 0.00 179.45 177.00 1jpr h ASP 302 N 0.22 0.72 -0.68 7.07 3.32 -1.97 -1.30 116.42 123.81 1jpr h ASP 302 Ca 0.05 -0.73 -0.00 0.00 0.02 0.00 0.00 57.03 56.37 1jpr h ASP 302 Cb 0.38 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1jpr h ASP 302 CO 0.02 1.35 0.41 0.40 -1.72 0.00 0.00 179.24 179.70 1jpr h ILE 303 N 0.17 1.19 -0.42 0.35 2.04 -1.95 -0.53 117.51 118.36 1jpr h ILE 303 Ca -0.09 -0.43 -0.12 0.00 1.00 0.00 0.00 64.86 65.22 1jpr h ILE 303 Cb 1.44 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1jpr h ILE 303 CO 0.15 0.20 -0.22 0.25 0.00 0.00 0.00 178.15 178.54 1jpr h LEU 304 N 0.92 0.86 -0.52 1.44 5.85 -1.43 -0.25 115.31 122.18 1jpr h LEU 304 Ca 0.24 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1jpr h LEU 304 Cb -0.03 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 1jpr h LEU 304 CO -0.05 1.05 0.30 0.00 -0.34 0.00 0.00 178.44 179.41 1jpr h GLN 306 N 0.70 1.09 -0.60 0.00 1.08 -0.43 -1.90 115.11 115.05 1jpr h GLN 306 Ca 0.19 -0.08 -0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1jpr h GLN 306 Cb 0.02 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.19 1jpr h GLN 306 CO -0.03 0.74 0.23 -0.92 -0.95 0.00 0.00 178.83 177.90 1jpr h TYR 307 N 1.11 0.92 -0.60 2.96 3.20 -0.56 0.26 116.97 124.26 1jpr h TYR 307 Ca 0.29 -0.07 0.03 0.00 3.14 0.00 0.00 58.73 62.12 1jpr h TYR 307 Cb -0.09 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 37.87 1jpr h TYR 307 CO -0.01 0.74 0.37 0.28 -1.64 0.00 0.00 178.16 177.90 1jpr h VAL 308 N 0.83 1.06 -0.55 1.81 2.07 -0.59 -0.40 116.25 120.47 1jpr h VAL 308 Ca 0.20 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.36 1jpr h VAL 308 Cb 0.22 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1jpr h VAL 308 CO -0.01 0.13 -0.09 -0.33 0.02 0.00 0.00 177.57 177.28 1jpr h GLU 309 N 0.72 1.04 0.20 1.57 5.08 -0.87 -0.11 114.58 122.21 1jpr h GLU 309 Ca 0.24 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1jpr h GLU 309 Cb 0.03 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1jpr h GLU 309 CO -0.11 1.07 -0.09 -0.92 -1.00 0.00 0.00 179.01 177.96 1jpr h TYR 310 N 0.93 -0.24 -0.26 4.33 3.20 -0.03 -2.61 116.97 122.28 1jpr h TYR 310 Ca 0.15 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.87 1jpr h TYR 310 Cb 0.66 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 1jpr h TYR 310 CO 0.04 -0.02 -0.43 -0.84 -1.64 0.00 0.00 178.16 175.27 1jpr h ILE 311 N -0.44 1.30 -0.57 1.81 3.07 -1.06 -2.90 117.51 118.72 1jpr h ILE 311 Ca -0.03 -1.61 0.08 0.00 1.55 0.00 0.00 64.86 64.85 1jpr h ILE 311 Cb 0.33 1.56 -0.06 0.00 -0.27 0.00 0.00 36.82 38.38 1jpr h ILE 311 CO 0.04 0.51 0.23 0.74 -1.05 0.00 0.00 178.15 178.63 1jpr h THR 312 N 0.52 0.83 -0.66 0.16 2.02 -1.02 -1.68 112.91 113.08 1jpr h THR 312 Ca 0.04 -0.15 0.06 0.00 0.77 0.00 0.00 66.41 67.13 1jpr h THR 312 Cb 0.96 0.36 -0.05 0.00 -1.74 0.00 0.00 68.15 67.68 1jpr h THR 312 CO 0.09 0.08 0.37 0.78 0.37 0.00 0.00 175.52 177.20 1jpr h ASN 313 N 0.43 0.54 -0.46 4.18 2.35 -1.32 -0.36 115.58 120.94 1jpr h ASN 313 Ca 0.28 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 56.02 1jpr h ASN 313 Cb 0.30 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 1jpr h ASN 313 CO -0.26 0.35 0.14 0.40 -1.65 0.00 0.00 177.43 176.41 1jpr h ILE 314 N 0.68 1.22 -0.16 2.81 2.04 -1.25 -1.06 117.51 121.79 1jpr h ILE 314 Ca 0.30 -0.75 -0.20 0.00 1.00 0.00 0.00 64.86 65.21 1jpr h ILE 314 Cb 0.18 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1jpr h ILE 314 CO -0.18 0.27 -0.69 0.03 0.00 0.00 0.00 178.15 177.58 1jpr h ARG 315 N 0.60 0.66 -0.57 2.37 2.47 -1.06 -1.19 114.38 117.67 1jpr h ARG 315 Ca 0.15 -0.50 -0.11 0.00 -1.26 0.00 0.00 59.98 58.26 1jpr h ARG 315 Cb 0.27 0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 1jpr h ARG 315 CO -0.00 1.12 -0.07 0.52 0.56 0.00 0.00 179.97 182.09 1jpr h MET 316 N 0.47 1.05 -0.71 0.04 2.86 -0.97 -2.54 114.93 115.13 1jpr h MET 316 Ca -0.03 -0.37 -0.05 0.00 -2.06 0.00 0.00 59.70 57.20 1jpr h MET 316 Cb 1.28 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.84 1jpr h MET 316 CO 0.14 1.07 0.25 0.37 1.06 0.00 0.00 176.91 179.79 1jpr h GLN 317 N 0.94 1.08 0.00 1.72 4.15 -1.06 0.49 115.11 122.43 1jpr h GLN 317 Ca 0.15 -0.21 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 1jpr h GLN 317 Cb 0.64 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 28.16 1jpr h GLN 317 CO 0.04 0.90 -0.00 0.00 -1.93 0.00 0.00 178.83 177.84 1jpr h ALA 318 N 1.22 1.44 -0.30 3.38 0.00 -0.80 -1.99 119.26 122.22 1jpr h ALA 318 Ca 0.23 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1jpr h ALA 318 Cb 0.25 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1jpr h ALA 318 CO -0.01 0.01 0.01 1.33 0.00 0.00 0.00 179.25 180.58 1jpr n VAL 319 N -3.72 2.36 -1.31 0.00 0.24 -0.85 -4.96 118.33 110.09 1jpr n VAL 319 Ca -0.03 -2.00 -0.02 0.00 -2.04 0.00 0.00 64.34 60.25 1jpr n VAL 319 Cb 0.08 -0.27 -0.01 0.00 -1.47 0.00 0.00 33.84 32.17 1jpr n VAL 319 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jpr n GLY 320 N -0.59 0.50 3.95 7.63 0.00 -0.75 -4.93 105.19 111.00 1jpr n GLY 320 Ca 0.24 -0.92 -0.25 0.00 0.00 0.00 0.00 46.02 45.09 1jpr n GLY 320 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jpr s LEU 321 N -0.60 4.29 0.62 0.99 1.43 0.11 -4.99 118.68 120.52 1jpr s LEU 321 Ca 0.00 0.21 -0.17 0.00 -1.03 0.00 0.00 54.13 53.14 1jpr s LEU 321 Cb 0.00 -2.97 -0.02 0.00 0.03 0.00 0.00 46.19 43.23 1jpr s LEU 321 CO 0.00 -0.02 1.13 -1.81 0.23 0.00 0.00 176.35 175.87 1jpr s ASP 322 N -3.48 5.26 -0.10 2.29 1.01 -1.26 -3.93 116.67 116.46 1jpr s ASP 322 Ca 0.35 2.09 -0.27 0.00 0.71 0.00 0.00 52.55 55.44 1jpr s ASP 322 Cb -0.10 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.24 1jpr s ASP 322 CO 0.29 -1.53 0.89 -0.76 0.21 0.00 0.00 175.17 174.27 1jpr s LEU 323 N -4.49 4.26 0.32 1.23 1.43 -1.26 -4.83 118.68 115.33 1jpr s LEU 323 Ca 0.70 1.37 0.20 0.00 -1.03 0.00 0.00 54.13 55.37 1jpr s LEU 323 Cb -0.22 -3.36 0.16 0.00 0.03 0.00 0.00 46.19 42.79 1jpr s LEU 323 CO 0.36 -0.33 1.39 1.55 0.23 0.00 0.00 176.35 179.56 1jpr h PRO 324 N 7.05 0.00 -6.03 1.29 0.13 -1.93 -3.47 132.00 129.03 1jpr h PRO 324 Ca -0.34 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.22 1jpr h PRO 324 Cb 1.17 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.21 1jpr h PRO 324 CO 0.81 0.16 -0.56 -0.06 -0.23 0.00 0.00 178.00 178.12 1jpr s PHE 325 N -3.14 2.63 0.20 1.56 0.08 -1.26 -5.08 117.98 112.96 1jpr s PHE 325 Ca 0.04 -0.44 -0.31 0.00 0.12 0.00 0.00 56.93 56.34 1jpr s PHE 325 Cb 0.07 -1.63 -0.11 0.00 -0.57 0.00 0.00 43.02 40.78 1jpr s PHE 325 CO 0.73 0.37 1.58 -1.14 -0.10 0.00 0.00 175.22 176.65 1jpr s GLN 326 N -3.80 4.20 0.33 0.44 0.74 -1.26 -4.94 119.66 115.36 1jpr s GLN 326 Ca 0.37 2.42 -0.28 0.00 0.05 0.00 0.00 55.36 57.92 1jpr s GLN 326 Cb -0.00 -3.12 -0.09 0.00 1.10 0.00 0.00 33.01 30.90 1jpr s GLN 326 CO 0.21 -0.60 1.13 0.99 -0.55 0.00 0.00 175.29 176.47 1jpr s THR 327 N 0.83 3.36 0.22 -0.34 2.01 -1.26 -4.90 115.64 115.56 1jpr s THR 327 Ca 0.68 1.27 -0.13 0.00 0.31 0.00 0.00 61.69 63.82 1jpr s THR 327 Cb -0.45 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.29 1jpr s THR 327 CO 0.35 0.23 0.45 0.00 -0.69 0.00 0.00 174.62 174.96 1jpr s ARG 328 N -1.83 1.45 0.65 4.92 1.70 -1.26 -5.16 118.95 119.41 1jpr s ARG 328 Ca 0.50 -1.17 -0.04 0.00 -0.47 0.00 0.00 55.73 54.55 1jpr s ARG 328 Cb -0.31 0.46 0.05 0.00 -0.57 0.00 0.00 34.95 34.58 1jpr s ARG 328 CO 0.40 -0.59 0.93 -1.54 -1.08 0.00 0.00 175.30 173.42 1jpr s SER 329 N -2.98 5.01 -0.07 -2.89 1.04 -1.26 -4.96 113.70 107.58 1jpr s SER 329 Ca 0.19 0.33 -0.34 0.00 0.48 0.00 0.00 55.95 56.61 1jpr s SER 329 Cb -0.00 -1.08 -0.12 0.00 0.10 0.00 0.00 66.02 64.91 1jpr s SER 329 CO 0.05 -1.42 1.84 -3.20 0.98 0.00 0.00 173.24 171.50 1jpr n ASN 330 N -2.72 3.36 0.21 7.02 2.85 -1.26 -4.85 115.26 119.88 1jpr n ASN 330 Ca 0.08 0.99 0.15 0.00 -0.11 0.00 0.00 54.58 55.68 1jpr n ASN 330 Cb 0.60 -1.37 0.51 0.00 1.24 0.00 0.00 39.78 40.76 1jpr n ASN 330 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1jpr h PRO 331 N 8.78 0.00 -2.08 1.20 0.13 -1.93 -3.33 132.00 134.77 1jpr h PRO 331 Ca -0.48 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.08 1jpr h PRO 331 Cb 1.27 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.00 1jpr h PRO 331 CO 0.94 0.00 -0.92 0.44 -0.23 0.00 0.00 178.00 178.23 1jpr n ILE 332 N -2.80 0.64 0.28 -3.56 -5.35 -1.26 -4.94 119.36 102.37 1jpr n ILE 332 Ca 0.02 -4.59 0.18 0.00 -0.27 0.00 0.00 62.75 58.09 1jpr n ILE 332 Cb 0.34 -1.74 0.96 0.00 -1.74 0.00 0.00 39.64 37.46 1jpr n ILE 332 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1jpr h PRO 333 N 3.84 0.00 0.00 6.28 0.13 -1.98 -0.37 132.00 139.90 1jpr h PRO 333 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1jpr h PRO 333 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1jpr h PRO 333 CO 0.61 0.00 0.09 0.11 -0.23 0.00 0.00 178.00 178.58 1jpr h TRP 334 N 0.00 0.00 0.00 1.56 5.08 -1.95 -1.68 115.95 118.97 1jpr h TRP 334 Ca 0.03 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 59.95 1jpr h TRP 334 Cb 0.30 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.45 1jpr h TRP 334 CO 0.00 0.00 -0.27 0.97 -1.28 0.00 0.00 178.44 177.86 1jpr h ILE 335 N 0.00 0.75 -0.06 0.12 2.10 -1.49 -2.63 117.51 116.31 1jpr h ILE 335 Ca 0.00 -1.15 0.02 0.00 1.08 0.00 0.00 64.86 64.80 1jpr h ILE 335 Cb 0.18 1.72 -0.00 0.00 -1.09 0.00 0.00 36.82 37.63 1jpr h ILE 335 CO 0.00 0.27 0.11 0.78 -1.08 0.00 0.00 178.15 178.22 1jpr h ASN 336 N 0.00 0.00 -0.34 2.19 2.35 -1.50 0.75 115.58 119.03 1jpr h ASN 336 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1jpr h ASN 336 Cb 0.70 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.05 1jpr h ASN 336 CO 0.04 0.00 0.16 0.74 -1.65 0.00 0.00 177.43 176.72 1jpr h THR 337 N 0.00 1.15 0.00 2.81 2.02 -1.65 -2.96 112.91 114.28 1jpr h THR 337 Ca 0.03 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1jpr h THR 337 Cb 0.24 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1jpr h THR 337 CO -0.00 0.17 -1.37 0.79 0.37 0.00 0.00 175.52 175.49 1jpr n TRP 338 N -4.39 0.13 -3.36 3.16 7.02 0.21 -4.61 117.44 115.60 1jpr n TRP 338 Ca 0.03 0.04 -0.45 0.00 -1.02 0.00 0.00 57.50 56.09 1jpr n TRP 338 Cb 0.13 -0.37 -0.02 0.00 -2.42 0.00 0.00 31.31 28.64 1jpr n TRP 338 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1jpr s LEU 339 N -3.96 6.50 0.00 -0.99 1.43 -0.90 -4.77 118.68 115.99 1jpr s LEU 339 Ca 0.00 -3.11 -0.12 0.00 -1.03 0.00 0.00 54.13 49.88 1jpr s LEU 339 Cb 0.14 -2.19 0.19 0.00 0.03 0.00 0.00 46.19 44.37 1jpr s LEU 339 CO 0.86 -0.43 0.49 1.33 0.23 0.00 0.00 176.35 178.82 1jpr n VAL 340 N 3.38 0.00 -0.82 -1.59 0.24 -1.26 -4.85 118.33 113.43 1jpr n VAL 340 Ca 0.18 -0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.40 1jpr n VAL 340 Cb 0.43 -0.69 0.00 0.00 -1.47 0.00 0.00 33.84 32.11 1jpr n VAL 340 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49